UCSF

ZINC31738233

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2009 35 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) 3.37 7.09 -23.7 2 9 0 102 476.533 10
Mid Mid (pH 6-8) 3.37 7.35 -60.03 3 9 1 103 477.541 10

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