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Jasen preklop med dedupliciranimi compounds in posameznimi samples.
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6 results for Pattern / motif query
Pattern / motif 6 results DB demo
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Pattern registry Vnos: hydroquinone Hydroquinone
ID 73 DB demo
2D structure

MK155

ID 73

Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(c1nnc(CCc3ccc(O)c(O)c3)o1)O2

Formula: C23H26N2O5

MW: 410.47 | LogP: 4.14

TPSA: 108.84

Patterns:

Hydroquinone
Detail
ID 983 DB demo
2D structure

KB_Leish_34

ID 983

COc1ccc(Oc2ccc([C@@H](C)N(C)c3ncc4c(N)nc(N)[nH+]c4n3)cc2)cc1

Formula: C22H24N7O2+

MW: 418.48 | LogP: 3.00

TPSA: 126.55

Patterns:

Hydroquinone
Detail
ID 1262 DB demo
2D structure

MK29

ID 1262

Cc1c(C)c2c(c(CCc3ccc(O)c(O)c3)c1O)CCC(C)(C)O2

Formula: C21H26O4

MW: 342.44 | LogP: 4.31

TPSA: 69.92

Patterns:

Hydroquinone
Detail
ID 1752 DB demo
2D structure

Z44425700

ID 1752

COc1ccc(O)c(C(=O)c2cnn(-c3ccccn3)c2)c1

Formula: C16H13N3O3

MW: 295.30 | LogP: 2.21

TPSA: 77.24

Patterns:

Hydroquinone
Detail
ID 3778 DB demo
2D structure

MK15

ID 3778

Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)NCC[NH+]1CCN(C(=O)/C=C/c3ccc(O)c(O)c3)CC1)O2

Formula: C29H38N3O6+

MW: 524.64 | LogP: 1.37

TPSA: 123.77

Patterns:

Hydroquinone
Detail
ID 3836 DB demo
2D structure

OHD_Babesia_21

ID 3836

COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)[C@H](O[C@H]1C[C@H](N)[C@H](O)[C@@H](C)O1)C[C@@](O)(C(=O)CO)C3

Formula: C27H29NO11

MW: 543.53 | LogP: 0.00

TPSA: 206.07

Patterns:

Hydroquinone
Detail