Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BH4JR7
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| Binder Name |
Benzyl [4-[3-[[2-(4-methoxyphenyl)-5-[2-(naphthalen-1-ylmethylamino)-2-oxoethyl]-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl]amino]-3-oxopropyl]phenyl] hydrogen phosphate
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| Synonyms |
CHEMBL304745; BDBM50103061
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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 |
C45H42N3O8PS
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| Canonical SMILES |
COC1=CC=C(C=C1)C2C(C(=O)N(C3=CC=CC=C3S2)CC(=O)NCC4=CC=CC5=CC=CC=C54)NC(=O)CCC6=CC=C(C=C6)OP(=O)(O)OCC7=CC=CC=C7
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| InChI |
1S/C45H42N3O8PS/c1-54-36-25-21-34(22-26-36)44-43(47-41(49)27-20-31-18-23-37(24-19-31)56-57(52,53)55-30-32-10-3-2-4-11-32)45(51)48(39-16-7-8-17-40(39)58-44)29-42(50)46-28-35-14-9-13-33-12-5-6-15-38(33)35/h2-19,21-26,43-44H,20,27-30H2,1H3,(H,46,50)(H,47,49)(H,52,53)
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| InChIKey |
QHNMMWOCJGIECZ-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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