UCSF

ZINC33752931

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 33 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) 3.87 8.1 -48.11 2 10 1 122 489.965 7
Mid Mid (pH 6-8) 3.87 5.75 -10.97 1 10 0 120 488.957 7

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