General Information of the Compound
| Compound ID |
CP0574056
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| Compound Name |
6-(4-Ethoxy, 6-methoxybenzofuran-2-yl)-2-(methylthio)imidazo[2,1-b][1,3,4]thiadiazole
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| Structure |
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| Formula |
C16H15N3O4S
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| Molecular Weight |
345.38
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| Canonical SMILES |
CCOc1cc(OC)cc2oc(cc12)-c1cn2nc(OC)sc2n1
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| InChI |
InChI=1S/C16H15N3O4S/c1-4-22-12-5-9(20-2)6-13-10(12)7-14(23-13)11-8-19-15(17-11)24-16(18-19)21-3/h5-8H,4H2,1-3H3
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| InChIKey |
WACOTWHRFLODGY-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