General Information of the Compound
| Compound ID |
CP0139759
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| Compound Name |
2,3,4,5-Tetrahydro-10-methoxybenzo[b]thieno[2,3-f]-1,5-thiazocin-6-one
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| Structure |
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| Formula |
C13H13NO2S2
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| Molecular Weight |
279.386
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| Canonical SMILES |
COc1ccc2sc3c(SCCCNC3=O)c2c1
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| InChI |
InChI=1S/C13H13NO2S2/c1-16-8-3-4-10-9(7-8)11-12(18-10)13(15)14-5-2-6-17-11/h3-4,7H,2,5-6H2,1H3,(H,14,15)
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| InChIKey |
GGFLGGNNYKCRAV-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