General Information of the Compound
| Compound ID |
CP0203512
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| Compound Name |
2-[6-(4-chlorophenyl)thieno[3,2-d]pyrimidin-4-yl]oxyacetic acid
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| Structure |
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| Formula |
C14H9ClN2O3S
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| Molecular Weight |
320.757
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| Canonical SMILES |
OC(=O)COc1ncnc2cc(sc12)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C14H9ClN2O3S/c15-9-3-1-8(2-4-9)11-5-10-13(21-11)14(17-7-16-10)20-6-12(18)19/h1-5,7H,6H2,(H,18,19)
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| InChIKey |
KGLQMZWSWMDATD-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