General Information of the Compound
| Compound ID |
CP0499719
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| Compound Name |
5-[(2,2-dimethylpropanoylamino)methyl]-N-(1H-imidazol-2-yl)-2-methylbenzamide
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| Structure |
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| Formula |
C17H22N4O2
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| Molecular Weight |
314.389
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| Canonical SMILES |
Cc1ccc(CNC(=O)C(C)(C)C)cc1C(=O)Nc1ncc[nH]1
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| InChI |
InChI=1S/C17H22N4O2/c1-11-5-6-12(10-20-15(23)17(2,3)4)9-13(11)14(22)21-16-18-7-8-19-16/h5-9H,10H2,1-4H3,(H,20,23)(H2,18,19,21,22)
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| InChIKey |
KQNYEOHTECKCBG-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