Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B4W5KO
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| Binder Name |
(2S,5S,8S)-2-(1-Benzothiophen-3-ylmethyl)-5-[4-(ethanethioylamino)butyl]-3,6,13,20-tetraoxo-1,4,7,12-tetrazacycloicosane-8-carboxamide
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| Synonyms |
CHEMBL3964797; BDBM50197389
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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 |
C32H46N6O5S2
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| Canonical SMILES |
CC(=S)NCCCC[C@H]1C(=O)N[C@@H](CCCNC(=O)CCCCCCC(=O)N[C@H](C(=O)N1)CC2=CSC3=CC=CC=C32)C(=O)N
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| InChI |
1S/C32H46N6O5S2/c1-21(44)34-17-9-8-12-25-31(42)37-24(30(33)41)13-10-18-35-28(39)15-4-2-3-5-16-29(40)36-26(32(43)38-25)19-22-20-45-27-14-7-6-11-23(22)27/h6-7,11,14,20,24-26H,2-5,8-10,12-13,15-19H2,1H3,(H2,33,41)(H,34,44)(H,35,39)(H,36,40)(H,37,42)(H,38,43)/t24-,25-,26-/m0/s1
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| InChIKey |
FMJMJQGMJXXPLJ-GSDHBNRESA-N
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| PubChem Compound ID | ||||
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