General Information of the Compound
| Compound ID |
CP0117214
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| Compound Name |
2-(4-phenylphenoxy)-1-(4-piperidin-1-ylpiperidin-1-yl)ethanone
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| Structure |
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| Formula |
C24H30N2O2
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| Molecular Weight |
378.516
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| Canonical SMILES |
O=C(COc1ccc(cc1)-c1ccccc1)N1CCC(CC1)N1CCCCC1
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| InChI |
InChI=1S/C24H30N2O2/c27-24(26-17-13-22(14-18-26)25-15-5-2-6-16-25)19-28-23-11-9-21(10-12-23)20-7-3-1-4-8-20/h1,3-4,7-12,22H,2,5-6,13-19H2
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| InChIKey |
NNJPSKCGFBHMTD-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
Protein ID: PT03099, Acetylcholinesterase
Protein ID: PT00636, Acetylcholinesterase