General Information of the Compound
| Compound ID |
CP0083290
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| Compound Name |
N'-(4-chloro-3-fluorophenyl)-N-[2-(dimethylamino)-2-pyrrolidin-1-ylethyl]oxamide
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| Structure |
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| Formula |
C16H22ClFN4O2
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| Molecular Weight |
356.829
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| Canonical SMILES |
CN(C)C(CNC(=O)C(=O)Nc1ccc(Cl)c(F)c1)N1CCCC1
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| InChI |
InChI=1S/C16H22ClFN4O2/c1-21(2)14(22-7-3-4-8-22)10-19-15(23)16(24)20-11-5-6-12(17)13(18)9-11/h5-6,9,14H,3-4,7-8,10H2,1-2H3,(H,19,23)(H,20,24)
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| InChIKey |
AEMXATFRAWPYNH-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