Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LB9DH6
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| Ligand Name |
6-[1-(2,2-Difluoro-3-Hydroxypropyl)-5-(4-Fluorophenyl)-3-Methyl-1h-Pyrazol-4-Yl]-2h-1,4-Benzoxazin-3(4h)-One
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| Synonyms |
6-[1-(2,2-Difluoro-3-Hydroxypropyl)-5-(4-Fluorophenyl)-3-Methyl-1h-Pyrazol-4-Yl]-2h-1,4-Benzoxazin-3(4h)-One; CHEMBL3337829; 4pf3; SCHEMBL3490981; BDBM50024856; Q27461074; HFN
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| Structure |
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Download2D MOL |
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| Formula |
C21H18F3N3O3
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| Canonical SMILES |
CC1=NN(C(=C1C2=CC3=C(C=C2)OCC(=O)N3)C4=CC=C(C=C4)F)CC(CO)(F)F
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| InChI |
1S/C21H18F3N3O3/c1-12-19(14-4-7-17-16(8-14)25-18(29)9-30-17)20(13-2-5-15(22)6-3-13)27(26-12)10-21(23,24)11-28/h2-8,28H,9-11H2,1H3,(H,25,29)
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| InChIKey |
YPCPZZOTKIPGMW-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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