General Information of the Compound
| Compound ID |
CP0399721
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| Compound Name |
N-(4-chlorophenyl)-1-[3-(trifluoromethyl)pyridin-2-yl]-3,6-dihydro-2H-pyridine-4-carboxamide
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| Structure |
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| Formula |
C18H15ClF3N3O
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| Molecular Weight |
381.785
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| Canonical SMILES |
FC(F)(F)c1cccnc1N1CCC(=CC1)C(=O)Nc1ccc(Cl)cc1
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| InChI |
InChI=1S/C18H15ClF3N3O/c19-13-3-5-14(6-4-13)24-17(26)12-7-10-25(11-8-12)16-15(18(20,21)22)2-1-9-23-16/h1-7,9H,8,10-11H2,(H,24,26)
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| InChIKey |
BHBZFJBSLMYUOQ-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