UCSF

ZINC32761239

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2009 34 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) 6.15 9.43 -11.52 2 6 0 71 477.63 11
Mid Mid (pH 6-8) 6.15 11.85 -45.33 3 6 1 72 478.638 11

Activity (Go SEA)

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