General Information of the Compound
| Compound ID |
CP0528490
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| Compound Name |
2-(3',4',5',6'-tetrahydro-2'H-[2,4'-bipyridine]-1'-yl)-N-(2,4,6trichlorophenyl)acetamide
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| Structure |
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| Formula |
C18H18Cl3N3O
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| Molecular Weight |
398.721
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| Canonical SMILES |
Clc1cc(Cl)c(NC(=O)CN2CCC(CC2)c2ccccn2)c(Cl)c1
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| InChI |
InChI=1S/C18H18Cl3N3O/c19-13-9-14(20)18(15(21)10-13)23-17(25)11-24-7-4-12(5-8-24)16-3-1-2-6-22-16/h1-3,6,9-10,12H,4-5,7-8,11H2,(H,23,25)
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| InChIKey |
YNIDFKZVSRNLCJ-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