Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BQ69ZJ
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| Binder Name |
Benzyl (2S)-2-[[3-amino-4-[[(2S)-2-amino-4-(4-phenylmethoxyphenyl)butanoyl]amino]benzoyl]amino]-3-(1H-indol-3-yl)propanoate
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| Synonyms |
CHEMBL3416719; BDBM50077121
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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 |
C42H41N5O5
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| Canonical SMILES |
C1=CC=C(C=C1)COC2=CC=C(C=C2)CC[C@@H](C(=O)NC3=C(C=C(C=C3)C(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6)N)N
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| InChI |
1S/C42H41N5O5/c43-35(21-17-28-15-19-33(20-16-28)51-26-29-9-3-1-4-10-29)41(49)46-38-22-18-31(23-36(38)44)40(48)47-39(42(50)52-27-30-11-5-2-6-12-30)24-32-25-45-37-14-8-7-13-34(32)37/h1-16,18-20,22-23,25,35,39,45H,17,21,24,26-27,43-44H2,(H,46,49)(H,47,48)/t35-,39-/m0/s1
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| InChIKey |
JJXYQZNYGWSPCB-HMIRPBQQSA-N
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| PubChem Compound ID | ||||
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