General Information of the Compound
| Compound ID |
CP0522167
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| Compound Name |
4,4,4-trifluoro-1-[4-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]butan-1-one
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| Structure |
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| Formula |
C17H17F4N3O2
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| Molecular Weight |
371.334
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| Canonical SMILES |
Fc1ccccc1-c1noc(n1)C1CCN(CC1)C(=O)CCC(F)(F)F
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| InChI |
InChI=1S/C17H17F4N3O2/c18-13-4-2-1-3-12(13)15-22-16(26-23-15)11-6-9-24(10-7-11)14(25)5-8-17(19,20)21/h1-4,11H,5-10H2
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| InChIKey |
QGLQCHLCOJTQNT-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