General Information of the Compound
| Compound ID |
CP0522066
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| Compound Name |
3-[2-(3-chlorophenyl)-6-fluorophenyl]-5-(piperidin-4-ylmethyl)-1,2,4-oxadiazole
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| Structure |
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| Formula |
C20H19ClFN3O
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| Molecular Weight |
371.843
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| Canonical SMILES |
Fc1cccc(-c2cccc(Cl)c2)c1-c1noc(CC2CCNCC2)n1
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| InChI |
InChI=1S/C20H19ClFN3O/c21-15-4-1-3-14(12-15)16-5-2-6-17(22)19(16)20-24-18(26-25-20)11-13-7-9-23-10-8-13/h1-6,12-13,23H,7-11H2
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| InChIKey |
JFEDLDBLCNWJJT-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