Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BLIT70
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| Binder Name |
Ala-Met-Val-Gly-Arg-Cys-Tyr-Arg-Pro-Cys-Trp-Glu-Val
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| Synonyms |
CHEMBL438946; BDBM50022799
Click to Show/Hide
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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 |
C68H102N20O17S3
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| Canonical SMILES |
C[C@@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](NC(=O)[C@@H](NC1=O)CC3=CC=C(C=C3)O)CCCN=C(N)N)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)C(=O)N[C@H](CCC(=O)O)C(=O)N[C@H](C(C)C)C(=O)O)N
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| InChI |
1S/C68H102N20O17S3/c1-34(2)53(86-58(96)44(23-27-106-6)79-55(93)36(5)69)64(102)77-31-51(90)78-42(14-9-24-74-67(70)71)56(94)84-48-32-107-108-33-49(62(100)83-47(29-38-30-76-41-13-8-7-12-40(38)41)60(98)80-43(21-22-52(91)92)57(95)87-54(35(3)4)66(104)105)85-63(101)50-16-11-26-88(50)65(103)45(15-10-25-75-68(72)73)81-59(97)46(82-61(48)99)28-37-17-19-39(89)20-18-37/h7-8,12-13,17-20,30,34-36,42-50,53-54,76,89H,9-11,14-16,21-29,31-33,69H2,1-6H3,(H,77,102)(H,78,90)(H,79,93)(H,80,98)(H,81,97)(H,82,99)(H,83,100)(H,84,94)(H,85,101)(H,86,96)(H,87,95)(H,91,92)(H,104,105)(H4,70,71,74)(H4,72,73,75)/t36-,42-,43+,44-,45+,46-,47+,48-,49-,50-,53-,54+/m0/s1
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| InChIKey |
PIKATPHTFFGTTN-AAYLXXCMSA-N
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| PubChem Compound ID | ||||
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