General Information of the Compound
| Compound ID |
CP0166339
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| Compound Name |
2-ethyl-3-(3-(3-(methylsulfonyl)benzyl)phenyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
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| Structure |
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| Formula |
C24H21F3N2O2S
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| Molecular Weight |
458.505
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| Canonical SMILES |
CCc1nc2c(cccn2c1-c1cccc(Cc2cccc(c2)S(C)(=O)=O)c1)C(F)(F)F
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| InChI |
InChI=1S/C24H21F3N2O2S/c1-3-21-22(29-12-6-11-20(23(29)28-21)24(25,26)27)18-9-4-7-16(14-18)13-17-8-5-10-19(15-17)32(2,30)31/h4-12,14-15H,3,13H2,1-2H3
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| InChIKey |
YVLZLCWGCDOOAT-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