UCSF

ZINC02391057

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2004 20 Yes

CAS Number: 22951-94-6

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) -0.51 -2.57 -64.23 4 5 0 96 278.352 7

Activity (Go SEA)

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