General Information of the Compound
| Compound ID |
CP0485126
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| Compound Name |
1-[4-[7-(dimethylamino)quinazolin-4-yl]oxyphenyl]-3-[(1-methylpyrazol-3-yl)methyl]urea
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| Structure |
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| Formula |
C22H23N7O2
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| Molecular Weight |
417.473
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| Canonical SMILES |
CN(C)c1ccc2c(Oc3ccc(NC(=O)NCc4ccn(C)n4)cc3)ncnc2c1
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| InChI |
InChI=1S/C22H23N7O2/c1-28(2)17-6-9-19-20(12-17)24-14-25-21(19)31-18-7-4-15(5-8-18)26-22(30)23-13-16-10-11-29(3)27-16/h4-12,14H,13H2,1-3H3,(H2,23,26,30)
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| InChIKey |
YBJCLKLSVZHLQY-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