UCSF

ZINC42551153

Substance Information

In ZINC since Heavy atoms Benign functionality
April 30th, 2010 20 No

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) 0.78 6.85 -17.88 0 7 0 92 284.243 6

Activity (Go SEA)

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