General Information of the Compound
| Compound ID |
CP0525476
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| Compound Name |
3-fluoro-5-(5-pyridin-2-yl-1,2,4-oxadiazol-3-yl)benzonitrile
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| Structure |
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| Formula |
C14H7FN4O
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| Molecular Weight |
266.235
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| Canonical SMILES |
Fc1cc(cc(c1)-c1noc(n1)-c1ccccn1)C#N
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| InChI |
InChI=1S/C14H7FN4O/c15-11-6-9(8-16)5-10(7-11)13-18-14(20-19-13)12-3-1-2-4-17-12/h1-7H
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| InChIKey |
WZPADMVXGDUSLR-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