General Information of the Compound
| Compound ID |
CP0963776
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| Compound Name |
N-(4-Methyl-3-((1-nicotinoylpiperidin-4-yl)oxy)phenyl)-6-(trifluoromethyl)picolinamide
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| Structure |
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| Formula |
C25H23F3N4O3
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| Molecular Weight |
484.478
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| Canonical SMILES |
Cc1ccc(NC(=O)c2cccc(C(F)(F)F)n2)cc1OC1CCN(C(=O)c2cccnc2)CC1
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| InChI |
InChI=1S/C25H23F3N4O3/c1-16-7-8-18(30-23(33)20-5-2-6-22(31-20)25(26,27)28)14-21(16)35-19-9-12-32(13-10-19)24(34)17-4-3-11-29-15-17/h2-8,11,14-15,19H,9-10,12-13H2,1H3,(H,30,33)
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| InChIKey |
MOUJNRNBMQOIRN-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