General Information of the Compound
| Compound ID |
CP0528523
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| Compound Name |
2-methoxy-N-[2-(4-methoxyphenyl)ethyl]-6-(4-morpholin-4-ylphenyl)pyrimidin-4-amine
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| Structure |
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| Formula |
C24H28N4O3
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| Molecular Weight |
420.513
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| Canonical SMILES |
COc1ccc(CCNc2cc(nc(OC)n2)-c2ccc(cc2)N2CCOCC2)cc1
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| InChI |
InChI=1S/C24H28N4O3/c1-29-21-9-3-18(4-10-21)11-12-25-23-17-22(26-24(27-23)30-2)19-5-7-20(8-6-19)28-13-15-31-16-14-28/h3-10,17H,11-16H2,1-2H3,(H,25,26,27)
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| InChIKey |
BZXYLLKICRAQTA-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