General Information of the Compound
| Compound ID |
CP0542629
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| Compound Name |
4-(2-fluorophenoxy)-5-(trifluoromethyl)thieno[2,3-d]pyrimidine
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| Structure |
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| Formula |
C13H6F4N2OS
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| Molecular Weight |
314.263
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| Canonical SMILES |
Fc1ccccc1Oc1ncnc2scc(c12)C(F)(F)F
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| InChI |
InChI=1S/C13H6F4N2OS/c14-8-3-1-2-4-9(8)20-11-10-7(13(15,16)17)5-21-12(10)19-6-18-11/h1-6H
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| InChIKey |
QNQLZOVJSGIUGE-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