General Information of the Compound
| Compound ID |
CP0540581
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| Compound Name |
6-(7-Ethoxybenzofuran-2-yl)-2-ethylimidazo[2,1-b][1,3,4]thiadiazole
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| Structure |
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| Formula |
C16H15N3O2S
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| Molecular Weight |
313.382
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| Canonical SMILES |
CCOc1cccc2cc(oc12)-c1cn2nc(CC)sc2n1
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| InChI |
InChI=1S/C16H15N3O2S/c1-3-14-18-19-9-11(17-16(19)22-14)13-8-10-6-5-7-12(20-4-2)15(10)21-13/h5-9H,3-4H2,1-2H3
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| InChIKey |
MPJRMCGVWRYIEE-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