Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BU8T0S
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| Binder Name |
[4-(5-Methoxy-4-oxo-3,7-disulfooxychromen-2-yl)-2-[[1-[4-[4-oxo-2-(3-sulfooxyphenyl)quinazolin-3-yl]butyl]triazol-4-yl]methoxy]phenyl] hydrogen sulfate
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| Synonyms |
CHEMBL2326351; BDBM50427847
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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 |
C37H31N5O21S4
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| Canonical SMILES |
COC1=CC(=CC2=C1C(=O)C(=C(O2)C3=CC(=C(C=C3)OS(=O)(=O)O)OCC4=CN(N=N4)CCCCN5C(=NC6=CC=CC=C6C5=O)C7=CC(=CC=C7)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O
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| InChI |
1S/C37H31N5O21S4/c1-57-30-17-25(61-65(48,49)50)18-31-32(30)33(43)35(63-67(54,55)56)34(59-31)21-11-12-28(62-66(51,52)53)29(16-21)58-20-23-19-41(40-39-23)13-4-5-14-42-36(38-27-10-3-2-9-26(27)37(42)44)22-7-6-8-24(15-22)60-64(45,46)47/h2-3,6-12,15-19H,4-5,13-14,20H2,1H3,(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)
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| InChIKey |
NKUMJJBFJNCWNJ-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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