General Information of the Compound
| Compound ID |
CP0541913
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| Compound Name |
2-N-[(4-chlorophenyl)methyl]-2-N-methyl-1-N-[4-(trifluoromethyl)phenyl]piperidine-1,2-dicarboxamide
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| Structure |
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| Formula |
C22H23ClF3N3O2
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| Molecular Weight |
453.892
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| Canonical SMILES |
CN(Cc1ccc(Cl)cc1)C(=O)C1CCCCN1C(=O)Nc1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C22H23ClF3N3O2/c1-28(14-15-5-9-17(23)10-6-15)20(30)19-4-2-3-13-29(19)21(31)27-18-11-7-16(8-12-18)22(24,25)26/h5-12,19H,2-4,13-14H2,1H3,(H,27,31)
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| InChIKey |
IRJXRYRNNJVUIZ-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