Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LGHC54
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Ligand Name |
Hydroxy(oxo)(3-{[(2Z)-4-[3-(1H-1,2,4-triazol-1-ylmethyl)phenyl]pyrimidin-2(5H)-ylidene]amino}phenyl)ammonium
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Synonyms |
HYDROXY(OXO)(3-{[(2Z)-4-[3-(1H-1,2,4-TRIAZOL-1-YLMETHYL)PHENYL]PYRIMIDIN-2(5H)-YLIDENE]AMINO}PHENYL)AMMONIUM; DB08218; Q27097443
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Structure |
Download2D MOL |
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Formula |
C19H15N7O2
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Canonical SMILES |
C1C=NC(=NC2=CC(=CC=C2)[N+](=O)[O-])N=C1C3=CC=CC(=C3)CN4C=NC=N4
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InChI |
1S/C19H15N7O2/c27-26(28)17-6-2-5-16(10-17)23-19-21-8-7-18(24-19)15-4-1-3-14(9-15)11-25-13-20-12-22-25/h1-6,8-10,12-13H,7,11H2
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InChIKey |
PLQVWKCQWFFUFJ-UHFFFAOYSA-N
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PubChem Compound ID |
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