Binder Information
Binder General Information | Top | |||
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Binder ID |
BD4WB5
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Binder Name |
Cys-Gly-Arg-Val-Tyr-Arg-Pro-Cys-Trp-Glu-Val
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Synonyms |
CHEMBL429546; BDBM50022802
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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 |
C60H88N18O15S2
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Canonical SMILES |
CC(C)[C@@H]1C(=O)N[C@H](C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](CSSC[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1)CCCN=C(N)N)N)C(=O)N[C@H](CC3=CNC4=CC=CC=C43)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](C(C)C)C(=O)O)CCCN=C(N)N)CC5=CC=C(C=C5)O
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InChI |
1S/C60H88N18O15S2/c1-30(2)47-56(90)74-41(24-32-15-17-34(79)18-16-32)52(86)72-40(13-8-22-67-60(64)65)57(91)78-23-9-14-44(78)55(89)75-43(29-95-94-28-36(61)49(83)69-27-45(80)70-38(50(84)76-47)12-7-21-66-59(62)63)54(88)73-42(25-33-26-68-37-11-6-5-10-35(33)37)53(87)71-39(19-20-46(81)82)51(85)77-48(31(3)4)58(92)93/h5-6,10-11,15-18,26,30-31,36,38-44,47-48,68,79H,7-9,12-14,19-25,27-29,61H2,1-4H3,(H,69,83)(H,70,80)(H,71,87)(H,72,86)(H,73,88)(H,74,90)(H,75,89)(H,76,84)(H,77,85)(H,81,82)(H,92,93)(H4,62,63,66)(H4,64,65,67)/t36-,38+,39-,40-,41+,42-,43+,44+,47-,48-/m1/s1
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InChIKey |
LKVGLLSEDVAWGH-OSCGIFDCSA-N
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PubChem Compound ID |
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