Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BRI30T
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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]-3-naphthalen-1-ylanilino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pyrrolidine-2-carboxamide
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| Synonyms |
CHEMBL507059
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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 |
C59H74N14O8
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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=C(C=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=CC6=CC=CC=C65
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| InChI |
1S/C59H74N14O8/c1-36(2)51(56(80)71-48(32-38-16-6-4-7-17-38)53(77)67-34-39-18-8-5-9-19-39)72-52(76)44-28-27-41(33-45(44)43-23-12-21-40-20-10-11-22-42(40)43)68-54(78)46(24-13-29-64-58(60)61)70-55(79)49-26-15-31-73(49)57(81)47(25-14-30-65-59(62)63)69-50(75)35-66-37(3)74/h4-12,16-23,27-28,33,36,46-49,51H,13-15,24-26,29-32,34-35H2,1-3H3,(H,66,74)(H,67,77)(H,68,78)(H,69,75)(H,70,79)(H,71,80)(H,72,76)(H4,60,61,64)(H4,62,63,65)/t46-,47-,48-,49-,51-/m0/s1
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| InChIKey |
QOISYFGKBGZQLU-RGRNQTMXSA-N
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| PubChem Compound ID | ||||
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