General Information of the Compound
| Compound ID |
CP0562121
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| Compound Name |
4-(4,5-dithiophen-2-yl-1H-imidazol-2-yl)-2,6-dimethoxyphenol
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| Structure |
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| Formula |
C19H16N2O3S2
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| Molecular Weight |
384.482
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| Canonical SMILES |
COc1cc(cc(OC)c1O)-c1nc(-c2cccs2)c([nH]1)-c1cccs1
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| InChI |
InChI=1S/C19H16N2O3S2/c1-23-12-9-11(10-13(24-2)18(12)22)19-20-16(14-5-3-7-25-14)17(21-19)15-6-4-8-26-15/h3-10,22H,1-2H3,(H,20,21)
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| InChIKey |
PIQCMLFUYBIPJG-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