General Information of the Compound
| Compound ID |
CP0425887
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| Compound Name |
ethyl 1-[1-(2,6-dichlorobenzoyl)piperidin-4-yl]-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate
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| Structure |
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| Formula |
C26H28Cl2N2O3
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| Molecular Weight |
487.427
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| Canonical SMILES |
CCOC(=O)C1=C(CCN(C1)C1CCN(CC1)C(=O)c1c(Cl)cccc1Cl)c1ccccc1
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| InChI |
InChI=1S/C26H28Cl2N2O3/c1-2-33-26(32)21-17-30(16-13-20(21)18-7-4-3-5-8-18)19-11-14-29(15-12-19)25(31)24-22(27)9-6-10-23(24)28/h3-10,19H,2,11-17H2,1H3
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| InChIKey |
IPWHZFANZVSXQH-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