UCSF

ZINC04536053

Substance Information

In ZINC since Heavy atoms Benign functionality
December 7th, 2005 20 No

CAS Number: 146-77-0

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) 0.14 -4.52 -15.21 5 9 0 140 301.69 2

Vendor Notes

Note Type Comments Provided By
Purity ¡Ý98.0% APIChem

Activity (Go SEA)

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