UCSF

ZINC39974101

Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2010 30 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) 4.64 12.82 -11.49 1 5 0 45 449.617 9
Mid Mid (pH 6-8) 4.64 15.04 -57.87 2 5 1 46 450.625 9

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