UCSF

ZINC30960916

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2009 35 No

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) 3.87 11.88 -54.89 3 10 1 124 501.995 8
Mid Mid (pH 6-8) 3.87 9.41 -14.91 2 10 0 123 500.987 8

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