General Information of the Compound
| Compound ID |
CP0455399
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| Compound Name |
5-(5-nitrothiophen-3-yl)-3-(pyridin-2-yl)-1,2,4-oxadiazole
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| Structure |
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| Formula |
C11H6N4O3S
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| Molecular Weight |
274.261
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| Canonical SMILES |
[O-][N+](=O)c1cc(cs1)-c1nc(no1)-c1ccccn1
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| InChI |
InChI=1S/C11H6N4O3S/c16-15(17)9-5-7(6-19-9)11-13-10(14-18-11)8-3-1-2-4-12-8/h1-6H
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| InChIKey |
WEEMTLZDWQOOKJ-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