General Information of the Compound
| Compound ID |
CP0464076
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| Compound Name |
2-(2,3-dihydro-1-benzofuran-5-yl)ethyl 4-(2-methoxyphenyl)-1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate
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| Structure |
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| Formula |
C24H27NO4
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| Molecular Weight |
393.483
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| Canonical SMILES |
COc1ccccc1C1=C(CN(C)CC1)C(=O)OCCc1ccc2OCCc2c1
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| InChI |
InChI=1S/C24H27NO4/c1-25-12-9-19(20-5-3-4-6-23(20)27-2)21(16-25)24(26)29-13-10-17-7-8-22-18(15-17)11-14-28-22/h3-8,15H,9-14,16H2,1-2H3
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| InChIKey |
SIAQJMVQWFGTPX-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: PT01516, Muscarinic acetylcholine receptor M5