General Information of the Compound
| Compound ID |
CP0539073
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| Compound Name |
2-cyclohexyl-2-(4-fluorophenyl)-N-[1-(3-pyridin-3-ylpropanoyl)piperidin-4-yl]acetamide
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| Structure |
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| Formula |
C27H34FN3O2
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| Molecular Weight |
451.586
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| Canonical SMILES |
Fc1ccc(cc1)C(C1CCCCC1)C(=O)NC1CCN(CC1)C(=O)CCc1cccnc1
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| InChI |
InChI=1S/C27H34FN3O2/c28-23-11-9-22(10-12-23)26(21-6-2-1-3-7-21)27(33)30-24-14-17-31(18-15-24)25(32)13-8-20-5-4-16-29-19-20/h4-5,9-12,16,19,21,24,26H,1-3,6-8,13-15,17-18H2,(H,30,33)
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| InChIKey |
RMCLCGKHIJSMEJ-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