General Information of the Compound
| Compound ID |
CP0303269
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| Compound Name |
N-[3-(4-ethylpiperazin-1-yl)propyl]-2-(4-phenylphenoxy)acetamide
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| Structure |
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| Formula |
C23H31N3O2
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| Molecular Weight |
381.52
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| Canonical SMILES |
CCN1CCN(CCCNC(=O)COc2ccc(cc2)-c2ccccc2)CC1
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| InChI |
InChI=1S/C23H31N3O2/c1-2-25-15-17-26(18-16-25)14-6-13-24-23(27)19-28-22-11-9-21(10-12-22)20-7-4-3-5-8-20/h3-5,7-12H,2,6,13-19H2,1H3,(H,24,27)
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| InChIKey |
ROYSJTCXIAEDDB-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: PT00636, Acetylcholinesterase
Protein ID: PT03099, Acetylcholinesterase