Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol11061 O=S(O)CCCc1ccccc1 2 2
mol11062 O=c1[nH]cc(C2CCCC2O)c(=O)[nH]1 0 0
mol11063 Cc1cn(C2CCCO2)c(=O)[nH]c1=O 0 0
mol11064 CCn1c(=O)c2[nH]c(=O)[nH]c2n(CC)c1=O 2 3
mol11065 Cc1cc(O)cc(C)c1S(C)(=O)=O 2 2
mol11066 COC(=O)C1=CN(C)C(=O)NC1CC(=O)O 0 0
mol11067 O=c1[nH]cc([C@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)c(=O)[nH]1 0 0
mol11068 O=c1ccn([C@@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)c(=O)[nH]1 0 0
mol11069 O=c1[nH]cc([C@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1 2 3
mol11070 O=c1[nH]cc([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]1 4 11
mol11071 Cc1nc(=S)c2c([nH]1)CCCC2 3 3
mol11072 NCCCc1ccccc1O 2 3
mol11073 CN(C)Cc1ccccc1O 3 4
mol11074 CN(C)Cc1cccc(O)c1 2 3
mol11075 CN(C)Cc1ccc(O)cc1 2 3
mol11076 CN(C)c1ccc(C(=O)NN)cc1 4 5
mol11077 CCN(O)N=Nc1ccc(C)cc1 2 2
mol11078 CCCN(O)N=Nc1ccccc1 2 2
mol11079 CN(C)Cc1cccc(O)c1O 2 4
mol11080 CCN(O)N=Nc1ccc(OC)cc1 2 2