General Information of the Compound
| Compound ID |
CP0509853
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| Compound Name |
N-(3,4-dichlorophenyl)-6-(methyloxy)-7-{[(3- morpholin-4-yl-1,2,4-oxadiazol-5- yl)methyl]oxy}quinazolin-4-amine
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| Structure |
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| Formula |
C22H20Cl2N6O4
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| Molecular Weight |
503.346
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| Canonical SMILES |
COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCc1nc(no1)N1CCOCC1
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| InChI |
InChI=1S/C22H20Cl2N6O4/c1-31-18-9-14-17(25-12-26-21(14)27-13-2-3-15(23)16(24)8-13)10-19(18)33-11-20-28-22(29-34-20)30-4-6-32-7-5-30/h2-3,8-10,12H,4-7,11H2,1H3,(H,25,26,27)
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| InChIKey |
DACWWGSNTVRALQ-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