General Information of the Compound
| Compound ID |
CP0455787
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| Compound Name |
N-[1-[2-fluoro-2-(3-fluorophenyl)ethyl]piperidin-4-yl]-N-phenylpropanamide
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| Structure |
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| Formula |
C22H26F2N2O
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| Molecular Weight |
372.459
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| Canonical SMILES |
CCC(=O)N(C1CCN(CC(F)c2cccc(F)c2)CC1)c1ccccc1
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| InChI |
InChI=1S/C22H26F2N2O/c1-2-22(27)26(19-9-4-3-5-10-19)20-11-13-25(14-12-20)16-21(24)17-7-6-8-18(23)15-17/h3-10,15,20-21H,2,11-14,16H2,1H3
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| InChIKey |
PWYOWTVTNKWSTQ-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