General Information of the Compound
| Compound ID |
CP0073798
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| Compound Name |
2-methyl-3-[[2-methyl-3-(trifluoromethyl)phenyl]methyl]-5-morpholin-4-ylimidazo[4,5-b]pyridine-7-carboxylic acid
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| Structure |
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| Formula |
C21H21F3N4O3
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| Molecular Weight |
434.418
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| Canonical SMILES |
Cc1nc2c(cc(nc2n1Cc1cccc(c1C)C(F)(F)F)N1CCOCC1)C(O)=O
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| InChI |
InChI=1S/C21H21F3N4O3/c1-12-14(4-3-5-16(12)21(22,23)24)11-28-13(2)25-18-15(20(29)30)10-17(26-19(18)28)27-6-8-31-9-7-27/h3-5,10H,6-9,11H2,1-2H3,(H,29,30)
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| InChIKey |
DQFJQMDNPRZOAO-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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Table of Molecular Bioactivities Related to the Compound