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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | L-selectin | ||
| Ligand | BDBM50205401 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_428319 (CHEMBL917097) | ||
| IC50 | 5700±n/a nM | ||
| Citation |  Kranich, R; Busemann, AS; Bock, D; Schroeter-Maas, S; Beyer, D; Heinemann, B; Meyer, M; Schierhorn, K; Zahlten, R; Wolff, G; Aydt, EM Rational design of novel, potent small molecule pan-selectin antagonists. J Med Chem50:1101-15 (2007) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| L-selectin | |||
| Name: | L-selectin | ||
| Synonyms: | LNHR | LYAM1 | LYAM1_HUMAN | Leukocyte adhesion molecule-1 | SELL | Selectin | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 42187.20 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | ChEMBL_200000 | ||
| Residue: | 372 | ||
| Sequence: |
| ||
| BDBM50205401 | |||
| n/a | |||
| Name | BDBM50205401 | ||
| Synonyms: | 4-{[3-(3,4,5-trihydroxy-phenyl)-propionylamino]-methyl}-cyclohexanecarboxylic acid | CHEMBL376200 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C16H21NO6 | ||
| Mol. Mass. | 323.341 | ||
| SMILES | OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)CCc1cc(O)c(O)c(O)c1 |wU:3.2,wD:6.9,(23.8,-27.36,;23.8,-25.82,;25.14,-25.06,;22.47,-25.04,;21.13,-25.81,;19.81,-25.04,;19.81,-23.5,;21.14,-22.72,;22.47,-23.5,;18.47,-22.73,;17.14,-23.5,;17.14,-25.04,;15.81,-22.73,;14.47,-23.5,;13.14,-22.73,;11.84,-23.55,;10.49,-22.82,;9.18,-23.62,;10.45,-21.27,;9.1,-20.53,;11.77,-20.47,;11.73,-18.93,;13.12,-21.2,)| | ||
| Structure | 
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