General Information of the Compound
| Compound ID |
CP0510424
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| Compound Name |
methyl 3-[[2-(3-methoxyphenyl)sulfanylacetyl]amino]thiophene-2-carboxylate
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| Structure |
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| Formula |
C15H15NO4S2
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| Molecular Weight |
337.422
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| Canonical SMILES |
COC(=O)c1sccc1NC(=O)CSc1cccc(OC)c1
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| InChI |
InChI=1S/C15H15NO4S2/c1-19-10-4-3-5-11(8-10)22-9-13(17)16-12-6-7-21-14(12)15(18)20-2/h3-8H,9H2,1-2H3,(H,16,17)
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| InChIKey |
SSNFSIOXJSLSLI-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