General Information of the Compound
| Compound ID |
CP0064668
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| Compound Name |
4-(3-(2-Fluoroethoxy)-2-methoxy-benzoyl)-1-(2-p-toluylethyl)-piperidine
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| Structure |
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| Formula |
C24H30FNO3
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| Molecular Weight |
399.506
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| Canonical SMILES |
COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1
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| InChI |
InChI=1S/C24H30FNO3/c1-18-6-8-19(9-7-18)10-14-26-15-11-20(12-16-26)23(27)21-4-3-5-22(24(21)28-2)29-17-13-25/h3-9,20H,10-17H2,1-2H3
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| InChIKey |
PPXOTGGYVKBLCQ-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