General Information of the Compound
| Compound ID |
CP0424094
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| Compound Name |
2-(5-tert-butyl-1,2-oxazol-3-yl)-5-(3-chloro-5-fluorophenyl)-1,3,4-oxadiazole
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| Structure |
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| Formula |
C15H13ClFN3O2
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| Molecular Weight |
321.739
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| Canonical SMILES |
CC(C)(C)c1cc(no1)-c1nnc(o1)-c1cc(F)cc(Cl)c1
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| InChI |
InChI=1S/C15H13ClFN3O2/c1-15(2,3)12-7-11(20-22-12)14-19-18-13(21-14)8-4-9(16)6-10(17)5-8/h4-7H,1-3H3
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| InChIKey |
IPJGFFHOIFJUQA-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