General Information of the Compound
| Compound ID |
CP0470507
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| Compound Name |
4-Nitro-N-(pyridin-3-yl)benzamide
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| Structure |
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| Formula |
C12H9N3O3
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| Molecular Weight |
243.222
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| Canonical SMILES |
[O-][N+](=O)c1ccc(cc1)C(=O)Nc1cccnc1
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| InChI |
InChI=1S/C12H9N3O3/c16-12(14-10-2-1-7-13-8-10)9-3-5-11(6-4-9)15(17)18/h1-8H,(H,14,16)
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| InChIKey |
DRCKREXMVGWWIE-UHFFFAOYSA-N
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| CAS |
13313-18-3
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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
Protein ID: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial