General Information of the Compound
| Compound ID |
CP0040382
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| Compound Name |
5-(1-(4-chlorophenylcarbamoyl)-3-phenylpiperidin-3-yl)pentanoic acid
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| Structure |
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| Formula |
C23H27ClN2O3
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| Molecular Weight |
414.933
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| Canonical SMILES |
OC(=O)CCCCC1(CCCN(C1)C(=O)Nc1ccc(Cl)cc1)c1ccccc1
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| InChI |
InChI=1S/C23H27ClN2O3/c24-19-10-12-20(13-11-19)25-22(29)26-16-6-15-23(17-26,14-5-4-9-21(27)28)18-7-2-1-3-8-18/h1-3,7-8,10-13H,4-6,9,14-17H2,(H,25,29)(H,27,28)
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| InChIKey |
CXIKGNQQHDCIPP-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