General Information of the Compound
| Compound ID |
CP0472388
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| Compound Name |
2-pyridin-4-yl-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
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| Structure |
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| Formula |
C20H13F3N4
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| Molecular Weight |
366.346
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| Canonical SMILES |
FC(F)(F)c1cccc(Nc2nc(nc3ccccc23)-c2ccncc2)c1
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| InChI |
InChI=1S/C20H13F3N4/c21-20(22,23)14-4-3-5-15(12-14)25-19-16-6-1-2-7-17(16)26-18(27-19)13-8-10-24-11-9-13/h1-12H,(H,25,26,27)
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| InChIKey |
YZVGCOGDFKMVQC-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