Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B3XK5O
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| Binder Name |
[16-Acetylamino-4-carbamoyl-13-(4-guanidino-butyl)-3,3-dimethyl-6,9,12,15-tetraoxo-1,2-dithia-5,8,11,14-tetraaza-cycloheptadec-7-yl]-acetic acid
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| Synonyms |
CHEMBL2370402; BDBM50010181
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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 |
C23H39N9O8S2
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| Canonical SMILES |
CC(=O)N[C@@H]1CSSC([C@@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@H](NC1=O)CCCCN=C(N)N)CC(=O)O)C(=O)N)(C)C
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| InChI |
1S/C23H39N9O8S2/c1-11(33)29-14-10-41-42-23(2,3)17(18(24)37)32-20(39)13(8-16(35)36)30-15(34)9-28-19(38)12(31-21(14)40)6-4-5-7-27-22(25)26/h12-14,17H,4-10H2,1-3H3,(H2,24,37)(H,28,38)(H,29,33)(H,30,34)(H,31,40)(H,32,39)(H,35,36)(H4,25,26,27)/t12-,13-,14-,17+/m1/s1
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| InChIKey |
VWGTZFRRIPINRY-WBOJAVRRSA-N
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| PubChem Compound ID | ||||
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