Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BLX0A1
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| Binder Name |
(2S)-5-Carbamimidamido-2-{[(2S)-1-[(2S)-5-carbamimidamido-2-(2-acetamidoacetamido)pentanoyl]pyrrolidin-2-yl]formamido}-N-(4-{[(1S)-2-methyl-1-{[(1S)-1-{[(4-pentylphenyl)methyl]carbamoyl}-2-phenylethyl]carbamoyl}propyl]carbamoyl}phenyl)pentanamide
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| Synonyms |
CHEMBL397075; BDBM50204335
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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 |
C54H78N14O8
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| Canonical SMILES |
CCCCCC1=CC=C(C=C1)CNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C(C)C)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
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| InChI |
1S/C54H78N14O8/c1-5-6-8-14-36-20-22-38(23-21-36)32-62-48(72)43(31-37-15-9-7-10-16-37)66-51(75)46(34(2)3)67-47(71)39-24-26-40(27-25-39)63-49(73)41(17-11-28-59-53(55)56)65-50(74)44-19-13-30-68(44)52(76)42(18-12-29-60-54(57)58)64-45(70)33-61-35(4)69/h7,9-10,15-16,20-27,34,41-44,46H,5-6,8,11-14,17-19,28-33H2,1-4H3,(H,61,69)(H,62,72)(H,63,73)(H,64,70)(H,65,74)(H,66,75)(H,67,71)(H4,55,56,59)(H4,57,58,60)/t41-,42-,43-,44-,46-/m0/s1
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| InChIKey |
BJMZMYWTCBXTQR-MUIHRTSISA-N
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| PubChem Compound ID | ||||
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