General Information of the Compound
| Compound ID |
CP0393595
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| Compound Name |
2-Cyclopentyl-2-hydroxy-2-phenyl-N-(1-pyridin-4-ylmethyl-piperidin-4-yl)-acetamide
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| Structure |
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| Formula |
C24H31N3O2
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| Molecular Weight |
393.531
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| Canonical SMILES |
OC(C1CCCC1)(C(=O)NC1CCN(Cc2ccncc2)CC1)c1ccccc1
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| InChI |
InChI=1S/C24H31N3O2/c28-23(24(29,21-8-4-5-9-21)20-6-2-1-3-7-20)26-22-12-16-27(17-13-22)18-19-10-14-25-15-11-19/h1-3,6-7,10-11,14-15,21-22,29H,4-5,8-9,12-13,16-18H2,(H,26,28)
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| InChIKey |
ODALTOXTLZKACI-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