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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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Query interpretation
Pattern registry Vnos: uracil Uracil
ID 839 DB Docking_panel_21
2D structure

NMT-TY0569

ID 839

CC(=O)Nc1ccc(S(=O)(=O)Nc2c[nH]c(=O)[nH]c2=O)cc1

Formula: C12H12N4O5S

MW: 324.32 | LogP: -0.18

TPSA: 140.99

Patterns:

Uracil
Detail
ID 853 DB Docking_panel_21
2D structure

NMT-TY0808

ID 853

Nc1ccccc1S(=O)(=O)Nc1c[nH]c(=O)[nH]c1=O

Formula: C10H10N4O4S

MW: 282.28 | LogP: -0.55

TPSA: 137.91

Patterns:

Uracil
Detail
ID 1024 DB Docking_panel_21
2D structure

NMT-TY0573

ID 1024

CC(=O)Nc1ccc(S(=O)(=O)/N=C(\O)CNc2c[nH]c(=O)[nH]c2=O)cc1

Formula: C14H15N5O6S

MW: 381.37 | LogP: -0.22

TPSA: 173.58

Patterns:

Uracil
Detail
ID 2505 DB Docking_panel_21
2D structure

NMT-TY0578

ID 2505

CC(=O)Nc1ccc(S(=O)(=O)Nc2c(N)[nH]c(=O)[nH]c2=O)cc1

Formula: C12H13N5O5S

MW: 339.33 | LogP: -0.60

TPSA: 167.01

Patterns:

Uracil
Detail