Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L47ASZ
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| Ligand Name |
N~2~-{4-[6-(3,4-Dihydroquinolin-1(2h)-Ylcarbonyl)-1h-Benzimidazol-1-Yl]-6-Ethoxy-1,3,5-Triazin-2-Yl}-3-(2,2-Dimethyl-4h-1,3-Benzodioxin-6-Yl)-N-Methyl-L-Alaninamide
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| Synonyms |
(S)-3-(2,2-Dimethyl-4H-benzo[d][1,3]dioxin-6-yl)-2-(4-ethoxy-6-(6-(1,2,3,4-tetrahydroquinoline-1-carbonyl)-1H-benzo[d]imidazol-1-yl)-1,3,5-triazin-2-ylamino)-N-methylpropanamide; N~2~-{4-[6-(3,4-Dihydroquinolin-1(2h)-Ylcarbonyl)-1h-Benzimidazol-1-Yl]-6-Ethoxy-1,3,5-Triazin-2-Yl}-3-(2,2-Dimethyl-4h-1,3-Benzodioxin-6-Yl)-N-Methyl-L-Alaninamide; DEL-B, 14b; CHEMBL1213155; BDBM36474; Q27455810; 5JZ
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| Structure |
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Download2D MOL |
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| Formula |
C36H38N8O5
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| Canonical SMILES |
CCOC1=NC(=NC(=N1)N2C=NC3=C2C=C(C=C3)C(=O)N4CCCC5=CC=CC=C54)NC(CC6=CC7=C(C=C6)OC(OC7)(C)C)C(=O)NC
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| InChI |
1S/C36H38N8O5/c1-5-47-35-41-33(39-27(31(45)37-4)18-22-12-15-30-25(17-22)20-48-36(2,3)49-30)40-34(42-35)44-21-38-26-14-13-24(19-29(26)44)32(46)43-16-8-10-23-9-6-7-11-28(23)43/h6-7,9,11-15,17,19,21,27H,5,8,10,16,18,20H2,1-4H3,(H,37,45)(H,39,40,41,42)/t27-/m0/s1
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| InChIKey |
IIOQBYZRVQSNSJ-MHZLTWQESA-N
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| PubChem Compound ID | ||||
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