Binder Information
Binder General Information | Top | |||
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Binder ID |
B4GWA5
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Binder Name |
(2S)-2-Amino-4-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-1-(3-methylidenepyrrolidin-1-yl)butane-1,4-dione;2,2,2-trifluoroacetic acid
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Synonyms |
CHEMBL3800113
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C30H32F8N4O6
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Canonical SMILES |
C=C1CCN(C1)C(=O)[C@H](CC(=O)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
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InChI |
1S/C26H30F2N4O2.2C2HF3O2/c1-18-10-11-32(17-18)26(34)23(29)16-24(33)30-12-14-31(15-13-30)25(19-2-6-21(27)7-3-19)20-4-8-22(28)9-5-20;2*3-2(4,5)1(6)7/h2-9,23,25H,1,10-17,29H2;2*(H,6,7)/t23-;;/m0../s1
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InChIKey |
IUGTXHQZGVFBDD-IFUPQEAVSA-N
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PubChem Compound ID |
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