General Information of the Compound
| Compound ID |
CP0418482
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| Compound Name |
2-naphthalen-1-ylethyl 1-methyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate
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| Structure |
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| Formula |
C25H25NO2
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| Molecular Weight |
371.48
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| Canonical SMILES |
CN1CCC(=C(C1)C(=O)OCCc1cccc2ccccc12)c1ccccc1
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| InChI |
InChI=1S/C25H25NO2/c1-26-16-14-23(20-8-3-2-4-9-20)24(18-26)25(27)28-17-15-21-12-7-11-19-10-5-6-13-22(19)21/h2-13H,14-18H2,1H3
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| InChIKey |
KPAAMRKQCRIZJP-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