General Information of the Compound
| Compound ID |
CP0282432
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| Compound Name |
2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-[1,3]thiazolo[4,5-b]pyridine
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| Structure |
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| Formula |
C18H16F3N3OS
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| Molecular Weight |
379.407
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| Canonical SMILES |
FC(F)(F)c1ccccc1OC1CCN(CC1)c1nc2ncccc2s1
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| InChI |
InChI=1S/C18H16F3N3OS/c19-18(20,21)13-4-1-2-5-14(13)25-12-7-10-24(11-8-12)17-23-16-15(26-17)6-3-9-22-16/h1-6,9,12H,7-8,10-11H2
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| InChIKey |
WJJKHUYDDQZWEH-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