General Information of the Compound
| Compound ID |
CP0900956
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| Compound Name |
rac-6-(5-chloro-6-methoxybenzofuran-2-yl)-2-(1-fluoroethyl)imidazo[2,1-b][1,3,4]thiadiazole
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| Structure |
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| Formula |
C15H11ClFN3O2S
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| Molecular Weight |
351.79
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| Canonical SMILES |
COc1cc2oc(-c3cn4nc(C(C)F)sc4n3)cc2cc1Cl
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| InChI |
InChI=1S/C15H11ClFN3O2S/c1-7(17)14-19-20-6-10(18-15(20)23-14)13-4-8-3-9(16)12(21-2)5-11(8)22-13/h3-7H,1-2H3
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| InChIKey |
UWGGAGCONWPWLH-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