UCSF

ZINC00497084

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 20 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) 0.14 7.24 -24.31 2 4 1 52 284.364 3
Lo Low (pH 4.5-6) 0.14 7.79 -92.38 3 4 2 53 285.372 3

Activity (Go SEA)

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