UCSF

ZINC39262502

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 16 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) 2.55 6.17 -136.99 0 3 -2 63 232.175 2
Mid Mid (pH 6-8) 2.55 5.07 -46.04 1 3 -1 60 233.183 2

Activity (Go SEA)

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