General Information of the Compound
| Compound ID |
CP0077795
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| Compound Name |
N-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-4-oxo-6-(trifluoromethoxy)chromene-2-carboxamide
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| Structure |
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| Formula |
C24H21F3N2O6
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| Molecular Weight |
490.434
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| Canonical SMILES |
FC(F)(F)Oc1ccc2oc(cc(=O)c2c1)C(=O)NC1CCN(Cc2ccc3OCOc3c2)CC1
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| InChI |
InChI=1S/C24H21F3N2O6/c25-24(26,27)35-16-2-4-19-17(10-16)18(30)11-22(34-19)23(31)28-15-5-7-29(8-6-15)12-14-1-3-20-21(9-14)33-13-32-20/h1-4,9-11,15H,5-8,12-13H2,(H,28,31)
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| InChIKey |
FPVGIMJAYIADNO-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