General Information of the Compound
| Compound ID |
CP0475734
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| Compound Name |
3-(cyclopropylmethyl)-7-[[4-phenyl-4-(trifluoromethyl)piperidin-1-yl]methyl]-8-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
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| Structure |
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| Formula |
C24H24F6N4
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| Molecular Weight |
482.472
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| Canonical SMILES |
FC(F)(F)c1c(CN2CCC(CC2)(c2ccccc2)C(F)(F)F)ccn2c(CC3CC3)nnc12
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| InChI |
InChI=1S/C24H24F6N4/c25-23(26,27)20-17(8-11-34-19(14-16-6-7-16)31-32-21(20)34)15-33-12-9-22(10-13-33,24(28,29)30)18-4-2-1-3-5-18/h1-5,8,11,16H,6-7,9-10,12-15H2
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| InChIKey |
OSKUYCXCNARYBR-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