UCSF

ZINC06474144

Substance Information

In ZINC since Heavy atoms Benign functionality
March 31st, 2006 28 Yes

CAS Number: 117621-64-4

Other Names:

BRD-A89208012-001-01-4

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) 5.05 -0.71 -50.62 1 5 -1 78 401.866 7

Activity (Go SEA)

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