General Information of the Compound
| Compound ID |
CP0502236
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| Compound Name |
2-(6-(4-fluorophenylsulfonyl)-5-methyl-6H-thieno[2,3-b]pyrrol-4-yl)acetic acid
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| Structure |
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| Formula |
C15H12FNO4S2
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| Molecular Weight |
353.396
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| Canonical SMILES |
Cc1c(CC(O)=O)c2ccsc2n1S(=O)(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C15H12FNO4S2/c1-9-13(8-14(18)19)12-6-7-22-15(12)17(9)23(20,21)11-4-2-10(16)3-5-11/h2-7H,8H2,1H3,(H,18,19)
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| InChIKey |
QYKDKHYDSONTKB-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