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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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Compounds 144 Samples 0
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2 results for Pattern / motif query
Pattern / motif 2 results DB demo
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Query interpretation
Pattern registry Vnos: thioamide Thioamide
ID 2323 DB demo
2D structure

ulfkktlib_901

ID 2323

O=C(CNC(=O)c1ccccc1)N/C=C1\SC(=S)NC1=O

Formula: C13H11N3O3S2

MW: 321.38 | LogP: 0.52

TPSA: 87.30

Patterns:

Thioamide
Detail
ID 5328 DB demo
2D structure

Z56065053

ID 5328

O=C(NC(=S)N1CCN(c2ccc(O)cc2)CC1)c1cccs1

Formula: C16H17N3O2S2

MW: 347.47 | LogP: 2.29

TPSA: 55.81

Patterns:

Thioamide
Detail