General Information of the Compound
| Compound ID |
CP0465341
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| Compound Name |
N-(4-chlorophenyl)-1-[3-(3,3-dimethylbutanoylamino)benzoyl]piperidine-3-carboxamide
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| Structure |
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| Formula |
C25H30ClN3O3
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| Molecular Weight |
455.986
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| Canonical SMILES |
CC(C)(C)CC(=O)Nc1cccc(c1)C(=O)N1CCCC(C1)C(=O)Nc1ccc(Cl)cc1
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| InChI |
InChI=1S/C25H30ClN3O3/c1-25(2,3)15-22(30)27-21-8-4-6-17(14-21)24(32)29-13-5-7-18(16-29)23(31)28-20-11-9-19(26)10-12-20/h4,6,8-12,14,18H,5,7,13,15-16H2,1-3H3,(H,27,30)(H,28,31)
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| InChIKey |
UWVXAKCERCVTQH-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