Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BY2KW3
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| Binder Name |
2-[(2S)-2-[[(2R)-2-[[(2S)-2-Acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
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| Synonyms |
CHEMBL3287071; BDBM50017149
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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 |
C33H42N10O5
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| Canonical SMILES |
CC(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N3CC4=CC=CC=C4CC3C(=O)N
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| InChI |
1S/C33H42N10O5/c1-20(44)40-27(16-24-17-37-19-39-24)31(47)42-26(14-21-8-3-2-4-9-21)30(46)41-25(12-7-13-38-33(35)36)32(48)43-18-23-11-6-5-10-22(23)15-28(43)29(34)45/h2-6,8-11,17,19,25-28H,7,12-16,18H2,1H3,(H2,34,45)(H,37,39)(H,40,44)(H,41,46)(H,42,47)(H4,35,36,38)/t25-,26+,27-,28?/m0/s1
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| InChIKey |
MNPGXWWVUBHRNN-KSAQDQTQSA-N
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| PubChem Compound ID | ||||
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