General Information of the Compound
| Compound ID |
CP0527742
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| Compound Name |
4-(6-methylpyridin-2-yl)-5-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-N-[[2-(trifluoromethoxy)phenyl]methyl]-1,3-thiazol-2-amine
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| Structure |
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| Formula |
C23H17F3N6OS
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| Molecular Weight |
482.491
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| Canonical SMILES |
Cc1cccc(n1)-c1nc(NCc2ccccc2OC(F)(F)F)sc1-c1ccc2ncnn2c1
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| InChI |
InChI=1S/C23H17F3N6OS/c1-14-5-4-7-17(30-14)20-21(16-9-10-19-28-13-29-32(19)12-16)34-22(31-20)27-11-15-6-2-3-8-18(15)33-23(24,25)26/h2-10,12-13H,11H2,1H3,(H,27,31)
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| InChIKey |
AIQDEVOVNXQXKX-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