General Information of the Compound
| Compound ID |
CP0413659
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| Compound Name |
7-[1-(oxan-4-yl)indol-5-yl]-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine-8-carbonitrile
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| Structure |
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| Formula |
C23H19F3N4O
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| Molecular Weight |
424.426
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| Canonical SMILES |
FC(F)(F)Cc1cnc2c(C#N)c(ccn12)-c1ccc2n(ccc2c1)C1CCOCC1
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| InChI |
InChI=1S/C23H19F3N4O/c24-23(25,26)12-18-14-28-22-20(13-27)19(4-8-30(18)22)15-1-2-21-16(11-15)3-7-29(21)17-5-9-31-10-6-17/h1-4,7-8,11,14,17H,5-6,9-10,12H2
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| InChIKey |
SUUOKLVCMLONGL-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