UCSF

ZINC03954386

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2005 35 Yes

CAS Number: 2632-29-3

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) 4.86 -2.44 -131.58 5 6 2 75 477.649 5

Activity (Go SEA)

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