Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol9001 O=c1nc[nH][nH]c1=O 3 3
mol9002 O=c1nc[nH]c(=O)[nH]1 2 3
mol9003 O=C(O)c1c[nH]nn1 3 3
mol9004 O=C(O)/C=C\Cl 2 2
mol9005 O=C(O)/C=C/Br 2 2
mol9006 O=C(O)/C=C\Br 2 2
mol9007 O=C(O)/C=C/I 2 2
mol9008 O=C(O)/C=C\I 2 2
mol9009 O=c1[nH][nH]c(=O)c(=O)[nH]1 2 4
mol9010 O=C(O)/C=C/[N+](=O)[O-] 2 2
mol9011 N#CCC([N+](=O)[O-])[N+](=O)[O-] 2 2
mol9012 O=C1NC(=O)C(=NO)C(=O)N1 4 5
mol9013 O=c1[nH]c(O)c([N+](=O)[O-])c(=O)[nH]1 2 4
mol9014 S=c1cn[nH]c(=S)[nH]1 2 3
mol9015 Nc1nc(=O)cn[nH]1 2 4
mol9016 CC(=O)C(Cl)Cl 2 3
mol9017 OCC(F)(F)C(F)F 2 2
mol9018 O=C1CNC(=O)N1 2 3
mol9019 Nc1n[nH]c(=O)[nH]c1=O 2 3
mol9020 O=C(C=NO)C=NO 3 3