General Information of the Compound
| Compound ID |
CP0496572
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| Compound Name |
(3-Chloro-4-fluoro-phenyl)-{7-methoxy-6-[2-(2-methoxy-ethylamino)-ethoxy]-quinazolin-4-yl}-amine
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| Structure |
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| Formula |
C20H22ClFN4O3
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| Molecular Weight |
420.872
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| Canonical SMILES |
COCCNCCOc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OC
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| InChI |
InChI=1S/C20H22ClFN4O3/c1-27-7-5-23-6-8-29-19-10-14-17(11-18(19)28-2)24-12-25-20(14)26-13-3-4-16(22)15(21)9-13/h3-4,9-12,23H,5-8H2,1-2H3,(H,24,25,26)
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| InChIKey |
FDBDZTQUOIKCIZ-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