UCSF

ZINC05234142

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2006 24 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) 4.81 8.71 -12.44 1 5 0 72 338.388 4
Ref Reference (pH 7) 4.32 8.59 -40.27 0 5 -1 70 337.38 5

Activity (Go SEA)

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