UCSF

ZINC05631131

Substance Information

In ZINC since Heavy atoms Benign functionality
February 8th, 2006 9 Yes

CAS Numbers: 533-67-5 , [533-67-5]

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) -1.52 -7.88 -7.54 3 4 0 69 134.131 0

Activity (Go SEA)

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