General Information of the Compound
| Compound ID |
CP0562147
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| Compound Name |
2,5-dimethyl-1-(2-methylphenyl)pyrrole-3-carboxylic acid
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| Structure |
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| Formula |
C14H15NO2
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| Molecular Weight |
229.279
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| Canonical SMILES |
Cc1cc(C(O)=O)c(C)n1-c1ccccc1C
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| InChI |
InChI=1S/C14H15NO2/c1-9-6-4-5-7-13(9)15-10(2)8-12(11(15)3)14(16)17/h4-8H,1-3H3,(H,16,17)
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| InChIKey |
UTVAQKWEKCHEIW-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