UCSF

ZINC25408425

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2009 22 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) 3.53 7.79 -5.95 0 3 0 22 315.8 2
Mid Mid (pH 6-8) 3.53 10.08 -37.75 1 3 1 23 316.808 2

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