UCSF

ZINC02390984

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 14 Yes

CAS Number: 30806-09-8

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) -0.55 0.45 -71.92 4 5 0 97 202.254 6

Activity (Go SEA)

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