General Information of the Compound
| Compound ID |
CP0178748
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| Compound Name |
N-(3-chloro-6-methoxypyridin-2-yl)-7-(3-morpholin-4-ylpropoxy)-5-(oxan-4-yloxy)quinazolin-4-amine
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| Structure |
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| Formula |
C26H32ClN5O5
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| Molecular Weight |
530.025
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| Canonical SMILES |
COc1ccc(Cl)c(Nc2ncnc3cc(OCCCN4CCOCC4)cc(OC4CCOCC4)c23)n1
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| InChI |
InChI=1S/C26H32ClN5O5/c1-33-23-4-3-20(27)25(30-23)31-26-24-21(28-17-29-26)15-19(16-22(24)37-18-5-11-34-12-6-18)36-10-2-7-32-8-13-35-14-9-32/h3-4,15-18H,2,5-14H2,1H3,(H,28,29,30,31)
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| InChIKey |
DRRPOWMBNXYOQX-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