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2510757
 
#1

ChemMol: 44011731, 1031561
eMolecules: 920373
Acros Organics: CC67423
ACT Chemical BB: ACT05461
AK Scientific: X8652...44 total

ref: mol2, SDF, SMILES, flexibase
1.45,4.65,-5.29,0,3,0, 172.224, 4

Similar to: 34957361, 39381860,
2572545
 
#2

ChemMol: 1031556, 44011243
eMolecules: 504883
Molport: MolPort-001-759-520
Acorn PharmaTech: ACN-S004131
Alinda Building Blocks: ALBB-027732...51 total

ref: mol2, SDF, SMILES, flexibase
0.93,3.08,-5.79,0,3,0, 144.17, 2

Similar to: 34579830,
2510758
 
#3

ChemMol: 97802130, 30109967, 1031538, 44010998
Acros Organics: CC29908
AKOS: AKOS005146251
Aldrich CPR: CDS013754|ALDRICH
Angene Building Blocks: AGN-PC-0KKVBO...52 total

ref: mol2, SDF, SMILES, flexibase
1.81,3.7,-2.26,0,1,0, 179.057, 1
161997
 
#4

ChemMol: 97801435, 44013219
eMolecules: 724740
Acorn PharmaTech: ACN-S003401
Acros Organics: CC29909
ACT Chemical BB: ACT04637...71 total

ref: mol2, SDF, SMILES, flexibase
0.44,-0.25,-3.51,1,2,0, 116.16, 1
2541315
 
#5

ChemMol: 1031563, 44011732
eMolecules: 2796534
Molport: MolPort-001-769-268
AK Scientific: X2950
AKOS: AKOS011671325...33 total

ref: mol2, SDF, SMILES, flexibase
0.71,3.46,-7.26,0,2,0, 125.171, 1
156973
 
#6

ChemMol: 30114426, 44024176, 1201482, 97800198, 96707569, 44001761, 1036216, 2000430
eMolecules: 531016
Acros Organics: SB00736, 12262
ACT Chemical BB: ACT02073
AK Scientific: W7261...146 total

ref: mol2, SDF, SMILES, flexibase
-0.23,3,-61.8,2,3,0, 129.159, 1

Similar to: 38804031,
395662
 
#7

ChemMol: 1031564
eMolecules: 594675
Molport: MolPort-001-769-267
Acros Organics: 13825
AK Scientific: X3066...56 total

ref: mol2, SDF, SMILES, flexibase
0.56,0.12,-4.64,1,2,0, 116.16, 1

Similar to: 2164650, 5211760, 5838414, 5838421, 5841859, ... 17 in total.
3860774
 
#8

ChemMol: 1031564
eMolecules: 594675
Molport: MolPort-001-769-267
TCM Database @ Taiwan: tcm03_005341
Acros Organics: 13825...54 total

ref: mol2, SDF, SMILES, flexibase
0.56,0.12,-4.65,1,2,0, 116.16, 1

Similar to: 5211760, 5838414, 5838421, 5841859, 5841871, ... 17 in total.
164886
 
#9

Alfa-Aesar: A14350
Apollo Scientific: PC3976
Bosche Scientific: F1795
Chemik Building Blocks: CHB83231
Combi-Blocks: AN-1020...10 total

ref: mol2, SDF, SMILES, flexibase
1.51,3.1,-30.15,0,4,-1, 156.092, 1

Similar to: 36047178,
2555149
 
#10

ChemMol: 98001616, 1032273, 1033576, 30103608, 1033863, 44003355, 83600342, 1203488
Molport: MolPort-002-461-683
AK Scientific: R094, V3930
AKOS: AKOS009158959
Alfa-Aesar: H26084...75 total

ref: mol2, SDF, SMILES, flexibase
1.03,-0.4,-4.86,3,2,0, 127.118, 0
2382629
 
#11

eMolecules: 22696094
Molport: MolPort-002-344-529
Scientific Exchange (make on demand): F-393791
AK Scientific: V8518, W6380
Alfa-Aesar: H32885...54 total

ref: mol2, SDF, SMILES, flexibase
1.57,1.75,-4.73,2,2,0, 141.145, 1

Similar to: 32210216,
2382631
 
#12

eMolecules: 23805618, 45475679
Molport: MolPort-002-461-684, MolPort-004-782-025
Scientific Exchange (make on demand): F-393790
AK Scientific: V5603
Alfa-Aesar: H33706...48 total

ref: mol2, SDF, SMILES, flexibase
1.95,2.67,-4.55,2,2,0, 155.172, 2

Similar to: 32102773, 32113820, 36671757, 43472255, 43472257, ... 12 in total.
2382632
 
#13

Molport: MolPort-002-461-685
AK Scientific: V8041
Anward: ANW-41665
Ark Pharm Building Blocks: AK135536
Chembo Pharma: KB-23944...24 total

ref: mol2, SDF, SMILES, flexibase
2.31,0.22,-3.87,2,2,0, 169.199, 2

Similar to: 32102773, 36671757, 43472255, 43472266, 43472401, ... 9 in total.
2527708
 
#14

Molport: MolPort-002-461-686
AK Scientific: 5982AD, V8042
Anward: ANW-42284
Ark Pharm Building Blocks: AK135535
Chembo Pharma: KB-23620...35 total

ref: mol2, SDF, SMILES, flexibase
1.95,2.78,-3.82,2,2,0, 155.172, 2

Similar to: 32122810, 36671755, 36749807, 36765131, 37092200, ... 6 in total.
2382633
 
#15

ChemMol: 44032452
Molport: MolPort-002-461-687
AK Scientific: W5879, V3404
AKOS: AKOS000145920
Angene Building Blocks: AGN-PC-0KZMCP...36 total

ref: mol2, SDF, SMILES, flexibase
2.31,0.33,-3.73,2,2,0, 169.199, 2

Similar to: 36749807, 36765131,
167117
 
#16

ChemMol: 1201962, 30110048, 98001200, 44011155, 97800771, 1031419
eMolecules: 519400
Acorn PharmaTech: ACN-S003893
Acros Organics: TL00351
AK Scientific: N624...71 total

ref: mol2, SDF, SMILES, flexibase
1.74,5.59,-8.15,0,4,0, 166.111, 1

Similar to: 38810387,
2382635
 
#17

ChemMol: 44009985, 1031333, 1202169, 83603262, 98002128
AK Scientific: X2777
Aldrich CPR: PH011764|ALDRICH
Alfa-Aesar: H32756
Angene Building Blocks: AGN-PC-0KZME1...38 total

ref: mol2, SDF, SMILES, flexibase
1.74,5.37,-10.54,0,4,0, 166.111, 1

Similar to: 34626283,
2382636
 
#18

ChemMol: 44010876, 98002129, 97801756, 1031423, 30117309
Acorn PharmaTech: ACN-S003955
AK Scientific: X8535
Aldrich CPR: CDS004724|ALDRICH
Alfa-Aesar: H32391...53 total

ref: mol2, SDF, SMILES, flexibase
1.74,5.58,-10.62,0,4,0, 166.111, 1
hi: mol2, SDF, SMILES, flexibase
-0.20,0.12,-97.27,6,11,2, 409.454, 5
3880152
 
#19

ChemMol: 98001511, 97800937, 44001220, 1034445, 30110042, 1200448
Acorn PharmaTech: ACN-S003958
Aldrich CPR: CDS004210|ALDRICH
Alfa-Aesar: B20256
Angene Building Blocks: AGN-PC-0JMTSC...56 total

ref: mol2, SDF, SMILES, flexibase
2.68,5.42,-6.27,0,1,0, 189.111, 1
164503
 
#20

ChemMol: 1031382, 44001756, 30101333
eMolecules: 481005
Acorn PharmaTech: ACN-S003979
AKOS: AKOS000120915
Alfa-Aesar: B24287...70 total

ref: mol2, SDF, SMILES, flexibase
2.26,2.88,-7.32,0,4,0, 182.566, 1
4272187
 
#21

ChemMol: 83603551
eMolecules: 725930
Molport: MolPort-001-762-107
Scientific Exchange Building Blocks: F-435452
AK Scientific: V7891...44 total

ref: mol2, SDF, SMILES, flexibase
2.49,-0.36,-4.82,2,4,0, 231.049, 1

Similar to: 34386125, 34623236,
140295
 
#22

ChemMol: 1031408, 44008947, 1200422, 1031435, 30110061, 97806514, 98000956
eMolecules: 516132
Acorn PharmaTech: ACN-S004574
Acros Organics: 38074
AK Scientific: N614...61 total

ref: mol2, SDF, SMILES, flexibase
2.84,2.36,-7.4,0,1,0, 247.01, 0
37781
 
#23

eMolecules: 45475704
Molport: MolPort-001-521-959
Scientific Exchange (make on demand): E-087088
AK Scientific: V4981
AKOS: AKOS000424176...32 total

ref: mol2, SDF, SMILES, flexibase
2.94,2.07,-7.32,0,4,0, 201.609, 3

Similar to: 38526256,
2516094
 
#24

ChemMol: 97806552, 44004836, 1200467, 98001405, 1031352, 30109275
Acorn PharmaTech: ACN-S003799
AK Scientific: V0078
Alfa-Aesar: H26170
Angene Building Blocks: AGN-PC-0KKL1W...49 total

ref: mol2, SDF, SMILES, flexibase
1.27,2.86,-6.09,2,2,0, 136.129, 0
156607
 
#25

ChemMol: 44012275, 1031400, 30110068
eMolecules: 889282
Acorn PharmaTech: ACN-S004016
AK Scientific: R199
Alfa-Aesar: L07035...50 total

ref: mol2, SDF, SMILES, flexibase
1.84,5.57,-11.24,0,4,0, 184.101, 1
158134
 
#26

ChemMol: 1031720, 44003453, 98001407, 1200506, 97800912, 30103628
eMolecules: 513882
Acorn PharmaTech: ACN-S004051
Acros Organics: 39887
AK Scientific: Q484...74 total

ref: mol2, SDF, SMILES, flexibase
2.08,2.21,-51.29,0,5,-1, 184.102, 2
1609488
 
#27

ChemMol: 1201205, 30114985, 98000552, 1035491, 44003362
AK Scientific: S400
AKOS: AKOS005145650
Aldrich CPR: CDS003861|ALDRICH
Alfa-Aesar: H63317...59 total

ref: mol2, SDF, SMILES, flexibase
2.44,2.69,-9.26,0,3,0, 155.128, 1

Similar to: 34427549,
2379824
 
#28

ChemMol: 1037487, 30109807
Molport: MolPort-000-861-486
AK Scientific: Q221
AKOS: AKOS015856537
Angene Building Blocks: AGN-PC-0JSEY6...43 total

ref: mol2, SDF, SMILES, flexibase
1.22,1.38,-10.02,1,4,0, 182.175, 3

Similar to: 39223589, 32312, 155425, 157150, ... 4 in total.
155425
 
#29

ChemMol: 83603033, 1037500
AKOS: AKOS009156386
Angene Building Blocks: AGN-PC-0JL97U
Anward: ANW-35963
Ark Pharm Building Blocks: AK111130...40 total

ref: mol2, SDF, SMILES, flexibase
1.69,1.51,-8.14,1,4,0, 182.175, 3

Similar to: 2379824, 32312,
2584514
 
#30

AK Scientific: V6523
AKOS: AKOS000295502
Angene Building Blocks: AGN-PC-0JMT33
Anward: ANW-32052
Ark Pharm Building Blocks: AK112885...23 total

ref: mol2, SDF, SMILES, flexibase
2.39,1.34,-8.57,0,2,0, 184.622, 4
152328
 
#31

Alfa-Aesar: B22098
Chemik Building Blocks: CHH01500
Combi-Blocks: BK-4501
Fluorochem: 018016
Focus Synthesis BB: FS000027...8 total

ref: mol2, SDF, SMILES, flexibase
0.74,1.3,-28.09,3,2,1, 129.57, 0
164466
 
#32

ChemMol: 44008214, 1031199, 30100200, 97806467, 1031528, 1201334
eMolecules: 476708
Molport: MolPort-000-000-460
Scientific Exchange (make on demand): M-101255
Acros Organics: 10342...103 total

ref: mol2, SDF, SMILES, flexibase
1.15,1.11,-5.62,2,2,0, 128.562, 0

Similar to: 39051799,
2583407
 
#33

ChemMol: 1035655, 2001080, 96701206, 44013839
Acorn PharmaTech: ACN-S004631, ACN-S004385
AK Scientific: Z7398
AKOS: AKOS015853507
Angene Building Blocks: AGN-PC-0KKZBF...41 total

ref: mol2, SDF, SMILES, flexibase
2.13,1.2,-7.4,0,1,0, 161.179, 0
lo: mol2, SDF, SMILES, flexibase
2.13,1.26,-29.37,1,1,1, 162.187, 0

Similar to: 1526712,
164626
 
#34

ChemMol: 30106544, 1031754, 98000990, 30100629, 1200540, 44000945, 96707653
AK Scientific: Z1833
AKOS: AKOS015995321
Alfa-Aesar: A14193
Angene Building Blocks: AGN-PC-0JS9W3...81 total

ref: mol2, SDF, SMILES, flexibase
1.86,4.27,-42.31,0,2,-1, 175.085, 1

Similar to: 164939, 2022417, 2579167,
1845704
 
#35

ChemMol: 98001215, 44000243, 1035763, 1202051, 30100186
Alfa-Aesar: A16313
Anward: ANW-36969
APIChem: AC-10203
Apollo Scientific: PC7789...50 total

ref: mol2, SDF, SMILES, flexibase
2.24,3.84,-8.4,0,3,0, 177.081, 1
75328
 
#36

eMolecules: 520822
Scientific Exchange: LK-56
Scientific Exchange (make on demand): M-317683
Acros Organics: 35513
AK Scientific: N691...54 total

ref: mol2, SDF, SMILES, flexibase
1.62,2.66,-9.98,0,2,0, 235.102, 1

Similar to: 34538919,
154100
 
#37

ChemMol: 2100607, 97801268, 44001779, 1201344, 30109136
eMolecules: 519863
Alfa-Aesar: L19858
Angene Building Blocks: AGN-PC-0JT1BZ
Anward: ANW-27593...79 total

ref: mol2, SDF, SMILES, flexibase
1.42,3.56,-5.86,0,2,0, 138.557, 0
1081357
 
#38

ChemMol: 30103023, 83601722, 44003017, 2000051, 1200573, 96707726, 98001399, 97806550
Acorn PharmaTech: ACN-S004266
AK Scientific: L204
AKOS: AKOS001286432
Alfa-Aesar: L19321...65 total

ref: mol2, SDF, SMILES, flexibase
2.41,0.78,-42.37,0,2,-1, 218.001, 1

Similar to: 38263830, 39953642, 39953643,
389627
 
#39

ChemMol: 30100802, 97800773, 1031731, 1200570, 44008836, 98001170
eMolecules: 499564
Acorn PharmaTech: ACN-S004076
Acros Organics: 39770
AKOS: AKOS005530693...78 total

ref: mol2, SDF, SMILES, flexibase
2.75,0.75,-42.25,0,2,-1, 218.001, 1

Similar to: 38263830,
403961
 
#40

ChemMol: 98001974, 30103644, 1200568, 44003466, 1031781, 97806595
eMolecules: 518493
Acorn PharmaTech: ACN-S004347
Acros Organics: 44251
AKOS: AKOS001274850...70 total

ref: mol2, SDF, SMILES, flexibase
2.28,1.28,-49.61,0,2,-1, 173.55, 1

Similar to: 34607297,
388444
 
#41

ChemMol: 1031925, 30110170, 44008331, 98000195, 1202193, 97806452
Molport: MolPort-001-759-143
Scientific Exchange (make on demand): Z-008554
Acorn PharmaTech: ACN-S002037
AKOS: AKOS000119557...76 total

ref: mol2, SDF, SMILES, flexibase
2.93,-0.15,-46.19,0,2,-1, 234.456, 1

Similar to: 34465090,
167018
 
#42

ChemMol: 1031745, 83601127, 1200534, 44000467, 30100325, 96707643, 97806505, 98000937
eMolecules: 493145
AK Scientific: X2823
AKOS: AKOS015995318
Alfa-Aesar: A13403...101 total

ref: mol2, SDF, SMILES, flexibase
1.77,4.22,-46.27,0,2,-1, 157.095, 1
404062
 
#43

ChemMol: 1200645, 30110143, 83600896, 1031842, 44008863, 98001745
eMolecules: 519467
Acorn PharmaTech: ACN-S003571
Acros Organics: 44189
AK Scientific: R206...76 total

ref: mol2, SDF, SMILES, flexibase
1.72,1.36,-46.04,1,3,-1, 155.104, 1

Similar to: 39128123,
167449
 
#44

ChemMol: 96708266, 98002890, 83600888, 1031805, 44007187, 30110505, 97801825
eMolecules: 909415
Acorn PharmaTech: ACN-S004099
ACT Chemical BB: ACT00820
AK Scientific: N647...70 total

ref: mol2, SDF, SMILES, flexibase
1.90,4.81,-37.67,0,5,-1, 184.102, 2
409276
 
#45

ChemMol: 30101283, 97806500, 1200537, 44008827, 1031829, 98000878
eMolecules: 495084
AK Scientific: 7506AB
AKOS: AKOS015995320
Alfa-Aesar: A17033...81 total

ref: mol2, SDF, SMILES, flexibase
2.10,2.26,-41.85,0,2,-1, 157.095, 1

Similar to: 34475717, 39953720,
332946
 
#46

ChemMol: 44001835, 96706413, 30109121, 97801306, 51500648
eMolecules: 728817
Molport: MolPort-000-002-963
A&J Pharmtech: AJ-01030
Acorn PharmaTech: ACN-S004097...109 total

ref: mol2, SDF, SMILES, flexibase
1.36,2.82,-49.85,0,3,-1, 156.548, 1

Similar to: 34454691,
151256
 
#47

ChemMol: 1203134, 1032581, 2100821, 42307058, 97802115, 30104158, 44003779, 96705628
eMolecules: 833805
Molport: MolPort-000-002-358
Acorn PharmaTech: ACN-S004073
AKOS: AKOS000270390...84 total

ref: mol2, SDF, SMILES, flexibase
1.49,3.9,-47.74,0,3,-1, 200.999, 1
166657
 
#48

ChemMol: 30104723, 1201347, 1032498, 44004205, 2100608, 97801307
eMolecules: 519365
Molport: MolPort-000-002-968
Acros Organics: SPB06649, 39779
AKOS: AKOS001177390...97 total

ref: mol2, SDF, SMILES, flexibase
1.58,3.72,-40.57,0,3,-1, 156.548, 1
336011
 
#49

ChemMol: 1033165, 30112907, 83602547, 44009429, 96706520
eMolecules: 728883
Molport: MolPort-001-760-869
A&J Pharmtech: AJ-01067
Acros Organics: 44241...86 total

ref: mol2, SDF, SMILES, flexibase
0.96,0.83,-45.73,0,4,-1, 152.129, 2
334127
 
#50

ChemMol: 30106585, 44005432, 97800337, 83603524
eMolecules: 477021
Molport: MolPort-000-000-765
Scientific Exchange (make on demand): F-249394
Acros Organics: 20254...113 total

ref: mol2, SDF, SMILES, flexibase
0.10,2.49,-44.25,3,4,0, 138.126, 1
mid: mol2, SDF, SMILES, flexibase
0.10,2.02,-47.77,2,4,-1, 137.118, 1
334031
 
#51

ChemMol: 44003877, 30104314, 1201701, 51500111, 97801789
Molport: MolPort-000-002-383
Acorn PharmaTech: ACN-S004074
Acros Organics: 43540
ACT Chemical BB: ACT04951...82 total

ref: mol2, SDF, SMILES, flexibase
1.42,2.85,-42.06,0,3,-1, 200.999, 1

Similar to: 39340756,
334037
 
#52

ChemMol: 44013245, 97804652
AK Scientific: W4471
Angene Building Blocks: AGN-PC-0JQZSV
Anward: ANW-24489
Ark Pharm Building Blocks: AK-90371...47 total

ref: mol2, SDF, SMILES, flexibase
-0.17,2.68,-57.99,1,5,-1, 179.155, 2

Similar to: 39383914,
164425
 
#53

ChemMol: 30100103, 44008665, 1032496, 51500596, 1201346, 83602096, 97800305
eMolecules: 482646
Acorn PharmaTech: ACN-S002218
Acros Organics: 40486
Alfa-Aesar: H63669...111 total

ref: mol2, SDF, SMILES, flexibase
1.24,3.61,-45.83,0,3,-1, 156.548, 1
96049
 
#54

ChemMol: 44028704, 97801082
eMolecules: 525295
Scientific Exchange (make on demand): R-063287
Acorn PharmaTech: ACN-S004171
Acros Organics: KM01841...74 total

ref: mol2, SDF, SMILES, flexibase
0.62,1.62,-53.56,0,4,-1, 152.129, 2
332673
 
#55

APIChem: AC-2839
Asinex Building Blocks: BAS01947666
Bosche Scientific: H2614
ChemDiv BuildingBlocks: BB01-2808
Chemik Building Blocks: CHH00581...19 total

ref: mol2, SDF, SMILES, flexibase
0.20,-0.52,-46.1,1,4,-1, 138.102, 1

Similar to: 39128305, 40165650,
967308
 
#56

ChemMol: 42307004, 96707824, 97801107, 30103939, 51500792, 44003633
eMolecules: 717465
Molport: MolPort-002-537-411, MolPort-000-001-322
Scientific Exchange (make on demand): R-063398
Acros Organics: 36114...111 total

ref: mol2, SDF, SMILES, flexibase
-0.10,1.15,-46.94,2,4,-1, 137.118, 1
lo: mol2, SDF, SMILES, flexibase
-0.10,1.6,-44.3,3,4,0, 138.126, 1
39490
 
#57

ChemMol: 51501045, 30106576, 96707628, 44005427, 97800485, 1201341
eMolecules: 485160
Molport: MolPort-000-002-379
Scientific Exchange (make on demand): R-063286
Acorn PharmaTech: ACN-S002222...110 total

ref: mol2, SDF, SMILES, flexibase
1.23,3.89,-40.41,0,3,-1, 200.999, 1

Similar to: 32253009,
333065
 
#58

ChemMol: 96707999, 1201378, 44003730, 97801383, 51500819, 30104071
eMolecules: 717463
Acorn PharmaTech: ACN-S004170
Acros Organics: MAY00123, 36113
ACT Chemical BB: ACT02435...96 total

ref: mol2, SDF, SMILES, flexibase
-0.32,0.71,-43.71,3,4,0, 138.126, 1
407107
 
#59

ChemMol: 30105784, 98000190, 1200552, 44003342, 1032071
eMolecules: 491633
Scientific Exchange (make on demand): POD_02/0882
AK Scientific: W6704
AKOS: AKOS015995374...85 total

ref: mol2, SDF, SMILES, flexibase
1.77,4.21,-49.86,0,2,-1, 157.095, 1
137205
 
#60

eMolecules: 720756
Scientific Exchange (make on demand): X-017168
Acros Organics: CD01521
AK Scientific: 8947AE
AKOS: AKOS001326352...60 total

ref: mol2, SDF, SMILES, flexibase
0.90,5.61,-51.24,0,7,-1, 240.191, 5

Similar to: 32190583, 34444791, 34543908, 34605141, 44199117, ... 5 in total.
265814
 
#61

ChemMol: 1032082
eMolecules: 2796864
Molport: MolPort-001-772-781
AK Scientific: W8651
Alinda Building Blocks: ALBB-006613...48 total

ref: mol2, SDF, SMILES, flexibase
1.65,4.87,-53.75,0,5,-1, 202.092, 2

Similar to: 34580881,
161933
 
#62

eMolecules: 984240
Molport: MolPort-001-027-845
Scientific Exchange (make on demand): X-017167
AK Scientific: V3791
AKOS: AKOS000265311...42 total

ref: mol2, SDF, SMILES, flexibase
1.44,5.18,-13.56,0,6,0, 222.2, 4

Similar to: 34562633,
331098
 
#63

ChemMol: 96706420, 44003867, 30104303
Scientific Exchange (make on demand): H-047076
A&J Pharmtech: AJ-01111
Adesis: 2-336
AK Scientific: Y9356...49 total

ref: mol2, SDF, SMILES, flexibase
0.66,3.74,-12.77,1,3,0, 150.181, 1
lo: mol2, SDF, SMILES, flexibase
0.66,3.5,-26.61,2,3,1, 151.189, 1

Similar to: 34016823, 34542479, 39126143,
3883973
 
#64

ChemMol: 44008683, 1032582, 42307052
eMolecules: 528255
Acorn PharmaTech: ACN-S004331
AK Scientific: U484
AKOS: AKOS001427853...70 total

ref: mol2, SDF, SMILES, flexibase
1.84,3.82,-6.59,0,3,0, 171.583, 2
1081497
 
#65

ChemMol: 1031724, 97801194, 44003019, 1200571, 98001762, 30103025
Acorn PharmaTech: ACN-S004035
AKOS: AKOS001274724
Alfa-Aesar: B20118
Angene Building Blocks: AGN-PC-0JON9E...66 total

ref: mol2, SDF, SMILES, flexibase
2.41,0.67,-46.66,0,2,-1, 218.001, 1
2540362
 
#66

ChemMol: 44015064, 97802281
Acorn PharmaTech: ACN-S004195
AK Scientific: V7890
AKOS: AKOS015834199
Aldrich CPR: CDS003764|ALDRICH...36 total

ref: mol2, SDF, SMILES, flexibase
3.01,2.3,-4.44,0,2,0, 233.036, 2
337474
 
#67

ChemMol: 51501470, 97802258, 1033201, 96706522, 44028564, 30110524, 1033134, 96706550, 44008501
eMolecules: 728726
Molport: MolPort-000-002-969, MolPort-000-860-543
A&J Pharmtech: AJ-01107, AJ-00969
Acorn PharmaTech: ACN-S004096...126 total

ref: mol2, SDF, SMILES, flexibase
1.62,3.85,-6.57,0,3,0, 171.583, 2
2149906
 
#68

ChemMol: 30111509, 44028612, 83603027, 97801076
eMolecules: 501516
Molport: MolPort-001-764-387
Scientific Exchange (make on demand): F-182664
Acorn PharmaTech: ACN-000016...62 total

ref: mol2, SDF, SMILES, flexibase
2.08,2.94,-9.2,0,5,0, 195.174, 3

Similar to: 34568428,
1504246
 
#69

ChemMol: 44015692, 98002860, 97806575
eMolecules: 909325
Scientific Exchange Building Blocks: F-434771
Acorn PharmaTech: ACN-S004015
AK Scientific: X4275...50 total

ref: mol2, SDF, SMILES, flexibase
1.84,4.27,-7.07,0,2,0, 151.14, 1

Similar to: 34836626, 36886782, 36886802, 36886808, 36886819, ... 22 in total.
330875
 
#70

ChemMol: 1033124, 44005430, 2100719, 42307059, 97804748, 1203132, 30106582, 51500722
eMolecules: 887202
Molport: MolPort-000-002-377
Acorn PharmaTech: ACN-S004082
Acros Organics: 39399...97 total

ref: mol2, SDF, SMILES, flexibase
1.32,3.9,-45.6,0,3,-1, 200.999, 1
2526709
 
#71

ChemMol: 44006500, 30108585, 1203131
Molport: MolPort-001-760-373
AK Scientific: N160
Aldrich CPR: CDS003613|ALDRICH
Alfa-Aesar: B25415...55 total

ref: mol2, SDF, SMILES, flexibase
1.58,3.95,-5.34,0,3,0, 216.034, 2
494966
 
#72

ChemMol: 1033133, 44009421, 51501061, 96706435, 30115417
eMolecules: 728931
Molport: MolPort-001-769-292
A&J Pharmtech: AJ-01092
Acorn PharmaTech: ACN-S004201...61 total

ref: mol2, SDF, SMILES, flexibase
0.60,0.06,-7.2,2,3,0, 156.572, 1
71423
 
#73

ChemMol: 97806530, 44003880, 30104318
eMolecules: 717183
Acorn PharmaTech: ACN-S004298
AKOS: AKOS000265047
Aldrich CPR: CDS003122|ALDRICH...82 total

ref: mol2, SDF, SMILES, flexibase
1.86,4.92,-4.34,0,3,0, 230.061, 3

Similar to: 25368314, 34462432,
331852
 
#74

eMolecules: 478120
Acros Organics: 14810
Alfa-Aesar: A14887
Anward: ANW-21336
Apexmol Building Blocks: AM20061674...53 total

ref: mol2, SDF, SMILES, flexibase
0.73,3.51,-47.46,0,5,-1, 139.09, 1
mid: mol2, SDF, SMILES, flexibase
0.73,2.54,-14.92,1,5,0, 140.098, 1
lo: mol2, SDF, SMILES, flexibase
0.73,2.76,-43.8,2,5,1, 141.106, 1
lo: mol2, SDF, SMILES, flexibase
0.73,3.82,-36.6,1,5,0, 140.098, 1

Similar to: 39123517,
331618
 
#75

ChemMol: 30101688, 1201408, 44002154, 97806469
eMolecules: 476714
A&J Pharmtech: AJ-02748
Acros Organics: 36133
AKOS: AKOS000121100...92 total

ref: mol2, SDF, SMILES, flexibase
1.37,1.04,-5.6,2,2,0, 128.562, 0
403318
 
#76

ChemMol: 44003993, 1203005, 97804873, 30104428, 30115658
Acorn PharmaTech: ACN-S002794
Acros Organics: 37688
ACT Chemical BB: ACT01474
AKOS: AKOS005145726...77 total

ref: mol2, SDF, SMILES, flexibase
2.07,-1.28,-3.2,0,2,0, 188.024, 1
lo: mol2, SDF, SMILES, flexibase
2.07,-0.71,-29.22,1,2,1, 189.032, 1
369400
 
#77

ChemMol: 97801523, 1201705, 44003669, 30103989
eMolecules: 522547
Acorn PharmaTech: ACN-S002053
Acros Organics: 36594
ACT Chemical BB: ACT01445...69 total

ref: mol2, SDF, SMILES, flexibase
3.10,-1.45,-2.71,0,1,0, 283.894, 0
166496
 
#78

ChemMol: 30104412, 44003969, 96700642, 97801066
Acorn PharmaTech: ACN-S001339
Acros Organics: 39839
Alfa-Aesar: A13291
Angene Building Blocks: AGN-PC-0LNIEJ...64 total

ref: mol2, SDF, SMILES, flexibase
1.48,3.55,-5.79,0,2,0, 138.557, 0

Similar to: 34588931,
330869
 
#79

ChemMol: 44003874, 83603050, 97801380, 1201707, 30104311
eMolecules: 526153
A&J Pharmtech: AJ-02598
ACT Chemical BB: ACT01653
Alfa-Aesar: L19621...79 total

ref: mol2, SDF, SMILES, flexibase
1.50,3.63,-5.54,0,2,0, 183.008, 0
lo: mol2, SDF, SMILES, flexibase
1.50,3.9,-36.38,1,2,1, 184.016, 0
330752
 
#80

ChemMol: 44003970, 1201711, 30104413
Acorn PharmaTech: ACN-S003316
Aldrich CPR: CDS003979|ALDRICH
Alfa-Aesar: H61138
Angene Building Blocks: AGN-PC-0JWHTP...61 total

ref: mol2, SDF, SMILES, flexibase
3.30,-0.79,-2.35,0,1,0, 226.888, 0
1688074
 
#81

AK Scientific: Y9841
AKOS: AKOS009019750
Angene Building Blocks: AGN-PC-0JMQEP
Anward: ANW-35675
Apexmol Building Blocks: AM804239...29 total

ref: mol2, SDF, SMILES, flexibase
2.67,2.34,-5.16,0,2,0, 233.036, 2

Similar to: 34440147,
334926
 
#82

ACB Blocks: MIX-0152
APIChem: AC-5954
Bosche Scientific: H14882
Combi-Blocks: CA-4311
Life Chemicals: F2124-0959...10 total

ref: mol2, SDF, SMILES, flexibase
0.29,-0.53,-52.54,1,4,-1, 138.102, 1

Similar to: 6382813,
13086327
 
#83

ChemMol: 30104316, 97806627, 44033057
eMolecules: 2728152
Acros Organics: BTB12129
AK Scientific: Y6874
AKOS: AKOS015856443...75 total

ref: mol2, SDF, SMILES, flexibase
0.88,3.6,-54.42,1,5,-1, 196.182, 3
1427060
 
#84

ChemMol: 1031532, 30106590, 1031203, 97801735, 44005435, 1203182
Molport: MolPort-000-001-319
Acorn PharmaTech: ACN-S003650
Acros Organics: 36061
ACT Chemical BB: ACT05519...70 total

ref: mol2, SDF, SMILES, flexibase
1.50,1.11,-5.49,2,2,0, 173.013, 0
mid: mol2, SDF, SMILES, flexibase
1.50,1.38,-28.1,3,2,1, 174.021, 0
2598026
 
#85

ChemMol: 30104018, 1201696, 44026042, 97806628
eMolecules: 906834
Aldrich CPR: CDS006192|ALDRICH
Alfa-Aesar: H32633
Angene Building Blocks: AGN-PC-0KK7VD...47 total

ref: mol2, SDF, SMILES, flexibase
2.17,3.09,-7.46,0,1,0, 165.089, 1
77849
 
#86

ChemMol: 30103727, 44003519, 96707912, 97801257
eMolecules: 527342
Acorn PharmaTech: ACN-S004164
Acros Organics: RF04619
Alfa-Aesar: B20908...76 total

ref: mol2, SDF, SMILES, flexibase
1.49,3.99,-4.68,0,3,0, 216.034, 2
2513866
 
#87

ChemMol: 97802175, 51500688, 1203217, 30102139, 44002466
eMolecules: 526687
Molport: MolPort-000-002-960
Acros Organics: 43480
ACT Chemical BB: ACT01496...68 total

ref: mol2, SDF, SMILES, flexibase
2.48,-0.63,-3.33,0,1,0, 192.443, 0
331001
 
#88

ChemMol: 30106579, 44028127, 1032851, 1201706
Acorn PharmaTech: ACN-S002793
Alfa-Aesar: H27197
Angene Building Blocks: AGN-PC-0JWHWX
Anward: ANW-32414...59 total

ref: mol2, SDF, SMILES, flexibase
2.45,-1.29,-3.08,0,2,0, 202.051, 2
lo: mol2, SDF, SMILES, flexibase
2.45,-0.7,-29.16,1,2,1, 203.059, 2
2515993
 
#89

eMolecules: 8049363
Molport: MolPort-001-769-266
Scientific Exchange (make on demand): M-697187
AK Scientific: V9476
AKOS: AKOS015835211...23 total

ref: mol2, SDF, SMILES, flexibase
1.50,-2.64,-14.53,0,5,0, 280.099, 2

Similar to: 39320966,
120279
 
#90

ChemMol: 42305303, 30100320, 44010909, 1201499, 97800252, 1031580, 83603519
eMolecules: 486364
Scientific Exchange (make on demand): POD_07/0953
Acros Organics: 30572
AKOS: AKOS000113252...79 total

ref: mol2, SDF, SMILES, flexibase
2.36,-0.04,-6.5,0,1,0, 191.049, 1
166959
 
#91

ChemMol: 30106254, 1031582, 44005238, 97800946
eMolecules: 498703
ACB Blocks: MIX-0835
Acorn PharmaTech: ACN-S001385
ACT Chemical BB: ACT02266...81 total

ref: mol2, SDF, SMILES, flexibase
2.91,0.02,-2.38,0,0,0, 177.066, 0

Similar to: 34346377,
4244878
 
#92

ChemMol: 1036042, 97801759
Molport: MolPort-000-883-319
Acorn PharmaTech: ACN-S001952, ACN-S003134
Acros Organics: 45432
AK Scientific: H316...60 total

ref: mol2, SDF, SMILES, flexibase
1.13,3.06,-4.9,1,2,0, 193.975, 0
ref: mol2, SDF, SMILES, flexibase
1.13,3.05,-6.81,1,2,0, 193.975, 0
mid: mol2, SDF, SMILES, flexibase
1.13,3.55,-34.23,2,2,1, 194.983, 0
4262624
 
#93

ChemMol: 44006800, 1036116
AK Scientific: V1379
AKOS: AKOS003617905
Angene Building Blocks: AGN-PC-0JLBMQ
Anward: ANW-22722...31 total

ref: mol2, SDF, SMILES, flexibase
3.74,-3.84,-3.29,1,2,0, 445.767, 0
2382639
 
#94

ChemMol: 44006958, 30111671, 97804935, 1036046
Acorn PharmaTech: ACN-C000893
AK Scientific: H317, V8393
AKOS: AKOS015906527
Angene Building Blocks: AGN-PC-0KKVGC...61 total

ref: mol2, SDF, SMILES, flexibase
1.20,4.75,-6.88,0,2,0, 208.002, 0
mid: mol2, SDF, SMILES, flexibase
1.20,5.27,-31.31,1,2,1, 209.01, 0
1095289
 
#95

ChemMol: 1036071
Acorn PharmaTech: ACN-P000953
AK Scientific: W8067
AKOS: AKOS015850843
Alfa-Aesar: H56932...41 total

ref: mol2, SDF, SMILES, flexibase
1.20,4.72,-5.43,0,2,0, 208.002, 0
mid: mol2, SDF, SMILES, flexibase
1.20,5.24,-32.9,1,2,1, 209.01, 0
158990
 
#96

CCP W191G binders: MFCD00030439
ChemMol: 96705394, 1036047, 44010478, 30117319
A&J Pharmtech: AJ-00371
Acorn PharmaTech: ACN-C000850
Acros Organics: CC23604...67 total

ref: mol2, SDF, SMILES, flexibase
-0.82,3.35,-10.72,0,3,0, 110.116, 1
mid: mol2, SDF, SMILES, flexibase
-0.82,3.82,-37.93,1,3,1, 111.124, 1
2566818
 
#97

ChemMol: 44011022, 1202869, 83602952, 30115246
eMolecules: 728087
AK Scientific: W5536
Alfa-Aesar: H64028
Alinda Building Blocks: ALBB-004689...59 total

ref: mol2, SDF, SMILES, flexibase
0.90,1.3,-6.24,0,2,0, 113.141, 1
2577851
 
#98

ChemMol: 30112815, 44011021, 97804993
AK Scientific: S055
AKOS: AKOS005146055
Alfa-Aesar: H60138
Alinda Building Blocks: ALBB-015207...66 total

ref: mol2, SDF, SMILES, flexibase
0.90,1.57,-8.36,0,2,0, 113.141, 1
967314
 
#99

ChemMol: 1035982, 30112902, 44012323
Acros Organics: 16164
ACT Chemical BB: ACT07502
AK Scientific: N581
AKOS: AKOS015835021...54 total

ref: mol2, SDF, SMILES, flexibase
2.92,2.87,-3.73,1,2,0, 304.767, 0
1437392
 
#100

ChemMol: 1036051
Molport: MolPort-000-001-615
Acros Organics: 38104
Angene Building Blocks: AGN-PC-0K6AIH
Anward: ANW-14237...47 total

ref: mol2, SDF, SMILES, flexibase
0.93,4.29,-5.64,0,2,0, 161.002, 0
mid: mol2, SDF, SMILES, flexibase
0.93,4.8,-33.01,1,2,1, 162.01, 0

Old detail retrieval took 1 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 = 58 ) limit 0,100

Smiles were