Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BBR0N4
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| Binder Name |
(2S,5S,8S)-2-(1-Benzothiophen-3-ylmethyl)-5-[4-(ethanethioylamino)butyl]-3,6,12,19-tetraoxo-1,4,7,11-tetrazacyclononadecane-8-carboxamide
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| Synonyms |
CHEMBL3935771; BDBM50197514
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL |
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| Formula |
C31H44N6O5S2
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| Canonical SMILES |
CC(=S)NCCCC[C@H]1C(=O)N[C@@H](CCNC(=O)CCCCCCC(=O)N[C@H](C(=O)N1)CC2=CSC3=CC=CC=C32)C(=O)N
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| InChI |
1S/C31H44N6O5S2/c1-20(43)33-16-9-8-11-24-30(41)36-23(29(32)40)15-17-34-27(38)13-4-2-3-5-14-28(39)35-25(31(42)37-24)18-21-19-44-26-12-7-6-10-22(21)26/h6-7,10,12,19,23-25H,2-5,8-9,11,13-18H2,1H3,(H2,32,40)(H,33,43)(H,34,38)(H,35,39)(H,36,41)(H,37,42)/t23-,24-,25-/m0/s1
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| InChIKey |
CAFNVXAFOHHHLU-SDHOMARFSA-N
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| PubChem Compound ID | ||||
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