Binder Information
Binder General Information | Top | |||
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Binder ID |
BF3AU2
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Binder Name |
Cyclo(CYIQNCPLGAGAGAG
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Synonyms |
CHEMBL1630533; BDBM50332728
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C58H87N17O18S2
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Canonical SMILES |
CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]2CSSC[C@@H](C(=O)N[C@H](C(=O)N1)CC3=CC=C(C=C3)O)NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H]4CCCN4C2=O)CC(C)C)C)C)C)CC(=O)N)CCC(=O)N
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InChI |
1S/C58H87N17O18S2/c1-8-28(4)47-57(92)69-34(15-16-41(59)77)52(87)71-37(20-42(60)78)53(88)73-39-26-95-94-25-38(55(90)70-36(54(89)74-47)19-32-11-13-33(76)14-12-32)68-46(82)24-63-50(85)31(7)66-44(80)22-61-48(83)29(5)65-43(79)21-62-49(84)30(6)67-45(81)23-64-51(86)35(18-27(2)3)72-56(91)40-10-9-17-75(40)58(39)93/h11-14,27-31,34-40,47,76H,8-10,15-26H2,1-7H3,(H2,59,77)(H2,60,78)(H,61,83)(H,62,84)(H,63,85)(H,64,86)(H,65,79)(H,66,80)(H,67,81)(H,68,82)(H,69,92)(H,70,90)(H,71,87)(H,72,91)(H,73,88)(H,74,89)/t28-,29+,30-,31-,34-,35-,36-,37-,38-,39+,40-,47-/m0/s1
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InChIKey |
IMVJIHATGBYZHB-CVNWVNAISA-N
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PubChem Compound ID |
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