UCSF

ZINC05297798

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2006 28 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) 6.94 13.34 -13.44 1 5 0 75 499.162 4
Mid Mid (pH 6-8) 6.94 13.7 -44.66 2 5 1 76 500.17 4

Activity (Go SEA)

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