Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BF9A8H
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| Binder Name |
(2S,4S,5S)-5-[[(2S)-2-[(3R)-3-Benzyl-4-(4-methylpiperazine-1-carbonyl)-2-oxopiperazin-1-yl]hexanoyl]amino]-6-cyclohexyl-N-[2-(dimethylamino)ethyl]-4-hydroxy-2-propan-2-ylhexanamide
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| Synonyms |
CHEMBL419942; BDBM50084640
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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 |
C42H71N7O5
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| Canonical SMILES |
CCCC[C@@H](C(=O)N[C@@H](CC1CCCCC1)[C@H](C[C@@H](C(C)C)C(=O)NCCN(C)C)O)N2CCN([C@@H](C2=O)CC3=CC=CC=C3)C(=O)N4CCN(CC4)C
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| InChI |
1S/C42H71N7O5/c1-7-8-19-36(48-26-27-49(42(54)47-24-22-46(6)23-25-47)37(41(48)53)29-33-17-13-10-14-18-33)40(52)44-35(28-32-15-11-9-12-16-32)38(50)30-34(31(2)3)39(51)43-20-21-45(4)5/h10,13-14,17-18,31-32,34-38,50H,7-9,11-12,15-16,19-30H2,1-6H3,(H,43,51)(H,44,52)/t34-,35-,36-,37+,38-/m0/s1
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| InChIKey |
GTHDYUYBZNOOOE-AKHKZFQHSA-N
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| PubChem Compound ID | ||||
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