General Information of the Compound
| Compound ID |
CP0513867
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| Compound Name |
N-[1-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-3-methyl-1-oxobutan-2-yl]benzamide
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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 |
CC(C)C(NC(=O)c1ccccc1)C(=O)N1CCC(O)(CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C23H27ClN2O3/c1-16(2)20(25-21(27)17-6-4-3-5-7-17)22(28)26-14-12-23(29,13-15-26)18-8-10-19(24)11-9-18/h3-11,16,20,29H,12-15H2,1-2H3,(H,25,27)
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| InChIKey |
DMJAZWLPFLIXLF-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