General Information of the Compound
| Compound ID |
CP0488907
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| Compound Name |
2-(3,4-dimethoxyphenyl)ethyl 4-(2-methoxyphenyl)-1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate
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| Structure |
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| Formula |
C24H29NO5
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| Molecular Weight |
411.498
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| Canonical SMILES |
COc1ccc(CCOC(=O)C2=C(CCN(C)C2)c2ccccc2OC)cc1OC
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| InChI |
InChI=1S/C24H29NO5/c1-25-13-11-18(19-7-5-6-8-21(19)27-2)20(16-25)24(26)30-14-12-17-9-10-22(28-3)23(15-17)29-4/h5-10,15H,11-14,16H2,1-4H3
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| InChIKey |
YLPHXYUHNMSWJA-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