General Information of the Compound
| Compound ID |
CP0845254
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| Compound Name |
3-(2-Oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-7-yloxy)-N-(1-p-tolyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)benzamide
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| Structure |
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| Formula |
C25H18F3N5O3
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| Molecular Weight |
493.445
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| Canonical SMILES |
Cc1ccc(-n2nc(C(F)(F)F)cc2NC(=O)c2cccc(Oc3cccc4[nH]c(=O)[nH]c34)c2)cc1
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| InChI |
InChI=1S/C25H18F3N5O3/c1-14-8-10-16(11-9-14)33-21(13-20(32-33)25(26,27)28)30-23(34)15-4-2-5-17(12-15)36-19-7-3-6-18-22(19)31-24(35)29-18/h2-13H,1H3,(H,30,34)(H2,29,31,35)
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| InChIKey |
DOOHEZACSGBMDC-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