UCSF

ZINC04556491

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2005 18 No

CAS Numbers: 59080-45-4 , [59080-45-4]

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) 0.42 -8.65 -7.65 4 6 0 99 264.318 7

Activity (Go SEA)

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