Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B52MUV
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| Binder Name |
(5S)-4-[2-(1-Adamantyl)ethyl]-5-butyl-1-[(2S)-1-(4-hydroxyphenyl)-3-[(2S)-2-[[(6R)-6-(naphthalen-2-ylmethyl)-2,3-dioxopiperazin-1-yl]methyl]pyrrolidin-1-yl]propan-2-yl]piperazine-2,3-dione
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| Synonyms |
CHEMBL3593549; BDBM50104623
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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 |
C49H63N5O5
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| Canonical SMILES |
CCCC[C@H]1CN(C(=O)C(=O)N1CCC23CC4CC(C2)CC(C4)C3)[C@@H](CC5=CC=C(C=C5)O)CN6CCC[C@H]6CN7[C@@H](CNC(=O)C7=O)CC8=CC9=CC=CC=C9C=C8
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| InChI |
1S/C49H63N5O5/c1-2-3-9-41-32-54(48(59)47(58)52(41)19-17-49-26-35-20-36(27-49)22-37(21-35)28-49)43(24-33-12-15-44(55)16-13-33)30-51-18-6-10-40(51)31-53-42(29-50-45(56)46(53)57)25-34-11-14-38-7-4-5-8-39(38)23-34/h4-5,7-8,11-16,23,35-37,40-43,55H,2-3,6,9-10,17-22,24-32H2,1H3,(H,50,56)/t35?,36?,37?,40-,41-,42+,43-,49?/m0/s1
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| InChIKey |
DFINJLCZWBDBQX-KDNYSNCWSA-N
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| PubChem Compound ID | ||||
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