General Information of the Compound
| Compound ID |
CP0474086
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| Compound Name |
2-(3-chlorophenoxy)-N-(1-((5-(5-(trifluoromethyl)pyridin-2-yl)furan-2-yl)methyl)piperidin-4-yl)acetamide
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| Structure |
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| Formula |
C24H23ClF3N3O3
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| Molecular Weight |
493.913
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| Canonical SMILES |
FC(F)(F)c1ccc(nc1)-c1ccc(CN2CCC(CC2)NC(=O)COc2cccc(Cl)c2)o1
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| InChI |
InChI=1S/C24H23ClF3N3O3/c25-17-2-1-3-19(12-17)33-15-23(32)30-18-8-10-31(11-9-18)14-20-5-7-22(34-20)21-6-4-16(13-29-21)24(26,27)28/h1-7,12-13,18H,8-11,14-15H2,(H,30,32)
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| InChIKey |
BQLFNNIHBFLFOT-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