General Information of the Compound
| Compound ID |
CP0558455
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| Compound Name |
N-(1-cyclohexylpiperidin-4-yl)-4-(4-fluorophenyl)-4-oxobutanamide
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| Formula |
C21H29FN2O2
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| Molecular Weight |
360.473
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)CCC(=O)NC1CCN(CC1)C1CCCCC1
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| InChI |
InChI=1S/C21H29FN2O2/c22-17-8-6-16(7-9-17)20(25)10-11-21(26)23-18-12-14-24(15-13-18)19-4-2-1-3-5-19/h6-9,18-19H,1-5,10-15H2,(H,23,26)
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| InChIKey |
BRXFYOAHMPGDMV-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