Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L3N4CM
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| Ligand Name |
4-Acetyl-1-(3-{4-Amino-5-[1-(2,2,2-Trifluoroethyl)-1h-Pyrazol-5-Yl]pyrrolo[2,1-F][1,2,4]triazin-7-Yl}phenyl)-3,3-Dimethylpiperazin-2-One
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| Synonyms |
4-Acetyl-1-(3-{4-Amino-5-[1-(2,2,2-Trifluoroethyl)-1h-Pyrazol-5-Yl]pyrrolo[2,1-F][1,2,4]triazin-7-Yl}phenyl)-3,3-Dimethylpiperazin-2-One; CHEMBL4059848; SCHEMBL19279936; 9EM
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| Structure |
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Download2D MOL |
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| Formula |
C25H25F3N8O2
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| Canonical SMILES |
CC(=O)N1CCN(C(=O)C1(C)C)C2=CC=CC(=C2)C3=CC(=C4N3N=CN=C4N)C5=CC=NN5CC(F)(F)F
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| InChI |
1S/C25H25F3N8O2/c1-15(37)34-10-9-33(23(38)24(34,2)3)17-6-4-5-16(11-17)20-12-18(21-22(29)30-14-32-36(20)21)19-7-8-31-35(19)13-25(26,27)28/h4-8,11-12,14H,9-10,13H2,1-3H3,(H2,29,30,32)
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| InChIKey |
KSAKMNJFOKNIAA-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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