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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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Compounds 144 Samples 0
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5 results for Pattern / motif query
Pattern / motif 5 results DB demo
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Query interpretation
Pattern registry Vnos: benzothiazole Benzothiazole
ID 10 DB demo
2D structure

Z14342059

ID 10

O=c1cc(CSc2nnc(-c3cccs3)n2Cc2ccccc2)nc2sc3ccccc3n12

Formula: C24H17N5OS3

MW: 487.64 | LogP: 5.57

TPSA: 65.08

Patterns:

Benzothiazole
Detail
ID 678 DB demo
2D structure

Z20255081

ID 678

CCn1c(CSc2nc3ccccc3s2)nnc1SCC(=O)c1ccc(O)c(O)c1

Formula: C20H18N4O3S3

MW: 458.59 | LogP: 4.59

TPSA: 101.13

Patterns:

Benzothiazole
Detail
ID 1670 DB demo
2D structure

Z56802793

ID 1670

Cn1c(CSc2nc3ccccc3s2)n[nH]c1=S

Formula: C11H10N4S3

MW: 294.43 | LogP: 3.38

TPSA: 46.50

Patterns:

Benzothiazole
Detail
ID 1837 DB demo
2D structure

Z30206012

ID 1837

CCOc1ccc2nc(NC(=O)CCC(=O)c3cccs3)sc2c1

Formula: C17H16N2O3S2

MW: 360.46 | LogP: 4.36

TPSA: 68.29

Patterns:

Benzothiazole
Detail
ID 3596 DB demo
2D structure

Z28180197

ID 3596

Cc1ccc(/C(O)=N/c2nc3ccc(S(C)(=O)=O)cc3s2)cc1C

Formula: C17H16N2O3S2

MW: 360.46 | LogP: 3.95

TPSA: 79.62

Patterns:

Benzothiazole
Detail