UCSF

ZINC06688798

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 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) 2.10 9.63 -12.36 1 6 0 67 337.427 7
Mid Mid (pH 6-8) 2.10 10.1 -37.88 2 6 1 68 338.435 7

Activity (Go SEA)

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