UCSF

ZINC26514136

Substance Information

In ZINC since Heavy atoms Benign functionality
February 7th, 2009 15 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) 0.04 3.75 -44.33 2 5 1 63 215.273 5
Mid Mid (pH 6-8) 0.04 2.5 -15.19 1 5 0 59 214.265 5

Activity (Go SEA)

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