Binder Information
Binder General Information | Top | |||
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Binder ID |
B80IOT
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Binder Name |
3-[[12-(Azepan-1-yl)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-10-yl]amino]benzoic acid
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Synonyms |
CHEMBL2206359; IPR-803; AC1MV0EA; SCHEMBL12499325; BDBM50401173; MCULE-1693973491; HY-111192; CS-0034598; 3-[3-(Hexahydro-1H-azepine-1-yl)-6-oxo-6H-anthra[1,9-cd]isoxazole-5-ylamino]benzoic acid
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL |
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Formula |
C27H23N3O4
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Canonical SMILES |
C1CCCN(CC1)C2=CC(=C3C4=C(C5=CC=CC=C5C3=O)ON=C24)NC6=CC=CC(=C6)C(=O)O
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InChI |
1S/C27H23N3O4/c31-25-18-10-3-4-11-19(18)26-23-22(25)20(28-17-9-7-8-16(14-17)27(32)33)15-21(24(23)29-34-26)30-12-5-1-2-6-13-30/h3-4,7-11,14-15,28H,1-2,5-6,12-13H2,(H,32,33)
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InChIKey |
UAEULQWANHYLGJ-UHFFFAOYSA-N
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PubChem Compound ID |
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