General Information of the Compound
| Compound ID |
CP0539211
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| Compound Name |
4-[7-(1-methylpiperidin-4-yl)oxyimidazo[1,2-a]pyridin-3-yl]-2-[1-[2-(trifluoromethyl)phenyl]ethoxy]benzamide
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| Structure |
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| Formula |
C29H29F3N4O3
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| Molecular Weight |
538.57
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| Canonical SMILES |
CC(Oc1cc(ccc1C(N)=O)-c1cnc2cc(OC3CCN(C)CC3)ccn12)c1ccccc1C(F)(F)F
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| InChI |
InChI=1S/C29H29F3N4O3/c1-18(22-5-3-4-6-24(22)29(30,31)32)38-26-15-19(7-8-23(26)28(33)37)25-17-34-27-16-21(11-14-36(25)27)39-20-9-12-35(2)13-10-20/h3-8,11,14-18,20H,9-10,12-13H2,1-2H3,(H2,33,37)
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| InChIKey |
OZQBPQVARIELDX-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