Binder Information
Binder General Information | Top | |||
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Binder ID |
B5R3WQ
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Binder Name |
Tyr-Ser-Phe-Lys-Asp-Met-Pro-Leu-Phe-Arg
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Synonyms |
CHEMBL438728; BDBM50033561
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C62H90N14O15S
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Canonical SMILES |
CC(C)C[C@@H](C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](CO)NC(=O)[C@H](CC4=CC=C(C=C4)O)N
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InChI |
1S/C62H90N14O15S/c1-36(2)30-45(54(83)71-47(33-38-16-8-5-9-17-38)56(85)70-44(61(90)91)19-12-27-67-62(65)66)74-59(88)50-20-13-28-76(50)60(89)43(25-29-92-3)69-57(86)48(34-51(79)80)73-53(82)42(18-10-11-26-63)68-55(84)46(32-37-14-6-4-7-15-37)72-58(87)49(35-77)75-52(81)41(64)31-39-21-23-40(78)24-22-39/h4-9,14-17,21-24,36,41-50,77-78H,10-13,18-20,25-35,63-64H2,1-3H3,(H,68,84)(H,69,86)(H,70,85)(H,71,83)(H,72,87)(H,73,82)(H,74,88)(H,75,81)(H,79,80)(H,90,91)(H4,65,66,67)/t41-,42-,43-,44-,45-,46-,47+,48-,49-,50-/m0/s1
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InChIKey |
GLRNBVXDKNGXIZ-NJUBILFWSA-N
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PubChem Compound ID |
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