Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BP70CT
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| Binder Name |
(2S)-1-[(2S)-2-[(2-Acetamidoacetyl)amino]-5-(diaminomethylideneamino)pentanoyl]-N-[(2S)-1-[4-[[(2S)-1-[[(2S)-1-(benzylamino)-1-oxo-3-phenylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamoyl]-2-phenylanilino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carboxamide
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| Synonyms |
CHEMBL486269
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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 |
C55H72N14O8
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| Canonical SMILES |
CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)C)C5=CC=CC=C5
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| InChI |
1S/C55H72N14O8/c1-34(2)47(52(76)67-44(30-36-16-7-4-8-17-36)49(73)63-32-37-18-9-5-10-19-37)68-48(72)39-25-26-41(40(31-39)38-20-11-6-12-21-38)65-50(74)42(22-13-27-60-54(56)57)66-51(75)45-24-15-29-69(45)53(77)43(23-14-28-61-55(58)59)64-46(71)33-62-35(3)70/h4-12,16-21,25-26,31,34,42-45,47H,13-15,22-24,27-30,32-33H2,1-3H3,(H,62,70)(H,63,73)(H,64,71)(H,65,74)(H,66,75)(H,67,76)(H,68,72)(H4,56,57,60)(H4,58,59,61)/t42-,43-,44-,45-,47-/m0/s1
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| InChIKey |
LBAOLIOSIYMKJD-KRLHNBHHSA-N
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| PubChem Compound ID | ||||
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