General Information of the Compound
| Compound ID |
CP0497901
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| Compound Name |
1-benzyl-6,7-dichloro-3-(3-nitrophenyl)quinoxalin-2-one
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| Structure |
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| Formula |
C21H13Cl2N3O3
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| Molecular Weight |
426.259
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| Canonical SMILES |
[O-][N+](=O)c1cccc(c1)-c1nc2cc(Cl)c(Cl)cc2n(Cc2ccccc2)c1=O
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| InChI |
InChI=1S/C21H13Cl2N3O3/c22-16-10-18-19(11-17(16)23)25(12-13-5-2-1-3-6-13)21(27)20(24-18)14-7-4-8-15(9-14)26(28)29/h1-11H,12H2
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| InChIKey |
HOAGPCCBDXTJLP-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