BDBM50121498 4-[4,5-Dihydroxy-7-(4-hydroxymethyl-benzyl)-1,1-dioxo-3,6-bis-phenoxymethyl-1lambda*6*-[1,2,7]thiadiazepan-2-ylmethyl]-benzoic acid methyl ester::CHEMBL149862

SMILES: COC(=O)c1ccc(CN2[C@H](COc3ccccc3)[C@H](O)[C@@H](O)[C@@H](COc3ccccc3)N(Cc3ccc(CO)cc3)S2(=O)=O)cc1

InChI Key: InChIKey=ZMJUWFXCWLDAKQ-WZJLIZBTSA-N

Data: 1 KI  1 Kd  1 K_off  1 K_on

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Substructure Similarity at least:  must be >=0.5 Exact match