General Information of the Compound
| Compound ID |
CP0425882
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| Compound Name |
2-(2,3-dihydro-1-benzofuran-5-yl)ethyl 4-(2-fluorophenyl)-1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate
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| Structure |
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| Formula |
C23H24FNO3
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| Molecular Weight |
381.447
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| Canonical SMILES |
CN1CCC(=C(C1)C(=O)OCCc1ccc2OCCc2c1)c1ccccc1F
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| InChI |
InChI=1S/C23H24FNO3/c1-25-11-8-18(19-4-2-3-5-21(19)24)20(15-25)23(26)28-12-9-16-6-7-22-17(14-16)10-13-27-22/h2-7,14H,8-13,15H2,1H3
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| InChIKey |
MWFQIDNMZVEVKH-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: PT01198, Muscarinic acetylcholine receptor M2
Protein ID: PT01266, Muscarinic acetylcholine receptor M3
Protein ID: PT01156, Muscarinic acetylcholine receptor M4
Protein ID: PT01516, Muscarinic acetylcholine receptor M5