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Regex Pattern / motif 118 results

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118 results for Pattern / motif query

Cards

Pattern / motif 118 results DB fairmol

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Query interpretation

Pattern registry Vnos: urea Urea

Select ID 2 DB fairmol

Z20253414

ID 2

Cn1c(SCC(=O)NC(=O)NCc2ccco2)nnc1-c1ccccc1

Formula: C17H17N5O3S

MW: 371.42 | LogP: 2.19

TPSA: 102.05

Patterns:

Urea

Detail

Select ID 3 DB fairmol

Z19597181

ID 3

Cc1ccc(-c2nnc(SCC(=O)NC(=O)Nc3ccc(C)cc3C)n2N)cc1

Formula: C20H22N6O2S

MW: 410.50 | LogP: 3.02

TPSA: 114.93

Patterns:

Urea

Detail

Select ID 114 DB fairmol

OHD_Leishmania_482

ID 114

NC(=S)N/N=C(\C=C\c1cccnc1)c1cccc(NC(=O)Nc2ccc(Cl)cc2)c1

Formula: C22H19ClN6OS

MW: 450.96 | LogP: 4.63

TPSA: 104.43

Patterns:

Urea

Detail

Select ID 139 DB fairmol

OHD_TC1_128

ID 139

O=C(NCC[C@H]1CC[N@@H+](Cc2ccccc2)CC1)Nc1ncc(-c2ccc3c(c2)OCO3)[nH]1

Formula: C25H30N5O3+

MW: 448.55 | LogP: 2.81

TPSA: 92.71

Patterns:

Urea

Detail

Select ID 171 DB fairmol

Z56815608

ID 171

COc1ccc2nc(/N=C(/N)NC(=O)Nc3ccccc3)nc(C)c2c1

Formula: C18H18N6O2

MW: 350.38 | LogP: 2.71

TPSA: 114.52

Patterns:

Urea

Detail

Select ID 175 DB fairmol

OHD_Leishmania_479

ID 175

O=C(Nc1ccc(Cl)cc1)Nc1cccc(C2=NN(C(=O)c3cccnc3)[C@@H](c3cccnc3)C2)c1

Formula: C27H21ClN6O2

MW: 496.96 | LogP: 5.77

TPSA: 99.58

Patterns:

Urea

Detail

Select ID 186 DB fairmol

Z25575620

ID 186

Nn1c(SCC(=O)NC(=O)NCc2ccco2)nnc1-c1ccc(OC(F)F)cc1

Formula: C17H16F2N6O4S

MW: 438.42 | LogP: 1.97

TPSA: 137.30

Patterns:

Urea

Detail

Select ID 195 DB fairmol

KB_HAT_51

ID 195

CN1C(=O)c2ccccc2Sc2ccc(NC(=O)NCc3ccco3)cc21

Formula: C20H17N3O3S

MW: 379.44 | LogP: 4.34

TPSA: 74.58

Patterns:

Urea

Detail

Select ID 199 DB fairmol

Z44617742

ID 199

Nc1c(N(C(=O)Nc2ccc(Cl)c(Cl)c2)C2CCCC2)c(O)nc(=O)n1Cc1ccccc1

Formula: C23H23Cl2N5O3

MW: 488.38 | LogP: 4.87

TPSA: 113.48

Patterns:

Urea

Detail

Select ID 225 DB fairmol

OHD_Leishmania_477

ID 225

COc1cc([C@H]2CC(c3cccc(NC(=O)Nc4ccc(Cl)cc4)c3)=NN2C(=O)c2cccnc2)ccc1O

Formula: C29H24ClN5O4

MW: 542.00 | LogP: 6.08

TPSA: 116.15

Patterns:

Urea

Detail

Select ID 259 DB fairmol

OHD_Leishmania_478

ID 259

COc1ccc([C@H]2CC(c3cccc(NC(=O)Nc4ccc(Cl)cc4)c3)=NN2C(=O)c2cccnc2)cc1OC

Formula: C30H26ClN5O4

MW: 556.02 | LogP: 6.39

TPSA: 105.15

Patterns:

Urea

Detail

Select ID 297 DB fairmol

Z56261632

ID 297

NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccc(Cl)c(Cl)c2)cc1

Formula: C15H15Cl2N3O3S

MW: 388.28 | LogP: 3.01

TPSA: 101.29

Patterns:

Urea

Detail

Select ID 360 DB fairmol

Z277540138

ID 360

COc1ccc(Cl)cc1C(=O)NCCc1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1

Formula: C23H28ClN3O5S

MW: 494.01 | LogP: 3.64

TPSA: 113.60

Patterns:

Urea

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:

Urea

Detail

Select ID 469 DB fairmol

OHD_Leishmania_481

ID 469

NC(=S)N/N=C(\C=C\c1cccc(O)c1)c1cccc(NC(=O)Nc2ccc(Cl)cc2)c1

Formula: C23H20ClN5O2S

MW: 465.97 | LogP: 4.94

TPSA: 111.77

Patterns:

Urea

Detail

Select ID 482 DB fairmol

Z13863770

ID 482

C[C@H]1CC[C@@]2(CC1)NC(=O)N(CC(=O)Nc1ccc3c(c1)OCCCO3)C2=O

Formula: C20H25N3O5

MW: 387.44 | LogP: 2.29

TPSA: 96.97

Patterns:

Urea

Detail

Select ID 508 DB fairmol

Z56833821

ID 508

Cc1cc2nc(/N=C(/N)NC(=O)NC3CCCCC3)nc(C)c2cc1C

Formula: C19H26N6O

MW: 354.46 | LogP: 3.13

TPSA: 105.29

Patterns:

Urea

Detail

Select ID 562 DB fairmol

OHD_TB2020_29

ID 562

O=C(Nc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)N[C@H](/C=C/S(=O)(=O)c1ccccc1)CCCCNS(=O)(=O)c1cccc2ccccc12

Formula: C39H40N4O6S2

MW: 724.91 | LogP: 6.19

TPSA: 150.54

Patterns:

Urea

Detail

Select ID 690 DB fairmol

OHD_TC1_137

ID 690

O=C(CN1C(=O)N(Cc2ccccc2)[C@@]2(CCCCc3ccccc32)C1=O)NO

Formula: C22H23N3O4

MW: 393.44 | LogP: 2.58

TPSA: 89.95

Patterns:

Urea

Detail

Select ID 757 DB fairmol

ulfkktlib_249

ID 757

CN(C(=O)NC(=O)c1ccccc1)C(=O)c1c(C#N)c(-c2ccc(Cl)cc2)nn1-c1ccccc1

Formula: C26H18ClN5O3

MW: 483.92 | LogP: 4.69

TPSA: 108.09

Patterns:

Urea

Detail

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