General Information of the Compound
| Compound ID |
CP0406708
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| Compound Name |
N-(2-ethyl-6-methylphenyl)-2-(4-pyridin-2-ylpiperidin-1-yl)acetamide
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| Structure |
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| Formula |
C21H27N3O
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| Molecular Weight |
337.467
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| Canonical SMILES |
CCc1cccc(C)c1NC(=O)CN1CCC(CC1)c1ccccn1
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| InChI |
InChI=1S/C21H27N3O/c1-3-17-8-6-7-16(2)21(17)23-20(25)15-24-13-10-18(11-14-24)19-9-4-5-12-22-19/h4-9,12,18H,3,10-11,13-15H2,1-2H3,(H,23,25)
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| InChIKey |
JJKSMCTVAAPVHQ-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