General Information of the Compound
| Compound ID |
CP0964041
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| Compound Name |
N-[4-chloro-2,5-bis(methyloxy)phenyl]-7-{[(4-methylmorpholin-2-yl)methyl]oxy}-6-(methyloxy)quinazolin-4-amine
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| Structure |
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| Formula |
C23H27ClN4O5
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| Molecular Weight |
474.945
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| Canonical SMILES |
COc1cc(Nc2ncnc3cc(OCC4CN(C)CCO4)c(OC)cc23)c(OC)cc1Cl
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| InChI |
InChI=1S/C23H27ClN4O5/c1-28-5-6-32-14(11-28)12-33-22-9-17-15(7-21(22)31-4)23(26-13-25-17)27-18-10-19(29-2)16(24)8-20(18)30-3/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,25,26,27)
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| InChIKey |
ZKUNKJWGKBMFCR-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