General Information of the Compound
| Compound ID |
CP0418487
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| Compound Name |
2-(2,3-dihydro-1-benzofuran-5-yl)ethyl 1-methyl-5-phenyl-3,6-dihydro-2H-pyridine-4-carboxylate
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| Structure |
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| Formula |
C23H25NO3
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| Molecular Weight |
363.457
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| Canonical SMILES |
CN1CCC(C(=O)OCCc2ccc3OCCc3c2)=C(C1)c1ccccc1
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| InChI |
InChI=1S/C23H25NO3/c1-24-12-9-20(21(16-24)18-5-3-2-4-6-18)23(25)27-13-10-17-7-8-22-19(15-17)11-14-26-22/h2-8,15H,9-14,16H2,1H3
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| InChIKey |
IZEXJMUYOSKSDZ-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