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Supplier information; Representations
Properties:xLogP, ap & p desolvation, HBD,HBA,Charge,Mwt,NRB
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31533
 
#1

ChemMol: 80100337, 2200323
eMolecules: 828176
Scientific Exchange: POD_07/0761
AK Scientific: 6346AE
AKOS: AKOS000274165...54 total

ref: mol2, SDF, SMILES, flexibase
1.34,5.11,-46.48,1,5,-1, 236.247, 6
lo: mol2, SDF, SMILES, flexibase
1.34,3.14,-10.16,2,5,0, 237.255, 6

Similar to: 627271, 31979561, 34554898, 37788534, 37793248, ... 7 in total.
12138008
 
#2

eMolecules: 13123059
Molport: MolPort-002-785-972
Scientific Exchange (make on demand): F-182573
AKOS: AKOS000502551
Alinda: IBS-L0057165...20 total

ref: mol2, SDF, SMILES, flexibase
1.25,2.53,-11.78,2,3,0, 183.182, 3

Similar to: 12138009,
12138009
 
#3

eMolecules: 13123059
Molport: MolPort-002-785-972
Scientific Exchange (make on demand): F-182573
AKOS: AKOS000502551
Alinda: IBS-L0057165...20 total

ref: mol2, SDF, SMILES, flexibase
1.25,2.57,-11.76,2,3,0, 183.182, 3

Similar to: 12138008,
9777668
 
#4

eMolecules: 7818050
Molport: MolPort-002-787-242
Scientific Exchange (make on demand): F-077519
AKOS: AKOS000502917
Alinda: IBS-L0057115...22 total

ref: mol2, SDF, SMILES, flexibase
2.76,-0.08,-11.47,2,3,0, 221.3, 5

Similar to: 40456769, 40456770,
10154881
 
#5

eMolecules: 13123034
Molport: MolPort-002-787-891
Scientific Exchange (make on demand): F-176337
AKOS: AKOS000504053
Alinda: IBS-L0056757...19 total

ref: mol2, SDF, SMILES, flexibase
1.14,3.81,-12.6,2,3,0, 191.23, 3

Similar to: 5171889,
12137875
 
#6

eMolecules: 5987465
Molport: MolPort-002-786-842
Scientific Exchange (make on demand): F-187102
AKOS: AKOS000503758
Alinda: IBS-L0056656...26 total

ref: mol2, SDF, SMILES, flexibase
1.91,3.68,-12.23,2,3,0, 193.246, 3

Similar to: 12137876,
12137876
 
#7

eMolecules: 5987465
Molport: MolPort-002-786-842
Scientific Exchange (make on demand): F-187102
AKOS: AKOS000503758
Alinda: IBS-L0056656...25 total

ref: mol2, SDF, SMILES, flexibase
1.91,3.72,-12.27,2,3,0, 193.246, 3

Similar to: 12137875,
8722769
 
#8

eMolecules: 3770756
Molport: MolPort-002-786-073
Scientific Exchange (make on demand): F-116116
AKOS: AKOS000299359
Alinda: IBS-L0055466...26 total

ref: mol2, SDF, SMILES, flexibase
1.53,3.17,-11.94,2,3,0, 179.219, 3

Similar to: 37094024, 37094191,
258202
 
#9

eMolecules: 29806979
Molport: MolPort-001-502-680
AK Scientific: HTS000976, 5447AD
AKOS: AKOS000166900
Alinda: IVK/8077432...31 total

ref: mol2, SDF, SMILES, flexibase
0.44,4.06,-16.24,1,3,0, 192.193, 3

Similar to: 5307263, 41698477, 44811038, 44811040, 44826091, ... 6 in total.
11802086
 
#10

eMolecules: 25932949
Molport: MolPort-000-886-027
Scientific Exchange (make on demand): M-153988
Alinda: IVK/9186758
American Custom Chemicals Corp.: HCH0257552...23 total

ref: mol2, SDF, SMILES, flexibase
3.53,3.53,-5.8,1,3,0, 244.088, 3
11800455
 
#11

Otava BB Make-to-order: 7020682341
PubChem: 42179836, 22683870
ref: mol2, SDF, SMILES, flexibase
4.12,5.31,-8.57,1,4,0, 237.299, 7
11799830
 
#12

American Custom Chemicals Corp.: HCH0257252
Otava BB Make-to-order: 7020682082
AKOS BB (make-on-demand): AKOS000304725
PubChem: 22683655
Enamine BB Make on Demand: BBV-36750171...6 total

ref: mol2, SDF, SMILES, flexibase
3.15,2.29,-7.65,1,3,0, 230.061, 2
15979621
 
#13

eMolecules: 206976850
Molport: MolPort-002-539-061
AKOS: AKOS002289736
IBScreen: STOCK1S-08749
Innovapharm: STT-00328459...20 total

ref: mol2, SDF, SMILES, flexibase
3.29,3.36,-5.72,1,3,0, 179.219, 4

Similar to: 43953602,
11957436
 
#14

Scientific Exchange (make on demand): M-406194
Aldrich CPR: PH003985|ALDRICH
Labotest: LT01688547
NCI Plated 2007: 30750
Otava: 6668542...13 total

ref: mol2, SDF, SMILES, flexibase
2.95,0.01,-6.9,2,3,0, 171.583, 1
ref: mol2, SDF, SMILES, flexibase
2.95,0.35,-5.53,2,3,0, 171.583, 1
hi: mol2, SDF, SMILES, flexibase
1.32,3.09,-36.54,1,3,-1, 170.575, 1
hi: mol2, SDF, SMILES, flexibase
2.95,0.78,-35.15,1,3,-1, 170.575, 1
hi: mol2, SDF, SMILES, flexibase
2.95,1.13,-38.86,1,3,-1, 170.575, 1

Similar to: 25887,
11891034
 
#15

Otava BB Make-to-order: 7020673574
PubChem: 20993334, 42257002
ref: mol2, SDF, SMILES, flexibase
4.36,6.71,-8.09,1,3,0, 241.29, 4
11864037
 
#16

Chembo Pharma: KB-110381
Otava BB Make-to-order: 7020671247
PubChem: 42233110, 20991358
Enamine BB Make on Demand: BBV-36750169
UORSY BB Make-on-demand: BBV-36750169...6 total

ref: mol2, SDF, SMILES, flexibase
4.36,5.06,-6.22,1,3,0, 207.273, 6
11961538
 
#17

Otava BB Make-to-order: 7020662732
ChemDB: 5497571
PubChem: 3433170
ref: mol2, SDF, SMILES, flexibase
4.46,5.01,-5.62,1,3,0, 227.691, 5
11958103
 
#18

Otava BB Make-to-order: 7020662081
PubChem: 20985788, 42311536
ref: mol2, SDF, SMILES, flexibase
3.61,4.2,-6.38,1,4,0, 223.272, 6
11955564
 
#19

Otava BB Make-to-order: 7020661630
PubChem: 20985398, 10035189
Enamine BB Make on Demand: BBV-36752251
UORSY BB Make-on-demand: BBV-36752251
ref: mol2, SDF, SMILES, flexibase
3.27,3.35,-5.14,1,3,0, 179.219, 4
16693132
 
#20

Chemstep: 57759
Otava BB Make-to-order: 7020661497
AsisChem (Depleted): ACLSC-120249
ChemDB: 4395983
PubChem: 5443371...8 total

ref: mol2, SDF, SMILES, flexibase
3.90,5.44,-8.09,1,3,0, 215.252, 3
11950852
 
#21

Otava BB Make-to-order: 7020660813
PubChem: 11171187
SureChEMBL: SCHEMBL7349126
ref: mol2, SDF, SMILES, flexibase
2.33,-1.17,-7.53,2,4,0, 167.164, 2
hi: mol2, SDF, SMILES, flexibase
2.33,-0.09,-49.51,1,4,-1, 166.156, 2
hi: mol2, SDF, SMILES, flexibase
0.70,1.91,-42.4,1,4,-1, 166.156, 2
32497020
 
#22

Innovapharm Building Blocks: BBS-00008333
Matrix Scientific: 034242
Zylexa Pharma BB: ZP-BB-TV005625
Innovapharm BB Make on Demand: BBV-00024353
Otava BB Make-to-order: 7020410237...11 total

ref: mol2, SDF, SMILES, flexibase
2.16,5.83,-126.65,4,2,2, 228.767, 5
mid: mol2, SDF, SMILES, flexibase
2.16,5.47,-32.13,3,2,1, 227.759, 5
mid: mol2, SDF, SMILES, flexibase
2.16,3.78,-45.88,3,2,1, 227.759, 5

Similar to: 34555194, 36775774, 36775776, 36786825, 36786826, ... 28 in total.
32497019
 
#23

Innovapharm Building Blocks: BBS-00008333
Matrix Scientific: 034242
Zylexa Pharma BB: ZP-BB-TV005625
Innovapharm BB Make on Demand: BBV-00024353
Otava BB Make-to-order: 7020410237...11 total

ref: mol2, SDF, SMILES, flexibase
2.16,6.2,-125.12,4,2,2, 228.767, 5
mid: mol2, SDF, SMILES, flexibase
2.16,6.1,-31.61,3,2,1, 227.759, 5
mid: mol2, SDF, SMILES, flexibase
2.16,4.41,-47.72,3,2,1, 227.759, 5

Similar to: 34456282, 34456283, 34555194, 36775774, 36775776, ... 36 in total.
169677
 
#24

ChemMol: 80100298, 2200284
eMolecules: 515950
Scientific Exchange (make on demand): E-068787
Acros Organics: 44248
AK Scientific: X6438...96 total

ref: mol2, SDF, SMILES, flexibase
3.50,0.98,-49.96,0,3,-1, 227.239, 4

Similar to: 8731837,
2685697
 
#25

eMolecules: 834683
Molport: MolPort-000-870-912
ChemBridge: 9073883
Enamine: Z56869424
Enamine Building Blocks: EN300-00120...22 total

ref: mol2, SDF, SMILES, flexibase
3.22,1.75,-44.16,0,3,-1, 221.276, 5

Similar to: 31972564, 36667493, 36670977, 36670978, 36670984, ... 6 in total.
265141
 
#26

ChemMol: 97801853
eMolecules: 3004486
Molport: MolPort-003-066-394
AK Scientific: 6880AD
AKOS: AKOS000298613...39 total

ref: mol2, SDF, SMILES, flexibase
1.13,5.36,-46.39,0,4,-1, 195.194, 5

Similar to: 34619734, 34940693, 36667506, 36671008, 36984769, ... 6 in total.
203312
 
#27

ChemMol: 97801506
eMolecules: 1556626
Molport: MolPort-002-029-140
Scientific Exchange (make on demand): C-025886
AK Scientific: 1978AB...45 total

ref: mol2, SDF, SMILES, flexibase
1.91,5.3,-44.82,0,3,-1, 179.195, 4

Similar to: 33727343, 36667491, 36670992, 36671007, 36671053, ... 8 in total.
1687430
 
#28

ChemMol: 44019066
eMolecules: 732318
Scientific Exchange (make on demand): X-007888
AKOS: AKOS000492771
Aldrich CPR: S700975|ALDRICH...35 total

ref: mol2, SDF, SMILES, flexibase
0.39,2.4,-47.52,1,4,-1, 172.204, 4

Similar to: 36466324, 37792866, 37792867,
1446446
 
#29

ChemMol: 2200590, 80100598
eMolecules: 33273492
Scientific Exchange (make on demand): POD_29/0503
AK Scientific: L353
AKOS: AKOS000263335...66 total

ref: mol2, SDF, SMILES, flexibase
2.89,1.18,-53.36,0,2,-1, 197.213, 2

Similar to: 34022271, 34381470, 34424734, 34524034, 34546079, ... 10 in total.
103261
 
#30

ChemMol: 80100236, 2200222
eMolecules: 828220
Molport: MolPort-000-900-529
Scientific Exchange (make on demand): Q-000141
AK Scientific: 8298AE...38 total

ref: mol2, SDF, SMILES, flexibase
2.43,0.52,-44.13,0,3,-1, 244.064, 3

Similar to: 5855641, 32151799,
54738
 
#31

ChemMol: 2200220, 80100234
eMolecules: 828218
Molport: MolPort-000-900-528
Scientific Exchange (make on demand): H-086946
AK Scientific: 2864AF...40 total

ref: mol2, SDF, SMILES, flexibase
2.43,0.48,-44.33,0,3,-1, 244.064, 3
38387
 
#32

eMolecules: 635929
Scientific Exchange: POD_07/0759
AK Scientific: 4813AB
AKOS: AKOS000269552
Alinda: IBS-L0007995...51 total

ref: mol2, SDF, SMILES, flexibase
1.35,4.65,-48.58,1,4,-1, 206.221, 4

Similar to: 39297670,
143585
 
#33

ChemMol: 2200212, 80100226
eMolecules: 847945
Molport: MolPort-000-889-478
Scientific Exchange (make on demand): H-001646
AK Scientific: 8414AD...47 total

ref: mol2, SDF, SMILES, flexibase
2.43,0.52,-47.75,0,3,-1, 244.064, 3
1871364
 
#34

eMolecules: 859577
Molport: MolPort-000-894-556
AKOS: AKOS000200725
Enamine Building Blocks: EN300-04258
Fluorochem: 344862...31 total

ref: mol2, SDF, SMILES, flexibase
2.21,6.9,-45.87,0,3,-1, 193.222, 5

Similar to: 32105344, 32109024, 32118113, 32118114, 32118115, ... 11 in total.
87943
 
#35

ChemMol: 30107424
eMolecules: 719228
Molport: MolPort-000-869-578
Acros Organics: 37921
AK Scientific: V3995...62 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.07,-48.04,0,3,-1, 230.037, 3

Similar to: 34940697,
143433
 
#36

ChemMol: 2200549, 80100557
eMolecules: 1385959
Molport: MolPort-001-505-946
Scientific Exchange (make on demand): K-013158
AK Scientific: 7278AD...43 total

ref: mol2, SDF, SMILES, flexibase
1.11,4.69,-45.94,1,4,-1, 198.242, 4
lo: mol2, SDF, SMILES, flexibase
1.11,2.71,-8.08,2,4,0, 199.25, 4

Similar to: 37791724, 37796644, 37796645, 37796646, 37796647, ... 5 in total.
4593460
 
#37

eMolecules: 6814993
AKOS: AKOS000130256
Ark Pharm Building Blocks: AK111625
ChemBridge BuildingBlocks: 9070925
Enamine Building Blocks: EN300-51883...28 total

ref: mol2, SDF, SMILES, flexibase
0.84,1.55,-43.16,3,3,1, 168.216, 3

Similar to: 34826739, 36459462, 39647373,
52530381
 
#38

eMolecules: 1334134
AKOS: AKOS000196074
Alfa-Aesar: H62699
Asinex: BAS01370085
Asinex Building Blocks: BAS01370085...42 total

ref: mol2, SDF, SMILES, flexibase
-0.16,4.7,-45.12,1,4,-1, 238.288, 3

Similar to: 4291753, 4291754,
52530380
 
#39

eMolecules: 1334134
AKOS: AKOS000196074
Alfa-Aesar: H62699
Asinex: BAS01370085
Asinex Building Blocks: BAS01370085...43 total

ref: mol2, SDF, SMILES, flexibase
-0.16,4.42,-46.05,1,4,-1, 238.288, 3

Similar to: 4291753, 4291754,
52530378
 
#40

eMolecules: 1334134
AKOS: AKOS000196074
Alfa-Aesar: H62699
Asinex: BAS01370085
Asinex Building Blocks: BAS01370085...45 total

ref: mol2, SDF, SMILES, flexibase
-0.16,4.72,-43.09,1,4,-1, 238.288, 3

Similar to: 4291753, 4291754,
52530377
 
#41

eMolecules: 1334134
AKOS: AKOS000196074
Alfa-Aesar: H62699
Asinex: BAS01370085
Asinex Building Blocks: BAS01370085...46 total

ref: mol2, SDF, SMILES, flexibase
-0.16,4.4,-43.18,1,4,-1, 238.288, 3

Similar to: 4291753, 4291754,
52530389
 
#42

eMolecules: 1287989
Scientific Exchange: POD_21/0425
AK Scientific: 8300AE
AKOS: AKOS000191126
Aldrich CPR: TMT00286|ALDRICH...43 total

ref: mol2, SDF, SMILES, flexibase
-0.01,5.34,-41.25,1,3,-1, 226.252, 2

Similar to: 4877935, 4877939, 4877943,
52530387
 
#43

eMolecules: 1287989
Scientific Exchange: POD_21/0425
AK Scientific: 8300AE
AKOS: AKOS000191126
Aldrich CPR: TMT00286|ALDRICH...44 total

ref: mol2, SDF, SMILES, flexibase
-0.01,5.17,-41.18,1,3,-1, 226.252, 2

Similar to: 4877935, 4877939, 4877943,
52530385
 
#44

eMolecules: 206844419, 1287989
Molport: MolPort-001-012-154
Scientific Exchange: POD_21/0425
AK Scientific: 8300AE
AKOS: AKOS003239900...60 total

ref: mol2, SDF, SMILES, flexibase
-0.01,5.28,-37.85,1,3,-1, 226.252, 2

Similar to: 4877935, 4877939, 4877943,
52530383
 
#45

eMolecules: 206844419, 1287989
Molport: MolPort-001-012-154
Scientific Exchange: POD_21/0425
AK Scientific: 8300AE
AKOS: AKOS000191126...62 total

ref: mol2, SDF, SMILES, flexibase
-0.01,4.84,-39.58,1,3,-1, 226.252, 2
2526131
 
#46

ChemMol: 80100286, 2200272
eMolecules: 848007
Molport: MolPort-000-889-516
Scientific Exchange (make on demand): M-910163
AK Scientific: 4060AD...40 total

ref: mol2, SDF, SMILES, flexibase
1.56,5.68,-43.25,0,6,-1, 210.165, 4

Similar to: 6249493, 34132958, 41944401, 41944404, 41944407, ... 17 in total.
6249493
 
#47

ChemMol: 80100286, 2200272
eMolecules: 848007
Molport: MolPort-000-889-516
Scientific Exchange (make on demand): M-910163
AK Scientific: 4060AD...40 total

ref: mol2, SDF, SMILES, flexibase
1.56,5.69,-43.27,0,6,-1, 210.165, 4

Similar to: 34132958, 41944401, 41944404, 41944407, 41944421, ... 17 in total.
371757
 
#48

ChemMol: 80100277, 2200263
eMolecules: 837383
Molport: MolPort-000-886-170
Scientific Exchange: M-147604
AK Scientific: 3736AD...46 total

ref: mol2, SDF, SMILES, flexibase
1.51,6.17,-58.86,0,6,-1, 210.165, 4

Similar to: 39020417, 41939997, 41940015, 41940018, 41946887, ... 20 in total.
371756
 
#49

ChemMol: 80100277, 2200263
eMolecules: 837383
Molport: MolPort-000-886-170
Scientific Exchange: M-147604
AK Scientific: 3736AD...46 total

ref: mol2, SDF, SMILES, flexibase
1.51,6.17,-58.86,0,6,-1, 210.165, 4

Similar to: 371757, 39020417, 41939997, 41940015, 41940018, ... 20 in total.
1747127
 
#50

ChemMol: 2200259, 80100273
eMolecules: 501446
Scientific Exchange (make on demand): K-041942
Acorn PharmaTech: ACN-S004315
AK Scientific: U417...78 total

ref: mol2, SDF, SMILES, flexibase
2.78,6.09,-47.01,0,3,-1, 179.195, 4

Similar to: 2163685, 34227453, 57835108, 57835112, 57835342, ... 6 in total.
1690099
 
#51

ChemMol: 80100271, 2200257
eMolecules: 479731
Scientific Exchange (make on demand): K-021007
AK Scientific: 4635AD
AKOS: AKOS000113874...78 total

ref: mol2, SDF, SMILES, flexibase
3.34,6.87,-46.94,0,3,-1, 193.222, 5

Similar to: 34227453, 38601907, 57832644, 57835108, 57835112, ... 5 in total.
1696794
 
#52

ChemMol: 80100270, 2200256
eMolecules: 488499
Scientific Exchange (make on demand): M-897528
AK Scientific: U354
AKOS: AKOS000119528...65 total

ref: mol2, SDF, SMILES, flexibase
3.85,1.15,-48.51,0,3,-1, 207.249, 6

Similar to: 4787811, 34219999, 34227453, 34364985, 34364986, ... 7 in total.
155410
 
#53

ChemMol: 80100268, 2200254
eMolecules: 440243
Molport: MolPort-000-889-509
Scientific Exchange (make on demand): M-272299
AK Scientific: Q589...55 total

ref: mol2, SDF, SMILES, flexibase
2.23,1.07,-49.17,0,3,-1, 199.613, 3
155409
 
#54

ChemMol: 80100268, 2200254
eMolecules: 440243
Molport: MolPort-000-889-509
Scientific Exchange (make on demand): M-272299
AK Scientific: Q589...56 total

ref: mol2, SDF, SMILES, flexibase
2.23,1.08,-49.1,0,3,-1, 199.613, 3
1926686
 
#55

ChemMol: 2200244, 80100258
eMolecules: 3767148
Molport: MolPort-001-611-263
Scientific Exchange (make on demand): M-790174
AK Scientific: 6399AD...38 total

ref: mol2, SDF, SMILES, flexibase
2.43,1.88,-48.64,0,3,-1, 193.222, 3

Similar to: 34618425, 34618426, 38276598, 38276599, ... 4 in total.
1926685
 
#56

ChemMol: 2200244, 80100258
eMolecules: 3767148
Molport: MolPort-001-611-263
Scientific Exchange (make on demand): M-790174
AK Scientific: 6399AD...38 total

ref: mol2, SDF, SMILES, flexibase
2.43,1.89,-48.56,0,3,-1, 193.222, 3

Similar to: 34618425, 34618426, 38276598, 38276599, ... 4 in total.
265140
 
#57

ChemMol: 80100256, 2200242
eMolecules: 846363
Molport: MolPort-000-889-122
Scientific Exchange (make on demand): M-230473
AK Scientific: 8876AE...60 total

ref: mol2, SDF, SMILES, flexibase
1.22,5.68,-52.5,0,4,-1, 195.194, 4
265139
 
#58

ChemMol: 2200242, 80100256
eMolecules: 846363
Molport: MolPort-000-889-122
Scientific Exchange (make on demand): M-230473
AK Scientific: 8876AE...60 total

ref: mol2, SDF, SMILES, flexibase
1.22,5.68,-52.54,0,4,-1, 195.194, 4
73634
 
#59

ChemMol: 2200241, 80100255
eMolecules: 440239
Molport: MolPort-001-581-882
Scientific Exchange (make on demand): M-267266
AK Scientific: W3289...89 total

ref: mol2, SDF, SMILES, flexibase
1.66,4.31,-47.59,0,4,-1, 195.194, 4

Similar to: 34355112, 34355114,
73632
 
#60

ChemMol: 2200241, 80100255
eMolecules: 440239
Molport: MolPort-001-581-882
Scientific Exchange (make on demand): M-267266
AK Scientific: W3289...88 total

ref: mol2, SDF, SMILES, flexibase
1.66,4.31,-47.58,0,4,-1, 195.194, 4

Similar to: 34355112, 34355114, 41956783,
265136
 
#61

ChemMol: 2200240, 97603013, 80100254, 44020839
eMolecules: 487595
Molport: MolPort-001-014-568
Scientific Exchange (make on demand): POD_49/0058
AK Scientific: HTS000651...109 total

ref: mol2, SDF, SMILES, flexibase
1.60,5.93,-47.1,0,3,-1, 165.168, 3
265135
 
#62

ChemMol: 80100254, 2200240
eMolecules: 487595
Molport: MolPort-001-014-568
Scientific Exchange (make on demand): POD_49/0058
AK Scientific: HTS000651...101 total

ref: mol2, SDF, SMILES, flexibase
1.60,5.93,-47.07,0,3,-1, 165.168, 3
288839
 
#63

eMolecules: 529506
AKOS: AKOS000120226
Aldrich CPR: PH000086|ALDRICH
ChemBridge: 5228174
Enamine: Z56755986...25 total

ref: mol2, SDF, SMILES, flexibase
2.80,0.38,-46.49,0,2,-1, 217.269, 3

Similar to: 34429044,
2890701
 
#64

ChemMol: 2200768, 80100775
eMolecules: 2271167
Molport: MolPort-001-593-668
Scientific Exchange (make on demand): M-500444
AKOS: AKOS000319785...33 total

ref: mol2, SDF, SMILES, flexibase
0.80,3.04,-62.03,1,5,-1, 228.268, 5

Similar to: 31978989, 31978991, 31978993, 31978995, 44693242, ... 8 in total.
2890703
 
#65

ChemMol: 2200768, 80100775
eMolecules: 2271167
Molport: MolPort-001-593-668
Scientific Exchange (make on demand): M-500444
AKOS: AKOS000319785...33 total

ref: mol2, SDF, SMILES, flexibase
0.80,3.29,-60.56,1,5,-1, 228.268, 5

Similar to: 31978989, 31978991, 31978993, 31978995, ... 4 in total.
2890705
 
#66

ChemMol: 2200768, 80100775
eMolecules: 2271167
Molport: MolPort-001-593-668
Scientific Exchange (make on demand): M-500444
AKOS: AKOS000319785...33 total

ref: mol2, SDF, SMILES, flexibase
0.80,3.29,-62.93,1,5,-1, 228.268, 5

Similar to: 31978989, 31978991, 31978993, 31978995, ... 4 in total.
2890707
 
#67

ChemMol: 2200768, 80100775
eMolecules: 2271167
Molport: MolPort-001-593-668
Scientific Exchange (make on demand): M-500444
AKOS: AKOS000319785...33 total

ref: mol2, SDF, SMILES, flexibase
0.80,3.05,-59.43,1,5,-1, 228.268, 5

Similar to: 31978989, 31978991, 31978993, 31978995, ... 4 in total.
1604340
 
#68

Molport: MolPort-002-096-548
Scientific Exchange (make on demand): M-500074
AKOS: AKOS000340019
Aldrich CPR: CDS020019|ALDRICH
Ark Pharm Building Blocks: AK108772...25 total

ref: mol2, SDF, SMILES, flexibase
1.46,4.51,-60.15,1,4,-1, 210.253, 4
1604341
 
#69

Molport: MolPort-002-096-548
Scientific Exchange (make on demand): M-500074
AKOS: AKOS000340019
Aldrich CPR: CDS020019|ALDRICH
Ark Pharm Building Blocks: AK108772...25 total

ref: mol2, SDF, SMILES, flexibase
1.46,4.76,-60.91,1,4,-1, 210.253, 4
1604342
 
#70

Molport: MolPort-002-096-548
Scientific Exchange (make on demand): M-500074
AKOS: AKOS000340019
Aldrich CPR: CDS020019|ALDRICH
Ark Pharm Building Blocks: AK108772...25 total

ref: mol2, SDF, SMILES, flexibase
1.46,4.76,-61.16,1,4,-1, 210.253, 4
1604343
 
#71

Molport: MolPort-002-096-548
Scientific Exchange (make on demand): M-500074
AKOS: AKOS000340019
Aldrich CPR: CDS020019|ALDRICH
Ark Pharm Building Blocks: AK108772...25 total

ref: mol2, SDF, SMILES, flexibase
1.46,4.51,-59.86,1,4,-1, 210.253, 4
4549061
 
#72

eMolecules: 8594419
Molport: MolPort-002-927-940
Scientific Exchange (make on demand): M-500065
AKOS: AKOS003442220
Mcule: MCULE-9223729933...19 total

ref: mol2, SDF, SMILES, flexibase
-0.15,1.65,-47.07,1,4,-1, 156.161, 5

Similar to: 38282335,
2736899
 
#73

eMolecules: 2756541
Molport: MolPort-001-632-443
Scientific Exchange (make on demand): R-006296
AKOS: AKOS002675923
Alinda: IVK/8036446...31 total

ref: mol2, SDF, SMILES, flexibase
1.67,4.56,-48.7,1,4,-1, 244.629, 4
1690596
 
#74

ChemMol: 44021673
eMolecules: 590506
Scientific Exchange (make on demand): F-337766
AK Scientific: 0183AC, Y8903
AKOS: AKOS000268407...90 total

ref: mol2, SDF, SMILES, flexibase
-0.92,3.68,-35.12,1,3,0, 129.159, 2

Similar to: 34473281,
529593
 
#75

ChemMol: 97801463, 30110528
eMolecules: 24825389, 828905, 590514
Molport: MolPort-019-705-677, MolPort-008-383-024
Scientific Exchange (make on demand): F-392697
ACB Blocks: MIX-0741...133 total

ref: mol2, SDF, SMILES, flexibase
-0.42,5.38,-30.52,1,3,0, 143.186, 2

Similar to: 33801054, 37116242, 38282470,
381371
 
#76

eMolecules: 1355764
Scientific Exchange (make on demand): Q-026194
AKOS: AKOS000301718
Asinex Building Blocks: BAS01908988
ChemDiv: 2293-4391...43 total

ref: mol2, SDF, SMILES, flexibase
-0.14,2.23,-47.86,1,5,-1, 196.182, 5

Similar to: 32107816, 32108466, 32113895, 32122802, 37827808, ... 5 in total.
556192
 
#77

ChemMol: 80100251, 2200237
eMolecules: 847991
Molport: MolPort-000-889-502
Scientific Exchange (make on demand): E-098354
AK Scientific: 8974AE...49 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.73,-48.47,0,3,-1, 179.195, 3

Similar to: 33727347, 33727348, 556191,
556191
 
#78

ChemMol: 80100251, 2200237
eMolecules: 847991
Molport: MolPort-000-889-502
Scientific Exchange (make on demand): E-098354
AK Scientific: 8974AE...49 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.73,-48.46,0,3,-1, 179.195, 3

Similar to: 556192, 33727347, 33727348, 41956546, ... 4 in total.
1459067
 
#79

ChemMol: 80100250, 2200236
eMolecules: 847993
Molport: MolPort-000-889-503
Scientific Exchange (make on demand): M-186959
AK Scientific: 8403AD...44 total

ref: mol2, SDF, SMILES, flexibase
2.03,1.5,-48.49,0,3,-1, 179.195, 3

Similar to: 32118110, 32133100, 32133102, 39282506, 39282507, ... 5 in total.
1459066
 
#80

ChemMol: 80100250, 2200236
eMolecules: 44219652, 847993
Molport: MolPort-000-889-503
Scientific Exchange (make on demand): M-186959
AK Scientific: 8403AD...48 total

ref: mol2, SDF, SMILES, flexibase
2.03,1.5,-48.38,0,3,-1, 179.195, 3

Similar to: 32118110, 39282506, 39282507,
1459065
 
#81

ChemMol: 80100248, 2200234
eMolecules: 440225
Molport: MolPort-000-889-504
Scientific Exchange (make on demand): M-186958
AK Scientific: 7688AD...53 total

ref: mol2, SDF, SMILES, flexibase
2.05,1.5,-48.05,0,3,-1, 179.195, 3

Similar to: 2583851, 31972568, 31972569, 33727207, 33727208, ... 5 in total.
1459064
 
#82

ChemMol: 80100248, 2200234
eMolecules: 440225
Molport: MolPort-000-889-504
Scientific Exchange (make on demand): M-186958
AK Scientific: 7688AD...53 total

ref: mol2, SDF, SMILES, flexibase
2.05,1.5,-48.06,0,3,-1, 179.195, 3

Similar to: 2583851, 31972568, 31972569, 33727207, 33727208, ... 5 in total.
2172603
 
#83

eMolecules: 6736436
Molport: MolPort-002-691-741, MolPort-001-814-739
Scientific Exchange (make on demand): X-060828
AKOS: AKOS002669871, AKOS001711863
Aldrich CPR: S782475|ALDRICH...38 total

ref: mol2, SDF, SMILES, flexibase
1.01,4.87,-48.55,1,4,-1, 220.248, 6

Similar to: 3203280, 3203282, 34615051, 37792812, 37792813, ... 8 in total.
157210
 
#84

ChemMol: 80100278, 2200264
eMolecules: 846545, 1862715
Molport: MolPort-002-345-717, MolPort-000-889-158, MolPort-001-633-852
Scientific Exchange (make on demand): Q-021654, H-064623
AK Scientific: 6021AD...86 total

ref: mol2, SDF, SMILES, flexibase
2.95,7.65,-45.83,0,3,-1, 207.249, 4
142850
 
#85

eMolecules: 626523, 4395285
Scientific Exchange (make on demand): X-048193
AK Scientific: V1424
AKOS: AKOS000265932
Aldrich CPR: R397911|ALDRICH...61 total

ref: mol2, SDF, SMILES, flexibase
0.03,5.25,-55.76,1,4,-1, 220.248, 4

Similar to: 2387090, 32104366, 32104367, 32112985, 32112986, ... 8 in total.
142845
 
#86

eMolecules: 26182566, 626523, 4395285
Scientific Exchange (make on demand): X-048193
AK Scientific: V1424
AKOS: AKOS001046585, AKOS000265932
Aldrich CPR: R397911|ALDRICH...69 total

ref: mol2, SDF, SMILES, flexibase
0.03,5.8,-56.34,1,4,-1, 220.248, 4

Similar to: 2387090, 32104366, 32104367, 32112985, 32112986, ... 8 in total.
397871
 
#87

eMolecules: 26916494, 1073833
Molport: MolPort-002-929-402, MolPort-001-823-891
Aldrich CPR: CDS004613|ALDRICH
Ark Pharm Building Blocks: AK108608
ChemBridge BuildingBlocks: 7259223...29 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.11,-60,1,4,-1, 226.296, 3

Similar to: 34432196, 34454076, 34482968, 34521534, 37792430, ... 12 in total.
397872
 
#88

eMolecules: 1073833
Molport: MolPort-001-823-891
Aldrich CPR: CDS004613|ALDRICH
Ark Pharm Building Blocks: AK108608
ChemBridge BuildingBlocks: 7259223...22 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.36,-61.38,1,4,-1, 226.296, 3

Similar to: 34432196, 34454076, 34482968, 34521534, ... 4 in total.
397873
 
#89

eMolecules: 1073833
Molport: MolPort-001-823-891
Aldrich CPR: CDS004613|ALDRICH
Ark Pharm Building Blocks: AK108608
ChemBridge BuildingBlocks: 7259223...22 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.36,-61.35,1,4,-1, 226.296, 3

Similar to: 34432196, 34454076, 34482968, 34521534, ... 4 in total.
397874
 
#90

eMolecules: 1073833, 26516396
Molport: MolPort-001-823-891, MolPort-003-915-980
Scientific Exchange (make on demand): Q-055024
AKOS: AKOS003421524
Aldrich CPR: S702773|ALDRICH...32 total

ref: mol2, SDF, SMILES, flexibase
2.00,5.11,-59.98,1,4,-1, 226.296, 3

Similar to: 34432196, 34454076, 34482968, 34521534, ... 4 in total.
31295
 
#91

eMolecules: 2337023
Scientific Exchange (make on demand): Z-014793
AKOS: AKOS001303702
Alinda: IBS-L0037088
Alinda Building Blocks: ALBB-023958...32 total

ref: mol2, SDF, SMILES, flexibase
0.69,2.57,-15.54,2,6,0, 196.162, 4

Similar to: 5842295,
293026
 
#92

eMolecules: 1195357
Scientific Exchange (make on demand): Z-015372
AKOS: AKOS002273898
Alinda: IVK/8020931
Innovapharm: STT-00196375...25 total

ref: mol2, SDF, SMILES, flexibase
2.43,-0.63,-122.54,1,6,-2, 289.287, 4

Similar to: 31979291, 31979292, 31979293, 31979294, 37792747, ... 8 in total.
293027
 
#93

eMolecules: 1195357
Scientific Exchange (make on demand): Z-015372
AKOS: AKOS002273898
Alinda: IVK/8020931
Innovapharm: STT-00196375...25 total

ref: mol2, SDF, SMILES, flexibase
2.43,-0.45,-119.36,1,6,-2, 289.287, 4

Similar to: 31979291, 31979292, 31979293, 31979294, 37792747, ... 8 in total.
293029
 
#94

eMolecules: 1195357
Scientific Exchange (make on demand): Z-015372
AKOS: AKOS002273898
Alinda: IVK/8020931
Innovapharm: STT-00196375...25 total

ref: mol2, SDF, SMILES, flexibase
2.43,-0.45,-118.03,1,6,-2, 289.287, 4

Similar to: 31979291, 31979292, 31979293, 31979294, 37792747, ... 8 in total.
293030
 
#95

eMolecules: 1195357
Scientific Exchange (make on demand): Z-015372
AKOS: AKOS002273898
Alinda: IVK/8020931
Innovapharm: STT-00196375...25 total

ref: mol2, SDF, SMILES, flexibase
2.43,-0.63,-120.14,1,6,-2, 289.287, 4

Similar to: 31979291, 31979292, 31979293, 31979294, 37792747, ... 8 in total.
196830
 
#96

eMolecules: 635437
Scientific Exchange (make on demand): Z-053386
AKOS: AKOS000296018
Aldrich CPR: R457426|ALDRICH
ChemBridge: 5222102...36 total

ref: mol2, SDF, SMILES, flexibase
1.56,4.51,-49.21,1,4,-1, 226.639, 4

Similar to: 6091344, 6091346, 6091347, 6091348, 39368433, ... 6 in total.
153288
 
#97

ChemMol: 30100254
eMolecules: 486845
Scientific Exchange (make on demand): T-060955
Acros Organics: 18344
AK Scientific: Y9712...60 total

ref: mol2, SDF, SMILES, flexibase
0.69,1.97,-15.58,2,5,0, 166.136, 2

Similar to: 36757584, 39250093,
493233
 
#98

eMolecules: 5386136
Molport: MolPort-003-791-582
Scientific Exchange (make on demand): K-000101
AKOS: AKOS002671903
Chembo Pharma: KB-120787...23 total

ref: mol2, SDF, SMILES, flexibase
-0.42,1.36,-48.51,1,5,-1, 200.214, 5

Similar to: 37835033, 37835034, 37835035, 42464282, 42464284, ... 11 in total.
5631081
 
#99

eMolecules: 5386136
Molport: MolPort-003-791-582
Scientific Exchange (make on demand): K-000101
AKOS: AKOS002671903
Chembo Pharma: KB-120787...22 total

ref: mol2, SDF, SMILES, flexibase
-0.42,1.38,-48.45,1,5,-1, 200.214, 5

Similar to: 37835033, 37835034, 37835035, 42464282, 42464284, ... 11 in total.
50811
 
#100

ChemMol: 80100346, 2200333
eMolecules: 828196
Scientific Exchange (make on demand): POD_27/1000
AK Scientific: 1938AE
AKOS: AKOS000296003...46 total

ref: mol2, SDF, SMILES, flexibase
2.06,-0.02,-49.28,1,4,-1, 242.254, 4

Similar to: 6437629, 6523043,

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 = 289 ) limit 0,100

Smiles were