General Information of the Compound
| Compound ID |
CP0534378
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| Compound Name |
methyl 1-methyl-5-thiophen-2-ylindole-3-carboxylate
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| Formula |
C15H13NO2S
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| Molecular Weight |
271.341
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| Canonical SMILES |
COC(=O)c1cn(C)c2ccc(cc12)-c1cccs1
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| InChI |
InChI=1S/C15H13NO2S/c1-16-9-12(15(17)18-2)11-8-10(5-6-13(11)16)14-4-3-7-19-14/h3-9H,1-2H3
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| InChIKey |
CJLNVMKPTQPICJ-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