General Information of the Compound
| Compound ID |
CP0512497
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| Compound Name |
4-fluoro-3-(4-oxo-2-pyridin-4-yl-5H-thieno[3,2-c]pyridin-7-yl)benzonitrile
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| Structure |
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| Formula |
C19H10FN3OS
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| Molecular Weight |
347.374
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| Canonical SMILES |
Fc1ccc(cc1-c1c[nH]c(=O)c2cc(sc12)-c1ccncc1)C#N
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| InChI |
InChI=1S/C19H10FN3OS/c20-16-2-1-11(9-21)7-13(16)15-10-23-19(24)14-8-17(25-18(14)15)12-3-5-22-6-4-12/h1-8,10H,(H,23,24)
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| InChIKey |
QTMWRIBZHAYRNM-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