General Information of the Compound
| Compound ID |
CP0381400
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| Compound Name |
N-[2-(4-methoxyphenyl)ethyl]-1-methyl-4-phenylpiperidine-4-carboxamide
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| Structure |
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| Formula |
C22H28N2O2
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| Molecular Weight |
352.478
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| Canonical SMILES |
COc1ccc(CCNC(=O)C2(CCN(C)CC2)c2ccccc2)cc1
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| InChI |
InChI=1S/C22H28N2O2/c1-24-16-13-22(14-17-24,19-6-4-3-5-7-19)21(25)23-15-12-18-8-10-20(26-2)11-9-18/h3-11H,12-17H2,1-2H3,(H,23,25)
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| InChIKey |
YSGQXZGDFDFWGM-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: PT01310, Muscarinic acetylcholine receptor M1
Protein ID: PT01266, Muscarinic acetylcholine receptor M3
Protein ID: PT01516, Muscarinic acetylcholine receptor M5