General Information of the Compound
| Compound ID |
CP0507683
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| Compound Name |
N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-N,5-dimethyl-7-phenyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
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| Structure |
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| Formula |
C24H18F6N4O
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| Molecular Weight |
492.423
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| Canonical SMILES |
CN(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)c1c(C)n2cnnc2cc1-c1ccccc1
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| InChI |
InChI=1S/C24H18F6N4O/c1-14-21(19(16-6-4-3-5-7-16)11-20-32-31-13-34(14)20)22(35)33(2)12-15-8-17(23(25,26)27)10-18(9-15)24(28,29)30/h3-11,13H,12H2,1-2H3
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| InChIKey |
QCVSZRBCNKHMIP-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