General Information of the Compound
| Compound ID |
CP0153468
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| Compound Name |
(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-phenylmethanone
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| Structure |
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| Formula |
C21H18F2N2O2
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| Molecular Weight |
368.383
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| Canonical SMILES |
FC1(F)CCN(CC1Oc1ccc2ccccc2n1)C(=O)c1ccccc1
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| InChI |
InChI=1S/C21H18F2N2O2/c22-21(23)12-13-25(20(26)16-7-2-1-3-8-16)14-18(21)27-19-11-10-15-6-4-5-9-17(15)24-19/h1-11,18H,12-14H2
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| InChIKey |
GREGEUCGFKPDRT-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