UCSF

ZINC42091533

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2010 27 Yes

Popular Name: N-(4-ethoxyphenyl)-2-[4-methyl-6-oxo-2-(4-pyridyl)-1H-pyrimidin-5-yl]acetamide N-(4-ethoxyphenyl)-2-[4-methyl-6…

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Download: MOL2 SDF SMILES Flexibase

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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) 2.07 6.02 -18.19 2 7 0 97 364.405 6 ↓
Hi High (pH 8-9.5) 2.53 4.2 -56.89 1 7 -1 100 363.397 6 ↓
Lo Low (pH 4.5-6) 2.07 6.48 -53.84 3 7 1 98 365.413 6 ↓

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

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