UCSF

ZINC04899464

Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2006 23 Yes

CAS Number: 57866-06-5

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) -3.58 -9.39 -150.8 8 10 0 193 332.357 12

Activity (Go SEA)

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