UCSF

ZINC67935259

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 27 Yes

Popular Name: 2,5-dioxo-6-[2-(1-phenylpyrazol-4-yl)ethyl]-1H-1,6-naphthyridine-3-carbonitrile 2,5-dioxo-6-[2-(1-phenylpyrazol-…

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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) 0.92 8.72 -27.17 1 7 0 96 357.373 4 ↓
Mid Mid (pH 6-8) 1.82 6.72 -52.77 0 7 -1 100 356.365 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.