Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BUKP90
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| Binder Name |
(3S)-3-[[2-[[(2S)-2-[[2-[[(2S,3R)-2-[[(2S)-2-Amino-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-4-[[(2S)-1-[(2S)-2-[[(1S)-1-carboxyethyl]carbamoyl]pyrrolidin-1-yl]-3-hydroxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid
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| Synonyms |
CHEMBL431797; BDBM50131109
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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 |
C34H58N12O14
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| Canonical SMILES |
C[C@H]([C@@H](C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](C(C)C)N)O
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| InChI |
1S/C34H58N12O14/c1-15(2)25(35)30(56)45-26(17(4)48)31(57)40-13-22(49)42-18(7-5-9-38-34(36)37)27(53)39-12-23(50)43-19(11-24(51)52)28(54)44-20(14-47)32(58)46-10-6-8-21(46)29(55)41-16(3)33(59)60/h15-21,25-26,47-48H,5-14,35H2,1-4H3,(H,39,53)(H,40,57)(H,41,55)(H,42,49)(H,43,50)(H,44,54)(H,45,56)(H,51,52)(H,59,60)(H4,36,37,38)/t16-,17+,18-,19-,20-,21-,25-,26-/m0/s1
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| InChIKey |
BZTOCKSEHYQIGJ-HNMIXQEFSA-N
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| PubChem Compound ID | ||||
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