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40844990
 
#1

ChemMol: 30112652
APIChem: AC-7893
Ark Pharm Building Blocks: AK135451
Chembo Pharma: KB-79271
PubChem: 53486395...5 total

ref: mol2, SDF, SMILES, flexibase
3.72,7.73,-48.96,1,7,-1, 322.337, 10

Similar to: 2585953, 36377618, 36446299, 36453913, 36453914, ... 19 in total.
40844989
 
#2

ChemMol: 30112650
APIChem: AC-7895
Ark Pharm Building Blocks: AK-63178
Capot Chemical: 18092
Chembo Pharma: KB-79270...8 total

ref: mol2, SDF, SMILES, flexibase
3.84,4.46,-9.25,2,6,0, 309.362, 10

Similar to: 36377618, 36446299, 36453913, 36453914, 36461865, ... 27 in total.
40844988
 
#3

ChemMol: 30112627
APIChem: AC-7935
Ark Pharm Building Blocks: AK137924
Capot Chemical: 18154
Chembo Pharma: KB-214112...7 total

ref: mol2, SDF, SMILES, flexibase
3.18,6.82,-12.89,1,5,0, 302.326, 6
hi: mol2, SDF, SMILES, flexibase
3.18,6.29,-46.14,0,5,-1, 301.318, 6

Similar to: 3198418, 34631893, 39023213, 35901155, ... 4 in total.
40844987
 
#4

ChemMol: 30112623
Aldrich CPR: T267449|ALDRICH
APIChem: AC-7930
Ark Pharm Building Blocks: AK135458
Capot Chemical: 18131...10 total

ref: mol2, SDF, SMILES, flexibase
1.69,5.44,-15.16,0,3,0, 246.715, 5

Similar to: 43447111, 43447112, 43447676, 43447677, 43447680, ... 9 in total.
40844986
 
#5

ChemMol: 30112623
Aldrich CPR: T267449|ALDRICH
APIChem: AC-7930
Ark Pharm Building Blocks: AK135458
Capot Chemical: 18131...10 total

ref: mol2, SDF, SMILES, flexibase
1.69,5.44,-15.16,0,3,0, 246.715, 5

Similar to: 43447111, 43447112, 43447676, 43447677, 43447680, ... 9 in total.
40844985
 
#6

ChemMol: 30112620
Molport: MolPort-019-879-357
AK Scientific: Z5054
Angene Building Blocks: AGN-PC-03R5SY
Anward: ANW-59047...21 total

ref: mol2, SDF, SMILES, flexibase
1.91,1.96,-8.23,1,3,0, 226.029, 0
hi: mol2, SDF, SMILES, flexibase
2.36,-0.63,-44.37,0,3,-1, 225.021, 0

Similar to: 34528931, 5379870, 39647899,
40844984
 
#7

ChemMol: 30112618
AK Scientific: Z3826
Angene Building Blocks: AGN-PC-088Q1R
Anward: ANW-63834
Apexmol Building Blocks: AM20020120...20 total

ref: mol2, SDF, SMILES, flexibase
3.12,7.42,-6.86,0,3,0, 298.18, 2
40844983
 
#8

ChemMol: 30112611
AK Scientific: 8052AA
Anward: ANW-71899
APIChem: AC-7898
Ark Pharm Building Blocks: AK-63177...12 total

ref: mol2, SDF, SMILES, flexibase
4.28,6.4,-20.85,1,8,0, 401.481, 12

Similar to: 38424112,
40844982
 
#9

ChemMol: 30112610
AK Scientific: 9239AA
Anward: ANW-63902
APIChem: AC-7897
Ark Pharm Building Blocks: AK-63179...11 total

ref: mol2, SDF, SMILES, flexibase
3.83,6,-21.63,1,8,0, 387.454, 12

Similar to: 38424112,
1444556
 
#10

ChemMol: 30101568
eMolecules: 2425535
Molport: MolPort-002-230-021
AK Scientific: I018
AKOS: AKOS005439340...81 total

ref: mol2, SDF, SMILES, flexibase
5.94,8.77,-7.56,1,3,0, 359.665, 3
ref: mol2, SDF, SMILES, flexibase
5.94,8.77,-7.17,1,3,0, 359.665, 3

Similar to: 38497574, 38564982,
72190348
 
#11

ChemMol: 30117457
APIChem: AC-24563
PubChem: 66042241
Enamine BB Make on Demand: BBV-41351914
UORSY BB Make-on-demand: BBV-41351914...5 total

ref: mol2, SDF, SMILES, flexibase
5.25,8.45,-3.36,0,1,0, 271.198, 6
72190347
 
#12

ChemMol: 30117447
APIChem: AC-24575
ref: mol2, SDF, SMILES, flexibase
3.52,6.29,-7.13,1,4,0, 288.409, 4
6494333
 
#13

eMolecules: 5834012, 43482707
Molport: MolPort-020-174-861, MolPort-002-897-302
Acorn PharmaTech: ACN-C000736
AK Scientific: W6682
Aldrich CPR: CDS003364|ALDRICH...35 total

ref: mol2, SDF, SMILES, flexibase
-0.43,1.59,-6.99,0,5,0, 156.141, 2
ref: mol2, SDF, SMILES, flexibase
-0.10,1.44,-9.52,1,5,0, 156.141, 2
mid: mol2, SDF, SMILES, flexibase
0.36,-0.62,-11.17,1,5,0, 156.141, 2
19286446
 
#14

Aldrich CPR: R426725|ALDRICH
Anward: ANW-59522
APIChem: AC-24631
Apollo Scientific Bioactives: BIH0893
Ark Pharm Building Blocks: AK-50037...22 total

ref: mol2, SDF, SMILES, flexibase
-3.96,-7.39,-43.74,2,7,-1, 267.327, 6
mid: mol2, SDF, SMILES, flexibase
-3.96,-5.03,-50.52,3,7,0, 268.335, 6
mid: mol2, SDF, SMILES, flexibase
-3.96,-4.99,-58.23,3,7,0, 268.335, 6

Similar to: 38575725, 38575726,
19286450
 
#15

Aldrich CPR: R426725|ALDRICH
Anward: ANW-59522
APIChem: AC-24631
Apollo Scientific Bioactives: BIH0893
Ark Pharm Building Blocks: AK-50037...21 total

ref: mol2, SDF, SMILES, flexibase
-3.96,-7.92,-43.99,2,7,-1, 267.327, 6
mid: mol2, SDF, SMILES, flexibase
-3.96,-5.49,-51.09,3,7,0, 268.335, 6
mid: mol2, SDF, SMILES, flexibase
-3.96,-5.52,-57.94,3,7,0, 268.335, 6

Similar to: 38575725, 38575726,
34545401
 
#16

ChemMol: 30117362
AK Scientific: 1311AB
APIChem: AC-24668
Ark Pharm Building Blocks: AK102985
BePharm Building Blocks: B234524...12 total

ref: mol2, SDF, SMILES, flexibase
-1.68,-5.08,-20.81,3,9,0, 302.283, 6
72190346
 
#17

ChemMol: 30117359
APIChem: AC-24671
ref: mol2, SDF, SMILES, flexibase
-4.34,-1.71,-26.03,6,9,1, 315.35, 6
72190345
 
#18

ChemMol: 30117355
APIChem: AC-24675
W&J PharmaChem: 201294
SureChEMBL: SCHEMBL5982157
ref: mol2, SDF, SMILES, flexibase
-1.09,-2.49,-23.48,3,6,0, 258.299, 2
2510815
 
#19

ChemMol: 30117355
APIChem: AC-24675
W&J PharmaChem: 201294
ref: mol2, SDF, SMILES, flexibase
-1.09,-2.4,-11.36,3,6,0, 258.299, 2
72190344
 
#20

ChemMol: 30117355
APIChem: AC-24675
W&J PharmaChem: 201294
ref: mol2, SDF, SMILES, flexibase
-1.09,-2.29,-18.23,3,6,0, 258.299, 2
72190343
 
#21

ChemMol: 30117355
APIChem: AC-24675
W&J PharmaChem: 201294
ref: mol2, SDF, SMILES, flexibase
-1.09,-2.17,-10.13,3,6,0, 258.299, 2
72190342
 
#22

ChemMol: 30117353
APIChem: AC-24677
ref: mol2, SDF, SMILES, flexibase
-1.33,-6.74,-19.02,3,10,0, 283.244, 4
72190341
 
#23

ChemMol: 30117352
APIChem: AC-24678
ref: mol2, SDF, SMILES, flexibase
-0.63,-6.07,-18.3,3,10,0, 297.271, 4
72190340
 
#24

ChemMol: 30117351
APIChem: AC-24679
ref: mol2, SDF, SMILES, flexibase
-0.74,-5.59,-118.66,8,9,2, 350.173, 2
mid: mol2, SDF, SMILES, flexibase
-0.74,-5.9,-43.81,7,9,1, 349.165, 2
72190339
 
#25

ChemMol: 30117351
APIChem: AC-24679
ref: mol2, SDF, SMILES, flexibase
-0.74,-5.6,-119.14,8,9,2, 350.173, 2
mid: mol2, SDF, SMILES, flexibase
-0.74,-5.89,-41.36,7,9,1, 349.165, 2
72190338
 
#26

ChemMol: 30117350
APIChem: AC-24680
ref: mol2, SDF, SMILES, flexibase
-0.50,-6.41,-120.27,8,12,2, 312.29, 3
mid: mol2, SDF, SMILES, flexibase
-0.50,-6.72,-44.62,7,12,1, 311.282, 3
72190337
 
#27

ChemMol: 30117350
APIChem: AC-24680
ref: mol2, SDF, SMILES, flexibase
-0.50,-6.4,-120.77,8,12,2, 312.29, 3
mid: mol2, SDF, SMILES, flexibase
-0.50,-6.7,-42.16,7,12,1, 311.282, 3
72190336
 
#28

ChemMol: 30117349
APIChem: AC-24681
ref: mol2, SDF, SMILES, flexibase
-0.64,-1.54,-112.96,7,8,2, 289.723, 2
mid: mol2, SDF, SMILES, flexibase
-0.64,-1.86,-40.78,6,8,1, 288.715, 2
72190335
 
#29

ChemMol: 30117349
APIChem: AC-24681
ref: mol2, SDF, SMILES, flexibase
-0.64,-1.54,-113.81,7,8,2, 289.723, 2
mid: mol2, SDF, SMILES, flexibase
-0.64,-1.86,-38.17,6,8,1, 288.715, 2
72190334
 
#30

ChemMol: 30117346
AK Scientific: 8224AB
Anward: ANW-63200
Apexmol Building Blocks: AM804048
APIChem: AC-24684...19 total

ref: mol2, SDF, SMILES, flexibase
2.34,7.22,-10.73,0,3,0, 215.252, 4
72190333
 
#31

ChemMol: 30117344
AK Scientific: 3312AA
Anward: ANW-67370
APIChem: AC-24686
Ark Pharm Building Blocks: AK-88309...12 total

ref: mol2, SDF, SMILES, flexibase
2.50,7.71,-10.21,0,3,0, 229.279, 4
72190332
 
#32

ChemMol: 30117344
AK Scientific: 3312AA
Anward: ANW-67370
APIChem: AC-24686
Ark Pharm Building Blocks: AK-88309...12 total

ref: mol2, SDF, SMILES, flexibase
2.50,7.7,-10.18,0,3,0, 229.279, 4
72190331
 
#33

ChemMol: 30117343
AK Scientific: 0585AA
Anward: ANW-67369
APIChem: AC-24687
Ark Pharm Building Blocks: AK-88310...15 total

ref: mol2, SDF, SMILES, flexibase
2.30,6.8,-43.23,0,3,-1, 265.086, 2
72190330
 
#34

ChemMol: 30117339
AK Scientific: 0958AB
Anward: ANW-67367
APIChem: AC-24692
Ark Pharm Building Blocks: AK-88312...12 total

ref: mol2, SDF, SMILES, flexibase
1.92,3.58,-4.86,2,2,0, 266.107, 1
72190329
 
#35

ChemMol: 30117338
Anward: ANW-65208
APIChem: AC-24693
Ark Pharm Building Blocks: AK102995
BePharm Building Blocks: B234534...10 total

ref: mol2, SDF, SMILES, flexibase
3.33,6.56,-8.12,1,4,0, 366.224, 4
hi: mol2, SDF, SMILES, flexibase
2.96,6.97,-43.85,0,4,-1, 365.216, 4
72190328
 
#36

ChemMol: 30117337
Anward: ANW-65209
APIChem: AC-24694
Ark Pharm Building Blocks: AK102994
BePharm Building Blocks: B234533...10 total

ref: mol2, SDF, SMILES, flexibase
2.32,5.44,-8.82,1,4,0, 240.328, 4
72190327
 
#37

ChemMol: 30117315
AK Scientific: 2783AC
Aldrich CPR: SYX00368|ALDRICH
Anward: ANW-55455
APIChem: AC-24717...16 total

ref: mol2, SDF, SMILES, flexibase
2.49,4.46,-5.9,2,4,0, 231.049, 1
72190326
 
#38

ChemMol: 30117299
Molport: MolPort-022-368-138
AK Scientific: 2046AC
Anward: ANW-53413
Apexmol Building Blocks: AM807131...15 total

ref: mol2, SDF, SMILES, flexibase
-0.29,0.82,-45,1,5,-1, 153.117, 1
72190325
 
#39

ChemMol: 30117286
AK Scientific: 6476AA
APIChem: AC-24752
Ark Pharm Building Blocks: AK119693
Chembo Pharma: KB-258110...9 total

ref: mol2, SDF, SMILES, flexibase
5.30,12.84,-10.74,1,6,0, 438.483, 8
33753394
 
#40

ChemMol: 30117285
APIChem: AC-24753
PubChem: 3035836, 10126745
SureChEMBL: SCHEMBL8584501
ref: mol2, SDF, SMILES, flexibase
1.13,6.57,-56.84,2,5,1, 366.503, 8

Similar to: 355488, 355493, 355495, 355496, 403701, ... 8 in total.
33753393
 
#41

ChemMol: 30117285
APIChem: AC-24753
PubChem: 69110544, 9554797, 54391405, 69288197, 10126745, 3035836
SureChEMBL: SCHEMBL4601518, SCHEMBL108912, SCHEMBL5036182, SCHEMBL8584501
ref: mol2, SDF, SMILES, flexibase
1.13,6.57,-47.05,2,5,1, 366.503, 8

Similar to: 355488, 355493, 355495, 355496, 403701, ... 8 in total.
72190324
 
#42

ChemMol: 30117285
APIChem: AC-24753
SureChEMBL: SCHEMBL222380
ref: mol2, SDF, SMILES, flexibase
1.13,6.55,-50.08,2,5,1, 366.503, 8
72190323
 
#43

ChemMol: 30117285
APIChem: AC-24753
PubChem: 54391405
SureChEMBL: SCHEMBL222380
ref: mol2, SDF, SMILES, flexibase
1.13,6.54,-52.63,2,5,1, 366.503, 8
72190322
 
#44

ChemMol: 30117277
APIChem: C-24761
ref: mol2, SDF, SMILES, flexibase
3.43,7.03,-50.25,3,5,-1, 389.512, 12
lo: mol2, SDF, SMILES, flexibase
3.43,5.05,-10.45,4,5,0, 390.52, 12
72190321
 
#45

ChemMol: 30117273
Molport: MolPort-020-005-835
AK Scientific: Z6153
Anward: ANW-62751
APIChem: AC-24765...26 total

ref: mol2, SDF, SMILES, flexibase
0.83,5.22,-10.3,2,4,0, 302.37, 5
72190320
 
#46

ChemMol: 30117273
APIChem: AC-24765
PubChem: 58782372
SureChEMBL: SCHEMBL14599106
ref: mol2, SDF, SMILES, flexibase
0.83,5.22,-10.65,2,4,0, 302.37, 5
72190319
 
#47

ChemMol: 30117268
APIChem: AC-24770
ref: mol2, SDF, SMILES, flexibase
2.81,7.1,-51.29,2,7,-1, 431.505, 11
lo: mol2, SDF, SMILES, flexibase
2.81,5.12,-14.96,3,7,0, 432.513, 11

Similar to: 30691625,
72190318
 
#48

ChemMol: 30117263
APIChem: AC-24775
ref: mol2, SDF, SMILES, flexibase
3.02,4.7,-16.56,4,6,0, 443.584, 13
72190317
 
#49

ChemMol: 30117203
APIChem: AC-24846
ref: mol2, SDF, SMILES, flexibase
2.62,6.3,-51.69,4,4,1, 324.379, 3
hi: mol2, SDF, SMILES, flexibase
2.62,4.85,-9.02,3,4,0, 323.371, 3
72190316
 
#50

ChemMol: 44033877, 30117194
APIChem: AC-24857
Toronto Research Chemicals: A164255
PubChem: 44629196, 68377588, 53259161
SureChEMBL: SCHEMBL37456...8 total

ref: mol2, SDF, SMILES, flexibase
5.40,13.2,-12.02,0,7,0, 453.274, 9
72190315
 
#51

ChemMol: 30117191, 44033881
APIChem: AC-24860
PubChem: 68811277, 46892261, 66600980, 68004200
SureChEMBL: SCHEMBL3843980, SCHEMBL9999640, SCHEMBL118662
ref: mol2, SDF, SMILES, flexibase
-0.97,5.91,-71.31,3,10,1, 313.29, 6
mid: mol2, SDF, SMILES, flexibase
-0.97,4.36,-19.1,2,10,0, 312.282, 6
2548485
 
#52

ChemMol: 44001821, 30117167
Molport: MolPort-023-220-636
Acros Organics: 44026
AK Scientific: V1229, V1163
Alfa-Aesar: H54404...38 total

ref: mol2, SDF, SMILES, flexibase
-3.81,6.33,-43.27,0,4,1, 226.325, 3
mid: mol2, SDF, SMILES, flexibase
-2.82,5.71,-23.77,1,4,0, 227.333, 3
72190314
 
#53

ChemMol: 30117169
APIChem: AC-24883
ref: mol2, SDF, SMILES, flexibase
-3.62,7.47,-38.29,0,7,1, 235.271, 2
36424460
 
#54

ChemMol: 30117162
APIChem: AC-24890
Sigma Aldrich (Building Blocks): 750433|ALDRICH
AK Scientific (Depleted): 65846
Debye Scientific BB (Depleted): DB-069422...7 total

ref: mol2, SDF, SMILES, flexibase
-3.68,7,-25.89,0,4,1, 238.336, 2
4217604
 
#55

ChemMol: 30117100, 44006923
APIChem: AC-24967
Tetrahedron Building Blocks: TS64352
AK Scientific (Depleted): 71256
AKOS BB (make-on-demand): AKOS015967450...25 total

ref: mol2, SDF, SMILES, flexibase
2.82,9.06,-15.5,1,3,0, 342.479, 2

Similar to: 34027240, 34573421, 36378002, 38462790, 38462791, ... 10 in total.
38247025
 
#56

ChemMol: 30117077
APIChem: AC-24996
Ark Pharm Building Blocks: AK153482
Bide Pharmatech BB: BD256275
Molport BB: MolPort-028-615-876...8 total

ref: mol2, SDF, SMILES, flexibase
3.04,5.2,-5.51,1,1,0, 214.037, 0

Similar to: 42684381, 16159465, 14983310, 2525090, ... 4 in total.
72190313
 
#57

ChemMol: 44034225, 30117074
AK Scientific: 4828AA
Anward: ANW-63066
APIChem: AC-24999
Ark Pharm Building Blocks: AK-90202...13 total

ref: mol2, SDF, SMILES, flexibase
0.96,1.89,-4.91,2,4,0, 186.598, 2
72190312
 
#58

ChemMol: 30117073, 44034220
AK Scientific: V9894
Anward: ANW-53604
APIChem: AC-25000
Ark Pharm Building Blocks: AK-90205...21 total

ref: mol2, SDF, SMILES, flexibase
2.06,4.47,-5.17,0,4,0, 172.571, 1
39383035
 
#59

ChemMol: 30117060
APIChem: AC-23920
Alfa Chemistry (Depleted): ACM84245125
PubChem: 13055419
SureChEMBL: SCHEMBL2576527...5 total

ref: mol2, SDF, SMILES, flexibase
-2.01,0.23,-24.96,4,10,0, 297.271, 6
mid: mol2, SDF, SMILES, flexibase
-1.55,-1.58,-70.19,3,10,-1, 296.263, 6

Similar to: 2472815, 1800215, 34291300,
72190311
 
#60

ChemMol: 30117058, 97300683
Molport: MolPort-023-220-821
AK Scientific: X4789
Apexmol Building Blocks: AM20090703
APIChem: AC-23922...14 total

ref: mol2, SDF, SMILES, flexibase
3.69,10.95,-15.72,0,8,0, 453.3, 3
34369931
 
#61

ChemMol: 30117027
APIChem: AC-23955
Chembo Pharma: KB-82554
Lab Seeker Building Blocks: SC-49959
Ryan Scientific BB: 073-46340...18 total

ref: mol2, SDF, SMILES, flexibase
2.34,3.61,-43.08,3,2,1, 206.309, 1

Similar to: 3880949, 3880950,
72190310
 
#62

ChemMol: 30117021
APIChem: AC-23961
PubChem: 59878036, 46868423
SureChEMBL: SCHEMBL6784640, SCHEMBL265353, SCHEMBL14891017
ref: mol2, SDF, SMILES, flexibase
5.32,9.81,-4.71,1,3,0, 437.355, 6
mid: mol2, SDF, SMILES, flexibase
5.32,10.98,-46.67,2,3,1, 438.363, 6
22052846
 
#63

APIChem: AC-23962
Ark Pharm Building Blocks: AK102292, AK-93502
BePharm Building Blocks: B233831, B221324, B230956
Debye Scientific BB (Depleted): DB-001104
ShangHai Biochempartner (Depleted): BCPM000326...10 total

ref: mol2, SDF, SMILES, flexibase
5.32,10.88,-50.5,2,3,1, 438.363, 6
mid: mol2, SDF, SMILES, flexibase
5.32,9.55,-5.2,1,3,0, 437.355, 6

Similar to: 22052850, 34044826, 34044827, 34044828, 34044829, ... 22 in total.
72190309
 
#64

ChemMol: 30117018
APIChem: AC-23964
ref: mol2, SDF, SMILES, flexibase
-1.33,-3.49,-64.36,6,8,0, 367.427, 5
hi: mol2, SDF, SMILES, flexibase
-1.33,-3.88,-51.38,5,8,-1, 366.419, 5
72190308
 
#65

ChemMol: 30117018
APIChem: AC-23964
ref: mol2, SDF, SMILES, flexibase
-1.33,-3.49,-68.38,6,8,0, 367.427, 5
hi: mol2, SDF, SMILES, flexibase
-1.33,-3.88,-51.47,5,8,-1, 366.419, 5
72190307
 
#66

ChemMol: 30117018
APIChem: AC-23964
ref: mol2, SDF, SMILES, flexibase
-1.33,-3.3,-87.49,6,8,0, 367.427, 5
hi: mol2, SDF, SMILES, flexibase
-1.33,-3.7,-55.17,5,8,-1, 366.419, 5
72190306
 
#67

ChemMol: 30117018
APIChem: AC-23964
ref: mol2, SDF, SMILES, flexibase
-1.33,-3.31,-87.09,6,8,0, 367.427, 5
hi: mol2, SDF, SMILES, flexibase
-1.33,-3.71,-54.72,5,8,-1, 366.419, 5
38197764
 
#68

eMolecules: 901933
Molport: MolPort-020-179-984
AK Scientific: O378
Alinda Building Blocks: ALBB-028535
APIChem: AC-1944...106 total

mid: mol2, SDF, SMILES, flexibase
-0.04,7.05,-52.32,3,7,1, 376.408, 4
mid: mol2, SDF, SMILES, flexibase
-2.78,7.73,-77.5,3,7,1, 376.408, 3
hi: mol2, SDF, SMILES, flexibase
-0.04,7.83,-63.43,1,7,-1, 374.392, 4
34584248
 
#69

ChemMol: 30117001
AK Scientific: 3190AC
Anward: ANW-67573
APIChem: AC-23990
Ark Pharm Building Blocks: AK-88025...15 total

ref: mol2, SDF, SMILES, flexibase
3.50,4.37,-5.79,2,2,0, 242.318, 4

Similar to: 1572785, 6002146, 1627618, 1627619, 1627620, ... 9 in total.
34584247
 
#70

ChemMol: 30117001
AK Scientific: 3190AC
Anward: ANW-67573
APIChem: AC-23990
Ark Pharm Building Blocks: AK-88025...15 total

ref: mol2, SDF, SMILES, flexibase
3.50,4.36,-6.19,2,2,0, 242.318, 4

Similar to: 1572785, 6002146, 1627618, 1627619, 1627620, ... 9 in total.
12413620
 
#71

Acros Organics: 36567
American Custom Chemicals Corp.: CCH0003726
APIChem: AC-24136
Ark Pharm Building Blocks: AK-47422
BePharm Building Blocks: B23083...20 total

ref: mol2, SDF, SMILES, flexibase
1.74,5.79,-49.73,3,3,1, 208.281, 6
mid: mol2, SDF, SMILES, flexibase
1.74,5.47,-7.41,2,3,0, 207.273, 6

Similar to: 34444939, 34453194, 34534590, 34570815, 34570817, ... 10 in total.
54954624
 
#72

eMolecules: 3768028, 489403, 36372873
Molport: MolPort-002-919-239, MolPort-002-497-764, MolPort-004-879-350
Scientific Exchange (make on demand): M-971366
Acros Organics: 20543
AK Scientific: I499...72 total

40433814
 
#73

ChemMol: 30116859
APIChem: AC-24207
ref: mol2, SDF, SMILES, flexibase
2.64,8.23,-6.15,0,2,0, 236.355, 0
40433813
 
#74

ChemMol: 30116859
APIChem: AC-24207
ref: mol2, SDF, SMILES, flexibase
2.64,8.35,-6.46,0,2,0, 236.355, 0
34424553
 
#75

ChemMol: 30116823
AK Scientific: 1529AA
Anward: ANW-62207
APIChem: AC-24245
Ark Pharm Building Blocks: AK102349...11 total

ref: mol2, SDF, SMILES, flexibase
5.95,11.98,-7.19,0,2,0, 316.4, 6

Similar to: 40762532, 1612326, 17175937, 26817631, 15017035, ... 9 in total.
20071407
 
#76

AK Scientific: 2316AA
APIChem: AC-24262
Ark Pharm Building Blocks: AK-29788
Chembo Pharma: KB-66503
Innovapharm Building Blocks: BBS-00025170...12 total

ref: mol2, SDF, SMILES, flexibase
0.13,6.4,-119.54,4,2,2, 206.333, 4
mid: mol2, SDF, SMILES, flexibase
0.13,6.11,-34.7,3,2,1, 205.325, 4
20071409
 
#77

AK Scientific: 2316AA
APIChem: AC-24262
Ark Pharm Building Blocks: AK-29788
Chembo Pharma: KB-66503
Innovapharm Building Blocks: BBS-00025170...12 total

ref: mol2, SDF, SMILES, flexibase
0.13,6.38,-118.14,4,2,2, 206.333, 4
mid: mol2, SDF, SMILES, flexibase
0.13,6.05,-36.87,3,2,1, 205.325, 4
34040492
 
#78

American Custom Chemicals Corp.: CCH0003359, CHM0118167
Anward: ANW-73370
APIChem: AC-24272
Ark Pharm Building Blocks: AK-29283, AK-77754, AK-59729
BePharm Building Blocks: B33740...18 total

ref: mol2, SDF, SMILES, flexibase
2.39,7.97,-110.02,3,2,2, 220.36, 3
mid: mol2, SDF, SMILES, flexibase
2.39,6.67,-32.17,2,2,1, 219.352, 3

Similar to: 34040493, 37078444, 37078445,
35270115
 
#79

Molport: MolPort-016-579-249
APIChem: AC-24273
Ark Pharm Building Blocks: AK-29282, AK110568
BePharm Building Blocks: B223212
Chembo Pharma: KB-62808...15 total

ref: mol2, SDF, SMILES, flexibase
2.39,7.69,-108.71,3,2,2, 220.36, 3
mid: mol2, SDF, SMILES, flexibase
2.39,6.56,-34.1,2,2,1, 219.352, 3
50888564
 
#80

AK Scientific: 0943AC, V7502
Angene Building Blocks: AGN-PC-0KNXCI
Anward: ANW-57015
Apexmol Building Blocks: AM807221
APIChem: AC-24283...24 total

ref: mol2, SDF, SMILES, flexibase
-0.34,3.74,-54.1,2,4,1, 172.204, 3
mid: mol2, SDF, SMILES, flexibase
-0.34,2.36,-9.79,1,4,0, 171.196, 3
50888562
 
#81

AK Scientific: 0943AC, V7502
Angene Building Blocks: AGN-PC-0KNXCI
Anward: ANW-57015
Apexmol Building Blocks: AM807221
APIChem: AC-24283...24 total

ref: mol2, SDF, SMILES, flexibase
-0.34,3.74,-54.09,2,4,1, 172.204, 3
mid: mol2, SDF, SMILES, flexibase
-0.34,2.37,-8.75,1,4,0, 171.196, 3
38338210
 
#82

ACT Chemical BB: ACT04867
AK Scientific: I079
American Custom Chemicals Corp.: CCH0001241
Anward: ANW-57732
APIChem: AC-313...27 total

ref: mol2, SDF, SMILES, flexibase
0.50,-1.15,-38.42,2,2,0, 126.203, 0
mid: mol2, SDF, SMILES, flexibase
0.50,0.67,-34.07,3,2,1, 127.211, 0
lo: mol2, SDF, SMILES, flexibase
0.50,2,-108.74,4,2,2, 128.219, 0

Similar to: 39343584, 39343585,
38665705
 
#83

ChemMol: 30116714
AK Scientific: Z1751
APIChem: AC-24368
Molport BB: MolPort-039-062-233
ref: mol2, SDF, SMILES, flexibase
-1.23,1.74,-44.77,4,4,0, 225.288, 2
40435197
 
#84

ChemMol: 30116691
APIChem: AC-24391
ref: mol2, SDF, SMILES, flexibase
7.84,14.05,-9.29,0,2,0, 396.53, 2
34997331
 
#85

AK Scientific: 3740AC
Anward: ANW-59622
APIChem: AC-24397
Ark Pharm Building Blocks: AK-45016
BePharm Building Blocks: B46581...13 total

ref: mol2, SDF, SMILES, flexibase
4.23,14.42,-36.79,1,5,1, 420.508, 5
mid: mol2, SDF, SMILES, flexibase
4.23,13.95,-14.82,0,5,0, 419.5, 5

Similar to: 35861266, 35861268, 38239799, 38239800, 38240023, ... 7 in total.
72190305
 
#86

ChemMol: 30116665
APIChem: AC-24419
Alfa Chemistry (Depleted): ACM3081627
PubChem: 54015082
SureChEMBL: SCHEMBL1614707...5 total

ref: mol2, SDF, SMILES, flexibase
-4.46,-2.19,-43.8,5,6,0, 174.156, 5
hi: mol2, SDF, SMILES, flexibase
-4.46,-2.5,-47.93,4,6,-1, 173.148, 5
72190304
 
#87

ChemMol: 30116648
AK Scientific: 5709AC
Anward: ANW-53875
APIChem: AC-24440
Ark Pharm Building Blocks: AK-87571...12 total

ref: mol2, SDF, SMILES, flexibase
9.35,20.85,-6.72,0,0,0, 509.446, 2
72190303
 
#88

ChemMol: 30116643
AK Scientific: 8939AB
APIChem: AC-24445
Ark Pharm Building Blocks: AK122649
Chembo Pharma: KB-251570...6 total

ref: mol2, SDF, SMILES, flexibase
4.24,8.78,-7.02,0,4,0, 402.038, 4
72190302
 
#89

ChemMol: 30116640
AK Scientific: 4812AC
Amadis Chemical: A847551
APIChem: AC-24448
Ark Pharm Building Blocks: AK119598...14 total

ref: mol2, SDF, SMILES, flexibase
7.39,15.82,-6.11,0,1,0, 398.303, 2
34410358
 
#90

ChemMol: 30116634
APIChem: AC-24454
Ark Pharm Building Blocks: AK122651
Bide Pharmatech BB: BD246829
Chembo Pharma: KB-163995...10 total

ref: mol2, SDF, SMILES, flexibase
5.19,8.47,-4.85,0,2,0, 366.008, 0
35975524
 
#91

ChemMol: 30116611
Alfa-Aesar: H63514
APIChem: AC-24495
Ark Pharm Building Blocks: AK162170
Bide Pharmatech BB: BD290435...18 total

ref: mol2, SDF, SMILES, flexibase
5.84,9.71,-17.08,0,6,0, 440.858, 6
35415726
 
#92

AK Scientific: I132
APIChem: AC-15710, AC-23364
Ark Pharm Building Blocks: AK113415, AK-26183
BePharm Building Blocks: B16731, B33268
Bosche Scientific: H3332...20 total

ref: mol2, SDF, SMILES, flexibase
1.90,7.28,-93.52,3,4,2, 285.391, 3
mid: mol2, SDF, SMILES, flexibase
1.90,6.9,-41.24,2,4,1, 284.383, 3
mid: mol2, SDF, SMILES, flexibase
1.90,4.53,-5.87,1,4,0, 283.375, 3
mid: mol2, SDF, SMILES, flexibase
1.90,4.91,-28.58,2,4,1, 284.383, 3

Similar to: 36988692, 36994222, 34679281,
19370162
 
#93

eMolecules: 835592, 31660876
Molport: MolPort-003-355-831
AK Scientific: W6892
Aldrich CPR: CDS002991|ALDRICH
Anward: ANW-52403...43 total

ref: mol2, SDF, SMILES, flexibase
-1.43,3.01,-55.89,1,4,0, 158.201, 2
mid: mol2, SDF, SMILES, flexibase
-1.43,0.63,-44.23,0,4,-1, 157.193, 2
mid: mol2, SDF, SMILES, flexibase
-1.43,2.81,-29.8,1,4,0, 158.201, 2
19370577
 
#94

eMolecules: 725751
AK Scientific: Y8267
APIChem: AC-23614
Apollo Scientific: PC31120
ChemBridge: 5355284...10 total

ref: mol2, SDF, SMILES, flexibase
1.14,3.12,-41.51,2,3,1, 239.314, 4
mid: mol2, SDF, SMILES, flexibase
1.14,0.73,-6.51,1,3,0, 238.306, 4
mid: mol2, SDF, SMILES, flexibase
1.14,3.35,-33.69,2,3,1, 239.314, 4

Similar to: 36798226,
54965254
 
#95

AK Scientific: W8857
Anward: ANW-71454
APIChem: AC-23647
Ark Pharm Building Blocks: AK-83448
BePharm Building Blocks: B84583...16 total

26896481
 
#96

AK Scientific: W8857
Anward: ANW-71454
APIChem: AC-23647
Ark Pharm Building Blocks: AK-83448
BePharm Building Blocks: B84583...18 total

ref: mol2, SDF, SMILES, flexibase
-1.75,1.59,-41.38,3,6,0, 230.264, 3
hi: mol2, SDF, SMILES, flexibase
-1.75,1.22,-44.21,2,6,-1, 229.256, 3
56898730
 
#97

APIChem: AC-23715
Chembo Pharma: KB-61734, KB-81158
MedChem Express: HY-B0995
MicroSource Pharmakon: 01503879
MicroSource US Drugs: 01503879...19 total

52986906
 
#98

Enolase via KEGG (EFI): C03283_2
Scientific Exchange (make on demand): F-441608
AK Scientific: 3213AB, 1360AC, W7673, V1165, X3169
Alfa-Aesar: A15408, L10093
Alinda Building Blocks: ALBB-025018...135 total

hi: mol2, SDF, SMILES, flexibase
2.50,6.11,-84.93,6,7,2, 475.637, 8
19202664
 
#99

eMolecules: 25765331, 476660, 1012711
Molport: MolPort-001-769-432, MolPort-003-720-815, MolPort-001-761-289
Scientific Exchange: CN4/3941
Scientific Exchange (make on demand): POD_18/0371
Acorn PharmaTech: ACN-S003740...62 total

ref: mol2, SDF, SMILES, flexibase
-0.16,1.91,-30.69,3,2,1, 127.211, 0
mid: mol2, SDF, SMILES, flexibase
-0.16,2.21,-105.78,4,2,2, 128.219, 0
hi: mol2, SDF, SMILES, flexibase
-0.16,-0.22,-41.5,3,2,1, 127.211, 0

Similar to: 37078997, 37078998, 37078999, 37082433, 37082434, ... 7 in total.
18189761
 
#100

ChemMol: 30116069, 44001789
eMolecules: 48229970, 593251
Molport: MolPort-003-666-777
AK Scientific: K525
AKOS: AKOS001637331...65 total

ref: mol2, SDF, SMILES, flexibase
2.18,9.68,-19.84,2,5,0, 245.33, 4
ref: mol2, SDF, SMILES, flexibase
2.18,8.8,-19.26,2,5,0, 245.33, 4
ref: mol2, SDF, SMILES, flexibase
2.01,8.02,-6.12,2,5,0, 245.33, 5
ref: mol2, SDF, SMILES, flexibase
2.01,10.47,-5.37,2,5,0, 245.33, 5
mid: mol2, SDF, SMILES, flexibase
2.01,8.58,-4.5,2,5,0, 245.33, 5
mid: mol2, SDF, SMILES, flexibase
2.01,10.22,-9.07,2,5,0, 245.33, 5
hi: mol2, SDF, SMILES, flexibase
2.18,8.31,-33.34,1,5,-1, 244.322, 4
hi: mol2, SDF, SMILES, flexibase
2.18,9.19,-29.92,1,5,-1, 244.322, 4
hi: mol2, SDF, SMILES, flexibase
2.01,10.09,-30.29,1,5,-1, 244.322, 5
hi: mol2, SDF, SMILES, flexibase
2.01,10.06,-33.2,1,5,-1, 244.322, 5
lo: mol2, SDF, SMILES, flexibase
2.01,8.47,-33.8,3,5,1, 246.338, 5
lo: mol2, SDF, SMILES, flexibase
2.01,10.7,-36.72,3,5,1, 246.338, 5
lo: mol2, SDF, SMILES, flexibase
2.01,10.93,-33.34,3,5,1, 246.338, 5
lo: mol2, SDF, SMILES, flexibase
2.01,9.05,-33.93,3,5,1, 246.338, 5

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 = 379 ) limit 0,100

Smiles were