General Information of the Compound
| Compound ID |
CP0931290
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| Compound Name |
N-(2-(4-(2,4-difluorophenoxy)piperidin-1-yl)-5-methylpyridin-3-yl)-3-methoxy-1-methyl-1H-pyrazole-4-carboxamide
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| Structure |
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| Formula |
C23H25F2N5O3
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| Molecular Weight |
457.481
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| Canonical SMILES |
COc1nn(C)cc1C(=O)Nc1cc(C)cnc1N1CCC(Oc2ccc(F)cc2F)CC1
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| InChI |
InChI=1S/C23H25F2N5O3/c1-14-10-19(27-22(31)17-13-29(2)28-23(17)32-3)21(26-12-14)30-8-6-16(7-9-30)33-20-5-4-15(24)11-18(20)25/h4-5,10-13,16H,6-9H2,1-3H3,(H,27,31)
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| InChIKey |
JOSREYSUAGVAIK-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