Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BN6WL9
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| Binder Name |
(2S)-6-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-hydroxybutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanamide
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| Synonyms |
CHEMBL1791266; BDBM50369485
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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 |
C55H103N23O11
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| Canonical SMILES |
C[C@@H]([C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)N)O
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| InChI |
1S/C55H103N23O11/c1-32(79)43(52(89)76-41(19-12-30-70-55(66)67)48(85)74-40(18-11-29-69-54(64)65)46(83)71-36(44(61)81)14-2-6-24-56)78-50(87)39(17-5-9-27-59)75-51(88)42(31-33-20-22-34(80)23-21-33)77-49(86)38(16-4-8-26-58)73-47(84)37(15-3-7-25-57)72-45(82)35(60)13-10-28-68-53(62)63/h20-23,32,35-43,79-80H,2-19,24-31,56-60H2,1H3,(H2,61,81)(H,71,83)(H,72,82)(H,73,84)(H,74,85)(H,75,88)(H,76,89)(H,77,86)(H,78,87)(H4,62,63,68)(H4,64,65,69)(H4,66,67,70)/t32-,35-,36-,37-,38-,39-,40-,41-,42-,43-/m0/s1
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| InChIKey |
CGHNSTTXFDTLPU-KXPJEIABSA-N
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| PubChem Compound ID | ||||
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