General Information of the Compound
| Compound ID |
CP0514880
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| Compound Name |
(4-Trifluoromethylphenyl)-[7-(3-trifluoromethylpyridin-2-yl)-pyrimido[4,5-d]pyrimidin-4-yl]amine
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| Structure |
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| Formula |
C19H10F6N6
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| Molecular Weight |
436.319
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2ncnc3nc(ncc23)-c2ncccc2C(F)(F)F)cc1
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| InChI |
InChI=1S/C19H10F6N6/c20-18(21,22)10-3-5-11(6-4-10)30-15-12-8-27-17(31-16(12)29-9-28-15)14-13(19(23,24)25)2-1-7-26-14/h1-9H,(H,27,28,29,30,31)
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| InChIKey |
RMZAABQIOLQGNU-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