UCSF

ZINC35497258

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 28 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) 1.06 8.72 -34.67 1 7 1 71 381.456 5
Mid Mid (pH 6-8) 1.06 9.38 -14.57 0 7 0 69 380.448 5

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