General Information of the Compound
| Compound ID |
CP0170147
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| Compound Name |
5-methyl-N-(2-nitrophenyl)-3-oxo-2-pyridin-2-yl-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C16H13N5O4
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| Molecular Weight |
339.311
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| Canonical SMILES |
Cc1[nH]n(-c2ccccn2)c(=O)c1C(=O)Nc1ccccc1[N+]([O-])=O
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| InChI |
InChI=1S/C16H13N5O4/c1-10-14(16(23)20(19-10)13-8-4-5-9-17-13)15(22)18-11-6-2-3-7-12(11)21(24)25/h2-9,19H,1H3,(H,18,22)
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| InChIKey |
QFCQSDCKTUVWBP-UHFFFAOYSA-N
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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