General Information of the Compound
| Compound ID |
CP0418619
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| Compound Name |
N-(2,6-diethylphenyl)-4-oxo-1H-quinoline-3-carboxamide
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| Structure |
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| Formula |
C20H20N2O2
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| Molecular Weight |
320.392
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| Canonical SMILES |
CCc1cccc(CC)c1NC(=O)c1c[nH]c2ccccc2c1=O
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| InChI |
InChI=1S/C20H20N2O2/c1-3-13-8-7-9-14(4-2)18(13)22-20(24)16-12-21-17-11-6-5-10-15(17)19(16)23/h5-12H,3-4H2,1-2H3,(H,21,23)(H,22,24)
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| InChIKey |
MKFJVLOWTYFESB-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