UCSF

ZINC59533784

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2011 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) 0.27 3.92 -13.82 1 7 0 85 286.328 8
Mid Mid (pH 6-8) 0.27 5.72 -39.49 2 7 1 86 287.336 8

Activity (Go SEA)

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