basic_info |
|
Product_Name: | ABAMACHEM ABA-5886337 |
EnglishSynonyms: | ABAMACHEM ABA-5886337 |
pro_mdlNumber: | MFCD18024716 |
pro_acceptors: | 8 |
pro_donors: | 3 |
pro_smile: | CC(=O)NCCNS(=O)(=O)c1cc(oc1Br)C(=O)O |
InChi: | InChI=1S/C9H11BrN2O6S/c1-5(13)11-2-3-12-19(16,17)7-4-6(9(14)15)18-8(7)10/h4,12H,2-3H2,1H3,(H,11,13)(H,14,15) |
InChiKey: | InChIKey=QPJWBBPVCIVZHO-UHFFFAOYSA-N |
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