General Information of the Compound
| Compound ID |
CP0485335
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| Compound Name |
2-(4,4-dimethylcyclohexyl)-2-phenyl-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 |
CC1(C)CCC(CC1)C(C(=O)NC1CCN(CC1)C(=O)CCc1cccnc1)c1ccccc1
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| InChI |
InChI=1S/C29H39N3O2/c1-29(2)16-12-24(13-17-29)27(23-8-4-3-5-9-23)28(34)31-25-14-19-32(20-15-25)26(33)11-10-22-7-6-18-30-21-22/h3-9,18,21,24-25,27H,10-17,19-20H2,1-2H3,(H,31,34)
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| InChIKey |
ZFUDSPDPNQPCBN-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