General Information of the Compound
| Compound ID |
CP0533563
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| Compound Name |
2-(2,3-difluoro-4-methoxyphenyl)-5-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethoxy)phenyl]-1,3,4-oxadiazole
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| Structure |
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| Formula |
C18H10F5N5O3
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| Molecular Weight |
439.3
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| Canonical SMILES |
COc1ccc(-c2nnc(o2)-c2cc(OC(F)(F)F)ccc2-n2cncn2)c(F)c1F
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| InChI |
InChI=1S/C18H10F5N5O3/c1-29-13-5-3-10(14(19)15(13)20)16-26-27-17(30-16)11-6-9(31-18(21,22)23)2-4-12(11)28-8-24-7-25-28/h2-8H,1H3
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| InChIKey |
GQSIJIZTJDSDQV-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