General Information of the Compound
| Compound ID |
CP0093904
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| Compound Name |
2-imidazo[4,5-b]pyridin-3-yl-1-(4-nitrophenyl)ethanone
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| Structure |
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| Formula |
C14H10N4O3
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| Molecular Weight |
282.259
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| Canonical SMILES |
[O-][N+](=O)c1ccc(cc1)C(=O)Cn1cnc2cccnc12
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| InChI |
InChI=1S/C14H10N4O3/c19-13(10-3-5-11(6-4-10)18(20)21)8-17-9-16-12-2-1-7-15-14(12)17/h1-7,9H,8H2
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| InChIKey |
XCCRBQBHOWCSJO-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