General Information of the Compound
| Compound ID |
CP0219478
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| Compound Name |
2-[6-(3,4-dichlorophenyl)thieno[3,2-d]pyrimidin-4-yl]sulfanylacetic acid
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| Formula |
C14H8Cl2N2O2S2
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| Molecular Weight |
371.27
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| Canonical SMILES |
OC(=O)CSc1ncnc2cc(sc12)-c1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C14H8Cl2N2O2S2/c15-8-2-1-7(3-9(8)16)11-4-10-13(22-11)14(18-6-17-10)21-5-12(19)20/h1-4,6H,5H2,(H,19,20)
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| InChIKey |
NPJLPWQSNHXMCS-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