General Information of the Compound
| Compound ID |
CP0418484
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| Compound Name |
2-pyridin-2-ylethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate
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| Structure |
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| Formula |
C21H24N2O2
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| Molecular Weight |
336.435
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| Canonical SMILES |
CCN1CCC(=C(C1)C(=O)OCCc1ccccn1)c1ccccc1
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| InChI |
InChI=1S/C21H24N2O2/c1-2-23-14-11-19(17-8-4-3-5-9-17)20(16-23)21(24)25-15-12-18-10-6-7-13-22-18/h3-10,13H,2,11-12,14-16H2,1H3
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| InChIKey |
PAYAQSDGYIQGSL-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