General Information of the Compound
| Compound ID |
CP0462588
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| Compound Name |
N-[(2R,3R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxopentan-2-yl]benzamide
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| Structure |
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| Formula |
C24H29ClN2O2
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| Molecular Weight |
412.961
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| Canonical SMILES |
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C24H29ClN2O2/c1-3-17(2)22(26-23(28)20-7-5-4-6-8-20)24(29)27-15-13-19(14-16-27)18-9-11-21(25)12-10-18/h4-12,17,19,22H,3,13-16H2,1-2H3,(H,26,28)/t17-,22-/m1/s1
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| InChIKey |
HEPHWMFNKQUFCM-VGOFRKELSA-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