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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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16 results for Pattern / motif query
Pattern / motif 16 results DB demo
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Query interpretation
Pattern registry Vnos: thiazole Thiazole
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:

Thiazole
Detail
ID 83 DB demo
2D structure

KB_HAT_125

ID 83

Cc1cnc(Nc2cc(Cc3ccccc3)nc(N[C@H]3CC[C@H](O)CC3)n2)s1

Formula: C21H25N5OS

MW: 395.53 | LogP: 4.29

TPSA: 82.96

Patterns:

Thiazole
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:

Thiazole
Detail
ID 1072 DB demo
2D structure

Z275022778

ID 1072

Cc1ccc(-c2csc3nnc(SC/C(O)=N/c4nsc(-c5ccccc5)n4)n23)cc1

Formula: C21H16N6OS3

MW: 464.60 | LogP: 5.67

TPSA: 88.56

Patterns:

Thiazole
Detail
ID 1095 DB demo
2D structure

Z49605162

ID 1095

O=C(N/N=C/c1sc(N2CCOCC2)nc1-c1ccccc1)c1cccc(S(=O)(=O)N2CCCC2)c1

Formula: C25H27N5O4S2

MW: 525.66 | LogP: 3.20

TPSA: 104.20

Patterns:

Thiazole
Detail
ID 1375 DB demo
2D structure

Z49643066

ID 1375

Cc1ccc(NS(=O)(=O)c2cc([N+](=O)O)ccc2N/N=C/c2sc(N3CCOCC3)nc2-c2ccccc2)c(C)c1

Formula: C28H29N6O5S2+

MW: 593.71 | LogP: 5.31

TPSA: 136.23

Patterns:

Thiazole
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:

Thiazole
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:

Thiazole
Detail
ID 1939 DB demo
2D structure

NMT-TY0428

ID 1939

CC(=O)Nc1ccc(S(=O)(=O)N(C)c2nccs2)cc1

Formula: C12H13N3O3S2

MW: 311.39 | LogP: 1.93

TPSA: 79.37

Patterns:

Thiazole
Detail
ID 2284 DB demo
2D structure

Z275024592

ID 2284

O/C(CSc1nnc2scc(-c3ccccc3)n12)=N\c1nsc(-c2ccccc2)n1

Formula: C20H14N6OS3

MW: 450.57 | LogP: 5.36

TPSA: 88.56

Patterns:

Thiazole
Detail
ID 2802 DB demo
2D structure

Z53223394

ID 2802

[H]/N=c1/sccn1CC(=O)Nc1ccc(S(N)(=O)=O)cc1

Formula: C11H12N4O3S2

MW: 312.38 | LogP: 0.32

TPSA: 118.04

Patterns:

Thiazole
Detail
ID 3363 DB demo
2D structure

Z56902329

ID 3363

CC/N=c1\scc(-c2ccc(Br)cc2)n1/N=C/c1ccc(O)c(O)c1O

Formula: C18H16BrN3O3S

MW: 434.32 | LogP: 3.90

TPSA: 90.34

Patterns:

Thiazole
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:

Thiazole
Detail
ID 3758 DB demo
2D structure

Z56174682

ID 3758

Oc1c([C@H](Nc2nccs2)c2ccccn2)ccc2cccnc12

Formula: C18H14N4OS

MW: 334.40 | LogP: 3.99

TPSA: 70.93

Patterns:

Thiazole
Detail
ID 4882 DB demo
2D structure

Z57198680

ID 4882

Nc1ccc(S(=O)(=O)/N=c2\[nH]ccs2)cc1

Formula: C9H9N3O2S2

MW: 255.32 | LogP: 0.95

TPSA: 88.31

Patterns:

Thiazole
Detail
ID 5029 DB demo
2D structure

Z56964569

ID 5029

CC(C)COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2nccs2)cc1

Formula: C23H22N4O2S

MW: 418.52 | LogP: 5.28

TPSA: 69.04

Patterns:

Thiazole
Detail