Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LLT03H
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| Ligand Name |
Dhodh-IN-22
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| Synonyms |
DHODH-IN-22; (6M)-N-(3-chloro-2-methoxy-5-methylpyridin-4-yl)-6-[4-ethyl-3-(hydroxymethyl)-5-oxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-5-fluoro-2-{[(2S)-1,1,1-trifluoropropan-2-yl]oxy}pyridine-3-carboxamide; SCHEMBL22225080; HY-149031; CS-0566038; N-(3-chloro-2-methoxy-5-methylpyridin-4-yl)-6-[4-ethyl-3-(hydroxymethyl)-5-oxo-1,2,4-triazol-1-yl]-5-fluoro-2-[(2S)-1,1,1-trifluoropropan-2-yl]oxypyridine-3-carboxamide
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| Structure |
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Download2D MOL |
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| Formula |
C21H21ClF4N6O5
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| Canonical SMILES |
CCN1C(=NN(C1=O)C2=C(C=C(C(=N2)OC(C)C(F)(F)F)C(=O)NC3=C(C(=NC=C3C)OC)Cl)F)CO
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| InChI |
1S/C21H21ClF4N6O5/c1-5-31-13(8-33)30-32(20(31)35)16-12(23)6-11(18(29-16)37-10(3)21(24,25)26)17(34)28-15-9(2)7-27-19(36-4)14(15)22/h6-7,10,33H,5,8H2,1-4H3,(H,27,28,34)/t10-/m0/s1
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| InChIKey |
FJYNLQXYLQBCRQ-JTQLQIEISA-N
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| PubChem Compound ID | ||||
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