General Information of the Compound
| Compound ID |
CP0557883
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| Compound Name |
5-[4-cyclopropyl-3-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-ol
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| Structure |
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| Formula |
C12H9F3N2O2
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| Molecular Weight |
270.21
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| Canonical SMILES |
Oc1nnc(o1)-c1ccc(C2CC2)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C12H9F3N2O2/c13-12(14,15)9-5-7(10-16-17-11(18)19-10)3-4-8(9)6-1-2-6/h3-6H,1-2H2,(H,17,18)
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| InChIKey |
NHYRDZBYWMXBAW-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