UCSF

ZINC31916944

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 24 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) 3.47 8.94 -20.49 2 4 0 53 339.464 4
Mid Mid (pH 6-8) 3.47 9.38 -31.99 3 4 1 54 340.472 4

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