General Information of the Compound
| Compound ID |
CP0449730
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| Compound Name |
2,3-dihydro-1-benzofuran-5-ylmethyl 1-methyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate
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| Structure |
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| Formula |
C22H23NO3
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| Molecular Weight |
349.43
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| Canonical SMILES |
CN1CCC(=C(C1)C(=O)OCc1ccc2OCCc2c1)c1ccccc1
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| InChI |
InChI=1S/C22H23NO3/c1-23-11-9-19(17-5-3-2-4-6-17)20(14-23)22(24)26-15-16-7-8-21-18(13-16)10-12-25-21/h2-8,13H,9-12,14-15H2,1H3
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| InChIKey |
MXUUBTKSSNOHCO-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