UCSF

ZINC39255369

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 20 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) 3.30 10.78 -42.86 1 1 1 4 262.376 0
Hi High (pH 8-9.5) 3.30 8.22 -3.4 0 1 0 3 261.368 0

Activity (Go SEA)

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