Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B46EOG
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| Binder Name |
(2S)-2-[[(2R)-2-[[(2S)-6-(Adamantane-1-carbonylamino)-2-[[(2S,3R)-2-(benzylamino)-3-methylpentanoyl]amino]hexanoyl]amino]-3-sulfanylpropanoyl]amino]-3-methylbutanoic acid
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| Synonyms |
CHEMBL1790149; BDBM50366594
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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 |
C38H59N5O6S
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| Canonical SMILES |
CC[C@@H](C)[C@@H](C(=O)N[C@@H](CCCCNC(=O)C12CC3CC(C1)CC(C3)C2)C(=O)N[C@@H](CS)C(=O)N[C@@H](C(C)C)C(=O)O)NCC4=CC=CC=C4
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| InChI |
1S/C38H59N5O6S/c1-5-24(4)32(40-21-25-11-7-6-8-12-25)35(46)41-29(33(44)42-30(22-50)34(45)43-31(23(2)3)36(47)48)13-9-10-14-39-37(49)38-18-26-15-27(19-38)17-28(16-26)20-38/h6-8,11-12,23-24,26-32,40,50H,5,9-10,13-22H2,1-4H3,(H,39,49)(H,41,46)(H,42,44)(H,43,45)(H,47,48)/t24-,26?,27?,28?,29+,30+,31+,32+,38?/m1/s1
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| InChIKey |
HUKBUWVJCHSBPH-WRXPHCQZSA-N
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| PubChem Compound ID | ||||
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