General Information of the Compound
| Compound ID |
CP0528061
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| Compound Name |
5,6-dimethyl-4-[4-(trifluoromethyl)phenoxy]thieno[2,3-d]pyrimidine
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| Structure |
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| Formula |
C15H11F3N2OS
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| Molecular Weight |
324.327
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| Canonical SMILES |
Cc1sc2ncnc(Oc3ccc(cc3)C(F)(F)F)c2c1C
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| InChI |
InChI=1S/C15H11F3N2OS/c1-8-9(2)22-14-12(8)13(19-7-20-14)21-11-5-3-10(4-6-11)15(16,17)18/h3-7H,1-2H3
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| InChIKey |
QPBNLVBZVGPLGR-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