General Information of the Compound
| Compound ID |
CP0881889
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| Compound Name |
N-(4-Methoxy-3-((1-nicotinoylpiperidin-4-yl)oxy)phenyl)-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C26H24F3N3O4
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| Molecular Weight |
499.489
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| Canonical SMILES |
COc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1OC1CCN(C(=O)c2cccnc2)CC1
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| InChI |
InChI=1S/C26H24F3N3O4/c1-35-22-8-7-20(31-24(33)17-4-2-6-19(14-17)26(27,28)29)15-23(22)36-21-9-12-32(13-10-21)25(34)18-5-3-11-30-16-18/h2-8,11,14-16,21H,9-10,12-13H2,1H3,(H,31,33)
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| InChIKey |
BXBBGHQGKUHHSN-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