General Information of the Compound
| Compound ID |
CP0480113
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| Compound Name |
6-methyl-3-(1H-pyrazol-4-yl)thieno[3,2-b]thiophene-5-carboxylic acid
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| Structure |
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| Formula |
C11H8N2O2S2
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| Molecular Weight |
264.331
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| Canonical SMILES |
Cc1c(sc2c(csc12)-c1cn[nH]c1)C(O)=O
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| InChI |
InChI=1S/C11H8N2O2S2/c1-5-8-10(17-9(5)11(14)15)7(4-16-8)6-2-12-13-3-6/h2-4H,1H3,(H,12,13)(H,14,15)
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| InChIKey |
MDJAUISDURHTDB-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