General Information of the Compound
| Compound ID |
CP0446129
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| Compound Name |
N-[(2R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-3-fluorobenzamide
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| Structure |
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| Formula |
C23H26ClFN2O2
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| Molecular Weight |
416.924
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| Canonical SMILES |
CC(C)[C@@H](NC(=O)c1cccc(F)c1)C(=O)N1CCC(CC1)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C23H26ClFN2O2/c1-15(2)21(26-22(28)18-4-3-5-20(25)14-18)23(29)27-12-10-17(11-13-27)16-6-8-19(24)9-7-16/h3-9,14-15,17,21H,10-13H2,1-2H3,(H,26,28)/t21-/m1/s1
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| InChIKey |
ALVUGHOSJCUAKT-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