UCSF

ZINC39308523

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 24 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) 3.88 8.09 -45.29 3 3 1 45 320.412 2
Mid Mid (pH 6-8) 3.88 5.94 -8.53 2 3 0 44 319.404 2

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