Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LGA90T
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| Ligand Name |
Methyl 3-[4-[(4-bromophenyl)methyl]piperazine-1-carbonyl]-5-[(2-ethyl-2-formylbutanoyl)amino]benzoate
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| Structure |
 |
Download2D MOL |
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| Formula |
C27H32BrN3O5
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| Canonical SMILES |
CCC(CC)(C=O)C(=O)NC1=CC(=CC(=C1)C(=O)OC)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)Br
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| InChI |
1S/C27H32BrN3O5/c1-4-27(5-2,18-32)26(35)29-23-15-20(14-21(16-23)25(34)36-3)24(33)31-12-10-30(11-13-31)17-19-6-8-22(28)9-7-19/h6-9,14-16,18H,4-5,10-13,17H2,1-3H3,(H,29,35)
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| InChIKey |
DFOATAYHEDCOCM-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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