UCSF

ZINC05966679

Substance Information

In ZINC since Heavy atoms Benign functionality
February 20th, 2006 28 Yes

CAS Number: 146426-40-6

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) 3.46 -3.06 -62.39 4 6 1 95 402.854 2

Activity (Go SEA)

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