UCSF

ZINC49316009

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 18 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) 0.27 1.23 -10.32 2 7 0 84 252.274 5
Mid Mid (pH 6-8) 0.27 1.7 -35.09 3 7 1 85 253.282 5

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