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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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Compounds 144 Samples 0
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3 results for Pattern / motif query
Pattern / motif 3 results DB demo
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Query interpretation
Pattern registry Vnos: sulfone Sulfone
ID 388 DB demo
2D structure

KB_HAT_138

ID 388

CS(=O)(=O)c1ccc(Nc2nccc(Nc3n[nH]c4ccc(F)cc34)n2)c(F)c1

Formula: C18H14F2N6O2S

MW: 416.41 | LogP: 3.52

TPSA: 112.66

Patterns:

Sulfone
Detail
ID 1121 DB demo
2D structure

Z16382399

ID 1121

CCN(C(=O)CSc1ncnc2c1cnn2-c1ccccc1)[C@H]1CCS(=O)(=O)C1

Formula: C19H21N5O3S2

MW: 431.54 | LogP: 1.94

TPSA: 98.05

Patterns:

Sulfone
Detail
ID 3596 DB demo
2D structure

Z28180197

ID 3596

Cc1ccc(/C(O)=N/c2nc3ccc(S(C)(=O)=O)cc3s2)cc1C

Formula: C17H16N2O3S2

MW: 360.46 | LogP: 3.95

TPSA: 79.62

Patterns:

Sulfone
Detail