General Information of the Compound
| Compound ID |
CP0483170
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| Compound Name |
1-tert-butyl-3-[1-(4-chlorophenyl)-3-methyl-1-oxobutan-2-yl]-1-methylurea
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| Structure |
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| Formula |
C17H25ClN2O2
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| Molecular Weight |
324.852
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| Canonical SMILES |
CC(C)C(NC(=O)N(C)C(C)(C)C)C(=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C17H25ClN2O2/c1-11(2)14(19-16(22)20(6)17(3,4)5)15(21)12-7-9-13(18)10-8-12/h7-11,14H,1-6H3,(H,19,22)
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| InChIKey |
RAQSTFBWMXLVQS-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