UCSF

ZINC34733778

Substance Information

In ZINC since Heavy atoms Benign functionality
September 24th, 2009 24 Yes

CAS Numbers: 52659-56-0 , [52659-56-0]

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) 2.01 -1.43 -7.4 4 4 0 81 338.488 3

Activity (Go SEA)

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