Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol36002 O=C(O)CC(C(=O)O)C(P(=O)(O)O)P(=O)(O)O 2 4
mol36003 O=C(O)CC(C(=O)O)N(CCN(C(=S)S)C(CC(=O)O)C(=O)O)C(=S)S 2 3
mol36004 O=C(O)CC(N=Cc1ccccc1O)C(=O)O 2 2
mol36005 O=C(O)CC(NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(=O)O 2 3
mol36006 O=C(O)CC(O)(CC(=O)O)C(=O)Nc1ccccc1 2 2
mol36007 O=C(O)CC(O)(O)C(F)(F)F 2 2
mol36008 O=C(O)CC(Oc1ccccc1)C(=O)O 2 3
mol36009 C/C(=C(/S)CCO)N(C=O)Cc1cnc(C)nc1N 2 8
mol36010 C=CCSS/C(CCO)=C(/C)N(C=O)Cc1cnc(C)nc1N 2 6
mol36011 CC1=C(CCO)SC(O)N1Cc1cnc(C)nc1N 2 6
mol36012 Cc1ncc(CN2CCCCC2)c(N)n1 2 3
mol36013 Cc1ncc(CNc2ccccc2)c(N)n1 2 5
mol36014 Cc1ncc(CO)c(/C=N/NC(=O)c2ccncc2)c1O 2 6
mol36015 C=CCNC(=S)N/N=C/c1c(CO)cnc(C)c1O 2 8
mol36016 Cc1ncc(CO)c(/C=N/NC(=S)Nc2ccccc2)c1O 2 10
mol36017 Cc1ncc(CO)c(/C=N/NC(N)=S)c1O 2 4
mol36018 Cc1ncc(CO)c(/C=N/Nc2ccccn2)c1O 2 12
mol36019 Cc1ncc(COP(=O)(O)O)c(C(O)C#N)c1O 2 4
mol36020 Cc1ncc(COP(=O)(O)O)c(C=NCC(=O)O)c1O 2 7
mol36021 Cc1ncc(COP(=O)(O)O)c(C=NCCCCCC(=O)O)c1O 2 6