General Information of the Compound
| Compound ID |
CP0435973
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| Compound Name |
N-[(2R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-1-oxobutan-2-yl]-2-phenylacetamide
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| Structure |
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| Formula |
C23H27ClN2O2
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| Molecular Weight |
398.934
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| Canonical SMILES |
CC[C@@H](NC(=O)Cc1ccccc1)C(=O)N1CCC(CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C23H27ClN2O2/c1-2-21(25-22(27)16-17-6-4-3-5-7-17)23(28)26-14-12-19(13-15-26)18-8-10-20(24)11-9-18/h3-11,19,21H,2,12-16H2,1H3,(H,25,27)/t21-/m1/s1
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| InChIKey |
AONVLWLNGSANCR-OAQYLSRUSA-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