UCSF

ZINC09970259

Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2007 24 No

CAS Numbers: 497-76-7 , [497-76-7]

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) 0.99 -7.99 -11.35 5 7 0 119 342.388 3

Activity (Go SEA)

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