UCSF

ZINC25051469

Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2009 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) 2.98 10.65 -21.07 2 8 0 98 434.562 14
Mid Mid (pH 6-8) 3.71 10.49 -53.39 1 8 -1 95 433.554 14

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