UCSF

ZINC69742752

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 19 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) -0.07 1.54 -12.19 1 7 0 78 280.357 5
Mid Mid (pH 6-8) -0.07 2.7 -60.51 2 7 1 82 281.365 5

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

No pre-computed analogs available. Try a structural similarity search.