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Regex Pattern / motif 160 results

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160 results for Pattern / motif query

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Pattern / motif 160 results DB fairmol

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Query interpretation

Pattern registry Vnos: hydroquinone Hydroquinone

Select ID 58 DB fairmol

MK214

ID 58

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(c1cn(CCc3cc(O)cc(O)c3)nn1)O2

Formula: C23H27N3O4

MW: 409.49 | LogP: 3.80

TPSA: 100.63

Patterns:

Hydroquinone

Detail

Select ID 73 DB fairmol

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

Select ID 135 DB fairmol

MK217

ID 135

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(c1nnc(CCc3ccc(O)c(O)c3)s1)O2

Formula: C23H26N2O4S

MW: 426.54 | LogP: 4.61

TPSA: 95.70

Patterns:

Hydroquinone

Detail

Select ID 167 DB fairmol

MK220

ID 167

Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCc1cn(CCc3ccc(O)c(O)c3)nn1)O2

Formula: C25H31N3O4

MW: 437.54 | LogP: 4.28

TPSA: 100.63

Patterns:

Hydroquinone

Detail

Select ID 169 DB fairmol

MK160

ID 169

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(c1nc(CCc3ccc(O)c(O)c3)no1)O2

Formula: C23H26N2O5

MW: 410.47 | LogP: 4.14

TPSA: 108.84

Patterns:

Hydroquinone

Detail

Select ID 216 DB fairmol

MK61

ID 216

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)N1CCN(Cc3ccc(C(C)C)cc(=O)c3O)CC1)O2

Formula: C29H38N2O5

MW: 494.63 | LogP: 3.93

TPSA: 90.31

Patterns:

Hydroquinone

Detail

Select ID 276 DB fairmol

OHD_TB2022_22

ID 276

COc1ccc(Oc2ccc(CN(C)Cc3cnc4nc(N)nc(N)c4n3)cc2)cc1

Formula: C22H23N7O2

MW: 417.47 | LogP: 3.02

TPSA: 125.30

Patterns:

Hydroquinone

Detail

Select ID 281 DB fairmol

MK153

ID 281

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(c1cc(CCc3ccc(O)c(O)c3)no1)O2

Formula: C24H27NO5

MW: 409.48 | LogP: 4.74

TPSA: 95.95

Patterns:

Hydroquinone

Detail

Select ID 283 DB fairmol

MK44

ID 283

Cc1c(C)c2c(c(CCN3CCc4ccc(NS(C)(=O)=O)cc43)c1O)CCC(C)(C)O2

Formula: C24H32N2O4S

MW: 444.60 | LogP: 4.09

TPSA: 78.87

Patterns:

Hydroquinone

Detail

Select ID 284 DB fairmol

MK3

ID 284

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)NCC[NH2+]CCNC(=O)/C=C/c1ccc(O)c(O)c1)O2

Formula: C27H36N3O6+

MW: 498.60 | LogP: 1.32

TPSA: 144.73

Patterns:

Hydroquinone

Detail

Select ID 292 DB fairmol

MK212

ID 292

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(c1cnnn1CCc1ccc(O)c(O)c1)O2

Formula: C23H27N3O4

MW: 409.49 | LogP: 3.80

TPSA: 100.63

Patterns:

Hydroquinone

Detail

Select ID 296 DB fairmol

MK215

ID 296

Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(c1cnnn1CCc1cc(O)cc(O)c1)O2

Formula: C23H27N3O4

MW: 409.49 | LogP: 3.80

TPSA: 100.63

Patterns:

Hydroquinone

Detail

Select ID 312 DB fairmol

TC393

ID 312

COc1ccc(CCc2nnc([C@]3(C)CSc4c(C)c(O)c(C)c(C)c4O3)o2)cc1OC

Formula: C24H28N2O5S

MW: 456.56 | LogP: 4.90

TPSA: 86.84

Patterns:

Hydroquinone

Detail

Select ID 319 DB fairmol

OHD_Babesia_62

ID 319

COc1ccc(OC)c(NCc2ccc3nc(N)[nH+]c(N)c3c2Cl)c1

Formula: C17H19ClN5O2+

MW: 360.83 | LogP: 2.50

TPSA: 109.56

Patterns:

Hydroquinone

Detail

Select ID 350 DB fairmol

MK210

ID 350

Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(CCCc1cn(CCc3ccc(O)c(O)c3)nn1)O2

Formula: C26H33N3O4

MW: 451.57 | LogP: 4.67

TPSA: 100.63

Patterns:

Hydroquinone

Detail

Select ID 352 DB fairmol

TC369

ID 352

Cc1c(C)c2c(c(C)c1O)SC[C@](C)(c1cn(CCc3ccc(O)c(O)c3)nn1)O2

Formula: C22H25N3O4S

MW: 427.53 | LogP: 3.96

TPSA: 100.63

Patterns:

Hydroquinone

Detail

Select ID 365 DB fairmol

MK16

ID 365

Cc1c(C)c2c(c(C)c1O)CC[C@](C)(CNC(=O)/C=C/c1ccc(O)c(O)c1)O2

Formula: C23H27NO5

MW: 397.47 | LogP: 3.64

TPSA: 99.02

Patterns:

Hydroquinone

Detail

Select ID 395 DB fairmol

MK33

ID 395

Cc1c(C)c2c(c(CC[N@H+](C)CCc3ccc(NS(C)(=O)=O)cc3)c1O)CCC(C)(C)O2

Formula: C25H37N2O4S+

MW: 461.65 | LogP: 2.78

TPSA: 80.07

Patterns:

Hydroquinone

Detail

Select ID 405 DB fairmol

Z56919205

ID 405

COc1ccc(OC[C@@H](O)CNC(=O)Nc2ccc(Cl)cc2)cc1

Formula: C17H19ClN2O4

MW: 350.80 | LogP: 2.91

TPSA: 79.82

Patterns:

Hydroquinone

Detail

Select ID 418 DB fairmol

TC394

ID 418

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

Formula: C22H24N2O5S

MW: 428.51 | LogP: 4.30

TPSA: 108.84

Patterns:

Hydroquinone

Detail

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