Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol15501 O=C(O)CN(CC(=O)O)Cc1nc2ccccc2[nH]1 3 7
mol15502 COP(=O)(Nc1nccs1)c1ccc([N+](=O)[O-])cc1 2 2
mol15503 CN(C)Cc1cc(/N=N/c2ccccc2)ccc1O 2 3
mol15504 N#CC1C=CN(Cc2cccc(F)c2)C=C1C(N)=O 2 2
mol15505 Nc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1 2 2
mol15506 CC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1 3 3
mol15507 Cc1cc(C)nc(NS(=O)(=O)c2ccc(O)cc2)n1 3 4
mol15508 Cc1cccc(NS(=O)(=O)c2ccc(N)cc2)[n+]1[O-] 2 3
mol15509 C[N+](C)(C)CCC[N+](C)(C)CCCNC(=O)/C=N/O 2 2
mol15510 CN(C)CCCCCCCCCCNC(=O)/C=N/O 3 4
mol15511 NC(=O)CC[C@H](N)C(=O)N[C@@H](CCC(=O)O)C(=O)O 4 5
mol15512 CN1C[C@H](CO)C[C@H]2c3cccc4[nH]cc(c34)C[C@@H]21 2 2
mol15513 CN1C[C@@H](CO)C[C@H]2c3cccc4[nH]cc(c34)C[C@@H]21 2 2
mol15514 c1ccc([C@@H]2CN3CCC[C@@H]3c3ccccc32)cc1 2 2
mol15515 Cc1c(N)ccc2c1-c1c(ccc3ccccc13)C2 2 2
mol15516 C[C@H]1C[C@@]23[C@@H]4CCCN2CCC[C@H]3[C@@H](O)C[C@H]4C1=O 2 2
mol15517 CN1CCCC1c1cncc2[nH]c3ccccc3c12 3 4
mol15518 O=C1C(O)=C(c2ccccc2)C(=O)c2ccccc21 2 2
mol15519 C(=C\c1nnnn1-c1ccccc1)\c1ccccc1 2 6
mol15520 C(=C/c1nnnn1-c1ccccc1)\c1ccccc1 2 4