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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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Compounds 3586 Samples 0
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1 results for Pattern / motif query
Pattern / motif 1 results DB Docking_panel_21
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Pattern registry Vnos: isoindolin_1_one Isoindolinone
ID 1380 DB Docking_panel_21
2D structure

Z57728761

ID 1380

Cc1cccc(OCCCN2C(=O)C(=O)c3cc(C)ccc32)c1

Formula: C19H19NO3

MW: 309.37 | LogP: 3.30

TPSA: 46.61

Patterns:

Isoindolinone
Detail