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Compounds 144 Samples 0
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4 results for Pattern / motif query
Pattern / motif 4 results DB demo
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Pattern registry Vnos: nitrile Nitrile
ID 580 DB demo
2D structure

Z55185189

ID 580

Cn1cnnc1SCc1ccc(C(=O)n2ncc(C#N)c2N)cc1

Formula: C15H13N7OS

MW: 339.38 | LogP: 1.45

TPSA: 115.41

Patterns:

Nitrile
Detail
ID 2295 DB demo
2D structure

Z56775819

ID 2295

N#Cc1c(N)n(-c2cccc(S(N)(=O)=O)c2)c2nc3ccccc3nc12

Formula: C17H12N6O2S

MW: 364.39 | LogP: 1.67

TPSA: 140.68

Patterns:

Nitrile
Detail
ID 2824 DB demo
2D structure

Z275022726

ID 2824

N#Cc1c(NC(=O)CSc2nc[nH]n2)sc2c1CCCCC2

Formula: C14H15N5OS2

MW: 333.44 | LogP: 2.74

TPSA: 94.46

Patterns:

Nitrile
Detail
ID 3627 DB demo
2D structure

OHD_Leishmania_324

ID 3627

N#Cc1c(/N=C/c2cc3cc(Br)ccc3[nH]2)sc2c1CCCCCC2

Formula: C20H18BrN3S

MW: 412.36 | LogP: 6.27

TPSA: 51.94

Patterns:

Nitrile
Detail