General Information of the Compound
| Compound ID |
CP0145922
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| Compound Name |
(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-(3-methoxyphenyl)methanone
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| Structure |
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| Formula |
C22H20F2N2O3
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| Molecular Weight |
398.409
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| Canonical SMILES |
COc1cccc(c1)C(=O)N1CCC(F)(F)C(C1)Oc1ccc2ccccc2n1
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| InChI |
InChI=1S/C22H20F2N2O3/c1-28-17-7-4-6-16(13-17)21(27)26-12-11-22(23,24)19(14-26)29-20-10-9-15-5-2-3-8-18(15)25-20/h2-10,13,19H,11-12,14H2,1H3
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| InChIKey |
QZXSVMSMRJTFPZ-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