General Information of the Compound
| Compound ID |
CP0785688
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| Compound Name |
1-Methyl-6-(3-nitro-phenyl)-1,3-dihydro-benzoimidazol-2-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 |
Cn1c(O)nc2ccc(-c3cccc([N+](=O)[O-])c3)cc21
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| InChI |
InChI=1S/C14H11N3O3/c1-16-13-8-10(5-6-12(13)15-14(16)18)9-3-2-4-11(7-9)17(19)20/h2-8H,1H3,(H,15,18)
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| InChIKey |
HSFXVQCNUWBPQI-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