Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BGBO18
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| Binder Name |
(2S)-6-Acetamido-2-[[(2S)-6-[6-[(6-amino-7H-purin-8-yl)sulfanyl]hexanoylamino]-2-[[(2S)-2,6-diacetamidohexanoyl]amino]hexanoyl]amino]hexanamide
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| Synonyms |
CHEMBL3884078; BDBM50209648
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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 |
C35H58N12O7S
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| Canonical SMILES |
CC(=O)NCCCC[C@@H](C(=O)N)NC(=O)[C@H](CCCCNC(=O)CCCCCSC1=NC2=NC=NC(=C2N1)N)NC(=O)[C@H](CCCCNC(=O)C)NC(=O)C
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| InChI |
1S/C35H58N12O7S/c1-22(48)38-17-9-6-13-25(31(37)52)44-34(54)27(45-33(53)26(43-24(3)50)14-7-10-18-39-23(2)49)15-8-11-19-40-28(51)16-5-4-12-20-55-35-46-29-30(36)41-21-42-32(29)47-35/h21,25-27H,4-20H2,1-3H3,(H2,37,52)(H,38,48)(H,39,49)(H,40,51)(H,43,50)(H,44,54)(H,45,53)(H3,36,41,42,46,47)/t25-,26-,27-/m0/s1
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| InChIKey |
PQIRSOXTSVNLBV-QKDODKLFSA-N
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| PubChem Compound ID | ||||
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