Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BSA3J9
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| Binder Name |
[(S)-1-[5-(3-Cyclohexyl-propyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-ylcarbamoyl]-2-(4-hydroxy-phenyl)-ethyl]-carbamic acid tert-butyl ester
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| Synonyms |
CHEMBL304340; BDBM50103046
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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 |
C39H49N3O6S
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NC2C(SC3=CC=CC=C3N(C2=O)CCCC4CCCCC4)C5=CC=C(C=C5)OC
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| InChI |
1S/C39H49N3O6S/c1-39(2,3)48-38(46)40-31(25-27-16-20-29(43)21-17-27)36(44)41-34-35(28-18-22-30(47-4)23-19-28)49-33-15-9-8-14-32(33)42(37(34)45)24-10-13-26-11-6-5-7-12-26/h8-9,14-23,26,31,34-35,43H,5-7,10-13,24-25H2,1-4H3,(H,40,46)(H,41,44)/t31-,34?,35?/m0/s1
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| InChIKey |
QVWUFMRBACSUJQ-LKOMLCCKSA-N
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| PubChem Compound ID | ||||
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