General Information of the Compound
| Compound ID |
CP0558751
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| Compound Name |
1-[4-[[7-(dimethylamino)quinazolin-4-yl]amino]phenyl]-3-phenylurea
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| Structure |
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| Formula |
C23H22N6O
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| Molecular Weight |
398.47
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| Canonical SMILES |
CN(C)c1ccc2c(Nc3ccc(NC(=O)Nc4ccccc4)cc3)ncnc2c1
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| InChI |
InChI=1S/C23H22N6O/c1-29(2)19-12-13-20-21(14-19)24-15-25-22(20)26-17-8-10-18(11-9-17)28-23(30)27-16-6-4-3-5-7-16/h3-15H,1-2H3,(H,24,25,26)(H2,27,28,30)
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| InChIKey |
QLMTVDQQHJBWAE-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