Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L5K6JB
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| Ligand Name |
7-Amino-1-Methyl-3-(2-Methyl-5-{[3-(Trifluoromethyl)benzoyl]amino}phenyl)-2-Oxo-2,3-Dihydropyrimido[4,5-D]pyrimidin-1-Ium
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| Synonyms |
7-Amino-1-Methyl-3-(2-Methyl-5-{[3-(Trifluoromethyl)benzoyl]amino}phenyl)-2-Oxo-2,3-Dihydropyrimido[4,5-D]pyrimidin-1-Ium; Q27456749; 7MP
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| Structure |
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Download2D MOL |
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| Formula |
C22H18F3N6O2+
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| Canonical SMILES |
CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(F)(F)F)N3C=C4C=NC(=NC4=[N+](C3=O)C)N
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| InChI |
1S/C22H17F3N6O2/c1-12-6-7-16(28-19(32)13-4-3-5-15(8-13)22(23,24)25)9-17(12)31-11-14-10-27-20(26)29-18(14)30(2)21(31)33/h3-11,26H,1-2H3,(H,28,32)/p+1
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| InChIKey |
SQOIIWIQKKMCCG-UHFFFAOYSA-O
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| PubChem Compound ID | ||||
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