General Information of the Compound
| Compound ID |
CP0251265
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| Compound Name |
5-ethyl-3-[5-hydroxypentyl(methyl)amino]-6-methyl-4-[(3-methylphenyl)methyl]-1H-pyridin-2-one
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| Structure |
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| Formula |
C22H32N2O2
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| Molecular Weight |
356.51
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| Canonical SMILES |
CCc1c(C)[nH]c(=O)c(N(C)CCCCCO)c1Cc1cccc(C)c1
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| InChI |
InChI=1S/C22H32N2O2/c1-5-19-17(3)23-22(26)21(24(4)12-7-6-8-13-25)20(19)15-18-11-9-10-16(2)14-18/h9-11,14,25H,5-8,12-13,15H2,1-4H3,(H,23,26)
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| InChIKey |
AVHFITFFUBSKNU-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