Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BRIF94
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| Binder Name |
[3-[3-[4-[4-[[2-(3,5-Disulfooxyphenyl)-4-oxoquinazolin-3-yl]methyl]triazol-1-yl]butyl]-4-oxoquinazolin-2-yl]phenyl] hydrogen sulfate
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| Synonyms |
CHEMBL2326348; BDBM50427850
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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 |
C35H29N7O14S3
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| Canonical SMILES |
C1=CC=C2C(=C1)C(=O)N(C(=N2)C3=CC(=CC=C3)OS(=O)(=O)O)CCCCN4C=C(N=N4)CN5C(=NC6=CC=CC=C6C5=O)C7=CC(=CC(=C7)OS(=O)(=O)O)OS(=O)(=O)O
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| InChI |
1S/C35H29N7O14S3/c43-34-28-10-1-3-12-30(28)36-32(22-8-7-9-25(16-22)54-57(45,46)47)41(34)15-6-5-14-40-20-24(38-39-40)21-42-33(37-31-13-4-2-11-29(31)35(42)44)23-17-26(55-58(48,49)50)19-27(18-23)56-59(51,52)53/h1-4,7-13,16-20H,5-6,14-15,21H2,(H,45,46,47)(H,48,49,50)(H,51,52,53)
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| InChIKey |
UABURPFEINGDEA-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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