UCSF

ZINC20233000

Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 34 No

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) 4.81 13.52 -71.98 1 6 0 74 483.008 12
Lo Low (pH 4.5-6) 4.81 12.7 -51.44 2 6 1 71 484.016 12

Activity (Go SEA)

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