UCSF

ZINC05053176

Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2006 18 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 0.02 -6.4 -13.03 3 7 0 99 253.258 2

Activity (Go SEA)

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