General Information of the Compound
| Compound ID |
CP0903874
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| Compound Name |
N-(2-(4-(2,4-difluorophenoxy)piperidin-1-yl)-6-methylpyridin-3-yl)-4-methoxynicotinamide
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| Structure |
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| Formula |
C24H24F2N4O3
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| Molecular Weight |
454.477
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| Canonical SMILES |
COc1ccncc1C(=O)Nc1ccc(C)nc1N1CCC(Oc2ccc(F)cc2F)CC1
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| InChI |
InChI=1S/C24H24F2N4O3/c1-15-3-5-20(29-24(31)18-14-27-10-7-21(18)32-2)23(28-15)30-11-8-17(9-12-30)33-22-6-4-16(25)13-19(22)26/h3-7,10,13-14,17H,8-9,11-12H2,1-2H3,(H,29,31)
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| InChIKey |
TUSHMIKBWCCXKD-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