General Information of the Compound
| Compound ID |
CP0146025
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| Compound Name |
4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-[2-methoxyethyl(methyl)amino]-6-methyl-1H-pyridin-2-one
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| Structure |
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| Formula |
C21H30N2O2
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| Molecular Weight |
342.483
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| Canonical SMILES |
CCc1c(C)[nH]c(=O)c(N(C)CCOC)c1Cc1cc(C)cc(C)c1
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| InChI |
InChI=1S/C21H30N2O2/c1-7-18-16(4)22-21(24)20(23(5)8-9-25-6)19(18)13-17-11-14(2)10-15(3)12-17/h10-12H,7-9,13H2,1-6H3,(H,22,24)
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| InChIKey |
DNNXGKQZFKHVRU-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