General Information of the Compound
| Compound ID |
CP0405987
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| Compound Name |
5-[2-(2,5-dichlorophenyl)-6-fluorophenyl]-3-piperidin-4-yl-1,2,4-oxadiazole
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| Structure |
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| Formula |
C19H16Cl2FN3O
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| Molecular Weight |
392.261
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| Canonical SMILES |
Fc1cccc(-c2cc(Cl)ccc2Cl)c1-c1nc(no1)C1CCNCC1
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| InChI |
InChI=1S/C19H16Cl2FN3O/c20-12-4-5-15(21)14(10-12)13-2-1-3-16(22)17(13)19-24-18(25-26-19)11-6-8-23-9-7-11/h1-5,10-11,23H,6-9H2
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| InChIKey |
SFXHRHJZVXBMCV-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: PT01266, Muscarinic acetylcholine receptor M3