General Information of the Compound
| Compound ID |
CP0566806
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| Compound Name |
CHEMBL4639938
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| Formula |
C21H21FN2O3
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| Molecular Weight |
368.408
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| Canonical SMILES |
CN1[C@H]2C[C@H](C[C@@H]1[C@H]1O[C@@H]21)OC(=O)Nc1ccc(F)cc1-c1ccccc1
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| InChI |
InChI=1S/C21H21FN2O3/c1-24-17-10-14(11-18(24)20-19(17)27-20)26-21(25)23-16-8-7-13(22)9-15(16)12-5-3-2-4-6-12/h2-9,14,17-20H,10-11H2,1H3,(H,23,25)/t14-,17+,18-,19+,20-
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| InChIKey |
JXUDJJIKYUMXJI-DHEZPFDPSA-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