Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
B0CM3V
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| Binder Name |
Tyr-Ser-Phe-Lys-Asp-Met-Pro-Leu-D-Ala-Arg
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| Synonyms |
CHEMBL429535; BDBM50033563
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|
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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 |
C56H86N14O15S
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| Canonical SMILES |
C[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CC=C(C=C3)O)N
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| InChI |
1S/C56H86N14O15S/c1-31(2)26-40(49(78)62-32(3)46(75)65-39(55(84)85)15-10-23-61-56(59)60)68-53(82)44-16-11-24-70(44)54(83)38(21-25-86-4)64-51(80)42(29-45(73)74)67-48(77)37(14-8-9-22-57)63-50(79)41(28-33-12-6-5-7-13-33)66-52(81)43(30-71)69-47(76)36(58)27-34-17-19-35(72)20-18-34/h5-7,12-13,17-20,31-32,36-44,71-72H,8-11,14-16,21-30,57-58H2,1-4H3,(H,62,78)(H,63,79)(H,64,80)(H,65,75)(H,66,81)(H,67,77)(H,68,82)(H,69,76)(H,73,74)(H,84,85)(H4,59,60,61)/t32-,36+,37+,38+,39+,40+,41+,42+,43+,44+/m1/s1
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| InChIKey |
KOHKSMHBADZVOX-AIZWDXKSSA-N
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| PubChem Compound ID | ||||
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