General Information of the Compound
| Compound ID |
CP0482184
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| Compound Name |
N-[1-(4-cyano-3-fluorophenyl)-3,3-dimethyl-1-oxobutan-2-yl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
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| Structure |
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| Formula |
C21H24FN3O3
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| Molecular Weight |
385.439
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| Canonical SMILES |
CC(C)c1onc(C)c1C(=O)NC(C(=O)c1ccc(C#N)c(F)c1)C(C)(C)C
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| InChI |
InChI=1S/C21H24FN3O3/c1-11(2)18-16(12(3)25-28-18)20(27)24-19(21(4,5)6)17(26)13-7-8-14(10-23)15(22)9-13/h7-9,11,19H,1-6H3,(H,24,27)
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| InChIKey |
LBCLKSUDHMQCPT-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