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5379981
 
#1

Scientific Exchange (make on demand): R-042204
Aronis (Make on Request): ASKVIRT/33395
TimTec Make-on-Demand: OVS20162076
ChemDB: 6971058
PubChem: 5786909...7 total

ref: mol2, SDF, SMILES, flexibase
5.21,0.85,-16.82,1,4,0, 356.491, 7

Similar to: 516776,
9814711
 
#2

Scientific Exchange (make on demand): F-082228
Aronis (Make on Request): RESYN/48184
TimTec Make-on-Demand: OVS21273040
PubChem: 17097885
AKOS (make-on-demand): AKOS003496455...5 total

ref: mol2, SDF, SMILES, flexibase
5.28,1.59,-11.97,1,4,0, 341.451, 8
9814703
 
#3

Scientific Exchange (make on demand): F-082227
Aronis (Make on Request): RESYN/48183
TimTec Make-on-Demand: OVS21273039
PubChem: 17097884
AKOS (make-on-demand): AKOS003496454...5 total

ref: mol2, SDF, SMILES, flexibase
2.17,0.75,-22.55,1,7,0, 376.453, 8

Similar to: 9781889, 9781894, 9781900, 9781904, 9814679, ... 7 in total.
6735678
 
#4

Scientific Exchange (make on demand): M-077626
Aronis (Make on Request): ASKVIRT/49696
TimTec Make-on-Demand: OVS21201295
ChemDB: 6981597
PubChem: 4499589...6 total

ref: mol2, SDF, SMILES, flexibase
1.65,-3.7,-22.31,3,8,0, 395.462, 8
123098
 
#5

ChemMol: 2200860, 80100867
eMolecules: 666672
Molport: MolPort-000-998-641
Scientific Exchange (make on demand): R-034705
AK Scientific: 8291AD...56 total

ref: mol2, SDF, SMILES, flexibase
1.14,2.38,-9.22,3,4,0, 202.213, 2

Similar to: 185668, 37045087, 38458553,
7523056
 
#6

Aronis (Make on Request): SYN2007/17499
TimTec Make-on-Demand: OVS21334533
PubChem: 8620453
AKOS (make-on-demand): AKOS000964818
ref: mol2, SDF, SMILES, flexibase
3.80,-4.26,-21.17,4,5,0, 398.557, 12

Similar to: 2994503,
5283092
 
#7

Aronis (Make on Request): SYN2007/17496
TimTec Make-on-Demand: OVS21334531
Collaborative Drug Discovery: 8766
PubChem: 7605286
AKOS (make-on-demand): AKOS003551033...5 total

ref: mol2, SDF, SMILES, flexibase
3.85,-4.36,-21.73,4,4,0, 382.558, 11

Similar to: 2876469,
2832181
 
#8

eMolecules: 2346708
Molport: MolPort-002-143-355
Scientific Exchange (make on demand): R-011676
AKOS: AKOS003551352
ChemBridge: 5305956...16 total

ref: mol2, SDF, SMILES, flexibase
2.00,-4.74,-15.78,4,4,0, 306.46, 10

Similar to: 44107463, 44107472,
3098233
 
#9

eMolecules: 2751397
Molport: MolPort-002-324-040
Scientific Exchange (make on demand): R-011677
AKOS: AKOS003551324
Mcule: MCULE-9086045645...14 total

ref: mol2, SDF, SMILES, flexibase
2.05,-4.88,-19.87,4,4,0, 306.46, 10

Similar to: 3199828,
6788748
 
#10

eMolecules: 3995369
Molport: MolPort-001-586-266
Scientific Exchange (make on demand): M-329910
AKOS: AKOS003316074
Alinda: IVK/4024645...14 total

ref: mol2, SDF, SMILES, flexibase
2.88,-3.11,-18.59,3,5,0, 307.419, 8

Similar to: 6788745,
6788745
 
#11

eMolecules: 3995369
Molport: MolPort-001-586-266
Scientific Exchange (make on demand): M-329910
AKOS: AKOS003316074
Alinda: IVK/4024645...14 total

ref: mol2, SDF, SMILES, flexibase
2.88,-3.11,-18.77,3,5,0, 307.419, 8

Similar to: 6788748,
6789381
 
#12

eMolecules: 3986895
Molport: MolPort-001-586-071
Scientific Exchange (make on demand): M-329686
AKOS: AKOS003344525
Alinda: IVK/4024052...13 total

ref: mol2, SDF, SMILES, flexibase
2.50,-3.43,-19.12,3,5,0, 293.392, 8

Similar to: 7556247,
7659976
 
#13

Scientific Exchange (make on demand): M-339459
Aronis (Make on Request): SYN2007/17481
TimTec Make-on-Demand: OVS21334520
ChEMBL12: CHEMBL573612
ChEMBL19: CHEMBL573612...8 total

ref: mol2, SDF, SMILES, flexibase
3.24,-3.6,-20.91,3,5,0, 329.425, 8

Similar to: 7659974,
7659974
 
#14

Scientific Exchange (make on demand): M-339459
Aronis (Make on Request): SYN2007/17481
TimTec Make-on-Demand: OVS21334520
ChEMBL12: CHEMBL573612
ChEMBL19: CHEMBL573612...8 total

ref: mol2, SDF, SMILES, flexibase
3.24,-3.51,-20.82,3,5,0, 329.425, 8

Similar to: 7659976,
2064521
 
#15

eMolecules: 1344434
Molport: MolPort-001-965-919
Scientific Exchange (make on demand): M-736339
AKOS: AKOS000604276
Asinex: BAS01580287...16 total

ref: mol2, SDF, SMILES, flexibase
3.88,-2.98,-18.7,3,5,0, 341.436, 9

Similar to: 7555929, 23617938, 23618030, 23618193, 23618195, ... 9 in total.
2064524
 
#16

Molport: MolPort-001-965-922
AKOS: AKOS000604309
Asinex: BAS01580291
Specs: AG-690/15433436
TimTec: ST50254462...8 total

ref: mol2, SDF, SMILES, flexibase
3.38,-3.66,-16.61,3,5,0, 341.436, 9

Similar to: 7528103, 15709869, 15876742, 15907424, 15907425, ... 8 in total.
4951183
 
#17

Molport: MolPort-001-965-917
AKOS: AKOS000604244
Asinex: BAS01580285
TimTec: ST51173889
Aronis (Make on Request): SYN2007/17477...7 total

ref: mol2, SDF, SMILES, flexibase
3.16,-3.06,-17.21,3,5,0, 293.392, 9

Similar to: 7555929, 14338041, 14338042,
3071131
 
#18

eMolecules: 2754326
Molport: MolPort-001-487-407
AKOS: AKOS003234768
ChemBridge: 5575920
Mcule: MCULE-4546590277...14 total

ref: mol2, SDF, SMILES, flexibase
2.49,-4.53,-16.16,3,4,0, 314.208, 6
3071119
 
#19

eMolecules: 1684306
Molport: MolPort-001-529-488
Scientific Exchange (make on demand): H-073343
AKOS: AKOS003288209
Alinda: IBS-L0032575...20 total

ref: mol2, SDF, SMILES, flexibase
1.37,-3.49,-17.85,3,6,0, 295.364, 8

Similar to: 8301673,
2117368
 
#20

eMolecules: 939830
Molport: MolPort-002-820-950
Scientific Exchange (make on demand): M-331350
Mcule: MCULE-4552708801
Ryan Scientific (Depleted): 003-42264...13 total

ref: mol2, SDF, SMILES, flexibase
2.28,-3.14,-17.39,3,5,0, 265.338, 7

Similar to: 6448068, 15908214,
6819681
 
#21

Scientific Exchange (make on demand): M-342417
Aronis (Make on Request): SYN2007/17459
TimTec Make-on-Demand: OVS21334506
PubChem: 40645202
AKOS (make-on-demand): AKOS003552588...5 total

ref: mol2, SDF, SMILES, flexibase
3.49,-3.51,-20.9,3,5,0, 341.436, 9

Similar to: 7622418,
9814694
 
#22

Scientific Exchange (make on demand): F-082227
Aronis (Make on Request): RESYN/48183
TimTec Make-on-Demand: OVS21273039
PubChem: 17097884
AKOS (make-on-demand): AKOS003496454...5 total

ref: mol2, SDF, SMILES, flexibase
2.17,0.69,-22.51,1,7,0, 376.453, 8

Similar to: 9814703, 9781889, 9781894, 9781900, 9781904, ... 7 in total.
5726749
 
#23

eMolecules: 9818539
Scientific Exchange (make on demand): M-333324
AKOS: AKOS002222372
Innovapharm: STT-00136502
Mcule: MCULE-4407588179...14 total

ref: mol2, SDF, SMILES, flexibase
3.43,-2.71,-13.71,3,4,0, 291.42, 7

Similar to: 6390157,
11050135
 
#24

Scientific Exchange (make on demand): R-019660
Aronis (Make on Request): SYN2007/17453
TimTec Make-on-Demand: OVS21334501
Enamine (Depleted): Z33100606
PubChem: 41794008...6 total

ref: mol2, SDF, SMILES, flexibase
2.98,-3.99,-18.44,3,4,0, 299.399, 7
6489926
 
#25

eMolecules: 3986905
Molport: MolPort-001-626-804
Scientific Exchange (make on demand): M-291194
AKOS: AKOS003321751
Alinda: IVK/4023359...14 total

ref: mol2, SDF, SMILES, flexibase
2.61,-3.57,-19.1,3,5,0, 293.392, 9

Similar to: 7622613,
6262042
 
#26

eMolecules: 3990542
Molport: MolPort-001-586-633
Scientific Exchange (make on demand): M-334429
AKOS: AKOS003311992
Alinda: IVK/4028146...13 total

ref: mol2, SDF, SMILES, flexibase
2.33,-4.15,-21.98,3,5,0, 299.783, 8

Similar to: 7555829,
2550026
 
#27

Scientific Exchange (make on demand): M-336794
AKOS: AKOS003553461
KeyOrganics: MS-10660
Ryan Scientific: 096-48569
Aronis (Make on Request): SYN2007/17447...8 total

ref: mol2, SDF, SMILES, flexibase
2.85,-3.86,-21.06,3,5,0, 315.398, 8
2144265
 
#28

eMolecules: 617331
Scientific Exchange (make on demand): POD_06/0445
AKOS: AKOS000323406
Aldrich CPR: R264067|ALDRICH
Alinda: IVK/1415563...33 total

ref: mol2, SDF, SMILES, flexibase
1.73,5.22,-14.47,3,4,0, 235.312, 6

Similar to: 39249605,
2064525
 
#29

eMolecules: 1081258
Molport: MolPort-001-586-428
Scientific Exchange (make on demand): M-330160
AKOS: AKOS000604340
Alinda: IVK/4037907...19 total

ref: mol2, SDF, SMILES, flexibase
2.51,6.46,-19.67,3,5,0, 344.234, 8

Similar to: 6447897, 7622759,
2582204
 
#30

Molport: MolPort-003-878-946
Scientific Exchange (make on demand): X-088920
KeyOrganics: MS-6831
Mcule: MCULE-8747342016
Rare Chemicals: BGFA0153...11 total

ref: mol2, SDF, SMILES, flexibase
1.36,-3.06,-17.25,3,7,0, 325.39, 9
6819662
 
#31

Scientific Exchange (make on demand): M-348917
Aronis (Make on Request): SYN2007/17429
TimTec Make-on-Demand: OVS21334486
PubChem: 40645194
AKOS (make-on-demand): AKOS003554378...5 total

ref: mol2, SDF, SMILES, flexibase
3.52,-4.62,-21.41,3,5,0, 362.282, 10
2299074
 
#32

eMolecules: 939828
Molport: MolPort-001-579-400
Scientific Exchange (make on demand): M-230659
AKOS: AKOS003312095
Alinda: IVK/1417959...15 total

ref: mol2, SDF, SMILES, flexibase
2.75,-3.81,-19.45,3,5,0, 313.81, 8

Similar to: 7622542,
4694452
 
#33

eMolecules: 6809322
Molport: MolPort-001-565-867
Scientific Exchange (make on demand): M-140456
AKOS: AKOS003292053
Alinda: IBS-L0039027...20 total

ref: mol2, SDF, SMILES, flexibase
2.10,6.55,-19.11,3,5,0, 279.365, 8

Similar to: 7555689,
3098797
 
#34

eMolecules: 3969221
Molport: MolPort-001-586-020
Scientific Exchange (make on demand): M-329628
AKOS: AKOS003344952
Alinda: IVK/4024730...22 total

ref: mol2, SDF, SMILES, flexibase
1.82,5.95,-16.84,3,4,0, 249.339, 7
6819823
 
#35

Scientific Exchange (make on demand): M-338809
Aronis (Make on Request): SYN2007/17418
TimTec Make-on-Demand: OVS21334480
PubChem: 12937915
AKOS (make-on-demand): AKOS000960701...5 total

ref: mol2, SDF, SMILES, flexibase
3.54,-5.26,-13.63,3,4,0, 325.846, 6
6819647
 
#36

Scientific Exchange (make on demand): M-338759
Aronis (Make on Request): SYN2007/17417
TimTec Make-on-Demand: OVS21334479
Enamine (Depleted): Z33100900
PubChem: 40645188...6 total

ref: mol2, SDF, SMILES, flexibase
3.20,-3.54,-15.25,3,4,0, 325.437, 8

Similar to: 7062179, 8301699, 6448186,
6646493
 
#37

eMolecules: 3979793
Molport: MolPort-001-576-735
Scientific Exchange (make on demand): M-190573
AKOS: AKOS003328343
Alinda: IVK/1272782...14 total

ref: mol2, SDF, SMILES, flexibase
1.88,-4.07,-18.93,3,5,0, 279.365, 8

Similar to: 6448162,
6819696
 
#38

Scientific Exchange (make on demand): M-336796
Aronis (Make on Request): SYN2007/17415
TimTec Make-on-Demand: OVS21334478
PubChem: 40645209
AKOS (make-on-demand): AKOS003551043...5 total

ref: mol2, SDF, SMILES, flexibase
2.88,-3.93,-21.83,3,5,0, 315.398, 8
5171612
 
#39

eMolecules: 617457
Molport: MolPort-001-576-737
Scientific Exchange (make on demand): M-190575
AKOS: AKOS003328470
Aldrich CPR: R265179|ALDRICH...16 total

ref: mol2, SDF, SMILES, flexibase
2.37,-4.2,-19.74,3,5,0, 299.783, 8
2180953
 
#40

eMolecules: 3967416
Molport: MolPort-001-577-272
Scientific Exchange (make on demand): M-191197
AKOS: AKOS001756781
Alinda: IBS-C0001357...27 total

ref: mol2, SDF, SMILES, flexibase
1.63,4.26,-12.98,3,4,0, 241.341, 6
5631206
 
#41

eMolecules: 939826, 45797468
Molport: MolPort-003-055-079
Scientific Exchange (make on demand): M-340559
AKOS: AKOS003624654, AKOS002232572
Aldrich CPR: S26965|ALDRICH...24 total

ref: mol2, SDF, SMILES, flexibase
2.98,6.88,-22.11,3,5,0, 334.228, 8

Similar to: 8301610,
2167149
 
#42

eMolecules: 939832
Molport: MolPort-001-537-243
Scientific Exchange (make on demand): Q-033445
AKOS: AKOS003292578
Aldrich CPR: S768812|ALDRICH...19 total

ref: mol2, SDF, SMILES, flexibase
2.36,-3.98,-16.52,3,4,0, 269.757, 6
5725814
 
#43

Scientific Exchange (make on demand): M-331697
Rare Chemicals: BGFGB043
Aronis (Make on Request): SYN2007/17409
TimTec Make-on-Demand: OVS21334476
PubChem: 40558950...6 total

ref: mol2, SDF, SMILES, flexibase
2.40,-4.01,-14.08,3,4,0, 269.757, 6

Similar to: 6447657,
4602749
 
#44

eMolecules: 621287
Molport: MolPort-001-822-507
Scientific Exchange (make on demand): Q-033446
AKOS: AKOS003551183
Aldrich CPR: R339598|ALDRICH...20 total

ref: mol2, SDF, SMILES, flexibase
3.01,-4.13,-15.63,3,4,0, 304.202, 6
5513592
 
#45

eMolecules: 954667
Molport: MolPort-001-019-767
Scientific Exchange (make on demand): Z-041164
AKOS: AKOS003240171
Alinda: IBS-L0031971...22 total

ref: mol2, SDF, SMILES, flexibase
1.78,-3.82,-15.5,3,5,0, 265.338, 7
4618714
 
#46

eMolecules: 3969215
Molport: MolPort-001-577-366
Scientific Exchange (make on demand): M-191319
AKOS: AKOS003327526
Alinda: IVK/1415347...19 total

ref: mol2, SDF, SMILES, flexibase
2.17,-3.54,-14.19,3,4,0, 249.339, 6

Similar to: 39249605,
6218013
 
#47

eMolecules: 3969207
Molport: MolPort-001-626-362
Scientific Exchange (make on demand): M-191315
AKOS: AKOS003327415
Alinda: IVK/1017810...14 total

ref: mol2, SDF, SMILES, flexibase
2.13,-3.61,-13.59,3,4,0, 249.339, 6

Similar to: 15876725,
3071121
 
#48

eMolecules: 617459
Molport: MolPort-001-022-957
Scientific Exchange (make on demand): Z-073661
AKOS: AKOS000371423
Aldrich CPR: R265187|ALDRICH...23 total

ref: mol2, SDF, SMILES, flexibase
1.70,-4.05,-19.36,3,5,0, 265.338, 8
6361744
 
#49

eMolecules: 3973276
Molport: MolPort-001-577-285
Scientific Exchange (make on demand): M-191212
AKOS: AKOS003327000
Alinda: IVK/1415249...14 total

ref: mol2, SDF, SMILES, flexibase
2.34,-4.01,-14.86,3,4,0, 263.366, 8
6819870
 
#50

Scientific Exchange (make on demand): M-336189
Aronis (Make on Request): SYN2007/17401
TimTec Make-on-Demand: OVS21334475
Enamine (Depleted): Z33100899
PubChem: 40645271...6 total

ref: mol2, SDF, SMILES, flexibase
3.52,-3.32,-15.43,3,4,0, 311.41, 7
3071129
 
#51

eMolecules: 1079365
Molport: MolPort-001-579-317
Scientific Exchange (make on demand): M-230544
AKOS: AKOS003313351
Alinda: IVK/1016218...22 total

ref: mol2, SDF, SMILES, flexibase
2.15,-3.54,-14.47,3,4,0, 249.339, 6

Similar to: 41961961,
6527775
 
#52

eMolecules: 3986885
Molport: MolPort-001-581-742
Scientific Exchange (make on demand): M-267106
AKOS: AKOS003331069
Alinda: IVK/4021507...13 total

ref: mol2, SDF, SMILES, flexibase
2.52,-3.4,-19.31,3,5,0, 293.392, 8
2550065
 
#53

eMolecules: 3986889
Molport: MolPort-001-586-601
Scientific Exchange (make on demand): M-333525
AKOS: AKOS003312363
Alinda: IVK/4040162...16 total

ref: mol2, SDF, SMILES, flexibase
2.52,-3.34,-19.03,3,5,0, 293.392, 8

Similar to: 41962359,
6490675
 
#54

eMolecules: 3987918
Molport: MolPort-001-582-231
Scientific Exchange (make on demand): M-272187
AKOS: AKOS003330072
Alinda: IVK/4021849...13 total

ref: mol2, SDF, SMILES, flexibase
1.75,-4.05,-20.94,3,6,0, 295.364, 9

Similar to: 41962201,
7527692
 
#55

Aronis (Make on Request): SYN2007/17387
TimTec Make-on-Demand: OVS21334467
PubChem: 8625984
AKOS (make-on-demand): AKOS003551478
ref: mol2, SDF, SMILES, flexibase
3.73,-0.43,-24.04,3,4,0, 379.407, 8
3078607
 
#56

Scientific Exchange (make on demand): M-785990
Aronis (Make on Request): SYN2007/17362
Otava (Virtual): 10019930
TimTec Make-on-Demand: OVS21334442
PubChem: 21239226...6 total

ref: mol2, SDF, SMILES, flexibase
3.18,-1.71,-11.4,2,2,0, 242.347, 5
7585644
 
#57

Aronis (Make on Request): SYN2007/17332
TimTec Make-on-Demand: OVS21334412
PubChem: 8684078
AKOS (make-on-demand): AKOS000948589
ref: mol2, SDF, SMILES, flexibase
1.71,-1.5,-16.85,2,4,0, 291.42, 8

Similar to: 7585649, 6336650,
6295823
 
#58

Scientific Exchange (make on demand): M-394171
Aronis (Make on Request): SYN2007/17331
TimTec Make-on-Demand: OVS21334411
PubChem: 20408320
AKOS (make-on-demand): AKOS003554289...5 total

ref: mol2, SDF, SMILES, flexibase
1.36,-2.99,-19.66,2,4,0, 289.404, 6

Similar to: 42668016,
7531340
 
#59

Aronis (Make on Request): SYN2007/17327
TimTec Make-on-Demand: OVS21334407
PubChem: 8629327
AKOS (make-on-demand): AKOS003551254
ref: mol2, SDF, SMILES, flexibase
1.69,-1.49,-21.09,2,4,0, 291.42, 8
5333189
 
#60

Aldrich CPR: PH007061|ALDRICH
Aronis (Make on Request): SYN2007/17292
TimTec Make-on-Demand: OVS21334373
PubChem: 24099925
AKOS (make-on-demand): AKOS003551609...5 total

ref: mol2, SDF, SMILES, flexibase
2.40,-1.82,-10.55,2,3,0, 236.34, 7
6295825
 
#61

Scientific Exchange (make on demand): M-402046
Aronis (Make on Request): SYN2007/17270
TimTec Make-on-Demand: OVS21334351
PubChem: 7933008
AKOS (make-on-demand): AKOS003552626...5 total

ref: mol2, SDF, SMILES, flexibase
3.65,-1.67,-13.07,2,3,0, 298.411, 8
6240901
 
#62

AKOS: AKOS003552594
Labotest: LT02088027
TimTec: ST51030306
Aronis (Make on Request): SYN2007/17267
ChemDB: 6526098...6 total

ref: mol2, SDF, SMILES, flexibase
3.49,-1.62,-11.58,2,3,0, 264.394, 9
6847111
 
#63

Scientific Exchange (make on demand): M-853320
Aronis (Make on Request): SYN2007/17259
Otava (Virtual): 10019777
TimTec Make-on-Demand: OVS21334341
ChemDB: 6526581...7 total

ref: mol2, SDF, SMILES, flexibase
2.66,-1.94,-10.81,2,3,0, 256.758, 6
5498637
 
#64

AKOS: AKOS002171862
Aldrich CPR: S674532|ALDRICH
Innovapharm: STT-00042763
NCI Plated 2007: 204238
TimTec: ST50055325...9 total

ref: mol2, SDF, SMILES, flexibase
1.49,2.84,-16.58,3,3,0, 208.286, 5
6488221
 
#65

eMolecules: 3049068
Molport: MolPort-004-256-246
Scientific Exchange (make on demand): M-786854
AKOS: AKOS001048781
Enamine: Z45770627...17 total

ref: mol2, SDF, SMILES, flexibase
3.05,7.09,-11.6,2,2,0, 240.759, 5
hi: mol2, SDF, SMILES, flexibase
3.73,6.79,-39.33,1,2,-1, 239.751, 4
2669150
 
#66

eMolecules: 31298221
Scientific Exchange (make on demand): M-709906
AKOS: AKOS002286302
Innovapharm: STT-00079295
Mcule: MCULE-3921330632...16 total

ref: mol2, SDF, SMILES, flexibase
3.28,6.85,-8.85,2,2,0, 261.177, 5
mid: mol2, SDF, SMILES, flexibase
3.96,6.55,-36.71,1,2,-1, 260.169, 4

Similar to: 6295668,
4678273
 
#67

Scientific Exchange (make on demand): M-785928
AKOS: AKOS003551193
ZereneX Building Blocks: E/4045100
Aronis (Make on Request): SYN2007/17229
Otava (Virtual): 10019999...8 total

ref: mol2, SDF, SMILES, flexibase
1.86,6.89,-9.51,2,2,0, 220.341, 5
3163977
 
#68

eMolecules: 2744738
Molport: MolPort-000-874-392
Scientific Exchange (make on demand): M-614950
AKOS: AKOS002665574
Labotest: LT02088355...20 total

ref: mol2, SDF, SMILES, flexibase
2.11,5.82,-9.01,2,2,0, 210.277, 5
hi: mol2, SDF, SMILES, flexibase
2.79,5.52,-41.05,1,2,-1, 209.269, 4
3161559
 
#69

Molport: MolPort-001-514-239
AKOS: AKOS001109905
Mcule: MCULE-8012263998
Molport BB: MolPort-001-514-239
PBMR Labs Building Blocks: RBK_049388...13 total

ref: mol2, SDF, SMILES, flexibase
2.76,6.28,-12.78,2,2,0, 244.722, 5
hi: mol2, SDF, SMILES, flexibase
3.44,5.88,-32.75,1,2,-1, 243.714, 4
1796569
 
#70

eMolecules: 5313868
Scientific Exchange (make on demand): M-615064
AKOS: AKOS002229214
Innovapharm: STT-00106389
Labotest: LT02088300...16 total

ref: mol2, SDF, SMILES, flexibase
1.59,4.2,-10.03,2,3,0, 196.275, 6

Similar to: 8150055,
5499916
 
#71

Scientific Exchange (make on demand): M-725927
AKOS: AKOS003550952
Aldrich CPR: S743410|ALDRICH
NCI Plated 2007: 204289
TimTec: ST50553098...10 total

ref: mol2, SDF, SMILES, flexibase
2.38,6.07,-13.21,2,3,0, 236.34, 7
2275297
 
#72

eMolecules: 4328600
Scientific Exchange (make on demand): M-137727
AKOS: AKOS002161297
BioBlocks: A4255/0181404
Chemical Block: A4255/0181404...24 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.1,-10.3,2,3,0, 222.313, 6
2995715
 
#73

eMolecules: 2179340
Molport: MolPort-002-227-977
Scientific Exchange (make on demand): M-827523
AKOS: AKOS001047865
American Custom Chemicals Corp.: CHM0294410...21 total

ref: mol2, SDF, SMILES, flexibase
2.79,-1.07,-10.69,2,2,0, 220.341, 5
6855819
 
#74

Scientific Exchange (make on demand): M-830648
AKOS: AKOS002665644
Molport BB: MolPort-000-874-380
PBMR Labs Building Blocks: RBK_054690
ZereneX Building Blocks: E/4045172...11 total

ref: mol2, SDF, SMILES, flexibase
3.25,-2.01,-8.29,2,2,0, 261.177, 5

Similar to: 6295673,
7558685
 
#75

Scientific Exchange (make on demand): M-648940
AKOS: AKOS000963120
Molport BB: MolPort-000-874-382
PBMR Labs Building Blocks: RBK_049382
ZereneX Building Blocks: E/4045092...11 total

ref: mol2, SDF, SMILES, flexibase
3.05,-1.69,-9.33,2,2,0, 240.759, 5
5598693
 
#76

AKOS: AKOS003551297
TimTec: ST51010468
Aronis (Make on Request): SYN2007/17205
ChemDB: 6512768
PubChem: 5192117...5 total

ref: mol2, SDF, SMILES, flexibase
1.81,-7.58,-18.52,3,6,0, 354.482, 8

Similar to: 39968950, 39968951, 39974114, 39974115, 39974116, ... 5 in total.
6262047
 
#77

Scientific Exchange (make on demand): M-573456
AKOS: AKOS003551146
Labotest: LT02087186
TimTec: ST51029962
Aronis (Make on Request): SYN2007/17203...7 total

ref: mol2, SDF, SMILES, flexibase
3.88,-2.15,-8.22,2,2,0, 295.622, 5
7526224
 
#78

Scientific Exchange (make on demand): M-652387
Aronis (Make on Request): SYN2007/17198
TimTec Make-on-Demand: OVS21334291
PubChem: 8624478
AKOS (make-on-demand): AKOS003551578...5 total

ref: mol2, SDF, SMILES, flexibase
1.71,-6.91,-17.45,2,5,0, 325.459, 7

Similar to: 7526230, 7526271, 6331829, 6331834, 7368076, ... 5 in total.
3210926
 
#79

eMolecules: 1200268
Molport: MolPort-001-926-189
Scientific Exchange (make on demand): M-711684
AKOS: AKOS000601697
Asinex: BAS00344451...17 total

ref: mol2, SDF, SMILES, flexibase
2.03,-1.83,-10.77,2,3,0, 222.313, 6

Similar to: 42653535, 43568594,
5377238
 
#80

eMolecules: 4434680
Molport: MolPort-002-564-054
AKOS: AKOS003551825
IBScreen: STOCK2S-32096
Mcule: MCULE-1092200266...17 total

ref: mol2, SDF, SMILES, flexibase
2.34,4.6,-11.37,4,4,0, 295.433, 6

Similar to: 39271352,
16133999
 
#81

eMolecules: 879124, 20310693
Scientific Exchange (make on demand): POD_91/0662
AKOS: AKOS000281968
IBScreen: STOCK1S-26227
Innovapharm: STT-00173872...20 total

ref: mol2, SDF, SMILES, flexibase
3.73,9.61,-12.55,2,4,0, 324.471, 8

Similar to: 33829297, 33829298, 36476217, 40141901, ... 7 in total.
2167525
 
#82

AKOS: AKOS000968935
Aldrich CPR: S718629|ALDRICH
Innovapharm: STT-00183735
Labotest: LT02088845
Mcule: MCULE-9780031311...13 total

ref: mol2, SDF, SMILES, flexibase
1.87,6.1,-12.76,2,3,0, 234.324, 6
2900640
 
#83

eMolecules: 2331252
AKOS: AKOS002232555
ChemBridge: 5134687
Florida Heterocyclic Compounds: 15831
Innovapharm: STT-00135561...25 total

ref: mol2, SDF, SMILES, flexibase
2.33,6.08,-9.42,2,2,0, 206.314, 6
4530196
 
#84

eMolecules: 1198262
Molport: MolPort-001-510-387
Scientific Exchange (make on demand): K-047156
AKOS: AKOS000506475
Aldrich CPR: S42235|ALDRICH...16 total

ref: mol2, SDF, SMILES, flexibase
3.21,-0.5,-10.29,2,4,0, 310.444, 8

Similar to: 5375174, 5870771,
7641429
 
#85

Scientific Exchange (make on demand): M-751634
Aronis (Make on Request): SYN2007/17182
TimTec Make-on-Demand: OVS21334281
PubChem: 8748111
AKOS (make-on-demand): AKOS003551566...5 total

ref: mol2, SDF, SMILES, flexibase
2.83,-0.47,-10.47,2,4,0, 296.417, 7

Similar to: 7967074, 8092124, 5870771,
4176562
 
#86

eMolecules: 1957432
Molport: MolPort-000-872-562
Scientific Exchange (make on demand): X-016866
AKOS: AKOS002663203
BioBlocks: A4206/0179022...22 total

ref: mol2, SDF, SMILES, flexibase
2.44,6.39,-10.6,2,2,0, 206.314, 5
6274934
 
#87

Scientific Exchange (make on demand): M-852672
AKOS: AKOS000969452
Labotest: LT02615894
TimTec: ST51033572
Aronis (Make on Request): SYN2007/17177...9 total

ref: mol2, SDF, SMILES, flexibase
2.04,-1.77,-13.08,2,4,0, 252.339, 7
6483635
 
#88

AKOS: AKOS003552748
Aldrich CPR: S791008|ALDRICH
Alinda: IBS-L0210381
Molport BB: MolPort-003-918-076
NCI Plated 2007: 164319...13 total

ref: mol2, SDF, SMILES, flexibase
3.02,7.07,-13.38,2,2,0, 240.759, 5
2703226
 
#89

eMolecules: 2088723
Scientific Exchange (make on demand): M-747434
AKOS: AKOS000269176
Aldrich CPR: PH010919|ALDRICH
ChemBridge: 5631794...21 total

ref: mol2, SDF, SMILES, flexibase
2.54,-0.74,-14.38,2,4,0, 264.35, 8

Similar to: 7555793,
7522009
 
#90

Scientific Exchange (make on demand): M-689603
AKOS: AKOS003552562
Molport BB: MolPort-006-829-426
PBMR Labs Building Blocks: RBK_056672
ZereneX Building Blocks: E/4045098...9 total

ref: mol2, SDF, SMILES, flexibase
2.82,-1.03,-10.58,2,2,0, 220.341, 5
2994580
 
#91

eMolecules: 2177926
Molport: MolPort-002-227-212
Scientific Exchange (make on demand): M-805831
AKOS: AKOS003552532
ChemBridge: 6884657...18 total

ref: mol2, SDF, SMILES, flexibase
2.82,-1.21,-10.43,2,2,0, 220.341, 5
2461934
 
#92

Scientific Exchange (make on demand): M-770799
AKOS: AKOS001045976
Mcule: MCULE-3952165697
Molport BB: MolPort-002-111-254
PBMR Labs Building Blocks: RBK_049385...15 total

ref: mol2, SDF, SMILES, flexibase
3.28,-2.13,-9.37,2,2,0, 261.177, 5
6238093
 
#93

Scientific Exchange (make on demand): M-802058
AKOS: AKOS003552378
Labotest: LT02087674
TimTec: ST51030159
Aronis (Make on Request): SYN2007/17163...8 total

ref: mol2, SDF, SMILES, flexibase
0.76,2.94,-12.72,4,4,0, 235.312, 6
5552494
 
#94

Scientific Exchange (make on demand): M-650915
AKOS: AKOS003552377
NCI Plated 2007: 204407
ZereneX Building Blocks: E/4045108
Aronis (Make on Request): SYN2007/17162...9 total

ref: mol2, SDF, SMILES, flexibase
2.26,7.41,-14,2,2,0, 234.368, 5

Similar to: 5330660,
2273185
 
#95

eMolecules: 4397636
Scientific Exchange (make on demand): M-317705
AKOS: AKOS000269175
IBScreen: STOCK1S-58903
Innovapharm: STT-00145376...22 total

ref: mol2, SDF, SMILES, flexibase
2.05,-1.83,-12.03,2,3,0, 222.313, 6
7522061
 
#96

Scientific Exchange (make on demand): M-830814
AKOS: AKOS003552350
ZereneX Building Blocks: E/4045244
Aronis (Make on Request): SYN2007/17160
Otava (Virtual): 10019811...8 total

ref: mol2, SDF, SMILES, flexibase
0.69,-8.08,-18.51,4,5,0, 271.367, 6

Similar to: 7522070,
13878986
 
#97

eMolecules: 3130792
Molport: MolPort-004-414-520
Scientific Exchange (make on demand): M-851777
AKOS: AKOS001061946
Chembo Pharma: KB-64841...18 total

ref: mol2, SDF, SMILES, flexibase
0.81,2.48,-18.58,4,4,0, 235.312, 6

Similar to: 6238214,
2994503
 
#98

eMolecules: 2177758
Molport: MolPort-002-227-136
Scientific Exchange (make on demand): M-608010
AKOS: AKOS001367450
Chembo Pharma: KB-64845...19 total

ref: mol2, SDF, SMILES, flexibase
3.75,-1.19,-12.08,2,3,0, 284.384, 7

Similar to: 7523056,
9814685
 
#99

Scientific Exchange (make on demand): F-082227
Aronis (Make on Request): RESYN/48183
TimTec Make-on-Demand: OVS21273039
PubChem: 17097884
AKOS (make-on-demand): AKOS003496454...5 total

ref: mol2, SDF, SMILES, flexibase
2.17,0.51,-17.19,1,7,0, 376.453, 8

Similar to: 9814694, 9814703, 9781889, 9781894, 9781900, ... 7 in total.
7518606
 
#100

Aronis (Make on Request): SYN2007/17155
Otava (Virtual): 10019910
TimTec Make-on-Demand: OVS21334265
PubChem: 8615783
AKOS (make-on-demand): AKOS003571873...5 total

ref: mol2, SDF, SMILES, flexibase
3.98,-2.49,-10.77,3,3,0, 283.4, 7

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 = 80 ) limit 0,100

Smiles were