Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L2NE8S
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| Ligand Name |
2-{5-[(2-{[3,5-Difluoro-4-(1-methylpiperidin-4-yl)phenyl]amino}-5-methylpyrimidin-4-yl)amino]-2-fluorophenyl}-1lambda~6~,2-thiazolidine-1,1-dione
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| Synonyms |
2-{5-[(2-{[3,5-difluoro-4-(1-methylpiperidin-4-yl)phenyl]amino}-5-methylpyrimidin-4-yl)amino]-2-fluorophenyl}-1lambda~6~,2-thiazolidine-1,1-dione; R61
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| Structure |
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Download2D MOL |
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| Formula |
C26H29F3N6O2S
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| Canonical SMILES |
CC1=CN=C(N=C1NC2=CC(=C(C=C2)F)N3CCCS3(=O)=O)NC4=CC(=C(C(=C4)F)C5CCN(CC5)C)F
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| InChI |
1S/C26H29F3N6O2S/c1-16-15-30-26(32-19-12-21(28)24(22(29)13-19)17-6-9-34(2)10-7-17)33-25(16)31-18-4-5-20(27)23(14-18)35-8-3-11-38(35,36)37/h4-5,12-15,17H,3,6-11H2,1-2H3,(H2,30,31,32,33)
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| InChIKey |
YFAXWSXYQLAMER-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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