General Information of the Compound
| Compound ID |
CP0559588
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| Compound Name |
N-[5-[3-[2-(2,5-dimethoxyphenyl)ethyl]-4-oxoquinazolin-6-yl]-6-methylpyridin-2-yl]acetamide
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| Structure |
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| Formula |
C26H26N4O4
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| Molecular Weight |
458.518
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| Canonical SMILES |
COc1ccc(OC)c(CCn2cnc3ccc(cc3c2=O)-c2ccc(NC(C)=O)nc2C)c1
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| InChI |
InChI=1S/C26H26N4O4/c1-16-21(7-10-25(28-16)29-17(2)31)18-5-8-23-22(14-18)26(32)30(15-27-23)12-11-19-13-20(33-3)6-9-24(19)34-4/h5-10,13-15H,11-12H2,1-4H3,(H,28,29,31)
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| InChIKey |
FPXDQZUOFXALPE-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