General Information of the Compound
| Compound ID |
CP0394676
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| Compound Name |
2-cyclohexyl-2-(3,5-dimethylphenyl)-N-[1-(3-pyridin-3-ylpropanoyl)piperidin-4-yl]acetamide
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| Structure |
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| Formula |
C29H39N3O2
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| Molecular Weight |
461.65
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| Canonical SMILES |
Cc1cc(C)cc(c1)C(C1CCCCC1)C(=O)NC1CCN(CC1)C(=O)CCc1cccnc1
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| InChI |
InChI=1S/C29H39N3O2/c1-21-17-22(2)19-25(18-21)28(24-8-4-3-5-9-24)29(34)31-26-12-15-32(16-13-26)27(33)11-10-23-7-6-14-30-20-23/h6-7,14,17-20,24,26,28H,3-5,8-13,15-16H2,1-2H3,(H,31,34)
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| InChIKey |
VFQWBATXPVQORO-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