Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B6X2WI
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| Binder Name |
N-((S)-5-[Bis-(4-benzyloxy-benzyl)-amino]-5-{12-[(R)-2-[bis-(4-benzyloxy-benzyl)-amino]-6-(3-carboxy-propionylamino)-hexanoylamino]-dodecylcarbamoyl}-pentyl)-succinamic acid
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| Synonyms |
CHEMBL268782; BDBM50091852
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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 |
C88H108N6O12
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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](CCCCNC(=O)CCC(=O)O)C(=O)NCCCCCCCCCCCCNC(=O)[C@H](CCCCNC(=O)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/C88H108N6O12/c95-83(53-55-85(97)98)89-57-25-21-35-81(93(61-69-37-45-77(46-38-69)103-65-73-27-13-9-14-28-73)62-70-39-47-78(48-40-70)104-66-74-29-15-10-16-30-74)87(101)91-59-23-7-5-3-1-2-4-6-8-24-60-92-88(102)82(36-22-26-58-90-84(96)54-56-86(99)100)94(63-71-41-49-79(50-42-71)105-67-75-31-17-11-18-32-75)64-72-43-51-80(52-44-72)106-68-76-33-19-12-20-34-76/h9-20,27-34,37-52,81-82H,1-8,21-26,35-36,53-68H2,(H,89,95)(H,90,96)(H,91,101)(H,92,102)(H,97,98)(H,99,100)/t81-,82+
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| InChIKey |
MQHMUHDMZZORGD-IEPOFJRRSA-N
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| PubChem Compound ID | ||||
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