Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BJ1W4Y
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| Binder Name |
2-[(1S)-1-[[(2S,3R)-2-Amino-3-methylpentanoyl]amino]-2-(4-fluorophenyl)ethyl]-N-[2-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-2-oxoethyl]-N-benzyl-1,3-thiazole-4-carboxamide
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| Synonyms |
CHEMBL1790239; BDBM50366501
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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 |
C42H53FN10O5S
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| Canonical SMILES |
CC[C@@H](C)[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)F)C2=NC(=CS2)C(=O)N(CC3=CC=CC=C3)CC(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N)N
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| InChI |
1S/C42H53FN10O5S/c1-3-26(2)36(44)39(57)51-33(22-28-16-18-30(43)19-17-28)40-52-34(25-59-40)41(58)53(23-29-13-8-5-9-14-29)24-35(54)49-31(15-10-20-48-42(46)47)38(56)50-32(37(45)55)21-27-11-6-4-7-12-27/h4-9,11-14,16-19,25-26,31-33,36H,3,10,15,20-24,44H2,1-2H3,(H2,45,55)(H,49,54)(H,50,56)(H,51,57)(H4,46,47,48)/t26-,31+,32+,33+,36+/m1/s1
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| InChIKey |
VFZAWGZAEVCXFB-OQJLRFEOSA-N
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| PubChem Compound ID | ||||
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