UCSF

ZINC06688846

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2006 20 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) 0.90 5.56 -16.07 1 6 0 67 275.356 5
Mid Mid (pH 6-8) 0.90 6.03 -36.73 2 6 1 68 276.364 5

Activity (Go SEA)

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