General Information of the Compound
| Compound ID |
CP0198745
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| Compound Name |
(4,4-difluoro-3-pyridin-2-yloxypiperidin-1-yl)-[2-(triazol-2-yl)phenyl]methanone
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| Structure |
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| Formula |
C19H17F2N5O2
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| Molecular Weight |
385.374
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| Canonical SMILES |
FC1(F)CCN(CC1Oc1ccccn1)C(=O)c1ccccc1-n1nccn1
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| InChI |
InChI=1S/C19H17F2N5O2/c20-19(21)8-12-25(13-16(19)28-17-7-3-4-9-22-17)18(27)14-5-1-2-6-15(14)26-23-10-11-24-26/h1-7,9-11,16H,8,12-13H2
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| InChIKey |
MCRVAAHURKFSNP-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