Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LHJ1A3
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| Ligand Name |
6-(2'-(Methylsulfonyl)biphenyl-4-YL)-1-(3-(5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-YL)phenyl)-3-(trifluoromethyl)-5,6-dihydro-1H-pyrazolo[3,4-C]pyridin-7(4H)-one
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| Synonyms |
CHEMBL578474; 6-(2'-(METHYLSULFONYL)BIPHENYL-4-YL)-1-(3-(5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-3-YL)PHENYL)-3-(TRIFLUOROMETHYL)-5,6-DIHYDRO-1H-PYRAZOLO[3,4-C]PYRIDIN-7(4H)-ONE; 3kqc; SCHEMBL5251540; BDBM50307096; Q27462500; 6-(2''-(methylsulfonyl)biphenyl-4-yl)-1-(3-(5-oxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)phenyl)-3-(trifluoromethyl)-3a,4,5,6-tetrahydro-1H-pyrazolo[3,4-c]pyridin-7(7aH)-one; 6-(2''-(METHYLSULFONYL)BIPHENYL-4-YL)-1-(3-(5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-3-YL)PHENYL)-3-(TRIFLUOROMETHYL)-5,6-DIHYDRO-1H-PYRAZOLO[3,4-C]PYRIDIN-7(4H)-ONE
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| Structure |
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Download2D MOL |
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| Formula |
C28H21F3N6O4S
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| Canonical SMILES |
CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)N3CCC4=C(C3=O)N(N=C4C(F)(F)F)C5=CC=CC(=C5)C6=NNC(=O)N6
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| InChI |
1S/C28H21F3N6O4S/c1-42(40,41)22-8-3-2-7-20(22)16-9-11-18(12-10-16)36-14-13-21-23(26(36)38)37(35-24(21)28(29,30)31)19-6-4-5-17(15-19)25-32-27(39)34-33-25/h2-12,15H,13-14H2,1H3,(H2,32,33,34,39)
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| InChIKey |
LOIQROHBNJYIKB-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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