UCSF

ZINC11919880

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2008 17 Yes

CAS Number: 322724-26-5

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) 3.07 -1.39 -48.46 3 2 1 33 225.315 2

Activity (Go SEA)

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