UCSF

ZINC06472665

Substance Information

In ZINC since Heavy atoms Benign functionality
March 31st, 2006 26 No

CAS Number: [50-24-8]

Other Names:

MFCD00003649

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) 1.59 -4.02 -16.76 3 5 0 94 360.45 2

Activity (Go SEA)

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