UCSF

ZINC04381774

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2005 26 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) 3.46 11.02 -10.43 1 6 0 65 353.422 8
Mid Mid (pH 6-8) 3.46 11.45 -30.28 2 6 1 66 354.43 8

Activity (Go SEA)

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