General Information of the Compound
| Compound ID |
CP0407138
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| Compound Name |
1-[3,5-bis(trifluoromethyl)benzoyl]-N-[3-(furan-2-yl)phenyl]piperidine-3-carboxamide
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| Structure |
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| Formula |
C25H20F6N2O3
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| Molecular Weight |
510.434
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| Canonical SMILES |
FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)N1CCCC(C1)C(=O)Nc1cccc(c1)-c1ccco1
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| InChI |
InChI=1S/C25H20F6N2O3/c26-24(27,28)18-10-17(11-19(13-18)25(29,30)31)23(35)33-8-2-5-16(14-33)22(34)32-20-6-1-4-15(12-20)21-7-3-9-36-21/h1,3-4,6-7,9-13,16H,2,5,8,14H2,(H,32,34)
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| InChIKey |
KEOBJHDLTRGAIN-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