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34781262
 
#1

ChemMol: 30200563, 30113745
Molport: MolPort-002-468-770
Acros Organics: 39750
ACT Chemical BB: ACT07185
AKOS: AKOS008043460...71 total

ref: mol2, SDF, SMILES, flexibase
-0.04,0.17,-5.15,1,3,0, 103.121, 3
34702233
 
#2

ChemMol: 30202408, 30107024, 44027629, 30202409
eMolecules: 534688, 1013282
Molport: MolPort-001-792-706
Scientific Exchange (make on demand): Z-032762
Acros Organics: 30836...164 total

ref: mol2, SDF, SMILES, flexibase
-0.62,0.01,-5.52,2,3,0, 103.121, 2

Similar to: 34702232, 1655962, 2168185, 6260245, 6267262, ... 5 in total.
54954730
 
#3

ChemMol: 30202677, 96707690, 30107091
eMolecules: 6883159, 7393352, 501168
Molport: MolPort-003-930-837, MolPort-003-986-504
Scientific Exchange (make on demand): F-137711
Acros Organics: 32060...103 total

ref: mol2, SDF, SMILES, flexibase
1.94,5.31,-7.21,1,3,0, 205.257, 4

Similar to: 4899560, 38292993, 38293530,
55345605
 
#4

ChemMol: 30202800, 30104329, 1030641
Acros Organics: 43542
ACT Chemical BB: ACT07330
Alfa-Aesar: H56322
Anward: ANW-22369...60 total

ref: mol2, SDF, SMILES, flexibase
1.55,2.99,-6.35,3,4,0, 237.299, 5

Similar to: 4899617, 25494346, 25494350, 25494354, 25494358, ... 7 in total.
34676246
 
#5

ChemMol: 30103793, 44006319, 30202543, 30113808, 44003556, 96705397, 44015448
eMolecules: 515539, 1013426, 538684
Molport: MolPort-001-836-491, MolPort-001-792-835
Scientific Exchange: POD_08/0614
Acros Organics: 42854...147 total

ref: mol2, SDF, SMILES, flexibase
0.57,3.23,-6.38,2,3,0, 165.192, 4

Similar to: 38276430, 34557851, 34562547, 388707, ... 4 in total.
19868853
 
#6

ChemMol: 44019751
eMolecules: 45490636, 37200024
Molport: MolPort-001-765-343, MolPort-002-964-498
ACT Chemical BB: ACT07378
AK Scientific: V8567...93 total

ref: mol2, SDF, SMILES, flexibase
-0.33,3.88,-5.74,2,3,0, 179.219, 4

Similar to: 31982756, 31982759, 33685246, 33685247, 34547148, ... 29 in total.
19230196
 
#7

ChemMol: 83603012, 30202449, 30113759
Molport: MolPort-002-464-721
Acros Organics: 30324
ACT Chemical BB: ACT07406
AKOS: AKOS015846052...133 total

ref: mol2, SDF, SMILES, flexibase
-0.64,0.21,-4.14,2,3,0, 135.188, 3
hi: mol2, SDF, SMILES, flexibase
-0.64,0.74,-37.06,2,3,-1, 134.18, 3

Similar to: 38281959,
54969026
 
#8

ChemMol: 30202575, 30107078, 83603332
eMolecules: 2859498, 523678
Molport: MolPort-004-443-468, MolPort-003-937-440, MolPort-001-794-139
Acros Organics: 43491
ACT Chemical BB: ACT07407...133 total

ref: mol2, SDF, SMILES, flexibase
0.66,2.09,-3.43,2,3,0, 145.202, 4
19300218
 
#9

ChemMol: 30110952, 30202686, 44011516
eMolecules: 7730340, 2895476
Molport: MolPort-002-791-781
Scientific Exchange (make on demand): X-048218
ACT Chemical BB: ACT07168...125 total

ref: mol2, SDF, SMILES, flexibase
-0.71,2.97,-5.92,2,3,0, 165.192, 3
54954743
 
#10

ChemMol: 30202772, 30113750, 30114524
eMolecules: 2858697, 889244
Molport: MolPort-002-497-769, MolPort-023-220-040, MolPort-002-465-299
Acros Organics: 39872
ACT Chemical BB: ACT07567...125 total

ref: mol2, SDF, SMILES, flexibase
0.16,1.46,-4.82,2,3,0, 131.175, 3

Similar to: 39372981,
34702232
 
#11

ChemMol: 30202407, 30202409, 44027629
eMolecules: 1013282, 534688, 476082
Molport: MolPort-003-925-463, MolPort-001-792-706
Scientific Exchange (make on demand): Z-032762
Acros Organics: 30836...201 total

ref: mol2, SDF, SMILES, flexibase
-0.62,0,-5.37,2,3,0, 103.121, 2

Similar to: 34702233, 1655962, 2168185, 6260245, 6267262, ... 5 in total.
20230744
 
#12

ChemMol: 44027069, 30202740, 30202741, 83601468
eMolecules: 1013159, 721999
Molport: MolPort-001-792-667
ACT Chemical BB: ACT07709
AK Scientific: I501...98 total

ref: mol2, SDF, SMILES, flexibase
-1.22,-2.42,-7.5,3,4,0, 133.147, 4

Similar to: 34345598, 34345599, 162629,
19943407
 
#13

ChemMol: 30202520
eMolecules: 7404571
Molport: MolPort-002-996-918
Scientific Exchange (make on demand): F-067306
ACT Chemical BB: ACT07728...75 total

ref: mol2, SDF, SMILES, flexibase
-0.87,1.55,-11.96,2,5,0, 175.184, 6

Similar to: 32250202, 32250205, 34332799, 34332800, 34332801, ... 6 in total.
52968847
 
#14

ChemMol: 30202786
eMolecules: 1059232, 594623, 532634
Molport: MolPort-001-814-517, MolPort-003-791-711
Acros Organics: RDP00077, 37667
ACT Chemical BB: ACT07754...102 total

ref: mol2, SDF, SMILES, flexibase
1.37,4.78,-7.55,3,4,0, 232.283, 5

Similar to: 39377672, 39377673, 39377674, 39377675, 38201492, ... 11 in total.
19943560
 
#15

ChemMol: 30107052
eMolecules: 510066
Molport: MolPort-003-933-463
Acros Organics: 37666
ACT Chemical BB: ACT07875...83 total

ref: mol2, SDF, SMILES, flexibase
-1.14,0.82,-7.24,2,5,0, 161.157, 5

Similar to: 1703665, 2169389,
53098690
 
#16

ChemMol: 30200572, 30107104, 44033202
eMolecules: 533075, 1013298, 2735534
Molport: MolPort-003-698-809, MolPort-001-792-718
ACT Chemical BB: ACT09025, ACT08083
AK Scientific: V6633...152 total

ref: mol2, SDF, SMILES, flexibase
0.74,1.87,-6.92,3,4,0, 209.245, 5

Similar to: 6351234, 6351240, 39044657, 25494361, 25494365, ... 7 in total.
16697864
 
#17

ChemMol: 97603456, 44018035, 44017801, 97603325
ACT Chemical BB: ACT08146
AK Scientific: X9788
Anward: ANW-46591
Ark Pharm Building Blocks: AK-43142...24 total

ref: mol2, SDF, SMILES, flexibase
1.28,3.02,-9.74,3,6,0, 274.361, 10
3588957
 
#18

ChemMol: 30201383, 44002578, 44020604
eMolecules: 874906
Molport: MolPort-000-005-161
ACT Chemical BB: ACT08191
AK Scientific: U604...89 total

ref: mol2, SDF, SMILES, flexibase
-0.33,0.91,-11.66,1,4,0, 143.142, 2

Similar to: 32136073, 32136075, 34395883, 34449180, 34568170, ... 9 in total.
19202571
 
#19

ChemMol: 44020547
ACT Chemical BB: ACT08335
AKOS: AKOS015851542
Anward: ANW-19751
Ark Pharm Building Blocks: AK-58373...23 total

ref: mol2, SDF, SMILES, flexibase
4.16,7.98,-9.68,2,4,0, 361.441, 8

Similar to: 32131700, 32131703, 32131705, 34456119, 34585522, ... 39 in total.
19202575
 
#20

ChemMol: 44026080, 44020547
ACT Chemical BB: ACT08335, ACT09733
AK Scientific: V5998
AKOS: AKOS015851542
American Custom Chemicals Corp.: AAA0003414...43 total

ref: mol2, SDF, SMILES, flexibase
4.16,7.56,-8.79,2,4,0, 361.441, 8

Similar to: 32131700, 32131703, 32131705, 34456119, 34528458, ... 43 in total.
19230193
 
#21

ChemMol: 30202739, 97800504, 30114529, 83601393, 97800952, 30116947, 44005694, 30107094
eMolecules: 983890, 489620
Molport: MolPort-001-788-323, MolPort-001-765-335
Acros Organics: 20745, 39679
ACT Chemical BB: ACT08359...153 total

ref: mol2, SDF, SMILES, flexibase
-1.59,-3.36,-7.19,3,4,0, 119.12, 3

Similar to: 2170258, 1736742,
19230192
 
#22

ChemMol: 97800504, 30116947, 1201547, 83601393, 30202739
eMolecules: 489620, 505864, 983890
Molport: MolPort-001-765-335, MolPort-002-317-296, MolPort-001-788-323
Acros Organics: 13267, 20745
ACT Chemical BB: ACT09183...171 total

ref: mol2, SDF, SMILES, flexibase
-1.59,-3.33,-7.78,3,4,0, 119.12, 3

Similar to: 2170258, 1736742,
34781219
 
#23

ChemMol: 30104782, 44025003, 30104915, 30202785
eMolecules: 501174, 1972790, 1053825
Acros Organics: RH01792
ACT Chemical BB: ACT03144, ACT08362
AF ChemPharm: SC-2401...136 total

ref: mol2, SDF, SMILES, flexibase
0.99,3.83,-6.65,3,4,0, 218.256, 4

Similar to: 38247180, 38527658, 34039996, 34329005, 34329006, ... 12 in total.
34781220
 
#24

ChemMol: 30101275, 30116895, 30104915, 30200462
eMolecules: 1053825, 1972790
Acros Organics: 37665, RH01792
ACT Chemical BB: ACT08801, ACT08362
AF ChemPharm: SC-2401...160 total

ref: mol2, SDF, SMILES, flexibase
0.99,3.86,-7.79,3,4,0, 218.256, 4

Similar to: 38201492, 38227550, 38247180, 38419197, ... 14 in total.
34781692
 
#25

ChemMol: 44005687, 30202544, 30107074
eMolecules: 515547, 1012339
Molport: MolPort-001-792-200
Acros Organics: 12010
ACT Chemical BB: ACT08376...128 total

ref: mol2, SDF, SMILES, flexibase
-1.02,-0.75,-5.82,2,3,0, 89.094, 2
54954739
 
#26

ChemMol: 30116936, 30202618
eMolecules: 2859430
Molport: MolPort-002-465-605, MolPort-002-497-761
ACT Chemical BB: ACT08412
AKOS: AKOS005612985...108 total

ref: mol2, SDF, SMILES, flexibase
0.69,2.05,-4.62,2,3,0, 145.202, 4
54954747
 
#27

ChemMol: 97800516, 44017785, 30202410, 44007698
eMolecules: 476070
Molport: MolPort-023-220-223
Acros Organics: 40043
ACT Chemical BB: ACT08470...124 total

ref: mol2, SDF, SMILES, flexibase
-0.24,0.91,-3.82,2,3,0, 117.148, 3
54954749
 
#28

ChemMol: 30201375, 30202410, 97800516, 1201554
eMolecules: 476070
Molport: MolPort-023-220-223
Acros Organics: 40043
ACT Chemical BB: ACT00044...141 total

ref: mol2, SDF, SMILES, flexibase
-0.24,0.91,-5.13,2,3,0, 117.148, 3
54954741
 
#29

ChemMol: 30202771, 44004726, 30105624, 97800521
eMolecules: 531661, 2858697, 889244
Molport: MolPort-002-465-299, MolPort-002-497-769, MolPort-023-220-040, MolPort-000-000-941, MolPort-003-939-357
Acros Organics: 22926
ACT Chemical BB: ACT08510...162 total

ref: mol2, SDF, SMILES, flexibase
0.16,1.44,-3.48,2,3,0, 131.175, 3

Similar to: 39372981,
53151193
 
#30

ChemMol: 30202680
eMolecules: 749248, 1972402
Molport: MolPort-023-220-220, MolPort-001-760-766, MolPort-002-780-203
Acros Organics: 44559
ACT Chemical BB: ACT02244...134 total

ref: mol2, SDF, SMILES, flexibase
0.35,1.16,-4.27,1,3,0, 129.159, 2

Similar to: 53151192, 391900, 391901,
19943557
 
#31

ChemMol: 44015035, 30107052
ACT Chemical BB: ACT08612
AK Scientific: X4316
Aldrich CPR: S787213|ALDRICH
Alfa-Aesar: H63197...71 total

ref: mol2, SDF, SMILES, flexibase
-1.14,0.81,-6.74,2,5,0, 161.157, 5

Similar to: 1703665, 2169389,
54954737
 
#32

ChemMol: 44009540, 30116433, 30202617
eMolecules: 2859430, 524795
Molport: MolPort-002-497-761, MolPort-003-937-804, MolPort-002-465-605
Acros Organics: 12513
ACT Chemical BB: ACT08766...154 total

ref: mol2, SDF, SMILES, flexibase
0.69,2.1,-3.44,2,3,0, 145.202, 4
19419113
 
#33

ChemMol: 97800502, 30101207, 2100276, 30202531
eMolecules: 530669, 884235, 1012257
Molport: MolPort-001-791-392, MolPort-002-497-765
Scientific Exchange (make on demand): F-033611
Acros Organics: 13032...222 total

ref: mol2, SDF, SMILES, flexibase
0.84,3.76,-5.76,2,3,0, 179.219, 4

Similar to: 19720118, 33817831, 34472727,
2584431
 
#34

ChemMol: 30116164, 83601182
eMolecules: 527962, 483380
Molport: MolPort-001-793-326, MolPort-001-768-483
Acorn PharmaTech: ACN-S003573
Acros Organics: 42598...93 total

ref: mol2, SDF, SMILES, flexibase
2.63,-2.65,-6.43,2,4,0, 175.228, 4

Similar to: 32008227, 32008229, 34562422, 34585919, 34599782, ... 9 in total.
19943814
 
#35

ChemMol: 30107055, 83601512, 30200493
eMolecules: 889029, 36736303
Molport: MolPort-023-220-222, MolPort-003-929-578, MolPort-006-109-372
Acros Organics: 11179
ACT Chemical BB: ACT08955...113 total

ref: mol2, SDF, SMILES, flexibase
-0.26,1.16,-3.67,2,3,0, 149.215, 4
hi: mol2, SDF, SMILES, flexibase
-0.26,1.67,-37.06,2,3,-1, 148.207, 4

Similar to: 162630, 162632,
2562468
 
#36

ChemMol: 97602785, 30107163, 44005715
ACT Chemical BB: ACT09134
AK Scientific: V0453
AKOS: AKOS015908605
Alfa-Aesar: H66211...36 total

ref: mol2, SDF, SMILES, flexibase
4.18,-3.73,-10.13,3,5,0, 327.38, 6

Similar to: 38261300, 38261301,
49625432
 
#37

ChemMol: 97602715, 44009541
ACT Chemical BB: ACT09379
AK Scientific: V0865
AKOS: AKOS015919529
Alfa-Aesar: H63727...47 total

ref: mol2, SDF, SMILES, flexibase
0.90,2.12,-8.69,3,6,0, 260.334, 9

Similar to: 34396609,
16697209
 
#38

ChemMol: 44018641
ACT Chemical BB: ACT09406
AK Scientific: W4863
AKOS: AKOS015920485
Amadis Chemical: A848434...22 total

ref: mol2, SDF, SMILES, flexibase
4.56,3.85,-12.1,3,7,0, 366.458, 12

Similar to: 32098784, 34218243, 34220315, 34399936, 34564560, ... 9 in total.
35052108
 
#39

ChemMol: 30202517
ACT Chemical BB: ACT09528, ACT10063
AK Scientific: 0231AB
AKOS: AKOS015842543
Aldrich CPR: S758051|ALDRICH...52 total

ref: mol2, SDF, SMILES, flexibase
2.32,9.53,-11.2,2,5,0, 327.38, 10

Similar to: 32228279, 32228281,
35529671
 
#40

ChemMol: 1030551, 30112007, 44010371
Molport: MolPort-002-498-099
A&J Pharmtech: AJ-00748
ACT Chemical BB: ACT09544
Aldrich CPR: CDS003704|ALDRICH...42 total

ref: mol2, SDF, SMILES, flexibase
-1.69,-2.39,-12.97,4,5,0, 160.173, 5

Similar to: 33949511,
34722398
 
#41

ChemMol: 96708273, 44019765
Molport: MolPort-002-500-072, MolPort-020-237-551
A&J Pharmtech: AJ-00736
ACT Chemical BB: ACT09574
AK Scientific: W5639...38 total

ref: mol2, SDF, SMILES, flexibase
0.81,1.78,-10.28,2,6,0, 246.307, 9

Similar to: 38222079, 38295144,
2549345
 
#42

ChemMol: 30109180, 44001681
Molport: MolPort-002-501-575
ACT Chemical BB: ACT10845, ACT09589
AK Scientific: U909, W6872, X3038
AKOS: AKOS015841248...59 total

ref: mol2, SDF, SMILES, flexibase
1.06,1.62,-14.55,2,5,0, 214.265, 3

Similar to: 34397048,
35050972
 
#43

ChemMol: 44014032, 44011524, 30110311
eMolecules: 4423490, 594397
Molport: MolPort-003-959-568, MolPort-002-560-294, MolPort-020-003-816
ACT Chemical BB: ACT09681
AK Scientific: X5883...76 total

ref: mol2, SDF, SMILES, flexibase
0.00,0.66,-6.25,3,4,0, 195.218, 5

Similar to: 36457405, 38293722, 42462859, 42462861, ... 10 in total.
30678414
 
#44

ChemMol: 44019796, 30116554
ACT Chemical BB: ACT09716
AK Scientific: W6237
AKOS: AKOS015919617
Anward: ANW-48377...30 total

ref: mol2, SDF, SMILES, flexibase
1.91,6.7,-6.75,0,5,0, 239.662, 3
1628053
 
#45

eMolecules: 628289
Molport: MolPort-001-828-549
Scientific Exchange (make on demand): R-007397
ACT Chemical BB: ACT09835
AKOS: AKOS002131781...28 total

ref: mol2, SDF, SMILES, flexibase
1.69,3.22,-11.23,1,5,0, 257.311, 6

Similar to: 6358369, 6593807, 33803039, 33842892, 33845740, ... 9 in total.
55157318
 
#46

ACT Chemical BB: ACT09920
AK Scientific: W7421
Aldrich CPR: PH008002|ALDRICH
American Custom Chemicals Corp.: AAA0004514, AAA0003909
Anward: ANW-46445...44 total

ref: mol2, SDF, SMILES, flexibase
1.03,1.88,-7.23,2,4,0, 221.256, 4
35052107
 
#47

ChemMol: 30107065, 30202516, 44005681
ACT Chemical BB: ACT10824, ACT10063
AK Scientific: 6287AB
Aldrich CPR: S758051|ALDRICH
Alfa-Aesar: H63598...76 total

ref: mol2, SDF, SMILES, flexibase
2.32,9.55,-9.35,2,5,0, 327.38, 10

Similar to: 39023934, 2579052, 2384850, 34451265, 34856083, ... 8 in total.
2379667
 
#48

ChemMol: 30112803, 97602784, 44000340, 44016496, 96705484
Acros Organics: 36829
ACT Chemical BB: ACT10076
AK Scientific: W7939, X9212
AKOS: AKOS005146339...85 total

ref: mol2, SDF, SMILES, flexibase
1.59,4.46,-11.26,0,4,0, 199.25, 3

Similar to: 2564774, 34592206, 34592208, 36373155, ... 4 in total.
34620507
 
#49

ChemMol: 44024210
ACT Chemical BB: ACT10487
Apexmol Building Blocks: AM81745
Ark Pharm Building Blocks: AK161881
Bide Pharmatech BB: BD32602...26 total

ref: mol2, SDF, SMILES, flexibase
0.42,4.6,-7.75,2,5,0, 227.26, 10

Similar to: 38202239, 38202240, 2584443, 2386629, ... 4 in total.
54967484
 
#50

ChemMol: 30200897, 97603239, 44020565
eMolecules: 30519004
Molport: MolPort-002-499-488, MolPort-003-981-764, MolPort-008-326-657
A&J Pharmtech: AJ-00510
ACB Blocks: MIX-0326...57 total

ref: mol2, SDF, SMILES, flexibase
0.90,1.35,-4,2,3,0, 131.175, 3

Similar to: 4237617, 4237618,
1640317
 
#51

Molport: MolPort-020-003-937
Scientific Exchange (make on demand): M-982075
ACT Chemical BB: ACT10727
AK Scientific: X5788
Aldrich CPR: S789291|ALDRICH...33 total

ref: mol2, SDF, SMILES, flexibase
3.53,0.74,-7.08,1,5,0, 237.255, 6

Similar to: 34464687, 34612584, 34612587, 34627054, ... 4 in total.
55343129
 
#52

ChemMol: 44003889, 30202529, 30104328
eMolecules: 7416927
Molport: MolPort-011-284-666
ACT Chemical BB: ACT10802
AK Scientific: W5554...78 total

ref: mol2, SDF, SMILES, flexibase
2.03,5.84,-4.42,2,3,0, 221.3, 5

Similar to: 6349989, 6350154,
2391066
 
#53

ChemMol: 30109888, 30200574
ACT Chemical BB: ACT10827
AKOS: AKOS015840279
Alfa-Aesar: H65570
Apexmol Building Blocks: AM82257...47 total

ref: mol2, SDF, SMILES, flexibase
2.35,-5.18,-15.66,4,6,0, 252.27, 6

Similar to: 22051125, 22051129, 22051134,
2556560
 
#54

ChemMol: 44014070, 44001681, 30116155, 44027453, 30109180
ACT Chemical BB: ACT10845, ACT03202
AK Scientific: U909, W6872
AKOS: AKOS008521529, AKOS015841241, AKOS015894508
American Custom Chemicals Corp.: AAA0003139...58 total

ref: mol2, SDF, SMILES, flexibase
1.06,1.63,-14.71,2,5,0, 214.265, 3

Similar to: 34397048,
1564876
 
#55

eMolecules: 1112786
Molport: MolPort-001-842-279
ACT Chemical BB: ACT10868
Indofine: 04-2505
Labotest: LT00452316...18 total

ref: mol2, SDF, SMILES, flexibase
2.92,-1.54,-6.92,2,6,0, 267.281, 7

Similar to: 6494314, 32211668, 32211672, 32211674, 32211678, ... 14 in total.
1564877
 
#56

eMolecules: 1112786
Molport: MolPort-001-842-279
ACT Chemical BB: ACT10868
AK Scientific: 8403AB, X8478, 5855AE, V6700
Alfa-Aesar: H66376...36 total

ref: mol2, SDF, SMILES, flexibase
2.92,-1.28,-7.15,2,6,0, 267.281, 7

Similar to: 6494314, 32211668, 32211672, 32211674, 32211678, ... 11 in total.
1564878
 
#57

eMolecules: 1112786
Molport: MolPort-001-842-279
ACT Chemical BB: ACT10868
Ark Pharm Building Blocks: AK-49932
BePharm Building Blocks: B14878...20 total

ref: mol2, SDF, SMILES, flexibase
2.92,-1.74,-6.93,2,6,0, 267.281, 7

Similar to: 6494314, 32211668, 32211672, 32211674, 32211678, ... 11 in total.
1564879
 
#58

eMolecules: 1112786
Molport: MolPort-001-842-279
ACT Chemical BB: ACT10868
Ark Pharm Building Blocks: AK-86809, AK-49932
BePharm Building Blocks: B14878...23 total

ref: mol2, SDF, SMILES, flexibase
2.92,-1.54,-6.92,2,6,0, 267.281, 7

Similar to: 6494314, 32211668, 32211672, 32211674, 32211678, ... 11 in total.
55388214
 
#59

ChemMol: 97800749, 30201406
Molport: MolPort-016-581-058
ACT Chemical BB: ACT10881
AK Scientific: K007, 8698AA
AKOS: AKOS015847161...68 total

ref: mol2, SDF, SMILES, flexibase
2.91,8.02,-11.88,3,6,0, 370.449, 12

Similar to: 4521942, 4787276,
6386475
 
#60

Molport: MolPort-002-494-465
ACT Chemical BB: ACT10903
AK Scientific: W8080
Amadis Chemical: A846484
Anward: ANW-74984...34 total

ref: mol2, SDF, SMILES, flexibase
1.74,-0.85,-6.12,1,3,0, 179.647, 4

Similar to: 34383950, 34616918,
1095288
 
#61

ChemMol: 97300881, 44002417, 44010856, 30200985, 30109333, 96707966, 97300880, 97602761, 30108667
eMolecules: 806945
Molport: MolPort-000-006-062, MolPort-003-981-807
ACT Chemical BB: ACT10907
AK Scientific: S965...91 total

ref: mol2, SDF, SMILES, flexibase
1.63,2.24,-12.05,0,5,0, 229.276, 4

Similar to: 33802039, 33802040, 33802041, 33802042, 33947556, ... 44 in total.
2564774
 
#62

ChemMol: 44000340, 44014546, 30112803
Acros Organics: 37623
ACT Chemical BB: ACT10909
AK Scientific: W8154, X9212
Alfa-Aesar: H26294...74 total

ref: mol2, SDF, SMILES, flexibase
1.59,5.25,-12.93,0,4,0, 199.25, 3

Similar to: 36373155, 2379667,
2556976
 
#63

Molport: MolPort-001-793-073
Acros Organics: 43477
ACT Chemical BB: ACT10916
AK Scientific: Z5136
Alfa-Aesar: H26014...39 total

ref: mol2, SDF, SMILES, flexibase
1.78,2.49,-4.96,1,3,0, 157.213, 4

Similar to: 34326575, 34351300, 36458875,
55345602
 
#64

Molport: MolPort-016-580-266
ACT Chemical BB: ACT10932
AK Scientific: V8522
Aldrich CPR: CDS006085|ALDRICH
Alfa-Aesar: H63274...30 total

ref: mol2, SDF, SMILES, flexibase
1.55,3.01,-5.67,3,4,0, 237.299, 5

Similar to: 4899617, 25494346, 25494350, 25494354, 25494358, ... 7 in total.
8614785
 
#65

ChemMol: 44002089
Molport: MolPort-002-499-442
ACT Chemical BB: ACT10944
AK Scientific: W9525
Alfa-Aesar: H53406...52 total

ref: mol2, SDF, SMILES, flexibase
1.29,2.43,-5.24,1,3,0, 155.197, 3

Similar to: 34826149, 44241364,
2558986
 
#66

ChemMol: 44025258, 1030322, 97600009
Acros Organics: 43846
ACT Chemical BB: ACT10948
AK Scientific: V1352
Alfa-Aesar: H61638...52 total

ref: mol2, SDF, SMILES, flexibase
3.79,-0.07,-5.3,1,5,0, 329.134, 6
2560531
 
#67

ChemMol: 97800593, 1036907, 30109212, 2100388, 42305340, 44010668
Molport: MolPort-020-007-840
Scientific Exchange (make on demand): Z-052528
Acorn PharmaTech: ACN-S002006, ACN-S003617
Acros Organics: 36472...88 total

ref: mol2, SDF, SMILES, flexibase
0.75,3.56,-4.77,2,1,0, 117.151, 0

Similar to: 39048980, 39049063, 39049066, 39049183, ... 4 in total.
406213
 
#68

ChemMol: 30106777, 98002072, 1036759, 44005535, 1202435
eMolecules: 1939756
Molport: MolPort-002-499-659
Scientific Exchange (make on demand): Z-073857
ACT Chemical BB: ACT00157...73 total

ref: mol2, SDF, SMILES, flexibase
2.21,-1.47,-3.4,2,2,0, 202.051, 1
4271989
 
#69

ChemMol: 83600291, 30116267, 98000968, 1030231
Acros Organics: 34824
ACT Chemical BB: ACT00253
Alfa-Aesar: A14130
Angene Building Blocks: AGN-PC-0CT0EG...68 total

ref: mol2, SDF, SMILES, flexibase
0.35,-0.3,-5.03,3,2,0, 123.155, 1

Similar to: 33790863, 1258940,
2534483
 
#70

ChemMol: 30107206, 44005769
A&J Pharmtech: AJ-00861
Acorn PharmaTech: ACN-S002660
Acros Organics: 37137
ACT Chemical BB: ACT00296...62 total

ref: mol2, SDF, SMILES, flexibase
1.86,5.76,-3.96,0,0,0, 120.126, 0

Similar to: 39049173,
153133
 
#71

ChemMol: 44015729, 98000993, 1202555, 97800602, 1031042
eMolecules: 907303, 497592
ACB Blocks: AHY-0011
Acorn PharmaTech: ACN-S003743
ACT Chemical BB: ACT00457...101 total

ref: mol2, SDF, SMILES, flexibase
1.44,2.33,-3.57,3,2,0, 144.124, 1

Similar to: 2384130,
153109
 
#72

ChemMol: 1031036, 1201295, 44004657, 83603685, 44009695, 30105522, 1202551, 98000928, 1031035, 98001261
eMolecules: 1012340, 483284
Acorn PharmaTech: ACN-000258
Acros Organics: 16705
ACT Chemical BB: ACT00607...122 total

ref: mol2, SDF, SMILES, flexibase
1.30,2.26,-3.83,3,2,0, 126.134, 1
26894744
 
#73

ChemMol: 97802796, 44028514
eMolecules: 31236074
Molport: MolPort-009-019-947
Acorn PharmaTech: ACN-000235
ACT Chemical BB: ACT00613...43 total

ref: mol2, SDF, SMILES, flexibase
2.96,6.32,-4.09,0,2,0, 229.073, 2

Similar to: 32264133, 2599125,
2243112
 
#74

ChemMol: 44015705, 1201298, 44015708, 98002244, 1031009
Acorn PharmaTech: ACN-S004560
ACT Chemical BB: ACT00750
AK Scientific: I601, W8984
AKOS: AKOS015849209...78 total

ref: mol2, SDF, SMILES, flexibase
1.44,2.3,-5.31,3,2,0, 144.124, 1
16697503
 
#75

ChemMol: 44019231
Molport: MolPort-002-462-000
ACT Chemical BB: ACT00880
AK Scientific: W6202
Anward: ANW-46442...23 total

ref: mol2, SDF, SMILES, flexibase
2.39,6.23,-7.87,0,1,0, 168.623, 2

Similar to: 39264223,
389573
 
#76

ChemMol: 1202434, 1036751, 44003456, 30103631, 98001580
eMolecules: 498610
Molport: MolPort-001-777-789
Acros Organics: 37588
ACT Chemical BB: ACT00950...73 total

ref: mol2, SDF, SMILES, flexibase
1.16,1.72,-6.25,2,2,0, 141.145, 1
153536
 
#77

ChemMol: 44013281
ACT Chemical BB: ACT01035
AK Scientific: W4518
AKOS: AKOS000115659
Alfa-Aesar: L20156...41 total

ref: mol2, SDF, SMILES, flexibase
3.77,2.45,-7.07,0,1,0, 210.704, 3

Similar to: 3887906,
4235226
 
#78

ChemMol: 44013446, 97804635
ACT Chemical BB: ACT01086
AK Scientific: X2855
AKOS: AKOS013212843
Anward: ANW-47402...33 total

ref: mol2, SDF, SMILES, flexibase
4.10,2.01,-3.86,0,2,0, 257.127, 3

Similar to: 32222356, 32222357, 32222739, 32222745, ... 4 in total.
153114
 
#79

ChemMol: 30100913, 1031065, 97800553, 44005315
eMolecules: 839429, 532500
Molport: MolPort-000-872-031, MolPort-000-861-556
Acorn PharmaTech: ACN-000241
Acros Organics: 13916...125 total

ref: mol2, SDF, SMILES, flexibase
1.63,2.85,-3.42,3,2,0, 122.171, 1

Similar to: 39276592,
156709
 
#80

ChemMol: 44009077, 1202613, 98000561, 30110629
eMolecules: 481831
Molport: MolPort-000-871-206
TCM Database @ Taiwan: tcm03_003980, 26394
Acros Organics: 16277...180 total

ref: mol2, SDF, SMILES, flexibase
1.25,1.39,-7.98,1,2,0, 122.123, 1
hi: mol2, SDF, SMILES, flexibase
1.25,2.16,-42.7,0,2,-1, 121.115, 1
330136
 
#81

ChemMol: 30112319, 1202654, 1034205, 98000270
eMolecules: 493547
Molport: MolPort-000-871-223
Scientific Exchange (make on demand): POD_75/0325
TCM Database @ Taiwan: 29805...121 total

ref: mol2, SDF, SMILES, flexibase
1.36,2.07,-8.13,1,2,0, 136.15, 1
hi: mol2, SDF, SMILES, flexibase
2.57,1.49,-101.22,0,2,-2, 134.134, 1
hi: mol2, SDF, SMILES, flexibase
1.36,2.92,-42.63,0,2,-1, 135.142, 1
1621442
 
#82

ChemMol: 98000279, 30103086, 1200032, 44001057, 1030236, 42305387
eMolecules: 481826
Molport: MolPort-000-871-738
Scientific Exchange (make on demand): X-076117
Acros Organics: 16276...75 total

ref: mol2, SDF, SMILES, flexibase
2.40,2.01,-5.72,0,1,0, 196.047, 1
164599
 
#83

ChemMol: 1031288, 42305389, 1200381, 44008935, 98000330, 30105772
eMolecules: 484598
Acros Organics: 10671
ACT Chemical BB: ACT01176
AK Scientific: L662...84 total

ref: mol2, SDF, SMILES, flexibase
2.50,1.82,-4.22,0,1,0, 182.02, 0

Similar to: 1260496, 39250540, 39648655,
1845655
 
#84

ChemMol: 30101588, 44008738, 1200019, 98000028, 1030032
eMolecules: 484673
Acros Organics: 18178
ACT Chemical BB: ACT01196
Alfa-Aesar: A15075...64 total

ref: mol2, SDF, SMILES, flexibase
3.43,6.5,-2.77,0,0,0, 249.933, 1
403114
 
#85

ChemMol: 44005237, 97602793, 1030723, 30106252
Molport: MolPort-019-903-439
ACT Chemical BB: ACT01853
AK Scientific: V0415
AKOS: AKOS015842713...65 total

ref: mol2, SDF, SMILES, flexibase
2.04,1.47,-6.96,0,4,0, 233.267, 3

Similar to: 33979053, 34218806, 34423767, 34546345, 34555137, ... 19 in total.
1433125
 
#86

ChemMol: 30108450, 97801588, 44005852
eMolecules: 1837626
Molport: MolPort-000-001-451
A&J Pharmtech: AJ-00614
Acorn PharmaTech: ACN-S003076...69 total

ref: mol2, SDF, SMILES, flexibase
3.03,-0.56,-7.9,1,4,0, 213.277, 3

Similar to: 36880176, 36880177, 36880180, 38277888, 44240231, ... 5 in total.
88591
 
#87

ChemMol: 44012079, 1031049, 44000495, 30101526, 97800534
eMolecules: 984337, 483326
Molport: MolPort-001-788-596, MolPort-001-769-972
Acorn PharmaTech: ACN-F000245, ACN-000245
ACT Chemical BB: ACT02736...93 total

ref: mol2, SDF, SMILES, flexibase
1.94,2.85,-3.14,3,2,0, 187.04, 1
2390003
 
#88

ChemMol: 44013261, 1201771, 98001288
eMolecules: 508762
Molport: MolPort-001-769-410
Acros Organics: 39854
ACT Chemical BB: ACT02943...53 total

ref: mol2, SDF, SMILES, flexibase
1.86,2.2,-6.82,1,2,0, 136.15, 1
160798
 
#89

ChemMol: 44003169, 30103335
eMolecules: 484922
Molport: MolPort-000-860-789
Acros Organics: 17358
ACT Chemical BB: ACT02958...88 total

ref: mol2, SDF, SMILES, flexibase
1.00,4.81,-6.95,0,3,0, 156.181, 3

Similar to: 1561951, 34618556, 34618558, 38218650, 38218651, ... 7 in total.
160796
 
#90

ChemMol: 44003169, 30103335
eMolecules: 484922
Molport: MolPort-000-860-789
Acros Organics: 17358
ACT Chemical BB: ACT02958...84 total

ref: mol2, SDF, SMILES, flexibase
1.00,4.81,-6.96,0,3,0, 156.181, 3

Similar to: 1561951, 34618556, 34618558, 38218650, 38218651, ... 7 in total.
153203
 
#91

ChemMol: 83603546, 1031091, 30116353, 44028861
eMolecules: 518963, 1014503
Molport: MolPort-001-794-006
ACB Blocks: AHY-0031
Acorn PharmaTech: ACN-S004512...91 total

ref: mol2, SDF, SMILES, flexibase
2.01,3.38,-3.62,3,2,0, 136.198, 1
16053620
 
#92

ChemMol: 2100288, 44007369, 96705401
eMolecules: 523705
Acros Organics: 27003
ACT Chemical BB: ACT02992
AK Scientific: U512...56 total

ref: mol2, SDF, SMILES, flexibase
1.51,3.26,-8.63,1,1,0, 132.162, 0

Similar to: 32189029, 34427344, 39017393, 39365254, ... 4 in total.
139547
 
#93

ChemMol: 97801142, 44001114, 1031022, 44015591, 83601179
eMolecules: 500270, 719193
Molport: MolPort-001-773-276
ACB Blocks: AHY-0046
Acorn PharmaTech: ACN-S003714...97 total

ref: mol2, SDF, SMILES, flexibase
2.05,-2.2,-3.81,3,2,0, 176.141, 2
159631
 
#94

ChemMol: 44004238, 1031014, 30104231, 44003831, 1031020, 97801286, 30104768
eMolecules: 723039, 505872
Scientific Exchange (make on demand): F-367038
Acorn PharmaTech: ACN-S004445, ACN-S002611
Acros Organics: SPB06880...104 total

ref: mol2, SDF, SMILES, flexibase
2.08,-2.2,-4.12,3,2,0, 176.141, 2
16158134
 
#95

ChemMol: 44012973, 98002914
ACT Chemical BB: ACT03042
AK Scientific: X3094
Alfa-Aesar: H60426
Angene Building Blocks: AGN-PC-0N6K9M...41 total

ref: mol2, SDF, SMILES, flexibase
1.33,-1.14,-5.81,2,2,0, 128.102, 0
12359134
 
#96

ChemMol: 30112596, 44007071, 98002943
ACT Chemical BB: ACT03183
Alfa-Aesar: H26015
Angene Building Blocks: AGN-PC-001Z2E
Anward: ANW-22326...45 total

ref: mol2, SDF, SMILES, flexibase
3.44,-0.84,-9.28,1,4,0, 247.294, 4

Similar to: 34397820, 34437403, 34529827, 38226363, 38226364, ... 7 in total.
57573
 
#97

ChemMol: 44005788, 30107217
ACT Chemical BB: ACT03328
AK Scientific: O990
Aldrich CPR: S436178|ALDRICH
Alfa-Aesar: B22140...53 total

ref: mol2, SDF, SMILES, flexibase
1.53,6.84,-6.16,0,4,0, 200.234, 6

Similar to: 34327579, 34327581, 34353152, 34625655, 44236412, ... 5 in total.
2510171
 
#98

ChemMol: 44009862, 1201876, 30108723, 83600728, 98001374, 1037440
Scientific Exchange Building Blocks: F-453388
Acros Organics: 39803
ACT Chemical BB: ACT03441
AK Scientific: Q280...60 total

ref: mol2, SDF, SMILES, flexibase
1.85,1.83,-5.39,1,2,0, 156.568, 1
5316724
 
#99

ACT Chemical BB: ACT03445
Fluorochem: 302078
ChemDB: 7602597
PubChem: 13910793, 82314
SureChEMBL: SCHEMBL1068218...8 total

ref: mol2, SDF, SMILES, flexibase
1.62,0.54,-5.69,2,3,0, 193.246, 5

Similar to: 5325509, 2530711, 152557, 1575717, ... 4 in total.
1691751
 
#100

ChemMol: 44020520
ACT Chemical BB: ACT03459
Amadis Chemical: A848776
Ark Pharm Building Blocks: AK-56751
BOC Sciences BB: 100627-39-2...10 total

ref: mol2, SDF, SMILES, flexibase
4.17,0.27,-13.98,0,7,0, 419.499, 11

Similar to: 34445801,

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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 = 735 ) limit 0,100

Smiles were