UCSF

ZINC39373649

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2010 17 Yes

Popular Name: 2,5-dimethyl-4-(3-methylbenzoyl)-1H-pyrazol-3-one 2,5-dimethyl-4-(3-methylbenzoyl)…

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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) 2.32 3.64 -9.56 1 4 0 55 230.267 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4063925; US4146726; US4261729; US4301293; US4414392; US4508910; US4687858 IBM Patent Data

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