General Information of the Compound
| Compound ID |
CP0443049
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| Compound Name |
3,4-dimethoxy-N-[[5-(6-methylpyridin-2-yl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline
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| Structure |
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| Formula |
C24H23N7O2
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| Molecular Weight |
441.495
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| Canonical SMILES |
COc1ccc(NCc2nc(c([nH]2)-c2cccc(C)n2)-c2ccc3ncnn3c2)cc1OC
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| InChI |
InChI=1S/C24H23N7O2/c1-15-5-4-6-18(28-15)24-23(16-7-10-22-26-14-27-31(22)13-16)29-21(30-24)12-25-17-8-9-19(32-2)20(11-17)33-3/h4-11,13-14,25H,12H2,1-3H3,(H,29,30)
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| InChIKey |
VMFODMXFJCDEFG-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