UCSF

ZINC06707535

Substance Information

In ZINC since Heavy atoms Benign functionality
April 16th, 2006 25 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) 1.00 8.97 -15.68 0 5 0 54 337.423 5
Lo Low (pH 4.5-6) 1.00 9.25 -50.17 1 5 1 55 338.431 5

Activity (Go SEA)

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