General Information of the Compound
| Compound ID |
CP0492081
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| Compound Name |
1-methyl-3-(3-nitrophenyl)quinoxalin-2-one
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| Structure |
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| Formula |
C15H11N3O3
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| Molecular Weight |
281.271
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| Canonical SMILES |
Cn1c2ccccc2nc(-c2cccc(c2)[N+]([O-])=O)c1=O
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| InChI |
InChI=1S/C15H11N3O3/c1-17-13-8-3-2-7-12(13)16-14(15(17)19)10-5-4-6-11(9-10)18(20)21/h2-9H,1H3
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| InChIKey |
HEKDNRATBRAJFG-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