General Information of the Compound
| Compound ID |
CP0391332
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| Compound Name |
(R)-N-(3-Aminomethyl-phenyl)-2-((R)-3,3-difluoro-cyclopentyl)-2-hydroxy-2-phenyl-acetamide
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| Structure |
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| Formula |
C20H22F2N2O2
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| Molecular Weight |
360.404
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| Canonical SMILES |
NCc1cccc(NC(=O)[C@@](O)([C@@H]2CCC(F)(F)C2)c2ccccc2)c1
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| InChI |
InChI=1S/C20H22F2N2O2/c21-19(22)10-9-16(12-19)20(26,15-6-2-1-3-7-15)18(25)24-17-8-4-5-14(11-17)13-23/h1-8,11,16,26H,9-10,12-13,23H2,(H,24,25)/t16-,20+/m1/s1
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| InChIKey |
FJIIFJMUKPRFTH-UZLBHIALSA-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