UCSF

ZINC15443479

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2008 12 No

Popular Name: 1-(4-Fluorophenyl)propane-1,2-dione monohydrate 1-(4-Fluorophenyl)propane-1,2-di…

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CAS Number: 10557-24-1

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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) 1.17 4.96 -3.51 0 2 0 34 166.151 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID WO2000053585A1 IBM Patent Data

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