Biološki aktivna jedinjenja sintetisana u okviru istraživanja Centra za Hemiju, IHTM
Na ovoj stranici možete pronaći tabele sa biološki aktivnim jedinjenjima koja su sintetisana i testirana u okviru istraživanja Centra za Hemiju. Jedinjenja su klasifikovana po receptorima i vrstama na kojima su obavljana biološka ispitivanja.
Ako ste zainteresovani za korišćenje ovih podataka u Vašem istraživanju, .sdf verzije podataka su dostupne na zahtev. Za dodatne informacije, ili ako imate pitanja, komentara ili sugestija u vezi same baze podataka, možete se obratiti Dr Jeleni Ranđelović na jelena.randjelovicATihtm.bg.ac.rs
Jedinjenja testirana na goveđim G-protein kuplovanim receptorima
Molekul | D2 Ki [nM] | 5HT1A Ki [nM] | 5HT2A Ki [nM] | Alpha 1 Ki [nM] | Referenca | SMILES | |
---|---|---|---|---|---|---|---|
1 | 138 | 197 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. Pharmazie. 1998 Jul;53(7):438-4 | c1ccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)cc1 | |
2 | 20 | 130 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(Cc1ccc2nc[nH]c2c1)N1CCN(c2ccccc2)CC1 | |
3 | >1000 | 300 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(CN1CCN(c2ccccc2)CC1)c1ccc2nc[nH]c2c1 | |
4 | 129 | 71.1 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. doi:10.1016/j.ejmech.2004.10.006 | c1ccc(N2CCN(CCCc3ccc4nc[nH]c4c3)CC2)cc1 | |
5 | 15 | 548 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(Cc1ccc2nn[nH]c2c1)N1CCN(c2ccccc2)CC1 | |
6 | >1000 | 300 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(CN1CCN(c2ccccc2)CC1)c1ccc2nn[nH]c2c1 | |
7 | >1000 | >1000 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. | S=c1[nH]c2ccc(CN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
8 | 16 | 13 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. Pharmazie. 2001 Oct;56(10):80 | S=c1[nH]c2ccc(CCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
9 | 5 | 170 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(Cc1ccc2[nH]c(=S)[nH]c2c1)N1CCN(c2ccccc2)CC1 | |
10 | 304 | 36 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(CN1CCN(c2ccccc2)CC1)c1ccc2[nH]c(=S)[nH]c2c1 | |
11 | 3 | 177 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. doi:10.1016/j.ejmech.2004.10.006 | S=c1[nH]c2ccc(CCCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
12 | 23 | 25 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. Pharmazie. 2001 Oct;56(10):803 | O=c1[nH]c2ccc(CCN3CCN(c4ccccc4)CC3)cc2[nH]c1=O | |
13 | 6 | 103 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(Cc1ccc2[nH]c(=O)c(=O)[nH]c2c1)N1CCN(c2ccccc2)CC1 | |
14 | 540 | 58 | NaN | NaN | Arch Pharm (Weinheim). 2001 Dec;334(12):375-80. | CC(CN1CCN(c2ccccc2)CC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 | |
15 | 21 | 93 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. | O=c1[nH]c2ccc(CCCN3CCN(c4ccccc4)CC3)cc2[nH]c1=O | |
16 | 473 | 237 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. | c1ccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)nc1 | |
17 | 416 | 71 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. | c1ccc(N2CCN(CCc3ccc4[nH]nnc4c3)CC2)nc1 | |
18 | 128 | 19 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. | S=c1[nH]c2ccc(CCN3CCN(c4ccccn4)CC3)cc2[nH]1 | |
19 | 198 | 30 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. | O=c1[nH]c2ccc(CCN3CCN(c4ccccn4)CC3)cc2[nH]c1=O | |
20 | >1000 | >1000 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. Pharmazie. 1998 Jul;53(7):438- | c1cnc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)nc1 | |
21 | >1000 | >1000 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. | c1cnc(N2CCN(CCc3ccc4nn[nH]c4c3)CC2)nc1 | |
22 | 16 | 134 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. | S=c1[nH]c2ccc(CCN3CCN(c4ncccn4)CC3)cc2[nH]1 | |
23 | 16 | 134 (17) | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43 | Cc1cccc(N2CCN(CCc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1C | |
24 | 56 | 13 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43. | Cc1cccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)c1C | |
25 | 31 | 4 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43 | Cc1cccc(N2CCN(CCc3ccc4nn[nH]c4c3)CC2)c1C | |
26 | 11 | 4 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43 | c1ccc2c(N3CCN(CCc4ccc5nc[nH]c5c4)CC3)cccc2c1 | |
27 | 11 | 1 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43 | c1ccc2c(N3CCN(CCc4ccc5nn[nH]c5c4)CC3)cccc2c1 | |
28 | 3 | 2 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43 | S=c1[nH]c2ccc(CCN3CCN(c4cccc5ccccc45)CC3)cc2[nH]1 | |
29 | 60 | 10 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q Pharmazie. 200 | c1ccc(-c2nc3ccc(CCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
30 | 64 | 3 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(N2CCN(CCc3ccc4nc(-c5ccccn5)[nH]c4c3)CC2)cc1 | |
31 | 11 | 71 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(N2CCN(CCc3ccc4nc(-c5cccnc5)[nH]c4c3)CC2)cc1 | |
32 | 157 | 22 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q Pharmazie. 200 | c1ccc(Cc2nc3ccc(CCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
33 | 231 | >1000 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | O=[N+]([O-])c1ccc(Cc2nc3ccc(CCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
34 | 47 | 64 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | Clc1ccc(Cc2nc3ccc(CCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
35 | 3 | 3 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(N2CCN(CCc3ccc4nc(Cc5ccccn5)[nH]c4c3)CC2)cc1 | |
36 | 52 | 149 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(N2CCN(CCc3ccc4nc(Cc5cccnc5)[nH]c4c3)CC2)cc1 | |
37 | 117 | 13 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(CCc2nc3ccc(CCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
38 | 232 | 481 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(N2CCN(CCc3ccc4nc(Cc5cccc6ccccc56)[nH]c4c3)CC2)cc1 | |
39 | 117 | 38 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(N2CCN(CCc3ccc4nc(Cc5ccc6ccccc6c5)[nH]c4c3)CC2)cc1 | |
40 | 76 | 4 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(C(c2ccccc2)c2nc3ccc(CCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
41 | >1000 | >1000 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | c1ccc(-c2ccc(Cc3nc4ccc(CCN5CCN(c6ccccc6)CC5)cc4[nH]3)cc2)cc1 | |
42 | 74 | 84 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. | c1ccc(-c2nc3ccc(CCCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
43 | 13 | 20 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. Pharmazie. 1998 Jul;53(7):438-41 | COc1ccccc1N1CCN(CCc2ccc3nc[nH]c3c2)CC1 | |
44 | 18 | 3 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | COc1ccccc1N1CCN(CCc2ccc3nn[nH]c3c2)CC1 | |
45 | 2 | 3 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | COc1ccccc1N1CCN(CCc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
46 | 12 | 10 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | COc1ccccc1N1CCN(CCc2ccc3[nH]c(=O)c(=O)[nH]c3c2)CC1 | |
47 | >1000 | 332 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | COc1ccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)cc1 | |
48 | >1000 | 474 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | COc1ccc(N2CCN(CCc3ccc4nn[nH]c4c3)CC2)cc1 | |
49 | 110 | >1000 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | COc1ccc(N2CCN(CCc3ccc4[nH]c(=S)[nH]c4c3)CC2)cc1 | |
50 | >1000 | >1000 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | COc1ccc(N2CCN(CCc3ccc4[nH]c(=O)c(=O)[nH]c4c3)CC2)cc1 | |
51 | 273 | 33 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. Pharmazie. 1998 Jul;53(7):438-41 | FC(F)(F)c1cccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)c1 | |
52 | 300 | 26 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | FC(F)(F)c1cccc(N2CCN(CCc3ccc4nn[nH]c4c3)CC2)c1 | |
53 | 134 | 11 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | FC(F)(F)c1cccc(N2CCN(CCc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1 | |
54 | 105 | 8 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | O=c1[nH]c2ccc(CCN3CCN(c4cccc(C(F)(F)F)c4)CC3)cc2[nH]c1=O | |
55 | 60 | 243 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. doi:10.1016/j.ejmech.2007.0 | Clc1ccccc1N1CCN(CCc2ccc3nc[nH]c3c2)CC1 | |
56 | 50 | 38 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | Clc1ccccc1N1CCN(CCc2ccc3nn[nH]c3c2)CC1 | |
57 | 21 | 81 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | S=c1[nH]c2ccc(CCN3CCN(c4ccccc4Cl)CC3)cc2[nH]1 | |
58 | 20 | 54 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | O=c1[nH]c2ccc(CCN3CCN(c4ccccc4Cl)CC3)cc2[nH]c1=O | |
59 | 204 | 31 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | Clc1cccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)c1 | |
60 | 47 | 13 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | S=c1[nH]c2ccc(CCN3CCN(c4cccc(Cl)c4)CC3)cc2[nH]1 | |
61 | 268 | 372 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | Clc1ccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)cc1 | |
62 | 472 | 115 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | Clc1ccc(N2CCN(CCc3ccc4nn[nH]c4c3)CC2)cc1 | |
63 | 32 | 217 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | S=c1[nH]c2ccc(CCN3CCN(c4ccc(Cl)cc4)CC3)cc2[nH]1 | |
64 | 116 | 54 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. | O=c1[nH]c2ccc(CCN3CCN(c4ccc(Cl)cc4)CC3)cc2[nH]c1=O | |
65 | 639 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | c1ccc(CN2CCN(c3ccccc3)CC2)cc1 | |
66 | 580 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | c1ccc(CN2CCN(c3cccc4ccccc34)CC2)cc1 | |
67 | 28 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | COc1ccccc1N1CCN(Cc2ccccc2)CC1 | |
68 | 577 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | COc1cccc(N2CCN(Cc3ccccc3)CC2)c1 | |
69 | >1000 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | COc1ccc(N2CCN(Cc3ccccc3)CC2)cc1 | |
70 | 989 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | COc1ccc(CN2CCN(c3ccccc3OC)CC2)cc1 | |
71 | 118 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | COc1ccccc1N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1 | |
72 | 478 | 43 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43 doi:10.1016/j.bmcl.2012.04 | c1ccc(CCN2CCN(c3ccccc3)CC2)cc1 | |
73 | 37 | 7 | NaN | NaN | J Pharm Pharmacol. 1997 Oct;49(10):1036-41. Arzneimittelforschung. 2005;55(3) | COc1ccccc1N1CCN(CCc2ccccc2)CC1 | |
74 | 132 | 7 | NaN | NaN | Arzneimittelforschung. 1997 Mar;47(3):239-43 Arzneimittelforschung. 2005;55( | c1ccc(CCN2CCN(c3cccc4ccccc34)CC2)cc1 | |
75 | 198 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | O=[N+]([O-])c1ccccc1N1CCN(Cc2ccccc2)CC1 | |
76 | >1000 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | O=[N+]([O-])c1cccc(N2CCN(Cc3ccccc3)CC2)c1 | |
77 | >1000 | NaN | NaN | NaN | Arzneimittelforschung. 2005;55(3):145-52 | O=[N+]([O-])c1ccc(N2CCN(Cc3ccccc3)CC2)cc1 | |
78 | >1000 | >1000 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. | Cc1nc2cc(CN3CCN(c4ccccc4)CC3)ccc2[nH]1 | |
79 | 45 | 143 | NaN | NaN | 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q Pharmazie. 2 | Cc1nc2cc(CCN3CCN(c4ccccc4)CC3)ccc2[nH]1 | |
80 | 14 | 8 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CSCc1nc2cc(CCN3CCN(c4ccccc4)CC3)ccc2[nH]1 | |
81 | 165 | >1000 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CS(=O)Cc1nc2cc(CCN3CCN(c4ccccc4)CC3)ccc2[nH]1 | |
82 | >1000 | >1000 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. | c1ccc(Cc2nc3cc(CN4CCN(c5ccccc5)CC4)ccc3[nH]2)cc1 | |
83 | 113 | 98 | NaN | NaN | Pharmazie. 2001 Oct;56(10):803-7. | c1ccc(Cc2nc3cc(CCCN4CCN(c5ccccc5)CC4)ccc3[nH]2)cc1 | |
84 | >10000 | 990 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCC)CCc1ccccc1 | |
85 | >10000 | 101 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1ccccc1 | |
86 | 867 | 121 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 | |
87 | >10000 | 98 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1ccc(Cl)cc1 | |
88 | >10000 | 110 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1ccc(C)cc1 | |
89 | >10000 | >10000 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCC)CCc1cccc2ccccc12 | |
90 | >10000 | 532 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCC)CCc1ccc2ccccc2c1 | |
91 | 988 | 99 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1cccc2ccccc12 | |
92 | >10000 | 233 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1ccc2ccccc2c1 | |
93 | 2730 | 147 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1cccc2ccccc12)CCc1cccc2ccccc12 | |
94 | >10000 | 226 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccc2ccccc2c1)CCc1cccc2ccccc12 | |
95 | >10000 | >10000 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1ccc(-c2ccccc2)cc1 | |
96 | >10000 | 465 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. Arch Pharm (Weinheim). 2003 Nov;336(11):514 | CCCN(CCC)CCc1ccc2[nH]cnc2c1 | |
97 | 1057 | 126 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccccc1)CCc1ccc2[nH]cnc2c1 | |
98 | 421 | 160 | NaN | NaN | Arch Pharm (Weinheim). 2003 Nov;336(11):514-22. | CCCN(CCc1ccc2[nH]cnc2c1)CCc1cccc2ccccc12 | |
99 | 50 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Cl)c2[nH]c(=S)[nH]c2c1 | |
100 | 200 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Br)c2[nH]c(=S)[nH]c2c1 | |
101 | 4000 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Cl)c2[nH]cnc2c1 | |
102 | >100000 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Br)c2[nH]cnc2c1 | |
103 | 300 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Cl)c2[nH]nnc2c1 | |
104 | 700 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Br)c2[nH]nnc2c1 | |
105 | 900 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Cl)c2[nH]c(=O)c(=O)[nH]c2c1 | |
106 | >100000 | NaN | NaN | NaN | doi: 10.1002/ardp.200300846 | CCCN(CCC)CCc1cc(Br)c2[nH]c(=O)c(=O)[nH]c2c1 | |
107 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | FC(F)(F)c1cccc(N2CCN(CCCc3ccc4[nH]cnc4c3)CC2)c1 | |
108 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | Clc1ccc(N2CCN(CCCc3ccc4[nH]cnc4c3)CC2)cc1 | |
109 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccc(N2CCN(CCCc3ccc4[nH]cnc4c3)CC2)cc1 | |
110 | 97 | 47 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccccc1N1CCN(CCCc2ccc3[nH]cnc3c2)CC1 | |
111 | 3 | 177 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | S=c1[nH]c2ccc(CCCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
112 | 6 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | FC(F)(F)c1cccc(N2CCN(CCCc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1 | |
113 | 20 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | S=c1[nH]c2ccc(CCCN3CCN(c4ccc(Cl)cc4)CC3)cc2[nH]1 | |
114 | 33 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccc(N2CCN(CCCc3ccc4[nH]c(=S)[nH]c4c3)CC2)cc1 | |
115 | 0.4 | 9 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccccc1N1CCN(CCCc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
116 | 274 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | c1ccc(N2CCN(CCOc3ccc4[nH]cnc4c3)CC2)cc1 | |
117 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | FC(F)(F)c1cccc(N2CCN(CCOc3ccc4[nH]cnc4c3)CC2)c1 | |
118 | 13 | 284 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccccc1N1CCN(CCOc2ccc3[nH]cnc3c2)CC1 | |
119 | >1000 | 330 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1cccc(N2CCN(CCOc3ccc4[nH]cnc4c3)CC2)c1 | |
120 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccc(N2CCN(CCOc3ccc4[nH]cnc4c3)CC2)cc1 | |
121 | 0.7 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | S=c1[nH]c2ccc(OCCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
122 | 6 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | FC(F)(F)c1cccc(N2CCN(CCOc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1 | |
123 | 0.2 | 308 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccccc1N1CCN(CCOc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
124 | 13 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1cccc(N2CCN(CCOc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1 | |
125 | 105 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccc(N2CCN(CCOc3ccc4[nH]c(=S)[nH]c4c3)CC2)cc1 | |
126 | 3 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | S=c1[nH]c2ccc(OCCN3CCN(c4ccccc4Cl)CC3)cc2[nH]1 | |
127 | 7 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | S=c1[nH]c2ccc(OCCN3CCN(c4cccc(Cl)c4)CC3)cc2[nH]1 | |
128 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | S=c1[nH]c2ccc(OCCN3CCN(c4ccc(Cl)cc4)CC3)cc2[nH]1 | |
129 | 8 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | O=c1[nH]c2ccc(OCCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
130 | 26 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | O=c1[nH]c2ccc(OCCN3CCN(c4cccc(C(F)(F)F)c4)CC3)cc2[nH]1 | |
131 | 1 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccccc1N1CCN(CCOc2ccc3[nH]c(=O)[nH]c3c2)CC1 | |
132 | 45 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1cccc(N2CCN(CCOc3ccc4[nH]c(=O)[nH]c4c3)CC2)c1 | |
133 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccc(N2CCN(CCOc3ccc4[nH]c(=O)[nH]c4c3)CC2)cc1 | |
134 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | O=c1[nH]c2ccc(OCCN3CCN(c4ccccc4Cl)CC3)cc2[nH]1 | |
135 | 45 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | O=c1[nH]c2ccc(OCCN3CCN(c4cccc(Cl)c4)CC3)cc2[nH]1 | |
136 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | O=c1[nH]c2ccc(OCCN3CCN(c4ccc(Cl)cc4)CC3)cc2[nH]1 | |
137 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | c1ccc(N2CCN(CCOc3ccc4[nH]nnc4c3)CC2)cc1 | |
138 | >1000 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | FC(F)(F)c1cccc(N2CCN(CCOc3ccc4[nH]nnc4c3)CC2)c1 | |
139 | 2 | >1000 | NaN | NaN | doi:10.1016/j.ejmech.2004.10.006 | COc1ccccc1N1CCN(CCOc2ccc3[nH]nnc3c2)CC1 | |
140 | 85 | 90 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | Clc1cc(CCN2CCN(c3ccccc3)CC2)cc2[nH]cnc12 | |
141 | 5 | 5 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | COc1ccccc1N1CCN(CCc2cc(Cl)c3nc[nH]c3c2)CC1 | |
142 | 19 | 46 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | Clc1ccccc1N1CCN(CCc2cc(Cl)c3nc[nH]c3c2)CC1 | |
143 | 200 | 21 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | FC(F)(F)c1cccc(N2CCN(CCc3cc(Cl)c4nc[nH]c4c3)CC2)c1 | |
144 | 550 | 530 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | Clc1cc(CCN2CCN(c3ncccn3)CC2)cc2[nH]cnc12 | |
145 | 62 | 24 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | Brc1cc(CCN2CCN(c3ccccc3)CC2)cc2[nH]cnc12 | |
146 | 0.6 | 1 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | COc1ccccc1N1CCN(CCc2cc(Br)c3nc[nH]c3c2)CC1 | |
147 | 6 | 0.1 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | Clc1ccccc1N1CCN(CCc2cc(Br)c3nc[nH]c3c2)CC1 | |
148 | 15 | 10 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | FC(F)(F)c1cccc(N2CCN(CCc3cc(Br)c4nc[nH]c4c3)CC2)c1 | |
149 | 26.7 | 129 | NaN | NaN | doi:10.1016/j.ejmech.2007.09.027 | Brc1cc(CCN2CCN(c3ncccn3)CC2)cc2[nH]cnc12 | |
150 | 5 | 13 | NaN | NaN | doi:10.2298/JSC0709747A | S=c1[nH]c2cc(CCN3CCN(c4ccccc4)CC3)cc(Cl)c2[nH]1 | |
151 | 0.05 | 0.4 | NaN | NaN | doi:10.2298/JSC0709747A | COc1ccccc1N1CCN(CCc2cc(Cl)c3[nH]c(=S)[nH]c3c2)CC1 | |
152 | 12 | 36 | NaN | NaN | doi:10.2298/JSC0709747A | S=c1[nH]c2cc(CCN3CCN(c4ccccc4Cl)CC3)cc(Cl)c2[nH]1 | |
153 | 45 | 15 | 33 | 155 | doi:10.2298/JSC0709747A | FC(F)(F)c1cccc(N2CCN(CCc3cc(Cl)c4[nH]c(=S)[nH]c4c3)CC2)c1 | |
154 | 6 | 19 | NaN | NaN | doi:10.2298/JSC0709747A | S=c1[nH]c2cc(CCN3CCN(c4ccccc4)CC3)cc(Br)c2[nH]1 | |
155 | 0.01 | 2 | NaN | NaN | doi:10.2298/JSC0709747A | COc1ccccc1N1CCN(CCc2cc(Br)c3[nH]c(=S)[nH]c3c2)CC1 | |
156 | 7 | 76 | NaN | NaN | doi:10.2298/JSC0709747A | S=c1[nH]c2cc(CCN3CCN(c4ccccc4Cl)CC3)cc(Br)c2[nH]1 | |
157 | 72 | 2 | 15 | 123 | doi:10.2298/JSC0709747A | FC(F)(F)c1cccc(N2CCN(CCc3cc(Br)c4[nH]c(=S)[nH]c4c3)CC2)c1 | |
158 | 24 | 583 | 350 | 47 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CC=Cc2ccccc2)CC1 | |
159 | 22 | 564 | 296 | 49 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CC=Cc2ccccc2[N+](=O)[O-])CC1 | |
160 | 17 | 225 | 204 | 43 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CC=Cc2cccc([N+](=O)[O-])c2)CC1 | |
161 | 66 | 651 | 788 | 158 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CC=Cc2ccc([N+](=O)[O-])cc2)CC1 | |
162 | 15 | 181 | 120 | 33 | DOI 10.1002/ardp.200700062 | COc1ccccc1C=CCN1CCN(c2ccccc2OC)CC1 | |
163 | 36 | 708 | 925 | 667 | DOI 10.1002/ardp.200700062 | COc1cccc(C=CCN2CCN(c3ccccc3OC)CC2)c1 | |
164 | 60 | 583 | 943 | 80 | DOI 10.1002/ardp.200700062 | COc1ccc(C=CCN2CCN(c3ccccc3OC)CC2)cc1 | |
165 | 32 | 343 | 597 | 300 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CC=Cc2ccccc2Cl)CC1 | |
166 | 42 | 590 | 922 | >1000 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CC=Cc2cccc(Cl)c2)CC1 | |
167 | 51 | 588 | 990 | >1000 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CC=Cc2ccc(Cl)cc2)CC1 | |
168 | 27 | 4 | N/A | 8 | DOI 10.1002/ardp.200700062 | COc1ccccc1N1CCN(CCCc2ccccc2)CC1 | |
169 | 1200 | 68 | NaN | NaN | doi 10.1002/ardp.200700062 | COc1ccccc1N1CCNCC1 | |
170 | 95 | 73 | NaN | NaN | doi: 10.1002/(SICI)1521-4184(199801)331:1 3.0.CO;2-Q | FC(F)(F)c1cccc(N2CCN(CCc3ccc4[nH]c(Cc5ccccc5)nc4c3)CC2)c1 | |
171 | 214 | 9 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CSCc1nc2cc(CCN3CCN(c4cccc(C(F)(F)F)c4)CC3)ccc2[nH]1 | |
172 | 482 | >1000 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CS(=O)Cc1nc2cc(CCN3CCN(c4cccc(C(F)(F)F)c4)CC3)ccc2[nH]1 | |
173 | 3 | 6 | NaN | NaN | Arch Pharm (Weinheim). 1998 Jan;331(1):22-6. | COc1ccccc1N1CCN(CCc2ccc3[nH]c(Cc4ccccc4)nc3c2)CC1 | |
174 | 56 | 388 | NaN | NaN | Arch Pharm (Weinheim). 1998 Jan;331(1):22-6. | COc1ccccc1N1CCN(CCc2ccc3[nH] c(C(c4ccccc4)c4ccccc4)nc3c2)CC1 |
|
175 | 15 | 10 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | COc1ccccc1N1CCN(CCc2ccc3[nH]c(CSC)nc3c2)CC1 | |
176 | 25 | >1000 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | COc1ccccc1N1CCN(CCc2ccc3[nH]c(CS(C)=O)nc3c2)CC1 | |
177 | >10000 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | c1ccc(C2CCCN(CCc3ccc4nc[nH]c4c3)C2)cc1 | |
178 | 12 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | S=c1[nH]c2ccc(CCN3CCCC(c4ccccc4)C3)cc2[nH]1 | |
179 | 3 (12) | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. Boll Chim Farm. 1998 Nov;13 | S=c1[nH]c2ccc(CCN3CCCC(c4ccccc4)C3)cc2[nH]1 | |
180 | 622 (215) | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. Boll Chim Farm. 1998 Nov;1 | O=c1[nH]c2ccc(CCN3CCCC(c4ccccc4)C3)cc2[nH]c1=O | |
181 | 160 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | S=c1[nH]c2ccc(CCN3CCC(c4ccccc4)CC3)cc2[nH]1 | |
182 | 159 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | O=c1[nH]c2ccc(CCN3CCC(c4ccccc4)CC3)cc2[nH]c1=O | |
183 | 938 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | c1ccc(C2CCN(CCc3ccc4[nH]cnc4c3)CC2)cc1 | |
184 | >10000 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | O=c1[nH]c2ccccc2n1C1CCN(CCc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
185 | >10000 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | O=c1[nH]c2ccc(CCN3CCC(n4c(=O)[nH]c5ccccc54)CC3)cc2[nH]c1=O | |
186 | >10000 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | O=c1[nH]c2ccccc2n1C1CCN(CCc2ccc3[nH]cnc3c2)CC1 | |
187 | >10000 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | O=C1NCN(c2ccccc2)C12CCN(CCc1ccc3[nH]c(=S)[nH]c3c1)CC2 | |
188 | 204 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | Fc1ccc(C(=C2CCN(CCc3ccc4[nH]c(=S)[nH]c4c3)CC2)c2ccc(F)cc2)cc1 | |
189 | 270 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | O=c1[nH]c2ccc(CCN3CCC(=C(c4ccc(F)cc4) c4ccc(F)cc4)CC3)cc2[nH]c1=O |
|
190 | 421 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | Fc1ccc(C(=C2CCN(CCc3ccc4[nH]cnc4c3)CC2)c2ccc(F)cc2)cc1 | |
191 | 67 | NaN | NaN | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 Arch Pharm (Weinheim). 1997 Ja | CCCN(CCc1ccccc1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
192 | 1050 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | CCCN(CCc1ccccc1)CCc1ccc2[nH]cnc2c1 | |
193 | 314 | NaN | NaN | NaN | Arch Pharm (Weinheim). 1997 Jan-Feb;330(1-2):25-8. | CCCN(CCc1ccccc1)CCc1ccc2[nH]c(=O)c(=O)[nH]c2c1 | |
194 | >1000 | 4200 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CCCN(CCC)CCc1ccc2[nH]c(CSC)nc2c1 | |
195 | >1000 | >1000 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CCCN(CCC)CCc1ccc2[nH]c(CS(C)=O)nc2c1 | |
196 | >1000 | 20 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CSCc1nc2ccc(CCN3CCN(c4ncccn4)CC3)cc2[nH]1 | |
197 | >1000 | >1000 | NaN | NaN | Pharmazie. 1998 Jul;53(7):438-41. | CS(=O)Cc1nc2ccc(CCN3CCN(c4ncccn4)CC3)cc2[nH]1 | |
198 | 60 | >10000 | NaN | NaN | Boll Chim Farm. 1998 Nov;137(10):417-21 | S=c1[nH]c2ccc(CCN3CCCC(c4cccc5ccccc45)C3)cc2[nH]1 | |
199 | 219 | >10000 | NaN | NaN | Boll Chim Farm. 1998 Nov;137(10):417-21 | O=c1[nH]c2ccc(CCN3CCCC(c4cccc5ccccc45)C3)cc2[nH]c1=O | |
200 | 497 | >10000 | NaN | NaN | Boll Chim Farm. 1998 Nov;137(10):417-21 | ClC(Cl)c1nc2cc(CCN3CCCC(c4cccc5ccccc45)C3)ccc2[nH]1 | |
201 | 563 | >10000 | NaN | NaN | Boll Chim Farm. 1998 Nov;137(10):417-21 | BrC(Br)c1nc2cc(CCN3CCCC(c4cccc5ccccc45)C3)ccc2[nH]1 | |
202 | 49 | >10000 | NaN | NaN | Boll Chim Farm. 1998 Nov;137(10):417-21 | Oc1ccccc1C1CCCN(CCc2ccc3[nH]c(=S)[nH]c3c2)C1 | |
203 | 476 | >10000 | NaN | NaN | Boll Chim Farm. 1998 Nov;137(10):417-21 | O=c1[nH]c2ccc(CCN3CCCC(c4ccccc4O)C3)cc2[nH]c1=O |
Jedinjenja testirana na ljudskim G-protein kuplovanim receptorima
Molekul | D2 Ki [nM] | 5HT1A Ki [nM] | Referenca | SMILES | |
---|---|---|---|---|---|
1 | 135 | NaN | doi:10.1016/j.ejphar.2012.03.011 | c1ccc(N2CCN(CCOc3ccc4[nH]cnc4c3)CC2)cc1 | |
2 | 137 | NaN | doi:10.1016/j.ejphar.2012.03.011 | FC(F)(F)c1cccc(N2CCN(CCOc3ccc4[nH]cnc4c3)CC2)c1 | |
3 | 64 | NaN | doi:10.1016/j.ejphar.2012.03.011 | COc1ccccc1N1CCN(CCOc2ccc3[nH]cnc3c2)CC1 | |
4 | 2 | NaN | doi:10.1016/j.ejphar.2012.03.011 | S=c1[nH]c2ccc(OCCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
5 | 3 | NaN | doi:10.1016/j.ejphar.2012.03.011 | FC(F)(F)c1cccc(N2CCN(CCOc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1 | |
6 | 1 | NaN | doi:10.1016/j.ejphar.2012.03.011 | COc1ccccc1N1CCN(CCOc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
7 | 8 | NaN | doi:10.1016/j.ejphar.2012.03.011 | S=c1[nH]c2ccc(OCCCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
8 | 2 | NaN | doi:10.1016/j.ejphar.2012.03.011 | COc1ccccc1N1CCN(CCCOc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
9 | 2 | NaN | doi:10.1016/j.ejphar.2012.03.011 | S=c1[nH]c2ccc(OCCCN3CCN(c4cccc5ccccc45)CC3)cc2[nH]1 | |
10 | 9 | NaN | doi:10.1016/j.ejphar.2012.03.011 | FC(F)(F)c1cccc(N2CCN(CCCOc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1 | |
11 | 25 | NaN | doi:10.1016/j.ejphar.2012.03.011 | c1ccc(N2CCN(CCCOc3ccc4nc[nH]c4c3)CC2)cc1 | |
12 | 8 | NaN | doi:10.1016/j.ejphar.2012.03.011 | COc1ccccc1N1CCN(CCCOc2ccc3nc[nH]c3c2)CC1 | |
13 | 2 | NaN | doi:10.1016/j.ejphar.2012.03.011 | c1ccc2c(N3CCN(CCCOc4ccc5nc[nH]c5c4)CC3)cccc2c1 | |
14 | 20 | NaN | doi:10.1016/j.ejphar.2012.03.011 | FC(F)(F)c1cccc(N2CCN(CCCOc3ccc4nc[nH]c4c3)CC2)c1 | |
15 | 457 | 2662 | doi:10.1002/ardp.201300189 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1ccccc1 | |
16 | 723 | 575 | doi:10.1002/ardp.201300189 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1ccccc1O | |
17 | 183 | 418 | doi:10.1002/ardp.201300189 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1ccccn1 | |
18 | 127 | 182 | doi:10.1002/ardp.201300189 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1cccnc1 | |
19 | 19 | 982 | doi:10.1002/ardp.201300189 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1ccncc1 | |
20 | 56 | 691 | doi:10.1002/ardp.201300189 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1ccnnc1 | |
21 | 183 | 142 | doi:10.1002/ardp.201300189 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1cnccn1 | |
22 | 19 | NaN | doi: 10.2298/JSC140423070S | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1ccc(O)nc1 | |
23 | 154 | NaN | doi: 10.2298/JSC140423070S | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)c1cccnc1O | |
24 | 416 | 38 | doi:10.1002/ardp.201300189 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1ccccc1 | |
25 | 220 | 51 | doi:10.1002/ardp.201300189 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1ccccc1O | |
26 | 72 | 2 | doi:10.1002/ardp.201300189 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1ccccn1 | |
27 | 83 | 2 | doi:10.1002/ardp.201300189 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1cccnc1 | |
28 | 471 | 8 | doi:10.1002/ardp.201300189 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1ccncc1 | |
29 | 270 | 0.6 | doi:10.1002/ardp.201300189 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1ccnnc1 | |
30 | 172 | 3 | doi:10.1002/ardp.201300189 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1cnccn1 | |
31 | 96 | NaN | doi: 10.2298/JSC140423070S | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1ccc(O)nc1 | |
32 | 120 | NaN | doi: 10.2298/JSC140423070S | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)c1cccnc1O | |
33 | 1250 | 260 | doi:10.1002/ardp.201300189 | O=C(Nc1ccccc1CCN1CCN(c2ccccc2)CC1)c1ccccc1 | |
34 | 1800 | 399 | doi:10.1002/ardp.201300189 | O=C(Nc1ccccc1CCN1CCN(c2ccccc2)CC1)c1ccccc1O | |
35 | 1400 | 305 | doi:10.1002/ardp.201300189 | O=C(Nc1ccccc1CCN1CCN(c2ccccc2)CC1)c1ccccn1 | |
36 | 2400 | 86 | doi:10.1002/ardp.201300189 | O=C(Nc1ccccc1CCN1CCN(c2ccccc2)CC1)c1cccnc1 | |
37 | 3700 | 438 | doi:10.1002/ardp.201300189 | O=C(Nc1ccccc1CCN1CCN(c2ccccc2)CC1)c1ccncc1 | |
38 | 3900 | 27 | doi:10.1002/ardp.201300189 | O=C(Nc1ccccc1CCN1CCN(c2ccccc2)CC1)c1ccnnc1 | |
39 | 2400 | 494 | doi:10.1002/ardp.201300189 | O=C(Nc1ccccc1CCN1CCN(c2ccccc2)CC1)c1cnccn1 | |
40 | 4189 | 903 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1ccccc1)Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1 | |
41 | 71 | 95 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1ccccn1)Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1 | |
42 | 70 | 160 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1cccnc1)Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1 | |
43 | 49 | 122 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1ccncc1)Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1 | |
44 | 482 | 2264 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1ccccc1)Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1 | |
45 | 14 | 126 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)Nc1ccccn1 | |
46 | 8 | 398 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1)Nc1cccnc1 | |
47 | 4 | 227 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1ccncc1)Nc1ccc(CCN2CCN(c3ccccc3)CC2)cc1 | |
48 | 3575 | 0.6 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1ccccc1)Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1 | |
49 | 278 | 5 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1ccccn1)Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1 | |
50 | 82 | 1 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1cccnc1)Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1 | |
51 | 202 | 2 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Cc1ccncc1)Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1 | |
52 | 3250 | 6 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1ccccc1)Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1 | |
53 | 364 | 8 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1)Nc1ccccn1 | |
54 | 30 | 1 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1cccnc1)Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1 | |
55 | 49 | 0.5 | doi:10.1016/j.bmcl.2012.04.098 | O=C(Nc1ccncc1)Nc1cccc(CCN2CCN(c3ccccc3)CC2)c1 |
Jedinjenja testirana na pacovskim G-protein kuplovanim receptorima
Molecule | D2 Ki [nM] | 5HT1A Ki [nM] | 5HT2A Ki [nM] | Alpha 1 Ki [nM] | Reference | SMILES | |
---|---|---|---|---|---|---|---|
1 | 72 | NaN | 79 | 43 | doi: 10.1002/ardp.200900168 | c1ccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)cc1 | |
2 | 2042 | NaN | 891 | 676 | doi: 10.1002/ardp.200900168 | c1cnc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)nc1 | |
3 | 51 | 83 | 5 | 68 | doi:10.1016/j.bmcl.2004.06.005 | Cc1cccc(N2CCN(CCc3ccc4nn[nH]c4c3)CC2)c1C | |
4 | 2 | 126 | 15 | 93 | doi:10.1016/j.bmcl.2004.06.005 | c1ccc2c(N3CCN(CCc4ccc5nc[nH]c5c4)CC3)cccc2c1 | |
5 | 24 | 39 | 10 | NaN | doi:10.1016/j.bmcl.2004.06.005 | c1ccc2c(N3CCN(CCc4ccc5nn[nH]c5c4)CC3)cccc2c1 | |
6 | 32 | 174 | 759 | NaN | doi:10.1016/j.bmcl.2004.06.005 | c1ccc(-c2nc3ccc(CCN4CCN(c5ccccc5)CC4)cc3[nH]2)cc1 | |
7 | 9 | NaN | 49 | 5 | 10.1002/ardp.200900168 | COc1ccccc1N1CCN(CCc2ccc3nc[nH]c3c2)CC1 | |
8 | 5 | 79 | 141 | NaN | doi:10.1016/j.bmcl.2004.06.005 | COc1ccccc1N1CCN(CCc2ccc3nn[nH]c3c2)CC1 | |
9 | 51 | NaN | 38 | 204 | doi: 10.1002/ardp.200900168 | FC(F)(F)c1cccc(N2CCN(CCc3ccc4nc[nH]c4c3)CC2)c1 | |
10 | 28 | 87 | 1548 | NaN | doi:10.1016/j.bmcl.2004.06.005 | O=c1[nH]c2ccc(CCN3CCN(c4cccc(C(F)(F)F)c4)CC3)cc2[nH]c1=O | |
11 | 15 | NaN | 66 | 15 | doi: 10.1002/ardp.200900168 | Clc1ccccc1N1CCN(CCc2ccc3nc[nH]c3c2)CC1 | |
12 | 28 | 174 | 81 | 35 | doi: 10.2298/JSC0705429A | O=[N+]([O-])c1ccccc1N1CCN(CCc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
13 | 2 | 126 | 15 | 93 | doi:10.1016/j.bmcl.2004.06.005 | c1ccc2c(N3CCN(CCc4ccc5nc[nH]c5c4)CC3)cccc2c1 | |
14 | 24 | 39 | 10 | NaN | doi:10.1016/j.bmcl.2004.06.005 | c1ccc2c(N3CCN(CCc4ccc5nn[nH]c5c4)CC3)cccc2c1 | |
15 | 19 | 43 | 16 | 11 | doi: 10.2298/JSC0705429A | O=[N+]([O-])c1ccccc1N1CCN(CCc2ccc3nc[nH]c3c2)CC1 | |
16 | 41 | NaN | 38 | 15 | doi: 10.1002/ardp.200900168 | Clc1cc(CCN2CCN(c3ccccc3)CC2)cc2[nH]cnc12 | |
17 | 11 | NaN | 16 | 3 | doi: 10.1002/ardp.200900168 | COc1ccccc1N1CCN(CCc2cc(Cl)c3nc[nH]c3c2)CC1 | |
18 | 16 | NaN | 13 | 3 | doi: 10.1002/ardp.200900168 | Clc1ccccc1N1CCN(CCc2cc(Cl)c3nc[nH]c3c2)CC1 | |
19 | 281 | NaN | 33 | 155 | doi: 10.1002/ardp.200900168 | FC(F)(F)c1cccc(N2CCN(CCc3cc(Cl)c4nc[nH]c4c3)CC2)c1 | |
20 | 616 | NaN | 295 | 380 | doi: 10.1002/ardp.200900168 | Clc1cc(CCN2CCN(c3ncccn3)CC2)cc2[nH]cnc12 | |
21 | 42 | 1175 | 13 | 22 | doi: 10.2298/JSC0705429A | O=[N+]([O-])c1ccccc1N1CCN(CCc2cc(Cl)c3nc[nH]c3c2)CC1 | |
22 | 26 | NaN | 17 | 5 | doi: 10.1002/ardp.200900168 | Brc1cc(CCN2CCN(c3ccccc3)CC2)cc2[nH]cnc12 | |
23 | 3 | NaN | 5 | 0.4 | doi: 10.1002/ardp.200900168 | COc1ccccc1N1CCN(CCc2cc(Br)c3nc[nH]c3c2)CC1 | |
24 | 3 | NaN | 8 | 1 | doi: 10.1002/ardp.200900168 | Clc1ccccc1N1CCN(CCc2cc(Br)c3nc[nH]c3c2)CC1 | |
25 | 72 | NaN | 15 | 123 | doi: 10.1002/ardp.200900168 | FC(F)(F)c1cccc(N2CCN(CCc3cc(Br)c4nc[nH]c4c3)CC2)c1 | |
26 | 229 | NaN | 148 | 575 | doi: 10.1002/ardp.200900168 | Brc1cc(CCN2CCN(c3ncccn3)CC2)cc2[nH]cnc12 | |
27 | 95 | 155 | 10 | 10 | doi: 10.2298/JSC0705429A | O=[N+]([O-])c1ccccc1N1CCN(CCc2cc(Br)c3nc[nH]c3c2)CC1 | |
28 | 83 | 182 | 148 | 59 | doi: 10.2298/JSC0705429A | O=[N+]([O-])c1ccccc1N1CCN(CCc2cc(Cl)c3[nH]c(=S)[nH]c3c2)CC1 | |
29 | 115 | 209 | 144 | 23 | doi: 10.2298/JSC0705429A | O=[N+]([O-])c1ccccc1N1CCN(CCc2cc(Br)c3[nH]c(=S)[nH]c3c2)CC1 | |
30 | 42 | 933 | 2 | 29.5 | doi:10.1016/j.bmcl.2007.08.066 | S=c1[nH]c2ccc(OCCCN3CCN(c4ccccc4)CC3)cc2[nH]1 | |
31 | 2 | 178 | 19 | 1.9 | doi:10.1016/j.bmcl.2007.08.066 | COc1ccccc1N1CCN(CCCOc2ccc3[nH]c(=S)[nH]c3c2)CC1 | |
32 | 95 | 550 | 190 | 426 | doi:10.1016/j.bmcl.2007.08.066 | S=c1[nH]c2ccc(OCCCN3CCN(c4cccc5ccccc45)CC3)cc2[nH]1 | |
33 | 363 | 100 | 316 | 490 | doi:10.1016/j.bmcl.2007.08.066 | FC(F)(F)c1cccc(N2CCN(CCCOc3ccc4[nH]c(=S)[nH]c4c3)CC2)c1 | |
34 | 76 | 646 | 14 | 26 | doi:10.1016/j.bmcl.2007.08.066 | c1ccc(N2CCN(CCCOc3ccc4nc[nH]c4c3)CC2)cc1 | |
35 | 9 | 15 | 79 | 6 | doi:10.1016/j.bmcl.2007.08.066 | COc1ccccc1N1CCN(CCCOc2ccc3nc[nH]c3c2)CC1 | |
36 | 42 | 60 | 51 | 63 | doi:10.1016/j.bmcl.2007.08.066 | c1ccc2c(N3CCN(CCCOc4ccc5nc[nH]c5c4)CC3)cccc2c1 | |
37 | 15 | 389 | 102 | 120 | doi:10.1016/j.bmcl.2007.08.066 | FC(F)(F)c1cccc(N2CCN(CCCOc3ccc4nc[nH]c4c3)CC2)c1 | |
38 | 736 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(Cc3ccccc3)CC2)CC1 | |
39 | 521 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(Cc3ccccc3[N+](=O)[O-])CC2)CC1 | |
40 | 937 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)CC1 | |
41 | 1512 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)CC1 | |
42 | 341 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(Cc3ccccc3)CC2)CC1 | |
43 | 31 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(Cc3ccccc3[N+](=O)[O-])CC2)CC1 | |
44 | 258 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)CC1 | |
45 | 200 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)CC1 | |
46 | 1583 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(C(=O)c3ccccc3)CC2)CC1 | |
47 | 1205 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1 | |
48 | 755 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1 | |
49 | 905 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 | |
50 | 189 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(C(=O)c3ccccc3)CC2)CC1 | |
51 | 219 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1 | |
52 | 300 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1 | |
53 | 334.5 | NaN | NaN | NaN | doi: 10.2298/JSC151021097P | COc1ccccc1N1CCN(CC2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 | |
54 | 3278 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(C(=O)Cc3ccccc3)CC2)CC1 | |
55 | 2538 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])CC2)CC1 | |
56 | 708 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 | |
57 | 1589 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)CC1 | |
58 | 1593 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(C(=O)Cc3ccccc3)CC2)CC1 | |
59 | 450 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1 | |
60 | 146 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1 | |
61 | 1465 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 | |
62 | 930 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(CCc3ccccc3)CC2)CC1 | |
63 | 500 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(CCc3ccccc3[N+](=O)[O-])CC2)CC1 | |
64 | 229 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(CCc3cccc([N+](=O)[O-])c3)CC2)CC1 | |
65 | 360 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 | |
66 | 1779 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(CCc3ccccc3)CC2)CC1 | |
67 | 319 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(CCc3ccccc3[N+](=O)[O-])CC2)CC1 | |
68 | 54 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(CCc3cccc([N+](=O)[O-])c3)CC2)CC1 | |
69 | 1530 | NaN | NaN | NaN | doi: 10.1002/ardp.201600081 | COc1ccccc1N1CCN(CC2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)CC1 |
Jedinjenja samo sa IC50 vrednostima, testirana na goveđim G-protein kuplovanim receptorima
Molekul | D2 IC50 [µM] | 5HT1A IC50 [µM] | Referenca | SMILES | |
---|---|---|---|---|---|
1 | 50 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 Curr Med Chem. 1998 Dec;5(6):49 | CCCN(CCC)CCc1ccc2[nH]cnc2c1 | |
2 | 50 | NaN | Bioorg Med Chem Lett 1991 1(8) 403-406 Curr Med Chem. 1998 Dec;5(6):493-512. | CCCN(CCC)CCc1ccc2[nH]nnc2c1 | |
3 | 3 | NaN | Bioorg Med Chem Lett 1991 1(8) 403-406 Curr Med Chem. 1998 Dec;5(6):493-512. | CCCN(CCC)CCc1ccc2[nH]c(=O)c(=O)[nH]c2c1 | |
4 | 3 | >1000 | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 Curr Med Chem. 1998 Dec;5(6):4 | CCCN(CCC)CCc1ccc2[nH]c(SC)nc2c1 | |
5 | >1000 | NaN | Curr Med Chem. 1998 Dec;5(6):493-512. | CCCN(CCC)CCc1ccc2[nH]c(SC)nc2c1 | |
6 | 1000 | >1000 | Bioorg Med Chem Lett 1991 1(8) 403-406 Curr Med Chem. 1998 Dec;5(6):493-512. D | CCCN(CCC)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
7 | >1000 | >1000 | Bioorg Med Chem Lett 1991 1(8) 403-406 Curr Med Chem. 1998 Dec;5(6):493-512. | CCCN(CCC)CCc1ccc2[nH]c(=O)[nH]c2c1 | |
8 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | NCCc1ccc(N)c(N)c1 | |
9 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | CC(=O)Nc1ccc(CCN)cc1NC(C)=O | |
10 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | NCCc1ccc(NC(=O)C(F)(F)F)c(NC(=O)C(F)(F)F)c1 | |
11 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | CS(=O)(=O)Nc1ccc(CCN)cc1NS(C)(=O)=O | |
12 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | CCCN(CCC)CCc1ccc(N)c(N)c1 | |
13 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | CCCN(CCC)CCc1ccc(NC(C)=O)c(NC(C)=O)c1 | |
14 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | CCCN(CCC)CCc1ccc(NC(=O)C(F)(F)F)c(NC(=O)C(F)(F)F)c1 | |
15 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | CCCN(CCC)CCc1ccc(NS(C)(=O)=O)c(NS(C)(=O)=O)c1 | |
16 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | NCCc1ccc2nc[nH]c2c1 | |
17 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | NCCc1ccc2nn[nH]c2c1 | |
18 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | NCCc1ccc2[nH]c(=O)[nH]c2c1 | |
19 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | NCCc1ccc2[nH]c(=S)[nH]c2c1 | |
20 | >100 | NaN | Arzneim. Forsch Drug Res 44 (I) 6 697-702 1994 | NCCc1ccc2[nH]c(=O)c(=O)[nH]c2c1 | |
21 | 3.4 | NaN | Pharmazie 1995 50 678-680 | CCCN(CCC)C1CCc2cc3nc[nH]c3cc2C1 | |
22 | 1.9 | NaN | Pharmazie 1995 50 678-680 | CCCN(CCC)C1CCc2cc3nn[nH]c3cc2C1 | |
23 | 1.3 | NaN | Pharmazie 1995 50 678-680 | CCCN(CCC)C1CCc2cc3[nH]c(=S)[nH]c3cc2C1 | |
24 | 5.2 | NaN | Pharmazie 1995 50 678-680 | CCCN(CCC)C1CCc2cc3[nH]c(=O)c(=O)[nH]c3cc2C1 | |
25 | 114 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCCc1ccccc1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
26 | 470 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCCc1ccccc1)CCc1ccc2[nH]c(=O)c(=O)[nH]c2c1 | |
27 | 240 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(C)cc1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
28 | 198 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(Cl)cc1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
29 | 203 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(O)cc1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
30 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(-c2ccccc2)cc1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
31 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(-c2ccccc2)cc1)CCc1ccc2[nH]c(=O)c(=O)[nH]c2c1 | |
32 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(-c2ccccc2)cc1)CCc1ccc2[nH]nnc2c1 | |
33 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(-c2ccccc2)cc1)CCc1ccc2[nH]cnc2c1 | |
34 | 53 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1cccc(C)c1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
35 | 244 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1cccc(OC)c1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
36 | 20 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1cccc(O)c1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
37 | 152 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1cccc(O)c1)CCc1ccc2[nH]nnc2c1 | |
38 | 952 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1cccc(O)c1)CCc1ccc2[nH]cnc2c1 | |
39 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc(OC)c(OC)c1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
40 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2[nH]c(=S)[nH]c2c1)CC(c1ccccc1)c1ccccc1 | |
41 | 17 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2[nH]c(=S)[nH]c2c1)CCc1cccc2ccccc12 | |
42 | 75 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2[nH]c(=O)c(=O)[nH]c2c1)CCc1cccc2ccccc12 | |
43 | 350 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2[nH]nnc2c1)CCc1cccc2ccccc12 | |
44 | 465 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2[nH]cnc2c1)CCc1cccc2ccccc12 | |
45 | 806 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2ccccc2c1)CCc1ccc2[nH]c(=S)[nH]c2c1 | |
46 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2ccccc2c1)CCc1ccc2[nH]c(=O)c(=O)[nH]c2c1 | |
47 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2ccccc2c1)CCc1ccc2[nH]nnc2c1 | |
48 | >100 | NaN | Arzneim Forsch Drug Res 46 (II) 8 741-746 1996 | CCCN(CCc1ccc2ccccc2c1)CCc1ccc2[nH]cnc2c1 | |
49 | >100 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(C)nc2c1 | |
50 | >100 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(CC)nc2c1 | |
51 | >100 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(C(C)C)nc2c1 | |
52 | >100 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(C(F)(F)F)nc2c1 | |
53 | 2.2 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(C(Cl)(Cl)Cl)nc2c1 | |
54 | 22.4 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(C(F)F)nc2c1 | |
55 | 0.59 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(C(Cl)Cl)nc2c1 | |
56 | 0.24 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(C(Br)Br)nc2c1 | |
57 | >100 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(CO)nc2c1 | |
58 | >100 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCC)CCc1ccc2[nH]c(COC(C)=O)nc2c1 | |
59 | 0.09 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCc1ccc2[nH]c(C(Cl)Cl)nc2c1)CCc1cccc2ccccc12 | |
60 | 0.119 | NaN | Pharmazie 51 1996 694-697 | CCCN(CCc1ccc2[nH]c(C(Br)Br)nc2c1)CCc1cccc2ccccc12 | |
61 | 50 | NaN | Pharmazie 51 1996 694-697 | CCCN(CC)CCc1ccc2[nH]cnc2c1 | |
62 | 7 | 7.1 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(-c3ccccc3)nc2c1 | |
63 | >100 | 2.9 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(-c3ccccn3)nc2c1 | |
64 | 11 | >100 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(-c3cccnc3)nc2c1 | |
65 | 10.8 | 42 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(Cc3ccccc3)nc2c1 | |
66 | 3.8 | 2.9 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(Cc3ccc(Cl)cc3)nc2c1 | |
67 | 1.5 | 0.78 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(Cc3ccc([N+](=O)[O-])cc3)nc2c1 | |
68 | 7.2 | 3.3 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(Cc3cccc4ccccc34)nc2c1 | |
69 | 2.9 | 4.2 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(Cc3ccccn3)nc2c1 | |
70 | >100 | >100 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(Cc3cccnc3)nc2c1 | |
71 | 3.1 | 6.4 | J Serb Chem Soc 1997 62(9) 769-775 | CCCN(CCC)CCc1ccc2[nH]c(C(c3ccccc3)c3ccccc3)nc2c1 |