General Information of the Compound
| Compound ID |
CP0966521
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| Compound Name |
N-(3,4-dichlorophenyl)-7-({[4-(2-fluoroethyl)morpholin-2-yl]methyl}oxy)-6-(methyloxy)quinazolin-4-amine
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| Structure |
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| Formula |
C22H23Cl2FN4O3
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| Molecular Weight |
481.355
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| Canonical SMILES |
COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCC1CN(CCF)CCO1
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| InChI |
InChI=1S/C22H23Cl2FN4O3/c1-30-20-9-16-19(10-21(20)32-12-15-11-29(5-4-25)6-7-31-15)26-13-27-22(16)28-14-2-3-17(23)18(24)8-14/h2-3,8-10,13,15H,4-7,11-12H2,1H3,(H,26,27,28)
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| InChIKey |
FFDFDDSWSCPPMW-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