Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4E2OJ
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| Ligand Name |
(S)-2-(3-((R)-1-(4-Bromophenyl)ethyl)ureido)-N-((S)-1-((S)-5-guanidino-1-oxo-1-(thiazol-2-YL)pentan-2-ylamino)-3-methyl-1-oxobutan-2-YL)-5-ureidopentanamide
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| Synonyms |
(S)-2-(3-((R)-1-(4-BROMOPHENYL)ETHYL)UREIDO)-N-((S)-1-((S)-5-GUANIDINO-1-OXO-1-(THIAZOL-2-YL)PENTAN-2-YLAMINO)-3-METHYL-1-OXOBUTAN-2-YL)-5-UREIDOPENTANAMIDE; Q27453505
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| Structure |
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Download2D MOL
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| Formula |
C29H45BrN10O5S
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| Canonical SMILES |
CC(C)C(C(=O)NC(CCCNC(N)N)C(=O)C1=NC=CS1)NC(=O)C(CCCNC(=O)N)NC(=O)NC(C)C2=CC=C(C=C2)Br
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| InChI |
1S/C29H45BrN10O5S/c1-16(2)22(25(43)38-20(6-4-12-35-27(31)32)23(41)26-34-14-15-46-26)40-24(42)21(7-5-13-36-28(33)44)39-29(45)37-17(3)18-8-10-19(30)11-9-18/h8-11,14-17,20-22,27,35H,4-7,12-13,31-32H2,1-3H3,(H,38,43)(H,40,42)(H3,33,36,44)(H2,37,39,45)/t17-,20+,21+,22+/m1/s1
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| InChIKey |
HWZOXFNZLMNLSU-MNAPGUCWSA-N
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| PubChem Compound ID | ||||
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