General Information of the Compound
| Compound ID |
CP0049401
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| Compound Name |
N'-(4-chloro-3-fluorophenyl)-N-[[4-(dimethylamino)-1-methylpiperidin-4-yl]methyl]oxamide
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| Structure |
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| Formula |
C17H24ClFN4O2
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| Molecular Weight |
370.856
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| Canonical SMILES |
CN(C)C1(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)CCN(C)CC1
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| InChI |
InChI=1S/C17H24ClFN4O2/c1-22(2)17(6-8-23(3)9-7-17)11-20-15(24)16(25)21-12-4-5-13(18)14(19)10-12/h4-5,10H,6-9,11H2,1-3H3,(H,20,24)(H,21,25)
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| InChIKey |
FOCAFJYJZZZDQT-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