General Information of the Compound
| Compound ID |
CP0372527
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| Compound Name |
2-[1-[2-(2-piperidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine
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| Structure |
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| Formula |
C23H28N2
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| Molecular Weight |
332.491
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| Canonical SMILES |
CC(C1=C(CCN2CCCCC2)Cc2ccccc12)c1ccccn1
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| InChI |
InChI=1S/C23H28N2/c1-18(22-11-5-6-13-24-22)23-20(12-16-25-14-7-2-8-15-25)17-19-9-3-4-10-21(19)23/h3-6,9-11,13,18H,2,7-8,12,14-17H2,1H3
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| InChIKey |
HCFXLIDWFGBUOO-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