General Information of the Compound
| Compound ID |
CP0563433
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| Compound Name |
ethyl 2-[[6-(4-methylsulfanylphenyl)thieno[3,2-d]pyrimidin-4-yl]amino]acetate
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| Formula |
C17H17N3O2S2
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| Molecular Weight |
359.476
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| Canonical SMILES |
CCOC(=O)CNc1ncnc2cc(sc12)-c1ccc(SC)cc1
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| InChI |
InChI=1S/C17H17N3O2S2/c1-3-22-15(21)9-18-17-16-13(19-10-20-17)8-14(24-16)11-4-6-12(23-2)7-5-11/h4-8,10H,3,9H2,1-2H3,(H,18,19,20)
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| InChIKey |
OUCZJDSFVJDQFO-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