UCSF

ZINC32155562

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 17 Yes

CAS Number: 71605-88-4

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) 4.65 9.26 -8.76 0 3 0 36 236.311 8

Activity (Go SEA)

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