Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BM8TB2
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| Binder Name |
(2S)-4-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2R)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-sulfanylpropanoyl]amino]-5-oxopentanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-4-oxobutanoic acid
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| Synonyms |
CHEMBL3407792; BDBM50070034
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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 |
C46H68N10O12S
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| Canonical SMILES |
CC(C)C[C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)O)N
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| InChI |
1S/C46H68N10O12S/c1-23(2)18-29(47)39(60)54-34(22-69)43(64)50-30(16-17-35(48)58)40(61)51-31(19-26-10-8-7-9-11-26)41(62)52-32(20-27-12-14-28(57)15-13-27)42(63)55-38(25(5)6)45(66)56-37(24(3)4)44(65)53-33(46(67)68)21-36(49)59/h7-15,23-25,29-34,37-38,57,69H,16-22,47H2,1-6H3,(H2,48,58)(H2,49,59)(H,50,64)(H,51,61)(H,52,62)(H,53,65)(H,54,60)(H,55,63)(H,56,66)(H,67,68)/t29-,30-,31-,32-,33-,34-,37-,38-/m0/s1
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| InChIKey |
UHGDVMRBWGRBKT-NXJDBLJPSA-N
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| PubChem Compound ID | ||||
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