General Information of the Compound
| Compound ID |
CP0903646
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| Compound Name |
N-(3,4-dichlorophenyl)-7-[({4-[2-(1,3-dioxolan-2-yl)ethyl]morpholin-2-yl}methyl)oxy]-6-(methyloxy)quinazolin-4-amine
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| Structure |
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| Formula |
C25H28Cl2N4O5
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| Molecular Weight |
535.428
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| Canonical SMILES |
COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCC1CN(CCC2OCCO2)CCO1
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| InChI |
InChI=1S/C25H28Cl2N4O5/c1-32-22-11-18-21(28-15-29-25(18)30-16-2-3-19(26)20(27)10-16)12-23(22)36-14-17-13-31(6-7-33-17)5-4-24-34-8-9-35-24/h2-3,10-12,15,17,24H,4-9,13-14H2,1H3,(H,28,29,30)
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| InChIKey |
RNCWMUAJKHOSIS-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