Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol13381 NCC[n+]1cc(Br)c2ccccc2c1 2 2
mol13382 Cc1nc(-c2ccccc2S)[nH]c1C 3 3
mol13383 O=C1NC(=O)c2c1cccc2[N+](=O)[O-] 2 2
mol13384 O=C1NC(=O)c2cc([N+](=O)[O-])ccc21 2 2
mol13385 O=C1NC(=O)C(=Cc2ccccc2)N1 2 3
mol13386 O=C1NC(=O)C(Cc2ccccc2)N1 2 3
mol13387 O=C1CC(c2ccccc2)NC(=O)N1 2 3
mol13388 Nc1ccc(C(=O)O)c2ncccc12 0 0
mol13389 O=C(O)CCc1nc2ccccc2[nH]1 4 4
mol13390 O=S1(=O)Cc2cc(Br)ccc2N=CN1 2 2
mol13391 COC(=O)c1nc2cc(Cl)ccc2[nH]1 3 3
mol13392 Cn1c(CCl)nc2c(O)ccc(O)c21 3 4
mol13393 Cn1c(CBr)nc2c(O)ccc(O)c21 2 2
mol13394 O=[N+]([O-])c1cccc(C2NCCS2)c1 2 2
mol13395 O=[N+]([O-])c1ccc(C2NCCS2)cc1 2 2
mol13396 CCOc1ccc2[nH]c(CC)nc2c1 2 2
mol13397 CCCc1ncnc2c(O)cccc12 2 2
mol13398 CCc1c(-c2ccccc2)n[nH]c1O 2 3
mol13399 Cc1nn(-c2ccccc2)c(O)c1C 3 3
mol13400 Cc1nn(C)c(O)c1-c1ccccc1 2 2