Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BQT87G
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| Binder Name |
1-Adamantyl N-[(2R)-1-[[(2S)-1-[[1-[4-(diaminomethylideneamino)phenyl]-4,4,4-trifluoro-3-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate
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| Synonyms |
CHEMBL1160809
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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 |
C36H45F3N6O5
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| Canonical SMILES |
CC(C)[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(CC2=CC=C(C=C2)N=C(N)N)C(=O)C(F)(F)F)NC(=O)OC34CC5CC(C3)CC(C5)C4
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| InChI |
1S/C36H45F3N6O5/c1-20(2)29(45-34(49)50-35-17-23-12-24(18-35)14-25(13-23)19-35)32(48)44-28(16-21-6-4-3-5-7-21)31(47)43-27(30(46)36(37,38)39)15-22-8-10-26(11-9-22)42-33(40)41/h3-11,20,23-25,27-29H,12-19H2,1-2H3,(H,43,47)(H,44,48)(H,45,49)(H4,40,41,42)/t23?,24?,25?,27?,28-,29+,35?/m0/s1
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| InChIKey |
AKQUVFNDHGSFAN-XRCFIFCTSA-N
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| PubChem Compound ID | ||||
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