Binder Information
Binder General Information | Top | |||
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Binder ID |
B54IQX
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Binder Name |
Cyclo(CYIQNCPLG)
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Synonyms |
CHEMBL1630532; BDBM50332727
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C42H61N11O12S2
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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)[C@@H]4CCCN4C2=O)CC(C)C)C(=O)N)CCC(=O)N
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InChI |
1S/C42H61N11O12S2/c1-5-21(4)32-40(63)47-24(12-13-30(43)55)36(59)52-33(34(44)57)41(64)50-28-19-67-66-18-27(38(61)48-26(37(60)51-32)16-22-8-10-23(54)11-9-22)46-31(56)17-45-35(58)25(15-20(2)3)49-39(62)29-7-6-14-53(29)42(28)65/h8-11,20-21,24-29,32-33,54H,5-7,12-19H2,1-4H3,(H2,43,55)(H2,44,57)(H,45,58)(H,46,56)(H,47,63)(H,48,61)(H,49,62)(H,50,64)(H,51,60)(H,52,59)/t21-,24-,25-,26-,27-,28-,29-,32-,33-/m0/s1
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InChIKey |
LUTVWUSTZDNDRX-BTBSYTIGSA-N
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PubChem Compound ID |
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