General Information of the Compound
| Compound ID |
CP0452537
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| Compound Name |
8-Nitro-6-pyridin-3-yl-3,4-dihydroquinolin-2(1H)-one
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| Structure |
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| Formula |
C14H11N3O3
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| Molecular Weight |
269.26
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| Canonical SMILES |
[O-][N+](=O)c1cc(cc2CCC(=O)Nc12)-c1cccnc1
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| InChI |
InChI=1S/C14H11N3O3/c18-13-4-3-9-6-11(10-2-1-5-15-8-10)7-12(17(19)20)14(9)16-13/h1-2,5-8H,3-4H2,(H,16,18)
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| InChIKey |
VKCHBDVJGGPFCP-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
Protein ID: PT03119, Cytochrome P450 11B1, mitochondrial
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial