UCSF

ZINC26895334

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2009 10 No

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) 0.77 4.02 -40.13 1 2 1 22 140.206 1
Hi High (pH 8-9.5) 0.77 1.35 -5.2 0 2 0 20 139.198 1

Activity (Go SEA)

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