UCSF

ZINC13783493

Substance Information

In ZINC since Heavy atoms Benign functionality
June 25th, 2008 22 No

CAS Number: 97240-79-4

Other Names:

TOPAMAX

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.16 -1.83 -42.22 1 9 -1 113 338.358 3
Mid Mid (pH 6-8) 0.16 -2.32 -14.01 2 9 0 116 339.366 3

Vendor Notes

Note Type Comments Provided By
Therapy anticonvulsant, antimigraine, GABA-A agonist, AMP/kinate glutamate receptor antagonist, carbonic anhydrase inhibitor SMDC Iconix

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )