General Information of the Compound
| Compound ID |
CP0551168
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| Compound Name |
1-[4-[7-(dimethylamino)quinazolin-4-yl]oxyphenyl]-3-[1-(1,3-thiazol-2-yl)ethyl]urea
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| Formula |
C22H22N6O2S
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| Molecular Weight |
434.525
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| Canonical SMILES |
CC(NC(=O)Nc1ccc(Oc2ncnc3cc(ccc23)N(C)C)cc1)c1nccs1
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| InChI |
InChI=1S/C22H22N6O2S/c1-14(21-23-10-11-31-21)26-22(29)27-15-4-7-17(8-5-15)30-20-18-9-6-16(28(2)3)12-19(18)24-13-25-20/h4-14H,1-3H3,(H2,26,27,29)
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| InChIKey |
RMIYGQQPVHZBHI-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