UCSF

ZINC32119603

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 19 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 0.39 4.4 -117.6 4 5 2 62 273.421 7
Mid Mid (pH 6-8) 0.39 3.36 -46.01 3 5 1 57 272.413 7

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