UCSF

ZINC06716799

Substance Information

In ZINC since Heavy atoms Benign functionality
April 17th, 2006 14 No

CAS Number: 777075-44-2

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) -1.03 -4.7 -122.96 4 6 -1 119 221.173 2

Activity (Go SEA)

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