UCSF

ZINC51019707

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 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) 1.06 6.59 -40.79 2 5 1 54 251.354 6
Mid Mid (pH 6-8) 1.06 4.39 -8.06 1 5 0 52 250.346 6

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