General Information of the Compound
| Compound ID |
CP0304538
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| Compound Name |
N'-(4-chloro-3-fluorophenyl)-N-[2-(diethylamino)-4-methylpentyl]oxamide
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| Structure |
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| Formula |
C18H27ClFN3O2
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| Molecular Weight |
371.884
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| Canonical SMILES |
CCN(CC)C(CNC(=O)C(=O)Nc1ccc(Cl)c(F)c1)CC(C)C
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| InChI |
InChI=1S/C18H27ClFN3O2/c1-5-23(6-2)14(9-12(3)4)11-21-17(24)18(25)22-13-7-8-15(19)16(20)10-13/h7-8,10,12,14H,5-6,9,11H2,1-4H3,(H,21,24)(H,22,25)
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| InChIKey |
BXCXGYNOTWJQIQ-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