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2768555
 
#1

eMolecules: 46450135
Molport: MolPort-004-965-532
AKOS: AKOS003282383
Alinda: IVK/9311802
American Custom Chemicals Corp.: CHM0226506...15 total

ref: mol2, SDF, SMILES, flexibase
3.15,4.19,-9.67,0,5,0, 289.331, 8

Similar to: 6935211, 6935905, 42361180,
1114379
 
#2

eMolecules: 2444093
Molport: MolPort-001-534-343
AKOS: AKOS003280416
Alinda: IVK/9311801
Mcule: MCULE-9143729707...14 total

ref: mol2, SDF, SMILES, flexibase
4.23,0.71,-8.95,1,4,0, 396.306, 6
2768552
 
#3

eMolecules: 2198633
Molport: MolPort-001-623-655
AKOS: AKOS003282643
Alinda: IVK/9311796
ChemBridge: 7254332...14 total

ref: mol2, SDF, SMILES, flexibase
5.01,13.48,-24.9,1,7,0, 481.501, 7
2768548
 
#4

eMolecules: 46450103
Molport: MolPort-004-965-531
AKOS: AKOS003282416
Alinda: IVK/9311785
American Custom Chemicals Corp.: CHM0226535...14 total

ref: mol2, SDF, SMILES, flexibase
3.79,1.36,-9.2,1,5,0, 364.445, 9

Similar to: 5711881, 6935859, 16409420, 16409431, 16409474, ... 7 in total.
2768541
 
#5

eMolecules: 46450253
Molport: MolPort-001-534-367
AKOS: AKOS003979258
American Custom Chemicals Corp.: CHM0226484
Mcule: MCULE-6862196835...13 total

ref: mol2, SDF, SMILES, flexibase
5.05,1.9,-10.18,1,5,0, 410.521, 5

Similar to: 662562, 662564,
20407528
 
#6

eMolecules: 46443581
Molport: MolPort-004-823-239
AKOS: AKOS003282410
Alinda: IVK/9311757
American Custom Chemicals Corp.: HCH0241989...14 total

ref: mol2, SDF, SMILES, flexibase
5.98,11.24,-13.36,1,4,0, 470.417, 4
2768532
 
#7

eMolecules: 46443579
Molport: MolPort-001-623-654
AKOS: AKOS003282569
Alinda: IVK/9311739
American Custom Chemicals Corp.: CHM0226554...14 total

ref: mol2, SDF, SMILES, flexibase
3.95,0.61,-22.12,1,6,0, 361.401, 4
652134
 
#8

eMolecules: 2196625
Molport: MolPort-001-534-529
AKOS: AKOS003282418
Alinda: IVK/9311735
Mcule: MCULE-3578767161...14 total

ref: mol2, SDF, SMILES, flexibase
4.85,-0.12,-14.36,1,4,0, 409.532, 6
652130
 
#9

eMolecules: 4070698
Molport: MolPort-001-534-535
AKOS: AKOS003282470
Alinda: IVK/9311718
Mcule: MCULE-9410568278...17 total

ref: mol2, SDF, SMILES, flexibase
4.20,-3.29,-13.71,3,4,0, 392.505, 4
5728620
 
#10

eMolecules: 46450219
Molport: MolPort-001-534-263
AKOS: AKOS003280539
Alinda: IVK/9311696
American Custom Chemicals Corp.: CHM0226445...12 total

ref: mol2, SDF, SMILES, flexibase
2.11,-1.01,-7.66,2,5,0, 292.342, 4
461227
 
#11

eMolecules: 2201974
Molport: MolPort-001-534-292
AKOS: AKOS003280540
Alinda: IVK/9311690
ChemBridge: 7293357...18 total

ref: mol2, SDF, SMILES, flexibase
3.67,7.69,-6.07,1,4,0, 329.83, 5
474578
 
#12

eMolecules: 2197204
Molport: MolPort-001-534-322
AKOS: AKOS003280526
Alinda: IBS-0012842
ChemBridge: 7243232...15 total

ref: mol2, SDF, SMILES, flexibase
2.78,0.16,-13.1,0,4,0, 332.35, 3
17070929
 
#13

eMolecules: 46450281
Molport: MolPort-004-965-530
AKOS: AKOS003755810
Alinda: IVK/9311685
American Custom Chemicals Corp.: CHM0226526...12 total

ref: mol2, SDF, SMILES, flexibase
4.23,9.15,-14.04,2,4,0, 337.448, 3

Similar to: 2768518,
17031577
 
#14

eMolecules: 46450263
Molport: MolPort-001-513-638
AKOS: AKOS002928449
American Custom Chemicals Corp.: CHM0226444
Mcule: MCULE-8485184816...14 total

ref: mol2, SDF, SMILES, flexibase
3.59,8.56,-9.05,2,4,0, 307.397, 3

Similar to: 17055836, 1448347, 1456697,
16990906
 
#15

eMolecules: 46450213
Molport: MolPort-004-965-529
AKOS: AKOS003746676
American Custom Chemicals Corp.: CHM0226472
Mcule: MCULE-9923041727...13 total

ref: mol2, SDF, SMILES, flexibase
2.05,6.71,-9.27,2,4,0, 265.316, 3

Similar to: 1456701,
355361
 
#16

eMolecules: 2201376
Molport: MolPort-001-534-432
AKOS: AKOS003282308
Alinda: IVK/9311665
ChemBridge: 7285091...17 total

ref: mol2, SDF, SMILES, flexibase
4.72,2.47,-8.55,0,3,0, 291.35, 3

Similar to: 34029223,
2768510
 
#17

eMolecules: 46443577
Molport: MolPort-001-534-594
AKOS: AKOS003282421
Alinda: IVK/9311664
American Custom Chemicals Corp.: HCH0242039...14 total

ref: mol2, SDF, SMILES, flexibase
5.12,11.04,-18.97,1,5,0, 408.914, 4
2768508
 
#18

eMolecules: 46443575
Molport: MolPort-001-623-646
AKOS: AKOS003280616
Alinda: IVK/9311662
American Custom Chemicals Corp.: CHM0226449...14 total

ref: mol2, SDF, SMILES, flexibase
1.90,5.38,-20.91,1,6,0, 274.324, 5

Similar to: 34871212,
999757
 
#19

eMolecules: 4024179
Molport: MolPort-001-534-354
Scientific Exchange (make on demand): Q-018341
AKOS: AKOS003280527
Alinda: IVK/9311653...16 total

ref: mol2, SDF, SMILES, flexibase
3.36,0.86,-12.85,1,5,0, 345.42, 6
2768506
 
#20

eMolecules: 4024179
Molport: MolPort-001-534-354
Scientific Exchange (make on demand): Q-018341
AKOS: AKOS003280527
Alinda: IVK/9311653...16 total

ref: mol2, SDF, SMILES, flexibase
3.36,0.92,-13.01,1,5,0, 345.42, 6
652121
 
#21

eMolecules: 4055237
Molport: MolPort-001-534-425
AKOS: AKOS003282634
Alinda: IVK/9311643
Mcule: MCULE-8350525880...15 total

ref: mol2, SDF, SMILES, flexibase
4.47,0.48,-10.2,1,4,0, 377.531, 5

Similar to: 4173260,
4631370
 
#22

eMolecules: 45937489
Molport: MolPort-002-820-389
AKOS: AKOS003753761
American Custom Chemicals Corp.: CHM0226479
Mcule: MCULE-7736571882...13 total

ref: mol2, SDF, SMILES, flexibase
2.07,2.29,-13.1,1,7,0, 327.34, 7

Similar to: 6493476,
475260
 
#23

eMolecules: 2198552
Molport: MolPort-001-534-413
AKOS: AKOS001311290
Alinda: IVK/9311617
ChemBridge: 7253631...19 total

ref: mol2, SDF, SMILES, flexibase
3.01,7.18,-14.88,1,3,0, 311.204, 3
17070981
 
#24

eMolecules: 46450255
Molport: MolPort-004-965-527
AKOS: AKOS003755608
Alinda: IVK/9311612
American Custom Chemicals Corp.: HCH0289741...13 total

ref: mol2, SDF, SMILES, flexibase
3.37,7.92,-8.59,2,5,0, 338.386, 4
2768483
 
#25

eMolecules: 4169717
Molport: MolPort-001-534-359
AKOS: AKOS003280558
Alinda: IVK/9311608
Mcule: MCULE-8521072684...13 total

ref: mol2, SDF, SMILES, flexibase
3.34,-5.92,-14.91,3,6,0, 495.651, 9

Similar to: 6251102, 36667107, 36667176,
662630
 
#26

eMolecules: 45937487
Molport: MolPort-001-534-168, MolPort-019-758-325
AKOS: AKOS003280893
Alinda: IVK/9311601
American Custom Chemicals Corp.: CHM0281802...17 total

ref: mol2, SDF, SMILES, flexibase
5.26,-1.14,-13.68,1,4,0, 405.548, 4
2768476
 
#27

eMolecules: 46450101
Molport: MolPort-001-534-482
Scientific Exchange (make on demand): Q-018493
AKOS: AKOS003282565
Alinda: IVK/9311600...15 total

ref: mol2, SDF, SMILES, flexibase
1.65,-1.44,-18.39,3,7,0, 379.416, 9

Similar to: 6410480, 20922019, 662594,
2768472
 
#28

eMolecules: 46449121
Molport: MolPort-001-534-396
AKOS: AKOS003282282
Alinda: IVK/9311597
American Custom Chemicals Corp.: CHM0226494...15 total

ref: mol2, SDF, SMILES, flexibase
2.77,-0.19,-9.9,1,6,0, 358.438, 9

Similar to: 6935081, 6935087, 20595439, 20595441, 34869256, ... 6 in total.
2768474
 
#29

eMolecules: 46449121
Molport: MolPort-001-534-396
AKOS: AKOS003282282
Alinda: IVK/9311597
American Custom Chemicals Corp.: CHM0226494...15 total

ref: mol2, SDF, SMILES, flexibase
2.77,-0.23,-9.97,1,6,0, 358.438, 9

Similar to: 6935081, 6935087, 20595439, 20595441, 34869256, ... 6 in total.
17080610
 
#30

eMolecules: 26782984
Molport: MolPort-001-534-312
AKOS: AKOS003768320
Alinda: IVK/9311591
American Custom Chemicals Corp.: CHM0226464...16 total

ref: mol2, SDF, SMILES, flexibase
3.35,7.45,-11.62,2,7,0, 394.475, 6

Similar to: 662622,
2768466
 
#31

eMolecules: 2195048
Molport: MolPort-001-534-566
AKOS: AKOS003282472
Alinda: IVK/9311586
ChemBridge: 7222150...16 total

ref: mol2, SDF, SMILES, flexibase
5.16,3.85,-25.56,1,7,0, 477.538, 6
20175898
 
#32

eMolecules: 46450033
Molport: MolPort-001-534-476
AKOS: AKOS003282491
Alinda: IVK/9311583
American Custom Chemicals Corp.: CHM0226525...14 total

ref: mol2, SDF, SMILES, flexibase
1.70,5.97,-26.15,3,9,0, 453.495, 12

Similar to: 16411701, 16411711, 16436362, 16436368, ... 4 in total.
2768465
 
#33

eMolecules: 4151091
Molport: MolPort-001-534-509
AKOS: AKOS003282566
Alinda: IVK/9311582
Mcule: MCULE-6291751363...13 total

ref: mol2, SDF, SMILES, flexibase
6.38,14.82,-11.25,1,4,0, 467.656, 7
6183595
 
#34

eMolecules: 46343319
Molport: MolPort-001-534-513
Scientific Exchange (make on demand): Q-018528
AKOS: AKOS003282615
Alinda: IVK/9311576...11 total

ref: mol2, SDF, SMILES, flexibase
3.05,2.66,-10.84,1,4,0, 292.338, 5
6183068
 
#35

eMolecules: 46343319
Molport: MolPort-001-534-513
Scientific Exchange (make on demand): Q-018528
AKOS: AKOS003282615
Alinda: IVK/9311576...15 total

ref: mol2, SDF, SMILES, flexibase
3.05,2.66,-10.86,1,4,0, 292.338, 5
2768462
 
#36

eMolecules: 46450249
Molport: MolPort-004-965-526
AKOS: AKOS003282517
Alinda: IVK/9311567
American Custom Chemicals Corp.: CHM0226552...14 total

ref: mol2, SDF, SMILES, flexibase
5.42,9.86,-5.8,1,3,0, 310.441, 4
lo: mol2, SDF, SMILES, flexibase
5.60,8.62,-37.39,2,3,1, 311.449, 4

Similar to: 6542701, 6542703, 6542707, 6542711, 13736734, ... 6 in total.
22708273
 
#37

eMolecules: 46450037
Molport: MolPort-001-534-588
AKOS: AKOS003997465
Alinda: IVK/9311564
American Custom Chemicals Corp.: CHM0226577...14 total

ref: mol2, SDF, SMILES, flexibase
4.18,11.38,-17.54,1,7,0, 472.541, 11

Similar to: 20787119,
19638851
 
#38

eMolecules: 45937485
Molport: MolPort-019-729-365, MolPort-001-534-533
AKOS: AKOS003282468
Alinda: IVK/9311558
American Custom Chemicals Corp.: CHM0226549...22 total

ref: mol2, SDF, SMILES, flexibase
3.39,7.26,-17.63,1,7,0, 443.569, 8

Similar to: 40147178, 40147179, 662617,
2768454
 
#39

eMolecules: 46450029
Molport: MolPort-001-534-601
AKOS: AKOS003282497
Alinda: IVK/9311554
American Custom Chemicals Corp.: CHM0226584...15 total

ref: mol2, SDF, SMILES, flexibase
5.04,14.14,-9.4,1,5,0, 432.527, 6
2768452
 
#40

eMolecules: 46450029
Molport: MolPort-001-534-601
AKOS: AKOS003282497
Alinda: IVK/9311554
American Custom Chemicals Corp.: CHM0226584...15 total

ref: mol2, SDF, SMILES, flexibase
5.04,14.14,-9.49,1,5,0, 432.527, 6
48029
 
#41

eMolecules: 46443573
Molport: MolPort-001-520-681
Scientific Exchange (make on demand): E-027969
AKOS: AKOS000365055
Alinda: IVK/9311547...15 total

ref: mol2, SDF, SMILES, flexibase
2.06,0.25,-16.2,1,6,0, 261.281, 4
2768446
 
#42

eMolecules: 46443571
Molport: MolPort-001-534-319
AKOS: AKOS003280490
Alinda: IVK/9311542
American Custom Chemicals Corp.: CHM0226467...14 total

ref: mol2, SDF, SMILES, flexibase
3.26,-0.63,-19.37,1,6,0, 322.368, 4

Similar to: 33779368,
17316571
 
#43

eMolecules: 46397740
Molport: MolPort-001-534-465
Alinda: IVK/9311534
American Custom Chemicals Corp.: NEW0104177
Mcule: MCULE-8994784820...19 total

ref: mol2, SDF, SMILES, flexibase
2.82,4.3,-5.19,1,2,0, 163.22, 2
ref: mol2, SDF, SMILES, flexibase
2.82,4.3,-5.75,1,2,0, 163.22, 2

Similar to: 33845909, 16951323, 12447446,
2768440
 
#44

eMolecules: 4036319
Molport: MolPort-001-534-332
Scientific Exchange: Q-018318
AKOS: AKOS003280605
Alinda: IVK/9311527...16 total

ref: mol2, SDF, SMILES, flexibase
3.34,-2.75,-14.01,3,5,0, 358.463, 5

Similar to: 7485905, 7485907, 7485908,
2768441
 
#45

eMolecules: 4036319
Molport: MolPort-001-534-332
Scientific Exchange: Q-018318
AKOS: AKOS003280605
Alinda: IVK/9311527...16 total

ref: mol2, SDF, SMILES, flexibase
3.34,-2.81,-13.87,3,5,0, 358.463, 5

Similar to: 1952172, 1952174, 1952175, 1952177, ... 4 in total.
2768438
 
#46

eMolecules: 4036319
Molport: MolPort-001-534-332
Scientific Exchange: Q-018318
AKOS: AKOS003280605
Alinda: IVK/9311527...16 total

ref: mol2, SDF, SMILES, flexibase
3.34,-2.81,-13.9,3,5,0, 358.463, 5

Similar to: 7485905, 7485907, 7485908,
2768439
 
#47

eMolecules: 4036319
Molport: MolPort-001-534-332
Scientific Exchange: Q-018318
AKOS: AKOS003280605
Alinda: IVK/9311527...16 total

ref: mol2, SDF, SMILES, flexibase
3.34,-2.81,-14.05,3,5,0, 358.463, 5

Similar to: 7485905, 7485907, 7485908,
22534684
 
#48

eMolecules: 46450115
Molport: MolPort-001-534-431
AKOS: AKOS003993139
Alinda: IVK/9311526
American Custom Chemicals Corp.: HCH0242001...14 total

ref: mol2, SDF, SMILES, flexibase
5.16,14,-10.35,1,5,0, 452.945, 6

Similar to: 17102833,
20175938
 
#49

eMolecules: 46443569
Molport: MolPort-001-534-426
AKOS: AKOS003282635
Alinda: IVK/9311522
American Custom Chemicals Corp.: CHM0226503...16 total

ref: mol2, SDF, SMILES, flexibase
3.76,8.23,-19.06,1,7,0, 457.596, 9
mid: mol2, SDF, SMILES, flexibase
3.76,10.62,-47.23,2,7,1, 458.604, 9

Similar to: 40147178, 40147179, 662617,
5729080
 
#50

eMolecules: 46450177
AKOS: AKOS002802167
Alinda: IVK/9311514
American Custom Chemicals Corp.: CHM0226521
Mcule: MCULE-5344000208...12 total

ref: mol2, SDF, SMILES, flexibase
1.95,-0.23,-10.66,2,6,0, 318.336, 5

Similar to: 2768431,
2768427
 
#51

eMolecules: 46450175
AKOS: AKOS002802370
Alinda: IVK/9311498
American Custom Chemicals Corp.: CHM0226496
Mcule: MCULE-4498066647...14 total

ref: mol2, SDF, SMILES, flexibase
3.29,2.58,-11.94,1,6,0, 394.434, 6

Similar to: 5069260, 8220602, 33808761, 33939637, ... 4 in total.
2768425
 
#52

eMolecules: 4057714
Molport: MolPort-001-534-385
AKOS: AKOS003280694
Alinda: IVK/9311496
Mcule: MCULE-7744846441...14 total

ref: mol2, SDF, SMILES, flexibase
6.97,1.68,-8.04,1,2,0, 380.37, 3
2768416
 
#53

eMolecules: 2445899
Molport: MolPort-001-534-517
AKOS: AKOS003282667
Alinda: IVK/9311481
ChemBridge: 7291216...17 total

ref: mol2, SDF, SMILES, flexibase
5.64,0.7,-12.6,1,5,0, 451.569, 7
5729017
 
#54

eMolecules: 46450147
Molport: MolPort-004-965-525
AKOS: AKOS003760049
Alinda: IVK/9311461
American Custom Chemicals Corp.: HCH0289751...12 total

ref: mol2, SDF, SMILES, flexibase
3.26,0.13,-10.28,2,5,0, 360.392, 6

Similar to: 2768405,
2768403
 
#55

eMolecules: 4146498
Molport: MolPort-001-534-323
AKOS: AKOS003280541
Alinda: IVK/9311457
Mcule: MCULE-9374596723...13 total

ref: mol2, SDF, SMILES, flexibase
7.27,13.74,-8.75,1,4,0, 462.036, 7
999753
 
#56

eMolecules: 4056494
Molport: MolPort-001-534-522
Scientific Exchange: Q-018538
AKOS: AKOS003282338
Alinda: IVK/9311452...16 total

ref: mol2, SDF, SMILES, flexibase
5.21,0.16,-9.31,0,3,0, 378.903, 2

Similar to: 6254314,
5728917
 
#57

eMolecules: 46450221
Molport: MolPort-001-534-251
AKOS: AKOS003280427
Alinda: IVK/9311439
American Custom Chemicals Corp.: HCH0289736...12 total

ref: mol2, SDF, SMILES, flexibase
1.82,-0.59,-7.69,2,5,0, 296.305, 4

Similar to: 33718694,
1113805
 
#58

eMolecules: 2199177
Molport: MolPort-001-534-350
AKOS: AKOS003280471
Alinda: IVK/9311437
Mcule: MCULE-1388359756...18 total

ref: mol2, SDF, SMILES, flexibase
1.41,-1.94,-17.42,3,9,0, 447.447, 9

Similar to: 19722457, 41707571, 183029,
5728445
 
#59

eMolecules: 46450031
Molport: MolPort-004-965-524
AKOS: AKOS003762939
Alinda: IVK/9311426
American Custom Chemicals Corp.: CHM0226443...12 total

ref: mol2, SDF, SMILES, flexibase
3.31,0.01,-9.98,2,6,0, 372.428, 6

Similar to: 20551258, 5728418, 2768392,
5728418
 
#60

eMolecules: 46450031
Molport: MolPort-004-965-524
AKOS: AKOS003762939
Alinda: IVK/9311426
American Custom Chemicals Corp.: CHM0226443...12 total

ref: mol2, SDF, SMILES, flexibase
3.31,0.04,-10.36,2,6,0, 372.428, 6

Similar to: 5728445, 20551258, 2768392,
2768385
 
#61

eMolecules: 46443567
Molport: MolPort-001-534-348
AKOS: AKOS003280453
Alinda: IVK/9311421
American Custom Chemicals Corp.: CHM0226478...14 total

ref: mol2, SDF, SMILES, flexibase
3.76,0.57,-17.86,1,6,0, 329.4, 7

Similar to: 5952111, 5953589, 33718854, 34847435, ... 4 in total.
4614753
 
#62

eMolecules: 4012662
Molport: MolPort-001-534-313
AKOS: AKOS003280431
Alinda: IVK/9311408
Mcule: MCULE-6820891639...16 total

ref: mol2, SDF, SMILES, flexibase
6.40,0.82,-11.09,1,3,0, 331.5, 4

Similar to: 5696550,
4614752
 
#63

eMolecules: 4012662
Molport: MolPort-001-534-313
AKOS: AKOS003280431
Alinda: IVK/9311408
Mcule: MCULE-6820891639...16 total

ref: mol2, SDF, SMILES, flexibase
6.40,0.89,-11.1,1,3,0, 331.5, 4

Similar to: 5696550,
19840349
 
#64

eMolecules: 26782978
Molport: MolPort-001-534-515
AKOS: AKOS003996445
Alinda: IVK/9311399
Mcule: MCULE-5878004798...13 total

ref: mol2, SDF, SMILES, flexibase
4.61,13.41,-12.37,1,6,0, 473.58, 6
lo: mol2, SDF, SMILES, flexibase
4.61,15.13,-46.94,2,6,1, 474.588, 6

Similar to: 662612,
2768375
 
#65

eMolecules: 2195696
Molport: MolPort-001-534-451
AKOS: AKOS003282563
Alinda: IVK/9311397
ChemBridge: 7227058...15 total

ref: mol2, SDF, SMILES, flexibase
4.53,-0.58,-10.05,1,5,0, 382.847, 6

Similar to: 6254325,
6183383
 
#66

eMolecules: 46453968
Molport: MolPort-001-534-357
AKOS: AKOS003280543
Alinda: IVK/9311368
American Custom Chemicals Corp.: HCH0241972...14 total

ref: mol2, SDF, SMILES, flexibase
3.57,0.08,-22.33,1,6,0, 335.791, 6

Similar to: 33746927, 33746928, 39127155,
6182807
 
#67

eMolecules: 46453968
Molport: MolPort-001-534-357
AKOS: AKOS003280543
Alinda: IVK/9311368
American Custom Chemicals Corp.: HCH0241972...14 total

ref: mol2, SDF, SMILES, flexibase
3.57,0.11,-22.33,1,6,0, 335.791, 6

Similar to: 33746927, 33746928, 39127155,
2768360
 
#68

eMolecules: 2446934
Molport: MolPort-001-534-598
AKOS: AKOS003282473
Alinda: IVK/9311366
ChemBridge: 7307310...14 total

ref: mol2, SDF, SMILES, flexibase
5.11,13.23,-25.54,1,7,0, 483.929, 7
8399660
 
#69

eMolecules: 26782976
Molport: MolPort-002-820-387
AKOS: AKOS003998972
American Custom Chemicals Corp.: CHM0226475
Mcule: MCULE-6657283169...13 total

ref: mol2, SDF, SMILES, flexibase
2.39,0.09,-17.92,0,2,0, 462.506, 9

Similar to: 2768358,
2768353
 
#70

eMolecules: 46449061
Molport: MolPort-004-965-523
Scientific Exchange (make on demand): Q-018332
AKOS: AKOS003280434
Alinda: IVK/9311348...15 total

ref: mol2, SDF, SMILES, flexibase
3.49,0.4,-6.32,1,3,0, 274.389, 3

Similar to: 6429424,
5728068
 
#71

eMolecules: 46450131
Molport: MolPort-001-534-369
AKOS: AKOS003749860
American Custom Chemicals Corp.: CHM0226485
Mcule: MCULE-5887457610...11 total

ref: mol2, SDF, SMILES, flexibase
2.48,1.93,-10.59,1,6,0, 297.314, 6

Similar to: 44214324, 2768351,
1116082
 
#72

eMolecules: 2201600
Molport: MolPort-001-534-507
AKOS: AKOS001692484
Alinda: IVK/9311345
ChemBridge: 7288337...15 total

ref: mol2, SDF, SMILES, flexibase
2.56,0.1,-27.53,0,7,0, 394.427, 4

Similar to: 8030455, 8243021, 8290757, 25520900, 25870641, ... 5 in total.
2768347
 
#73

eMolecules: 4104214
Molport: MolPort-001-534-584
AKOS: AKOS003282269
Alinda: IVK/9311330
Mcule: MCULE-8630272563...15 total

ref: mol2, SDF, SMILES, flexibase
5.91,1.01,-12.08,1,4,0, 421.543, 6
17079395
 
#74

eMolecules: 46450229
Molport: MolPort-004-965-522
AKOS: AKOS003766639
American Custom Chemicals Corp.: HCH0241994
Mcule: MCULE-5147925921...13 total

ref: mol2, SDF, SMILES, flexibase
3.68,11.23,-9.36,1,5,0, 388.858, 5

Similar to: 16409631, 7165399, 2768342,
2768341
 
#75

eMolecules: 2440179
Molport: MolPort-001-534-299
AKOS: AKOS003280669
Alinda: IVK/9311320
ChemBridge: 7226883...17 total

ref: mol2, SDF, SMILES, flexibase
5.97,0.26,-9.06,1,5,0, 449.981, 8
2768338
 
#76

eMolecules: 46447277
Molport: MolPort-003-006-813
AKOS: AKOS003282515
Alinda: IBS-0012840
American Custom Chemicals Corp.: CHM0226537...14 total

ref: mol2, SDF, SMILES, flexibase
3.10,-0.66,-7.66,2,4,0, 292.338, 4
2768335
 
#77

eMolecules: 45937483
Molport: MolPort-002-820-386, MolPort-019-729-275
AKOS: AKOS003282536
Alinda: IVK/9311304
American Custom Chemicals Corp.: CHM0226512...17 total

ref: mol2, SDF, SMILES, flexibase
4.24,1.68,-9.23,1,5,0, 378.472, 9

Similar to: 5711881, 16409420, 16409431, 16409474, 25883338, ... 6 in total.
5728567
 
#78

eMolecules: 46450095
Molport: MolPort-004-965-521
AKOS: AKOS003759557
Alinda: IVK/9311300
American Custom Chemicals Corp.: CHM0226442...12 total

ref: mol2, SDF, SMILES, flexibase
3.59,-0.1,-9.73,2,5,0, 356.429, 5

Similar to: 5728571, 5728616, 5905457, 6628858, 20368400, ... 6 in total.
474458
 
#79

eMolecules: 2197055
Molport: MolPort-001-534-345
AKOS: AKOS003280433
Alinda: IVK/9311290
Life Chemicals: F0174-0293...17 total

ref: mol2, SDF, SMILES, flexibase
4.49,7.58,-8.51,1,3,0, 308.815, 2
hi: mol2, SDF, SMILES, flexibase
4.56,5.75,-42.57,0,3,-1, 307.807, 2

Similar to: 4264278,
2768323
 
#80

eMolecules: 4178295
Molport: MolPort-001-534-590
AKOS: AKOS003282367
Alinda: IVK/9311281
Mcule: MCULE-6792724994...15 total

ref: mol2, SDF, SMILES, flexibase
7.25,0.41,-12.28,1,5,0, 513.018, 6
17077757
 
#81

eMolecules: 46450053
Molport: MolPort-001-534-326
AKOS: AKOS003764820
Alinda: IVK/9311276
American Custom Chemicals Corp.: CHM0226469...12 total

ref: mol2, SDF, SMILES, flexibase
2.85,7.07,-11.87,2,7,0, 380.448, 6

Similar to: 2768317,
2768311
 
#82

eMolecules: 46443565
Molport: MolPort-001-534-422
Scientific Exchange (make on demand): Q-018420
AKOS: AKOS003282586
Alinda: IVK/9311271...15 total

ref: mol2, SDF, SMILES, flexibase
2.62,0.09,-20.82,1,6,0, 287.319, 5

Similar to: 39127178, 39127252, 39127470, 39127471, ... 7 in total.
1112858
 
#83

eMolecules: 2197954
Molport: MolPort-001-534-558
AKOS: AKOS003282366
Alinda: IVK/9311269
ChemBridge: 7249230...14 total

ref: mol2, SDF, SMILES, flexibase
5.02,13.22,-25.4,1,7,0, 463.511, 7
2768304
 
#84

eMolecules: 46443563
Molport: MolPort-001-534-560
AKOS: AKOS003282390
Alinda: IVK/9311254
American Custom Chemicals Corp.: HCH0242032...14 total

ref: mol2, SDF, SMILES, flexibase
4.39,-1.29,-17.63,1,5,0, 347.827, 4
652088
 
#85

eMolecules: 2195568
Molport: MolPort-001-534-258
AKOS: AKOS003280486
Alinda: IVK/9311241
ChemBridge: 7226019...15 total

ref: mol2, SDF, SMILES, flexibase
5.71,8.52,-10.07,3,4,0, 432.998, 5
2768298
 
#86

eMolecules: 46449091
Molport: MolPort-004-965-520
AKOS: AKOS000967574
Alinda: IVK/9311236
American Custom Chemicals Corp.: CHM0226483...15 total

ref: mol2, SDF, SMILES, flexibase
2.37,1.59,-9.64,1,4,0, 266.3, 5

Similar to: 6281501,
4631367
 
#87

eMolecules: 45937481
Molport: MolPort-002-820-385
AKOS: AKOS003751862
Alinda: IVK/9311233
American Custom Chemicals Corp.: HCH0242002...14 total

ref: mol2, SDF, SMILES, flexibase
2.85,-0.99,-8.22,2,5,0, 314.776, 5

Similar to: 5863812, 6628812, 7327873,
5728354
 
#88

eMolecules: 46450047
Molport: MolPort-004-965-519
AKOS: AKOS003984649
Alinda: IVK/9311215
American Custom Chemicals Corp.: HCH0289749...12 total

ref: mol2, SDF, SMILES, flexibase
2.91,0.47,-14.62,2,7,0, 420.444, 8

Similar to: 5880328,
355332
 
#89

eMolecules: 4017893
Molport: MolPort-001-534-487
AKOS: AKOS003282639
Alinda: IVK/9311209
Mcule: MCULE-6642043100...20 total

ref: mol2, SDF, SMILES, flexibase
4.60,9.1,-8.45,1,2,0, 338.289, 3

Similar to: 5919860, 5919878, 5920750, 5920760, ... 4 in total.
355334
 
#90

eMolecules: 4017893
Molport: MolPort-001-534-487
AKOS: AKOS003282639
Alinda: IVK/9311209
Mcule: MCULE-6642043100...20 total

ref: mol2, SDF, SMILES, flexibase
4.60,10.01,-8.16,1,2,0, 338.289, 3

Similar to: 5919860, 5919878, 5920750, 5920760, 27891913, ... 5 in total.
355335
 
#91

eMolecules: 4017893
Molport: MolPort-001-534-487
AKOS: AKOS003282639
Alinda: IVK/9311209
Mcule: MCULE-6642043100...20 total

ref: mol2, SDF, SMILES, flexibase
4.60,10.01,-8.14,1,2,0, 338.289, 3

Similar to: 5919860, 5919878, 5920750, 5920760, 27891913, ... 5 in total.
355336
 
#92

eMolecules: 4017893
Molport: MolPort-001-534-487
AKOS: AKOS003282639
Alinda: IVK/9311209
Mcule: MCULE-6642043100...20 total

ref: mol2, SDF, SMILES, flexibase
4.60,9.1,-8.46,1,2,0, 338.289, 3

Similar to: 5919860, 5919878, 5920750, 5920760, ... 4 in total.
2768284
 
#93

eMolecules: 46343317
Molport: MolPort-001-534-474
AKOS: AKOS003282466
Alinda: IVK/9311206
American Custom Chemicals Corp.: CHM0226524...14 total

ref: mol2, SDF, SMILES, flexibase
5.14,1.19,-9.73,1,5,0, 404.51, 7

Similar to: 5720262, 8270168, 16410636, 40869072, ... 4 in total.
13111570
 
#94

eMolecules: 26782970
Molport: MolPort-019-758-353, MolPort-002-820-384
American Custom Chemicals Corp.: CHM0226459
Mcule: MCULE-7839457044
Princeton BioMolecular Research: OSSL_185518...13 total

ref: mol2, SDF, SMILES, flexibase
3.65,8.21,-7.73,2,5,0, 334.423, 4

Similar to: 34887698,
5728237
 
#95

eMolecules: 46450127
Molport: MolPort-004-965-518
AKOS: AKOS003746205
Alinda: IVK/9311192
American Custom Chemicals Corp.: CHM0281822...12 total

ref: mol2, SDF, SMILES, flexibase
2.05,1.97,-10.25,1,5,0, 253.261, 4

Similar to: 5879407, 7327859, 7327860, 44223711, ... 6 in total.
1116548
 
#96

eMolecules: 2258835
Molport: MolPort-001-534-553
AKOS: AKOS003282290
Alinda: IVK/9311182
Mcule: MCULE-3749131596...17 total

ref: mol2, SDF, SMILES, flexibase
3.45,9.2,-12.34,0,4,0, 352.459, 3
2768275
 
#97

eMolecules: 4150422
Molport: MolPort-001-534-438
AKOS: AKOS001692398
Alinda: IVK/9311176
Mcule: MCULE-3275543196...13 total

ref: mol2, SDF, SMILES, flexibase
4.35,-4.69,-19.18,1,6,0, 466.744, 5
2768271
 
#98

eMolecules: 4073845
Molport: MolPort-001-534-309
AKOS: AKOS003280398
Alinda: IVK/9311168
Mcule: MCULE-1297632996...15 total

ref: mol2, SDF, SMILES, flexibase
4.88,2.04,-13.43,1,5,0, 395.48, 7

Similar to: 6119814, 6119817, 6119820, 6119823, 6119826, ... 11 in total.
2768270
 
#99

eMolecules: 4073845
Molport: MolPort-001-534-309
AKOS: AKOS003280398
Alinda: IVK/9311168
Mcule: MCULE-1297632996...15 total

ref: mol2, SDF, SMILES, flexibase
4.88,2.05,-13.6,1,5,0, 395.48, 7

Similar to: 6119814, 6119817, 6119820, 6119823, 6119826, ... 11 in total.
370508
 
#100

eMolecules: 3962762
Molport: MolPort-001-534-488
AKOS: AKOS003282640
Alinda: IVK/9311159
Princeton BioMolecular Research: OSSL_185469...15 total

ref: mol2, SDF, SMILES, flexibase
2.16,4.23,-9.77,2,3,0, 206.289, 3

Similar to: 6385873, 6644835,

Old detail retrieval took 2 seconds.

start 0 size 100

select distinct(s.sub_id),s.smiles from substance s, catalog_item ci, catalog c where s.sub_id = ci.sub_id_fk and ci.cat_id_fk = c.cat_id and c.free=1 and ( c.cat_id = 109 ) limit 0,100

Smiles were