UCSF

ZINC28477134

Substance Information

In ZINC since Heavy atoms Benign functionality
February 28th, 2009 23 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) 5.44 7.99 -15.45 2 3 0 58 308.377 5
Hi High (pH 8-9.5) 5.44 8.78 -44.58 1 3 -1 60 307.369 5

Activity (Go SEA)

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