Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B30EOS
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| Binder Name |
(5S)-4-[2-(1-Adamantyl)ethyl]-1-[(2S)-1-[(2S)-2-[[(6S)-2,3-dioxo-6-propylpiperazin-1-yl]methyl]pyrrolidin-1-yl]-3-(4-hydroxyphenyl)propan-2-yl]-5-(naphthalen-2-ylmethyl)piperazine-2,3-dione
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| Synonyms |
CHEMBL3593542; BDBM50104630
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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 |
C48H61N5O5
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| Canonical SMILES |
CCC[C@H]1CNC(=O)C(=O)N1C[C@@H]2CCCN2C[C@H](CC3=CC=C(C=C3)O)N4C[C@@H](N(C(=O)C4=O)CCC56CC7CC(C5)CC(C7)C6)CC8=CC9=CC=CC=C9C=C8
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| InChI |
1S/C48H61N5O5/c1-2-6-39-28-49-44(55)45(56)52(39)30-40-9-5-17-50(40)29-41(23-32-11-14-43(54)15-12-32)53-31-42(24-33-10-13-37-7-3-4-8-38(37)22-33)51(46(57)47(53)58)18-16-48-25-34-19-35(26-48)21-36(20-34)27-48/h3-4,7-8,10-15,22,34-36,39-42,54H,2,5-6,9,16-21,23-31H2,1H3,(H,49,55)/t34?,35?,36?,39-,40-,41-,42-,48?/m0/s1
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| InChIKey |
XEZAWDWDXUIILJ-PSPHSCPFSA-N
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| PubChem Compound ID | ||||
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