Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B1AXW5
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| Binder Name |
(R)-N-{(S)-2-(4-Cyano-phenyl)-1-[(S)-4-guanidino-1-(thiazole-2-carbonyl)-butylcarbamoyl]-ethyl}-3-phenyl-2-phenylmethanesulfonylamino-propionamide
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| Synonyms |
CHEMBL77142; BDBM50130054; 2-[N-(Benzylsulfonyl)-D-Phe-4-cyano-L-Phe-L-Arg-]thiazole
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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 |
C35H38N8O5S2
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| Canonical SMILES |
C1=CC=C(C=C1)C[C@H](C(=O)N[C@@H](CC2=CC=C(C=C2)C#N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)C3=NC=CS3)NS(=O)(=O)CC4=CC=CC=C4
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| InChI |
1S/C35H38N8O5S2/c36-22-26-15-13-25(14-16-26)20-29(32(45)41-28(12-7-17-40-35(37)38)31(44)34-39-18-19-49-34)42-33(46)30(21-24-8-3-1-4-9-24)43-50(47,48)23-27-10-5-2-6-11-27/h1-6,8-11,13-16,18-19,28-30,43H,7,12,17,20-21,23H2,(H,41,45)(H,42,46)(H4,37,38,40)/t28-,29-,30+/m0/s1
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| InChIKey |
ORJYLMNCIRRJGS-OIFRRMEBSA-N
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| PubChem Compound ID | ||||
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