Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol18901 O=[N+]([O-])c1ncn(CCCNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 2 2
mol18902 O=[N+]([O-])c1ncn(CCCNCc2ccc3ccc(Cl)cc3n2)n1 2 2
mol18903 O=[N+]([O-])c1ncn(CCCN(Cc2ccc3ccc(Cl)cc3n2)Cc2ccc3ccc(Cl)cc3n2)n1 2 2
mol18904 O=[N+]([O-])c1ncn(CCCN(Cc2ccc3cc(Br)ccc3n2)Cc2ccc3cc(Br)ccc3n2)n1 2 2
mol18905 O=[N+]([O-])c1ncn(CCCNCc2ccc(C(F)(F)F)cc2)n1 2 2
mol18906 O=[N+]([O-])c1ncn(CCCN(Cc2ccc(C(F)(F)F)cc2)Cc2ccc(C(F)(F)F)cc2)n1 2 2
mol18907 O=[N+]([O-])c1ncn(CCCN2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)n1 2 3
mol18908 O=[N+]([O-])c1ncn(CCCCN2CCN(Cc3ccc(C(F)(F)F)cc3)CC2)n1 2 3
mol18909 O=[N+]([O-])c1ncn(CCCN2CCN(c3ccc(C(F)(F)F)cc3)CC2)n1 2 2
mol18910 CCCCCCCCC1CCC(=O)N1CCCCCCC(=O)O 2 2
mol18911 CCCCCCCCc1c[nH]c(=O)n1CCCCCCC(=O)O 2 2
mol18912 CCCCCCCCC1C(=O)NC(=O)N1CCCCCCC(=O)O 2 2
mol18913 CCCCCC(O)CCC1CCC(=O)N1CCCCCCC(=O)O 2 2
mol18914 COCCOc1ccn2c(-c3ccc4cccc(O[C@@H]5CCNC[C@H]5F)c4n3)cnc2c1 2 3
mol18915 COCCOc1ccn2c(-c3ccc4cccc(O[C@@H]5CCNC[C@@H]5F)c4n3)cnc2c1 2 4
mol18916 COCCOc1ccn2c(-c3ccc4cccc(OC5CCNCC5)c4n3)cnc2c1 2 4
mol18917 COc1cc(OC)c(/C=C/S(=O)(=O)Cc2cnc(OC)c(N)c2)c(OC)c1 2 3
mol18918 COc1cc(OC)c(/C=C/S(=O)(=O)Cc2ccc(OC)c(N)n2)c(OC)c1 2 3
mol18919 COc1cc(OC)c(/C=C/S(=O)(=O)Cc2ccc(OC)c(NS(C)(=O)=O)n2)c(OC)c1 2 2
mol18920 COc1cc(OC)c(/C=C/S(=O)(=O)Cc2cnc(OC)c(NS(C)(=O)=O)c2)c(OC)c1 2 2