UCSF

ZINC09789651

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2007 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) 0.23 0.31 -15.79 0 8 0 92 276.252 2
Mid Mid (pH 6-8) 0.23 1.22 -37.53 1 8 1 92 277.26 2

Activity (Go SEA)

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