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Regex Pattern / motif 20 results

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20 results for Pattern / motif query

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Pattern / motif 20 results DB demo

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Global compound selection stays available across the browser. Save selected compounds into analysis sets A / B / C, then use union, intersection or negation in the Analysis selection workbench.

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Pattern registry Vnos: alkene Alkene

Select ID 123 DB demo

OHD_ACDS_73

ID 123

C=CCc1cc(Cn2cc(-c3nc4ccccc4c(=O)[nH]3)nn2)c(O)c(OC)c1

Formula: C21H19N5O3

MW: 389.42 | LogP: 2.67

TPSA: 105.92

Patterns:

Alkene

Detail

Select ID 603 DB demo

OHD_TbNat_2

ID 603

CC(C)=CCc1c(O)cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c1O

Formula: C20H20O5

MW: 340.38 | LogP: 3.91

TPSA: 97.99

Patterns:

Alkene

Detail

Select ID 1399 DB demo

OHD_TC1_194

ID 1399

COc1ccc(C2=NN(C3CCN(S(=O)(=O)c4cccc5cccnc45)CC3)C(=O)[C@@H]3CC=CC[C@H]23)cc1OC

Formula: C30H32N4O5S

MW: 560.68 | LogP: 4.23

TPSA: 101.40

Patterns:

Alkene

Detail

Select ID 1588 DB demo

NMT-TY0834

ID 1588

C=CCSc1nc(N)c(N)c(=O)[nH]1

Formula: C7H10N4OS

MW: 198.25 | LogP: 0.21

TPSA: 97.79

Patterns:

Alkene

Detail

Select ID 1807 DB demo

Z56811592

ID 1807

CN(C)c1ccc(/C=C2\SC(=O)N(CCc3nnc(N)s3)C2=O)cc1

Formula: C16H17N5O2S2

MW: 375.48 | LogP: 2.47

TPSA: 92.42

Patterns:

Alkene

Detail

Select ID 1929 DB demo

Z31287542

ID 1929

O=C1/C(=C\N/N=C(\O)[C@H]2COc3ccccc3O2)c2ccccc2C(=O)N1c1ccccc1Cl

Formula: C25H18ClN3O5

MW: 475.89 | LogP: 4.17

TPSA: 100.46

Patterns:

Alkene

Detail

Select ID 2118 DB demo

ulfkktlib_2881

ID 2118

NN/C(O)=C(\C(=O)c1ccccc1)c1ccc2ccccc2n1

Formula: C18H15N3O2

MW: 305.34 | LogP: 2.81

TPSA: 88.24

Patterns:

Alkene

Detail

Select ID 2323 DB demo

ulfkktlib_901

ID 2323

O=C(CNC(=O)c1ccccc1)N/C=C1\SC(=S)NC1=O

Formula: C13H11N3O3S2

MW: 321.38 | LogP: 0.52

TPSA: 87.30

Patterns:

Alkene

Detail

Select ID 2877 DB demo

GemmaOHDUnisi_36

ID 2877

Cn1c(-c2ccc(O)cc2)cc2cc(/C=C/C(=O)c3ccc(O)cc3O)ccc21

Formula: C24H19NO4

MW: 385.42 | LogP: 4.86

TPSA: 82.69

Patterns:

Alkene

Detail

Select ID 2912 DB demo

OHD_TbNat_65

ID 2912

O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O

Formula: C18H16O8

MW: 360.32 | LogP: 1.76

TPSA: 144.52

Patterns:

Alkene

Detail

Select ID 3778 DB demo

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:

Alkene

Detail

Select ID 3926 DB demo

ulfkktlib_2320

ID 3926

O=C(N[C@@H]1CN(/C=C2\C(=O)N[C@@H](Cc3ccccc3)C2=O)NC1=O)OCc1ccccc1

Formula: C23H22N4O5

MW: 434.45 | LogP: 0.82

TPSA: 116.84

Patterns:

Alkene

Detail

Select ID 4851 DB demo

Z56824264

ID 4851

O=C(/C=C\c1ccccc1)Nc1ccc(O)cc1

Formula: C15H13NO2

MW: 239.27 | LogP: 3.04

TPSA: 49.33

Patterns:

Alkene

Detail

Select ID 4898 DB demo

ulfkktlib_3698

ID 4898

CN(C)/C=C/C(=O)c1ccc(C(=O)/C=C/Nc2ccc(/N=C\C=C(/O)c3ccc(C(=O)/C=C/N(C)C)cc3)cc2)cc1

Formula: C34H34N4O4

MW: 562.67 | LogP: 6.31

TPSA: 102.31

Patterns:

Alkene

Detail

Select ID 5037 DB demo

OHD_TC1_70

ID 5037

FC(F)(F)c1cccc(/C=C/c2nc3ccccc3n2CNc2cccnc2)c1

Formula: C22H17F3N4

MW: 394.40 | LogP: 5.69

TPSA: 42.74

Patterns:

Alkene

Detail

Select ID 5071 DB demo

ulfkktlib_2994

ID 5071

CC1(C)N=NC2=C(N/C=C/c3ccccc3)NN3C(c4ccccc4)=NSC3=C21

Formula: C22H20N6S

MW: 400.51 | LogP: 4.80

TPSA: 64.38

Patterns:

Alkene

Detail

Select ID 5343 DB demo

TC455

ID 5343

C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@@]21CC=C(CF)CO1

Formula: C24H35FO2

MW: 374.54 | LogP: 5.37

TPSA: 29.46

Patterns:

Alkene

Detail

Select ID 5377 DB demo

TC64

ID 5377

C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)C#CCc1ccccc1

Formula: C29H36O2

MW: 416.61 | LogP: 5.74

TPSA: 37.30

Patterns:

Alkene

Detail

Select ID 5383 DB demo

TC152

ID 5383

COc1ccc(C#CC(=O)[C@H]2CC[C@H]3[C@@H]4CC=C5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]23C)cc1

Formula: C29H36O3

MW: 432.60 | LogP: 5.56

TPSA: 46.53

Patterns:

Alkene

Detail

Select ID 5446 DB demo

ulfkktlib_135

ID 5446

CCCCOC(=O)[C@@H]1C/C(=C\Nc2ccc(O)cc2)C(=O)N1C(=O)OC(C)(C)C

Formula: C21H28N2O6

MW: 404.46 | LogP: 3.57

TPSA: 105.17

Patterns:

Alkene

Detail