UCSF

ZINC12033714

Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2008 27 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) 0.32 5.19 -51.9 3 9 1 107 380.469 5
Mid Mid (pH 6-8) 0.32 5.62 -126.59 4 9 2 108 381.477 5

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