Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LBV3J5
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| Ligand Name |
1-[5-(4-Amino-2,7-Dimethyl-7h-Pyrrolo[2,3-D]pyrimidin-5-Yl)-2,3-Dihydro-1h-Indol-1-Yl]-2-[3-Fluoro-5-(Trifluoromethyl)phenyl]ethanone
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| Synonyms |
1-[5-(4-Amino-2,7-Dimethyl-7h-Pyrrolo[2,3-D]pyrimidin-5-Yl)-2,3-Dihydro-1h-Indol-1-Yl]-2-[3-Fluoro-5-(Trifluoromethyl)phenyl]ethanone; Q27454270
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| Structure |
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Download2D MOL |
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| Formula |
C25H21F4N5O
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| Canonical SMILES |
CC1=NC(=C2C(=CN(C2=N1)C)C3=CC4=C(C=C3)N(CC4)C(=O)CC5=CC(=CC(=C5)F)C(F)(F)F)N
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| InChI |
1S/C25H21F4N5O/c1-13-31-23(30)22-19(12-33(2)24(22)32-13)15-3-4-20-16(10-15)5-6-34(20)21(35)9-14-7-17(25(27,28)29)11-18(26)8-14/h3-4,7-8,10-12H,5-6,9H2,1-2H3,(H2,30,31,32)
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| InChIKey |
MXBMIZHUPORZGB-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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