General Information of the Compound
| Compound ID |
CP0495603
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| Compound Name |
1-(3-Chloropyridin-2-yl)-N-(3,4-dichlorophenyl)-1,2,3,6-tetrahydropyridine-4-carboxamide
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| Structure |
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| Formula |
C17H14Cl3N3O
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| Molecular Weight |
382.678
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| Canonical SMILES |
Clc1ccc(NC(=O)C2=CCN(CC2)c2ncccc2Cl)cc1Cl
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| InChI |
InChI=1S/C17H14Cl3N3O/c18-13-4-3-12(10-15(13)20)22-17(24)11-5-8-23(9-6-11)16-14(19)2-1-7-21-16/h1-5,7,10H,6,8-9H2,(H,22,24)
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| InChIKey |
BVVULFOSJZIUFY-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