General Information of the Compound
| Compound ID |
CP0453721
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| Compound Name |
5-Methyl-4-oxy-pyrazine-2-carboxylic acid
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| Synonyms |
Acipimox
K 9321
Monted
Nedios
Olbemox
Olbetam
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| Structure |
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| Formula |
C6H6N2O3
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| Molecular Weight |
154.125
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| Canonical SMILES |
Cc1cnc(c[n+]1[O-])C(O)=O
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| InChI |
InChI=1S/C6H6N2O3/c1-4-2-7-5(6(9)10)3-8(4)11/h2-3H,1H3,(H,9,10)
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| InChIKey |
DJQOOSBJCLSSEY-UHFFFAOYSA-N
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| CAS |
51037-30-0
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Clinical Information about the Compound