General Information of the Compound
| Compound ID |
CP0410991
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| Compound Name |
3-ethynyl-6-methylthieno[3,2-b]thiophene-5-carboxylic acid
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| Structure |
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| Formula |
C10H6O2S2
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| Molecular Weight |
222.29
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| Canonical SMILES |
Cc1c(sc2c(csc12)C#C)C(O)=O
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| InChI |
InChI=1S/C10H6O2S2/c1-3-6-4-13-7-5(2)8(10(11)12)14-9(6)7/h1,4H,2H3,(H,11,12)
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| InChIKey |
HJKVOFGWCNNLEW-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