General Information of the Compound
| Compound ID |
CP0436803
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| Compound Name |
[3-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]azetidin-1-yl]-(4-fluorophenyl)methanone
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| Structure |
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| Formula |
C18H13ClFN3O2
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| Molecular Weight |
357.772
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| Canonical SMILES |
Fc1ccc(cc1)C(=O)N1CC(C1)c1nc(no1)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C18H13ClFN3O2/c19-14-3-1-2-12(8-14)16-21-17(25-22-16)13-9-23(10-13)18(24)11-4-6-15(20)7-5-11/h1-8,13H,9-10H2
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| InChIKey |
CVUBKDHLSVIKFS-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