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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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Compounds 3586 Samples 0
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4 results for Pattern / motif query
Pattern / motif 4 results DB Docking_panel_21
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Pattern registry Vnos: chromanone Chromanone
ID 2110 DB Docking_panel_21
2D structure

Z46095146

ID 2110

O=C1/C(=C/c2ccc(O)c(O)c2)COc2ccccc21

Formula: C16H12O4

MW: 268.27 | LogP: 2.76

TPSA: 66.76

Patterns:

Chromanone
Detail
ID 2450 DB Docking_panel_21
2D structure

Z46095090

ID 2450

COc1cc(/C=C2/COc3ccccc3C2=O)ccc1O

Formula: C17H14O4

MW: 282.30 | LogP: 3.06

TPSA: 55.76

Patterns:

Chromanone
Detail
ID 2528 DB Docking_panel_21
2D structure

OHD_Leishmania_370

ID 2528

O=C1C[C@H](c2ccc(O)cc2)Oc2cc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c(O)c21

Formula: C30H20O10

MW: 540.48 | LogP: 5.07

TPSA: 177.89

Patterns:

Chromanone
Detail
ID 3486 DB Docking_panel_21
2D structure

Z46095146

ID 3486

O=C1/C(=C\c2ccc(O)c(O)c2)COc2ccccc21

Formula: C16H12O4

MW: 268.27 | LogP: 2.76

TPSA: 66.76

Patterns:

Chromanone
Detail