General Information of the Compound
| Compound ID |
CP0128144
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| Compound Name |
2-[5-(3-Nitro-phenyl)-[1,2,4]oxadiazol-3-yl]-pyridine
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| Structure |
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| Formula |
C13H8N4O3
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| Molecular Weight |
268.232
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| Canonical SMILES |
[O-][N+](=O)c1cccc(c1)-c1nc(no1)-c1ccccn1
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| InChI |
InChI=1S/C13H8N4O3/c18-17(19)10-5-3-4-9(8-10)13-15-12(16-20-13)11-6-1-2-7-14-11/h1-8H
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| InChIKey |
YYKRPCBJFTUNFZ-UHFFFAOYSA-N
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| CAS |
5799-85-9
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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