General Information of the Compound
| Compound ID |
CP0477416
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| Compound Name |
(2-(4-(2,4-difluorophenoxy)piperidin-1-yl)-3-(isopropylamino)-7,8-dihydropyrido[3,4-b]pyrazin-6(5H)-yl)(morpholino)methanone
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| Structure |
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| Formula |
C26H34F2N6O3
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| Molecular Weight |
516.593
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| Canonical SMILES |
CC(C)Nc1nc2CN(CCc2nc1N1CCC(CC1)Oc1ccc(F)cc1F)C(=O)N1CCOCC1
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| InChI |
InChI=1S/C26H34F2N6O3/c1-17(2)29-24-25(32-8-5-19(6-9-32)37-23-4-3-18(27)15-20(23)28)31-21-7-10-34(16-22(21)30-24)26(35)33-11-13-36-14-12-33/h3-4,15,17,19H,5-14,16H2,1-2H3,(H,29,30)
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| InChIKey |
KISNBNRVWTUUOQ-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