General Information of the Compound
| Compound ID |
CP0463644
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| Compound Name |
2-(3-phenyl-1,2,4-oxadiazol-5-yl)-5-(trifluoromethyl)aniline
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| Structure |
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| Formula |
C15H10F3N3O
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| Molecular Weight |
305.259
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| Canonical SMILES |
Nc1cc(ccc1-c1nc(no1)-c1ccccc1)C(F)(F)F
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| InChI |
InChI=1S/C15H10F3N3O/c16-15(17,18)10-6-7-11(12(19)8-10)14-20-13(21-22-14)9-4-2-1-3-5-9/h1-8H,19H2
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| InChIKey |
WKURDEKTSXJDRZ-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