Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B38IBF
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| Binder Name |
(S)-4-[Bis-(4-benzyloxy-benzyl)-amino]-4-{2-[2-(2-{(R)-2-[bis-(4-benzyloxy-benzyl)-amino]-4-carboxy-butyrylamino}-ethoxy)-ethoxy]-ethylcarbamoyl}-butyric acid
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| Synonyms |
CHEMBL387062; BDBM50091845
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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 |
C72H78N4O12
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| Canonical SMILES |
C1=CC=C(C=C1)COC2=CC=C(C=C2)CN(CC3=CC=C(C=C3)OCC4=CC=CC=C4)[C@H](CCC(=O)O)C(=O)NCCOCCOCCNC(=O)[C@H](CCC(=O)O)N(CC5=CC=C(C=C5)OCC6=CC=CC=C6)CC7=CC=C(C=C7)OCC8=CC=CC=C8
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| InChI |
1S/C72H78N4O12/c77-69(78)39-37-67(75(47-55-21-29-63(30-22-55)85-51-59-13-5-1-6-14-59)48-56-23-31-64(32-24-56)86-52-60-15-7-2-8-16-60)71(81)73-41-43-83-45-46-84-44-42-74-72(82)68(38-40-70(79)80)76(49-57-25-33-65(34-26-57)87-53-61-17-9-3-10-18-61)50-58-27-35-66(36-28-58)88-54-62-19-11-4-12-20-62/h1-36,67-68H,37-54H2,(H,73,81)(H,74,82)(H,77,78)(H,79,80)/t67-,68+
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| InChIKey |
QYGVWIKNPVFLJG-NBHUNHBSSA-N
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| PubChem Compound ID | ||||
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