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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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Compounds 5571 Samples 0
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6 results for Pattern / motif query
Pattern / motif 6 results DB fairmol
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Query interpretation
Pattern registry Vnos: phenothiazine Phenothiazine
ID 1155 DB fairmol
2D structure

Z1530532754

ID 1155

OCCN1CC[NH+](CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1

Formula: C21H27ClN3OS+

MW: 404.99 | LogP: 2.53

TPSA: 31.15

Patterns:

Phenothiazine
Detail
ID 3008 DB fairmol
2D structure

Z1530532754

ID 3008

OCCN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1

Formula: C21H26ClN3OS

MW: 403.98 | LogP: 3.94

TPSA: 29.95

Patterns:

Phenothiazine
Detail
ID 3030 DB fairmol
2D structure

Z51312390

ID 3030

COc1ccc(SCC(=O)N2c3ccccc3Sc3ccccc32)cc1

Formula: C21H17NO2S2

MW: 379.51 | LogP: 5.62

TPSA: 29.54

Patterns:

Phenothiazine
Detail
ID 3041 DB fairmol
2D structure

Z56767389

ID 3041

O=C(Cc1cccc2ccccc12)N1c2ccccc2Sc2ccccc21

Formula: C24H17NOS

MW: 367.47 | LogP: 6.21

TPSA: 20.31

Patterns:

Phenothiazine
Detail
ID 3177 DB fairmol
2D structure

Z19729307

ID 3177

O=C(CSc1ccc(Cl)cc1)N1c2ccccc2Sc2ccccc21

Formula: C20H14ClNOS2

MW: 383.93 | LogP: 6.26

TPSA: 20.31

Patterns:

Phenothiazine
Detail
ID 4837 DB fairmol
2D structure

Z18770259

ID 4837

Cc1ccc(SCC(=O)N2c3ccccc3Sc3ccccc32)cc1

Formula: C21H17NOS2

MW: 363.51 | LogP: 5.92

TPSA: 20.31

Patterns:

Phenothiazine
Detail