General Information of the Compound
| Compound ID |
CP0415953
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| Compound Name |
1-(2-methyl-4,6-diphenyl-1,4-dihydropyridin-3-yl)ethanone
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| Structure |
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| Formula |
C20H19NO
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| Molecular Weight |
289.378
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| Canonical SMILES |
CC(=O)C1=C(C)NC(=CC1c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C20H19NO/c1-14-20(15(2)22)18(16-9-5-3-6-10-16)13-19(21-14)17-11-7-4-8-12-17/h3-13,18,21H,1-2H3
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| InChIKey |
HZKGSGWGVFPUFT-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