Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L9T0WZ
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| Ligand Name |
Hpk1-IN-3
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| Synonyms |
HPK1-IN-3; 4-[2-fluoro-6-(trifluoromethyl)anilino]-2-[(6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl)amino]pyrimidine-5-carboxamide; CHEMBL4878586; BDBM552521; WO2022098809, Example 4-8; HY-138568; CS-0159070; 4-((2-fluoro-6-(trifluoromethyl)phenyl)amino)-2-((6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl)amino)pyrimidine-5-carboxamide; YK1
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| Structure |
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Download2D MOL |
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| Formula |
C23H22F4N6O2
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| Canonical SMILES |
CN1CCC2=CC(=C(C=C2C1)NC3=NC=C(C(=N3)NC4=C(C=CC=C4F)C(F)(F)F)C(=O)N)OC
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| InChI |
1S/C23H22F4N6O2/c1-33-7-6-12-9-18(35-2)17(8-13(12)11-33)30-22-29-10-14(20(28)34)21(32-22)31-19-15(23(25,26)27)4-3-5-16(19)24/h3-5,8-10H,6-7,11H2,1-2H3,(H2,28,34)(H2,29,30,31,32)
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| InChIKey |
RZLXOEIALAVGKH-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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