General Information of the Compound
| Compound ID |
CP0961559
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| Compound Name |
N-(3,4-dichlorophenyl)-6-(methyloxy)-7-{[(4-pyridin-4-ylmorpholin-2-yl)methyl]oxy}quinazolin-4-amine
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| Structure |
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| Formula |
C25H23Cl2N5O3
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| Molecular Weight |
512.397
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| Canonical SMILES |
COc1cc2c(Nc3ccc(Cl)c(Cl)c3)ncnc2cc1OCC1CN(c2ccncc2)CCO1
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| InChI |
InChI=1S/C25H23Cl2N5O3/c1-33-23-11-19-22(29-15-30-25(19)31-16-2-3-20(26)21(27)10-16)12-24(23)35-14-18-13-32(8-9-34-18)17-4-6-28-7-5-17/h2-7,10-12,15,18H,8-9,13-14H2,1H3,(H,29,30,31)
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| InChIKey |
GBWHKHICVCJEQW-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