General Information of the Compound
| Compound ID |
CP0535900
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| Compound Name |
1-[2-methyl-4-[6-(methylamino)pyrimidin-4-yl]oxyphenyl]-3-(1,3-thiazol-2-yl)urea
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| Structure |
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| Formula |
C16H16N6O2S
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| Molecular Weight |
356.411
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| Canonical SMILES |
CNc1cc(Oc2ccc(NC(=O)Nc3nccs3)c(C)c2)ncn1
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| InChI |
InChI=1S/C16H16N6O2S/c1-10-7-11(24-14-8-13(17-2)19-9-20-14)3-4-12(10)21-15(23)22-16-18-5-6-25-16/h3-9H,1-2H3,(H,17,19,20)(H2,18,21,22,23)
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| InChIKey |
QLRVUAWHXYPDCL-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