UCSF

ZINC12154001

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2008 25 Yes

CAS Number: [92519-91-0]

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) 2.20 -3.69 -16.11 4 8 0 130 346.291 3

Activity (Go SEA)

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