Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol14341 CC(=O)c1c(C(=O)O)cccc1[N+](=O)[O-] 2 2
mol14342 COP(=O)(O)NS(=O)(=O)c1ccccc1 3 4
mol14343 CC(=O)NS(=O)(=O)c1ccsc1C(=O)O 2 3
mol14344 NC(=O)C(CCC(=O)O)c1ccccc1 2 2
mol14345 C[S+](C)CC(=O)c1ccc([N+](=O)[O-])cc1 0 0
mol14346 CN(C)c1ccc(NC(=O)/C=N/O)cc1 3 4
mol14347 N#CC(C#N)Cc1ccc([N+](=O)[O-])cc1 2 2
mol14348 CCCCc1c(C)nc(NCC)nc1O 3 5
mol14349 COC(=O)C(Cc1c[nH]cn1)NC(C)=O 2 2
mol14350 CBr 0 0
mol14351 C#N 0 0
mol14352 OCO 3 3
mol14353 N#CS 0 0
mol14354 CNCl 2 2
mol14355 N#CO 2 2
mol14356 C#[N+]O 0 0
mol14357 c1ccc([P+](c2ccccc2)(c2ccccc2)C2c3ccccc3-c3ccccc32)cc1 0 0
mol14358 COc1cc(S(C)(=O)=O)cc(C(=O)N[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1OC 2 2
mol14359 COc1cc(S(N)(=O)=O)cc(C(=O)N[C@@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)c1OC 2 2
mol14360 C=Cc1c(C)c2cc3nc(c(CC(=O)OC)c4[nH]c(cc5nc(cc1[nH]2)C(C)=C5CC)c(C)c4C(=O)NCC)[C@@H](CCC(=O)OC)[C@@H]3C 2 9