General Information of the Compound
| Compound ID |
CP0534848
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| Compound Name |
2-({2-[2-({[4-[(3,4-dichlorophenyl)amino]-6- (methyloxy)quinazolin-7- yl]oxy}methyl)morpholin-4- yl]ethyl}oxy)ethanol
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| Structure |
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| Formula |
C24H28Cl2N4O5
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| Molecular Weight |
523.417
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| Canonical SMILES |
COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCC1CN(CCOCCO)CCO1
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| InChI |
InChI=1S/C24H28Cl2N4O5/c1-32-22-11-18-21(27-15-28-24(18)29-16-2-3-19(25)20(26)10-16)12-23(22)35-14-17-13-30(5-8-34-17)4-7-33-9-6-31/h2-3,10-12,15,17,31H,4-9,13-14H2,1H3,(H,27,28,29)
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| InChIKey |
VDNKDMALAXYLFZ-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