UCSF

ZINC04382491

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2005 24 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) 4.05 8.28 -10.09 1 4 0 47 348.512 9
Mid Mid (pH 6-8) 4.05 8.74 -29.73 2 4 1 49 349.52 9

Activity (Go SEA)

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