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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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Compounds 144 Samples 0
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1 results for Pattern / motif query
Pattern / motif 1 results DB demo
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Pattern registry Vnos: azepane Azepane
ID 3617 DB demo
2D structure

OSA_Lib_227

ID 3617

C[NH+]1CCN(CCC[N@@H+]2CC[C@]3([NH+]4CCCC4)C[C@H](c4ccccc4)[C@H]2[C@@H](c2ccccc2)C3)CC1

Formula: C32H49N4+3

MW: 489.77 | LogP: 0.64

TPSA: 16.56

Patterns:

Azepane
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