UCSF

ZINC03925617

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2005 28 No

CAS Number: 71097-83-1

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) 3.56 -1.25 -52.46 2 6 -1 113 390.5 10

Activity (Go SEA)

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