Binder Information
Binder General Information | Top | |||
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Binder ID |
BWX8P9
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Binder Name |
(5S,8S)-3-[(S)-2-Carboxy-2-(2,4,6-trimethyl-benzenesulfonylamino)-ethylcarbamoyl]-8-(pyridin-2-ylaminomethyl)-1-oxa-2,7-diaza-spiro[4.4]non-2-ene-7-carboxylic acid benzyl ester
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Synonyms |
CHEMBL338439; BDBM50138318
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL |
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Formula |
C33H38N6O8S
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Canonical SMILES |
CC1=CC(=C(C(=C1)C)S(=O)(=O)N[C@@H](CNC(=O)C2=NO[C@]3(C2)C[C@H](N(C3)C(=O)OCC4=CC=CC=C4)CNC5=CC=CC=N5)C(=O)O)C
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InChI |
1S/C33H38N6O8S/c1-21-13-22(2)29(23(3)14-21)48(44,45)38-27(31(41)42)18-36-30(40)26-16-33(47-37-26)15-25(17-35-28-11-7-8-12-34-28)39(20-33)32(43)46-19-24-9-5-4-6-10-24/h4-14,25,27,38H,15-20H2,1-3H3,(H,34,35)(H,36,40)(H,41,42)/t25-,27-,33-/m0/s1
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InChIKey |
IBXMYCNAAVLIET-SUPILHGUSA-N
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PubChem Compound ID |
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