General Information of the Compound
| Compound ID |
CP0380626
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| Compound Name |
2-(3-Fluoro-cyclopentyl)-2-hydroxy-N-[1-(4-methyl-pent-3-enyl)-piperidin-4-yl]-2-phenyl-acetamide
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| Structure |
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| Formula |
C24H35FN2O2
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| Molecular Weight |
402.554
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| Canonical SMILES |
CC(C)=CCCN1CCC(CC1)NC(=O)[C@@](O)([C@H]1CC[C@H](F)C1)c1ccccc1
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| InChI |
InChI=1S/C24H35FN2O2/c1-18(2)7-6-14-27-15-12-22(13-16-27)26-23(28)24(29,19-8-4-3-5-9-19)20-10-11-21(25)17-20/h3-5,7-9,20-22,29H,6,10-17H2,1-2H3,(H,26,28)/t20-,21-,24-/m0/s1
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| InChIKey |
MXMXMYWNGBMDEJ-HFMPRLQTSA-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