General Information of the Compound
| Compound ID |
CP0959566
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| Compound Name |
6-(5-chloro-6-methylbenzofuran-2-yl)-2-methoxyimidazo[2,1-b][1,3,4]thiadiazole
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| Structure |
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| Formula |
C14H10ClN3O2S
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| Molecular Weight |
319.773
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| Canonical SMILES |
COc1nn2cc(-c3cc4cc(Cl)c(C)cc4o3)nc2s1
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| InChI |
InChI=1S/C14H10ClN3O2S/c1-7-3-11-8(4-9(7)15)5-12(20-11)10-6-18-13(16-10)21-14(17-18)19-2/h3-6H,1-2H3
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| InChIKey |
BYCBOULRJWWZOJ-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