Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LE2GR4
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| Ligand Name |
Borussertib
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| Synonyms |
Borussertib; 1800070-77-2; N-[2-oxo-3-[1-[[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]methyl]piperidin-4-yl]-1H-benzimidazol-5-yl]prop-2-enamide; CHEMBL4795065; SCHEMBL18203544; EX-A3188; s8839; ZB1628; AC-33206; HY-122913; CS-0090402; N-(2-oxo-3-(1-(4-(5-oxo-3-phenyl-5,6-dihydro-1,6-naphthyridin-2-yl)benzyl)piperidin-4-yl)-2,3-dihydro-1H-benzo[d]imidazol-5-yl)acrylamide
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| Structure |
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Download2D MOL |
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| Formula |
C36H32N6O3
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| Canonical SMILES |
C=CC(=O)NC1=CC2=C(C=C1)NC(=O)N2C3CCN(CC3)CC4=CC=C(C=C4)C5=C(C=C6C(=N5)C=CNC6=O)C7=CC=CC=C7
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| InChI |
1S/C36H32N6O3/c1-2-33(43)38-26-12-13-31-32(20-26)42(36(45)40-31)27-15-18-41(19-16-27)22-23-8-10-25(11-9-23)34-28(24-6-4-3-5-7-24)21-29-30(39-34)14-17-37-35(29)44/h2-14,17,20-21,27H,1,15-16,18-19,22H2,(H,37,44)(H,38,43)(H,40,45)
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| InChIKey |
HXBRBOYWXDLHDC-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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