General Information of the Compound
| Compound ID |
CP0245292
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| Compound Name |
2-[1-[2-[3-fluoro-4-(trifluoromethoxy)phenyl]acetyl]piperidin-4-yl]oxy-5-(1-methylimidazol-4-yl)benzamide
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| Structure |
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| Formula |
C25H24F4N4O4
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| Molecular Weight |
520.483
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| Canonical SMILES |
Cn1cnc(c1)-c1ccc(OC2CCN(CC2)C(=O)Cc2ccc(OC(F)(F)F)c(F)c2)c(c1)C(N)=O
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| InChI |
InChI=1S/C25H24F4N4O4/c1-32-13-20(31-14-32)16-3-5-21(18(12-16)24(30)35)36-17-6-8-33(9-7-17)23(34)11-15-2-4-22(19(26)10-15)37-25(27,28)29/h2-5,10,12-14,17H,6-9,11H2,1H3,(H2,30,35)
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| InChIKey |
HIDHDSBYUFLSPQ-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