Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BX27NK
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| Binder Name |
Methyl N-[(2S)-1-[(2S)-2-[5-fluoro-4-[4-[4-[5-fluoro-2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-4-yl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
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| Synonyms |
CHEMBL2047191; BDBM50387086
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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 |
C40H48F2N8O6
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| Canonical SMILES |
CC(C)[C@@H](C(=O)N1CCC[C@H]1C2=NC(=C(N2)F)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=C(NC(=N5)[C@@H]6CCCN6C(=O)[C@H](C(C)C)NC(=O)OC)F)NC(=O)OC
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| InChI |
1S/C40H48F2N8O6/c1-21(2)29(45-39(53)55-5)37(51)49-19-7-9-27(49)35-43-31(33(41)47-35)25-15-11-23(12-16-25)24-13-17-26(18-14-24)32-34(42)48-36(44-32)28-10-8-20-50(28)38(52)30(22(3)4)46-40(54)56-6/h11-18,21-22,27-30H,7-10,19-20H2,1-6H3,(H,43,47)(H,44,48)(H,45,53)(H,46,54)/t27-,28-,29-,30-/m0/s1
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| InChIKey |
IYDMAGVFBIEVMF-KRCBVYEFSA-N
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| PubChem Compound ID | ||||
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