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403992
 
#1

AK Scientific: 9032AB, 3466AA
AKOS: AKOS008053816
Anward: ANW-55921
Ark Pharm Building Blocks: AK-90819, AK-51354
BePharm Building Blocks: B40407...53 total

ref: mol2, SDF, SMILES, flexibase
0.83,2.94,-89.88,3,3,0, 165.192, 3
1712638
 
#2

AK Scientific: 9144AB
Anward: ANW-57393
Apexmol Building Blocks: AM83148
Ark Pharm Building Blocks: AK-94870
BePharm Building Blocks: B52895...24 total

ref: mol2, SDF, SMILES, flexibase
3.10,2.56,-6.67,0,3,0, 165.192, 1

Similar to: 32149222, 34451953, 34451958, 39133590, 39133616, ... 6 in total.
1677586
 
#3

ChemMol: 44028550
AK Scientific: 0721AB
Aldrich CPR: CDS013594|ALDRICH
Alfa-Aesar: A12967
Amadis Chemical: A846676...48 total

ref: mol2, SDF, SMILES, flexibase
2.08,0.8,-54.54,0,3,-1, 164.184, 2

Similar to: 32189784, 44224692, 44226819,
160549
 
#4

eMolecules: 498030
Molport: MolPort-001-768-103
AK Scientific: S796
Anward: ANW-23070
Ark Pharm Building Blocks: AK-94774...34 total

ref: mol2, SDF, SMILES, flexibase
3.41,2.52,-5.75,0,3,0, 165.192, 2

Similar to: 32202597, 34454610, 39340134, 39340135, ... 4 in total.
1686932
 
#5

eMolecules: 888754
Molport: MolPort-001-779-993
Acros Organics: 45307
AK Scientific: X5650
AKOS: AKOS015917518...33 total

ref: mol2, SDF, SMILES, flexibase
3.10,2.79,-6.58,0,3,0, 165.192, 1

Similar to: 39133547,
8461952
 
#6

ChemMol: 97602181
eMolecules: 969813, 29619083
Molport: MolPort-021-795-057, MolPort-000-000-522
Scientific Exchange (make on demand): M-618654
AK Scientific: 8261AB...71 total

ref: mol2, SDF, SMILES, flexibase
1.00,2.77,-37.59,3,3,0, 165.192, 2

Similar to: 8462000, 31518966, 3677087, 3677088, ... 4 in total.
8462000
 
#7

ChemMol: 97603264, 44018307
eMolecules: 29619083, 969813
Molport: MolPort-000-000-522
Scientific Exchange (make on demand): M-618654
AK Scientific: 8261AB...79 total

ref: mol2, SDF, SMILES, flexibase
1.00,2.75,-38.36,3,3,0, 165.192, 2

Similar to: 31518966, 8461952,
33941739
 
#8

American Custom Chemicals Corp.: CHM0165977
Chembo Pharma: KB-50521
Tetrahedron Building Blocks: TS11996
Tractus: TRA0149203
ChemDB: 6657563...9 total

ref: mol2, SDF, SMILES, flexibase
0.77,2.71,-46.84,1,4,-1, 164.14, 2

Similar to: 33957324, 5742744, 28979268,
1494945
 
#9

ChemMol: 30100231
eMolecules: 933519
AK Scientific: Y9594
AKOS: AKOS001359231
Aldrich CPR: CDS004491|ALDRICH...56 total

ref: mol2, SDF, SMILES, flexibase
0.67,0.9,-50.09,2,4,-1, 164.14, 2

Similar to: 32189892,
12648485
 
#10

ChemMol: 30114125, 44000977
Molport: MolPort-002-499-472
A&J Pharmtech: AJ-00119
Aldrich CPR: CDS009150|ALDRICH
Anward: ANW-71525...24 total

ref: mol2, SDF, SMILES, flexibase
1.21,2.04,-44.96,2,4,-1, 164.14, 2

Similar to: 4787000,
39663
 
#11

Scientific Exchange (make on demand): POD_87/0038
AK Scientific: X5247
AKOS: AKOS000807562, AKOS002389300
American Custom Chemicals Corp.: CHM0025841
Anward: ANW-72914...50 total

ref: mol2, SDF, SMILES, flexibase
1.63,3.72,-8,1,4,0, 165.148, 2

Similar to: 8617556,
164801
 
#12

ChemMol: 30100915, 83600962
eMolecules: 529700
Molport: MolPort-000-871-219
Scientific Exchange (make on demand): R-064281
Acros Organics: 12834...83 total

ref: mol2, SDF, SMILES, flexibase
1.80,5.62,-9.23,0,4,0, 165.148, 2

Similar to: 2391889, 5167589, 6092589, 6092687, 33957296, ... 6 in total.
1673421
 
#13

ChemMol: 96700373
eMolecules: 496764
Molport: MolPort-000-892-070
Acros Organics: 37279
Ark Pharm Building Blocks: AK-48391...38 total

ref: mol2, SDF, SMILES, flexibase
2.36,5.74,-45.49,0,4,-1, 164.14, 2
lo: mol2, SDF, SMILES, flexibase
1.24,6.31,-12.63,0,4,0, 165.148, 3

Similar to: 34589091, 39260340, 39343312,
148003
 
#14

ChemMol: 1034192, 44006617
eMolecules: 529698
Acros Organics: 12833
AK Scientific: I916
AKOS: AKOS000119652...70 total

ref: mol2, SDF, SMILES, flexibase
1.77,5.68,-14.28,0,4,0, 165.148, 2

Similar to: 34548981, 36721159, 36721160,
404206
 
#15

Molport: MolPort-002-497-994
Scientific Exchange (make on demand): T-028143
AK Scientific: 2115AF
AKOS: AKOS002310261
Aldrich CPR: L132101|ALDRICH...54 total

ref: mol2, SDF, SMILES, flexibase
0.28,1.84,-69.48,2,4,-1, 164.14, 2
15021962
 
#16

ChemMol: 44013508, 30114147
AK Scientific: X9528
Alfa-Aesar: H34059
Anward: ANW-46448
APIChem: AC-9101...35 total

ref: mol2, SDF, SMILES, flexibase
0.31,2.95,-48.53,0,4,-1, 164.14, 2
hi: mol2, SDF, SMILES, flexibase
2.98,6.34,-5.07,0,2,0, 234.249, 1

Similar to: 38294669,
2244055
 
#17

Molport: MolPort-002-499-008
American Custom Chemicals Corp.: CHM0129587
Ark Pharm Building Blocks: AK150529
Chembo Pharma: KB-08759
Element Store BB: b2star-3156-44-3...19 total

ref: mol2, SDF, SMILES, flexibase
1.60,0.43,-7.84,1,4,0, 165.148, 2

Similar to: 4829015, 39343312,
70234657
 
#18

Chembo Pharma: KB-01579
Tetrahedron Building Blocks: TS11985
Debye Scientific BB (Depleted): DB-073715
PubChem: 11528408
SureChEMBL: SCHEMBL287236...8 total

ref: mol2, SDF, SMILES, flexibase
1.87,5.71,-13.55,0,4,0, 165.148, 3
895124
 
#19

ChemMol: 30116970, 44012507, 30200548, 30104335, 30202494, 97602681, 44002391
eMolecules: 498263
Enolase via KEGG (EFI): C00025_1
Molport: MolPort-002-130-089, MolPort-002-499-418, MolPort-001-779-720
Scientific Exchange (make on demand): E-003934...675 total

ref: mol2, SDF, SMILES, flexibase
-3.25,1.72,-74,3,5,-1, 146.122, 4

Similar to: 33836585,
2169445
 
#20

Aldrich CPR: R261505|ALDRICH
Alfa-Aesar: L10517
Apollo Scientific: PC3753D, PC3753, PC3753A
BOC Sciences BB: 2708-77-2
Chembo Pharma: KB-38836...42 total

ref: mol2, SDF, SMILES, flexibase
-3.23,-1.9,-75.72,3,5,-1, 164.112, 4

Similar to: 2169443, 2169444,
2169443
 
#21

Aldrich CPR: R261505|ALDRICH
Alfa-Aesar: L10517
Apollo Scientific: PC3753D, PC3753, PC3753A
BOC Sciences BB: 2708-77-2
Chembo Pharma: KB-38836...39 total

ref: mol2, SDF, SMILES, flexibase
-3.23,-1.89,-70.22,3,5,-1, 164.112, 4

Similar to: 2169444, 2169445, 2169442,
2169442
 
#22

AK Scientific: 2978AF
Aldrich CPR: R261505|ALDRICH
Alfa-Aesar: L10517
Apollo Scientific: PC3753D, PC3753, PC3753A
BOC Sciences BB: 2708-77-2...48 total

ref: mol2, SDF, SMILES, flexibase
-3.23,-1.92,-75.68,3,5,-1, 164.112, 4

Similar to: 2169443, 2169444,
2169444
 
#23

Molport: MolPort-019-937-771
AK Scientific: 2979AF
Aldrich CPR: R261505|ALDRICH
Alfa-Aesar: L10517
Apollo Scientific: PC3753D...53 total

ref: mol2, SDF, SMILES, flexibase
-3.23,-1.89,-70.21,3,5,-1, 164.112, 4

Similar to: 2169445, 2169443, 2169442,
19172733
 
#24

ChemMol: 44027116
Molport: MolPort-016-633-633
AK Scientific: V5510
AKOS: AKOS015844195, AKOS000148650
Ark Pharm Building Blocks: AK153250...41 total

ref: mol2, SDF, SMILES, flexibase
0.94,2.83,-36.57,4,2,1, 129.227, 2
hi: mol2, SDF, SMILES, flexibase
0.94,2.37,-0.92,3,2,0, 128.219, 2

Similar to: 31771077,
19401378
 
#25

Molport: MolPort-020-001-330, MolPort-016-636-164
AK Scientific: Y4105
Ark Pharm Building Blocks: AK154662, AK157471
BOC Sciences BB: 17630-34-1
Chembo Pharma: KB-11997...25 total

ref: mol2, SDF, SMILES, flexibase
1.06,2.52,-36.78,4,2,1, 129.227, 1
hi: mol2, SDF, SMILES, flexibase
1.06,2.03,-2.43,3,2,0, 128.219, 1
11886332
 
#26

eMolecules: 3785425, 31661470
Molport: MolPort-003-752-420
Scientific Exchange (make on demand): F-351869
AK Scientific: Y8064, Y1661
AKOS: AKOS000264022...87 total

ref: mol2, SDF, SMILES, flexibase
-0.42,0.53,-46.91,3,2,1, 129.208, 2
8700980
 
#27

eMolecules: 2791460
Molport: MolPort-003-787-473
Scientific Exchange Building Blocks: F-367426
AK Scientific: V4616, 1553AE
AKOS: AKOS015847490...66 total

ref: mol2, SDF, SMILES, flexibase
-1.13,-3.27,-44.26,3,3,1, 129.183, 1

Similar to: 36984197, 37809419, 41679549, 41679604, ... 4 in total.
19413552
 
#28

eMolecules: 31660989, 29918447
Molport: MolPort-016-577-884, MolPort-008-334-089, MolPort-020-004-550
AK Scientific: Y7477
Aldrich CPR: CDS003931|ALDRICH
Alinda Building Blocks: ALBB-027135...68 total

ref: mol2, SDF, SMILES, flexibase
-0.41,-0.09,-38.75,3,3,1, 129.183, 1
hi: mol2, SDF, SMILES, flexibase
-0.41,-1.38,-10.92,2,3,0, 128.175, 1

Similar to: 34594854, 34594855, 34594856, 34594857, ... 6 in total.
404452
 
#29

ChemMol: 97800195, 30114431
eMolecules: 592863
Molport: MolPort-016-577-901, MolPort-001-791-766, MolPort-027-633-179
Acorn PharmaTech: ACN-S004091
Acros Organics: 12830...117 total

ref: mol2, SDF, SMILES, flexibase
-0.75,-0.9,-48.42,4,3,1, 129.183, 1
404453
 
#30

ChemMol: 97800195, 30114431
eMolecules: 592863
Molport: MolPort-001-791-766, MolPort-027-633-323, MolPort-016-577-901
Acorn PharmaTech: ACN-S004091
Acros Organics: 12830...112 total

ref: mol2, SDF, SMILES, flexibase
-0.75,-0.9,-48.41,4,3,1, 129.183, 1
2040682
 
#31

Chembo Pharma: KB-46308
Tetrahedron Building Blocks: TS11959
Tractus: TRA0086890
ChemDB: 7549660
Debye Scientific BB (Depleted): DB-045198...8 total

ref: mol2, SDF, SMILES, flexibase
2.22,5.65,-45.29,0,2,-1, 163.624, 6
lo: mol2, SDF, SMILES, flexibase
2.22,4.53,-7.56,1,2,0, 164.632, 6

Similar to: 32212603,
12359623
 
#32

eMolecules: 887577
Molport: MolPort-001-792-836
Aldrich CPR: VBP00004|ALDRICH
Alfa-Aesar: H50255
Capot Chemical: 20696...29 total

ref: mol2, SDF, SMILES, flexibase
1.26,5.02,-38.17,2,2,1, 165.26, 5
lo: mol2, SDF, SMILES, flexibase
1.26,5.3,-98.03,3,2,2, 166.268, 5

Similar to: 32251237, 34938172, 36679505, 36679506, ... 4 in total.
54333069
 
#33

eMolecules: 871555, 42977894
Molport: MolPort-000-900-451
Scientific Exchange (make on demand): H-074378, F-279165
AKOS: AKOS000265110
Alfa-Aesar: H65635...67 total

ref: mol2, SDF, SMILES, flexibase
0.57,2.02,-42.07,4,2,1, 165.26, 5
161464
 
#34

FineTech: FT-0629690
Tetrahedron Building Blocks: TS11940
Apollo Scientific (Depleted): OR25627
ChemDB: 4731677
Maybridge (Depleted): KM08322...10 total

ref: mol2, SDF, SMILES, flexibase
1.38,6.28,-38.88,1,2,1, 165.26, 4
lo: mol2, SDF, SMILES, flexibase
1.38,6.56,-81.8,2,2,2, 166.268, 4

Similar to: 5839691, 38434201,
2598946
 
#35

ChemMol: 51500508, 80100931
eMolecules: 1522910
Molport: MolPort-002-017-660
Scientific Exchange (make on demand): F-360345
AK Scientific: 7699AC...74 total

ref: mol2, SDF, SMILES, flexibase
1.02,3.71,-44.4,3,2,1, 165.26, 3
6733646
 
#36

ChemMol: 30201265, 44012578
Molport: MolPort-002-506-629, MolPort-020-014-068
AK Scientific: W9671
AKOS: AKOS015840101
Aldrich CPR: CDS019496|ALDRICH...31 total

ref: mol2, SDF, SMILES, flexibase
-0.09,3.63,-42,3,2,1, 165.26, 2
22129860
 
#37

ChemMol: 97600362
American Custom Chemicals Corp.: CCH0007718
Chembo Pharma: KB-02832
Tetrahedron Building Blocks: TS11933
BOC Sciences BB (Depleted): 111954-72-4...9 total

ref: mol2, SDF, SMILES, flexibase
0.88,3.74,-44.45,3,2,1, 165.26, 4
lo: mol2, SDF, SMILES, flexibase
0.88,4.18,-93.33,4,2,2, 166.268, 4

Similar to: 22198608,
6733648
 
#38

ChemMol: 44027174, 30201266
Molport: MolPort-021-783-816, MolPort-002-506-629
Aldrich CPR: CDS019496|ALDRICH
American Custom Chemicals Corp.: CCH0000251
Ark Pharm Building Blocks: AK133445...30 total

ref: mol2, SDF, SMILES, flexibase
-0.09,3.64,-42.16,3,2,1, 165.26, 2
388427
 
#39

ChemMol: 98002794, 30111531
eMolecules: 476756
Molport: MolPort-000-871-533, MolPort-002-328-769
Acorn PharmaTech: ACN-S002520
Acros Organics: 39500...167 total

ref: mol2, SDF, SMILES, flexibase
1.87,4.75,-15.85,3,2,0, 165.26, 3
hi: mol2, SDF, SMILES, flexibase
1.87,4.67,-3,2,2,0, 164.252, 3

Similar to: 32219881, 32220755,
2556905
 
#40

eMolecules: 1011868
Molport: MolPort-001-794-162
AK Scientific: 5110AE
AKOS: AKOS000121431
Aldrich CPR: PH011328|ALDRICH...40 total

ref: mol2, SDF, SMILES, flexibase
1.12,4,-44.43,3,2,1, 165.26, 4

Similar to: 32007240, 32007241, 32008621, 32143399, 32230209, ... 16 in total.
2599302
 
#41

Molport: MolPort-003-731-160
Ark Pharm Building Blocks: AK157641, AK153832
Chembo Pharma: KB-33813
Enamine Building Blocks: EN300-67616
Life Chemicals: F2189-0464...24 total

ref: mol2, SDF, SMILES, flexibase
1.22,5.15,-35.04,3,2,1, 165.26, 3

Similar to: 32189620, 34334390, 34423847, 36786584, 36788524, ... 19 in total.
32629249
 
#42

eMolecules: 11606457
Aldrich CPR: PH010277|ALDRICH
Ark Pharm Building Blocks: AK-44387
Chembo Pharma: KB-57758
Enamine: Z425484772...22 total

ref: mol2, SDF, SMILES, flexibase
1.28,4.47,-117.81,4,2,2, 166.268, 5
mid: mol2, SDF, SMILES, flexibase
1.28,3.05,-39.07,3,2,1, 165.26, 5

Similar to: 44651726,
19369239
 
#43

Chembo Pharma: KB-25871
Tetrahedron Building Blocks: TS11927
AKOS BB (make-on-demand): AKOS015890272
ChemDB: 7557991
Leadscope via PubChem: LS-45678...9 total

ref: mol2, SDF, SMILES, flexibase
1.06,1.7,-37.3,5,2,1, 165.26, 3
mid: mol2, SDF, SMILES, flexibase
1.06,2,-124.85,6,2,2, 166.268, 3
hi: mol2, SDF, SMILES, flexibase
1.06,1.21,-1.73,4,2,0, 164.252, 3

Similar to: 22043018, 22043019, 39234754, 39234755, 39391865, ... 5 in total.
19369237
 
#44

Chembo Pharma: KB-25871
Tetrahedron Building Blocks: TS11927
AKOS BB (make-on-demand): AKOS015890272
ChemDB: 7557991
Leadscope via PubChem: LS-45678...9 total

ref: mol2, SDF, SMILES, flexibase
1.06,1.88,-39.8,5,2,1, 165.26, 3
mid: mol2, SDF, SMILES, flexibase
1.06,2.07,-125.33,6,2,2, 166.268, 3
hi: mol2, SDF, SMILES, flexibase
1.06,1.52,-2.02,4,2,0, 164.252, 3

Similar to: 22043018, 22043019, 39234754, 39234755, 39391865, ... 5 in total.
162771
 
#45

ChemMol: 51501419
eMolecules: 12602531
Molport: MolPort-002-904-281
Aldrich CPR: PH009733|ALDRICH
Chembo Pharma: KB-17267...21 total

ref: mol2, SDF, SMILES, flexibase
1.06,1.78,-101.13,6,2,2, 166.268, 2

Similar to: 1647456, 44236543, 44250081,
5217753
 
#46

Molport: MolPort-023-220-159
Alinda Building Blocks: ALBB-026580
Chembo Pharma: KB-10448
ChemBridge BuildingBlocks: 4049559
Combi-Blocks: QA-7536...21 total

ref: mol2, SDF, SMILES, flexibase
0.71,-1.08,-48.9,0,2,-1, 163.243, 1

Similar to: 39253356,
2548438
 
#47

Acros Organics: 43010
Chembo Pharma: KB-44303
Chemstep: 8018
Tetrahedron Building Blocks: TS11918
Maybridge (Depleted): AC43010...7 total

ref: mol2, SDF, SMILES, flexibase
1.53,1.96,-52.95,3,2,1, 165.241, 1
hi: mol2, SDF, SMILES, flexibase
1.53,1.56,-6.38,2,2,0, 164.233, 1
2168455
 
#48

ChemMol: 42303069, 44013031
eMolecules: 718772, 11878432
Molport: MolPort-005-310-969
Acros Organics: 36713
Aldrich CPR: CDS003437|ALDRICH...67 total

ref: mol2, SDF, SMILES, flexibase
-0.25,0.89,-43.96,2,4,1, 165.22, 1

Similar to: 21819341, 34349652, 37039477, 39957377, ... 4 in total.
26893217
 
#49

Bosche Scientific: M7648
Tetrahedron Building Blocks: TS11903
PubChem: 34175001
Ambinter: Amb8629042
ref: mol2, SDF, SMILES, flexibase
-3.37,4.72,-46.59,1,3,1, 165.216, 0
1444885
 
#50

eMolecules: 36909391
Scientific Exchange Building Blocks: F-332633
Chembo Pharma: KB-31597
Enamine Building Blocks: EN300-93388
Lab Seeker Building Blocks: SC-13080...16 total

ref: mol2, SDF, SMILES, flexibase
0.73,2.62,-31.54,4,3,1, 165.216, 3

Similar to: 34928599,
5593970
 
#51

Molport: MolPort-019-872-026
Ark Pharm Building Blocks: AK158691, AK135307
Chembo Pharma: KB-48557
Fluorochem: 387488
Molport BB: MolPort-019-872-026...12 total

ref: mol2, SDF, SMILES, flexibase
1.12,-4.16,-45.39,4,3,1, 165.216, 1

Similar to: 39318398, 39318399, 39318407, 39318408, 39318482, ... 6 in total.
5011309
 
#52

Molport: MolPort-019-872-026
Ark Pharm Building Blocks: AK158691, AK135307
Chembo Pharma: KB-48557
Fluorochem: 387488
Molport BB: MolPort-019-872-026...12 total

ref: mol2, SDF, SMILES, flexibase
1.12,-4.14,-45.13,4,3,1, 165.216, 1

Similar to: 39318398, 39318399, 39318407, 39318408, 39318482, ... 6 in total.
157748
 
#53

ChemMol: 30106503
eMolecules: 498355
Acros Organics: 30596, BTB09874
Alfa-Aesar: A14538
Anward: ANW-13735...72 total

ref: mol2, SDF, SMILES, flexibase
3.15,7.28,-48.93,0,2,-1, 163.196, 3

Similar to: 33824161,
1669506
 
#54

Chembo Pharma: KB-61721
Tetrahedron Building Blocks: TS11890
ChemDB: 4988786
PubChem: 72620
SureChEMBL: SCHEMBL2474863...5 total

ref: mol2, SDF, SMILES, flexibase
2.07,1.65,-54.38,0,2,-1, 163.196, 1
2528074
 
#55

ChemMol: 30201046, 2100298
eMolecules: 527770
AK Scientific: W5837
Alfa-Aesar: H34395, H32088
Anward: ANW-72304...50 total

ref: mol2, SDF, SMILES, flexibase
2.31,1.44,-46.41,0,2,-1, 163.196, 3

Similar to: 12956558, 34482471,
396095
 
#56

ChemMol: 1200185, 98001610, 44011936
eMolecules: 507679
AK Scientific: Y3222
Alfa-Aesar: H34375
Angene Building Blocks: AGN-PC-0JKLNN...59 total

ref: mol2, SDF, SMILES, flexibase
2.28,1.38,-46.52,0,2,-1, 163.196, 3

Similar to: 32142152, 34452457, 39244392, 39244393, 39952845, ... 5 in total.
368526
 
#57

ChemMol: 1201940, 98001637
Scientific Exchange (make on demand): R-051201
AK Scientific: P326
Angene Building Blocks: AGN-PC-0JK9O1
Anward: ANW-31577...46 total

ref: mol2, SDF, SMILES, flexibase
2.71,1.58,-52.51,0,2,-1, 163.196, 1

Similar to: 390983, 390998, 391264, 391266, 1571182, ... 8 in total.
2572191
 
#58

ChemMol: 83601314
eMolecules: 719617
AKOS: AKOS000274304
Aldrich CPR: CDS003331|ALDRICH
Alfa-Aesar: L09707...47 total

ref: mol2, SDF, SMILES, flexibase
2.19,1.68,-48.26,0,2,-1, 163.196, 2

Similar to: 33801100, 33801101,
390901
 
#59

eMolecules: 3106458
Scientific Exchange (make on demand): M-265171, M-171922
AK Scientific: W5021
AKOS: AKOS000295352, AKOS000286773
Aldrich CPR: S24059|ALDRICH...39 total

ref: mol2, SDF, SMILES, flexibase
0.64,1.91,-33.02,0,4,-1, 163.156, 0

Similar to: 34622086,
8699781
 
#60

ChemMol: 44026348
Molport: MolPort-003-886-278
AK Scientific: Y4212
Angene Building Blocks: AGN-PC-00LMHE
Anward: ANW-71671...31 total

ref: mol2, SDF, SMILES, flexibase
1.70,4.26,-7.45,1,4,0, 164.164, 1

Similar to: 37061159, 37104344, 37104345, 37104406, 37104578, ... 5 in total.
4043641
 
#61

ChemMol: 44010060, 1036561, 83601431
eMolecules: 480461
Scientific Exchange (make on demand): POD_85/0027
AKOS: AKOS001200764
Alfa-Aesar: B25417...78 total

ref: mol2, SDF, SMILES, flexibase
1.72,4.35,-7.94,1,4,0, 164.164, 1
4528594
 
#62

ChemMol: 83602503, 44030407
Molport: MolPort-016-633-628
TCM Database @ Taiwan: tcm03_006521
Acros Organics: 12428, 20627, 27054, 35211, 40388
AK Scientific: K452...1342 total

ref: mol2, SDF, SMILES, flexibase
-1.20,0.25,-113.85,0,4,-2, 88.018, 1
1482113
 
#63

ChemMol: 30101197, 30200548, 1030766, 44012507, 30116970
eMolecules: 498263, 477277
Enolase via KEGG (EFI): C00025_2
Molport: MolPort-002-130-089, MolPort-001-779-720, MolPort-019-903-834
Scientific Exchange (make on demand): R-064261...974 total

ref: mol2, SDF, SMILES, flexibase
-3.25,1.74,-73.91,3,5,-1, 146.122, 4

Similar to: 33836585,
40448430
 
#64

AK Scientific: 0700AB
Anward: ANW-75273
Ark Pharm Building Blocks: AK-28965
BePharm Building Blocks: B65713
Bide Pharmatech BB: BD65713...18 total

ref: mol2, SDF, SMILES, flexibase
1.51,4.81,-48.12,0,3,-1, 163.152, 1

Similar to: 4100633,
40448431
 
#65

AK Scientific: Z4578
Angene Building Blocks: AGN-PC-01VPH6
Anward: ANW-75266
Ark Pharm Building Blocks: AK-29112
BePharm Building Blocks: B65717...18 total

ref: mol2, SDF, SMILES, flexibase
1.87,4.9,-51.18,0,3,-1, 163.152, 1
14400989
 
#66

ChemMol: 96706744
A&J Pharmtech: AJ-01083
Adesis: 3-113
AK Scientific: 0489AF
Aldrich CPR: ADE000840|ALDRICH...20 total

ref: mol2, SDF, SMILES, flexibase
1.52,2.6,-13.01,1,3,0, 164.139, 0
mid: mol2, SDF, SMILES, flexibase
1.97,0.49,-53.47,0,3,-1, 163.131, 0
16159494
 
#67

ChemMol: 1035696
eMolecules: 723525
Molport: MolPort-019-937-841
Acros Organics: BTB04061
AK Scientific: W6285...58 total

ref: mol2, SDF, SMILES, flexibase
1.10,3.53,-13.53,1,3,0, 164.139, 0
hi: mol2, SDF, SMILES, flexibase
1.56,1.54,-47.23,0,3,-1, 163.131, 0
1076023
 
#68

ChemMol: 83602606, 44031621
eMolecules: 710425
Molport: MolPort-000-859-946
ACB Blocks: MIX-0589
AK Scientific: Y8157...60 total

ref: mol2, SDF, SMILES, flexibase
-0.48,4.29,-64.49,0,6,-1, 163.116, 1
1395452
 
#69

ChemMol: 44500320
Molport: MolPort-002-482-720
AK Scientific: V3646
Chembo Pharma: KB-40040
Combi-Blocks: HI-1982...20 total

ref: mol2, SDF, SMILES, flexibase
1.64,2.29,-15.47,0,5,0, 164.12, 1
19075455
 
#70

ChemMol: 44003757, 30104118
Molport: MolPort-005-934-958
AK Scientific: V2518
Anward: ANW-57208
APIChem: AC-14737...31 total

ref: mol2, SDF, SMILES, flexibase
1.10,3.21,-29.11,0,5,-1, 163.112, 1
164794
 
#71

eMolecules: 493395
Molport: MolPort-001-732-414
Acros Organics: 33618
Alfa-Aesar: A16920
Alinda Building Blocks: ALBB-007518...42 total

ref: mol2, SDF, SMILES, flexibase
1.70,2.76,-7.78,0,5,0, 164.12, 2
158671
 
#72

ChemMol: 96700882, 30112753
eMolecules: 520124
Acros Organics: CC09701
AK Scientific: Y8109
AKOS: AKOS002664672...60 total

ref: mol2, SDF, SMILES, flexibase
1.79,2.94,-39.95,0,5,-1, 163.112, 1
26567330
 
#73

ChemMol: 44033527
AK Scientific: Z4700
Angene Building Blocks: AGN-PC-0O9WQB
Anward: ANW-61256
Ark Pharm Building Blocks: AK-50613...20 total

ref: mol2, SDF, SMILES, flexibase
1.66,4.6,-10.55,0,5,0, 164.12, 1
4262255
 
#74

Scientific Exchange (make on demand): F-441861
Acros Organics: 29670
AKOS: AKOS000202535
Alfa-Aesar: A11194
Alinda Building Blocks: ALBB-007522...47 total

ref: mol2, SDF, SMILES, flexibase
1.73,2.76,-8.73,0,5,0, 164.12, 2
4262254
 
#75

ChemMol: 83600371
eMolecules: 493393
Acros Organics: 29669, AC29669
Alinda Building Blocks: ALBB-007523
BioSynth: W-200307...41 total

ref: mol2, SDF, SMILES, flexibase
1.68,3.25,-11.87,0,5,0, 164.12, 2

Similar to: 39261988,
2559908
 
#76

eMolecules: 29485197
AKOS: AKOS015922432
Chembo Pharma: KB-24398
Enamine Building Blocks: EN300-88382
Mcule: MCULE-7171373501...20 total

ref: mol2, SDF, SMILES, flexibase
1.34,4.67,-44.4,0,5,-1, 163.112, 1
lo: mol2, SDF, SMILES, flexibase
1.34,3.66,-11.94,1,5,0, 164.12, 1

Similar to: 25502934, 34374914, 34622862,
2540018
 
#77

Ark Pharm Building Blocks: AK-60816
BOC Sciences BB: 173783-71-6
Chembo Pharma: KB-16301
Tetrahedron Building Blocks: TS11792
PubChem: 57345499...10 total

ref: mol2, SDF, SMILES, flexibase
-2.39,-3.97,-133.18,2,6,-2, 162.097, 4
lo: mol2, SDF, SMILES, flexibase
-2.39,-5.09,-66.5,3,6,-1, 163.105, 4

Similar to: 32153446, 34569179, 60219035,
2561371
 
#78

ChemMol: 2100327, 30108037, 44006223
eMolecules: 886420
Molport: MolPort-005-938-637
AK Scientific: M426
Alfa-Aesar: B23461...40 total

ref: mol2, SDF, SMILES, flexibase
-0.44,0.78,-34.65,0,6,-1, 141.11, 3
2386405
 
#79

ChemMol: 51502199
AK Scientific: Y4207
AKOS: AKOS015850271, AKOS015851103
Angene Building Blocks: AGN-PC-0OJB9B
Ark Pharm Building Blocks: AK121849...29 total

ref: mol2, SDF, SMILES, flexibase
2.27,1.62,-33.3,0,2,-1, 162.983, 0
mid: mol2, SDF, SMILES, flexibase
1.82,3.06,-15.41,1,2,0, 163.991, 0
331793
 
#80

ChemMol: 44033464
Acros Organics: 37942
AK Scientific: W4919
AKOS: AKOS015833833
Alfa-Aesar: H30427...33 total

ref: mol2, SDF, SMILES, flexibase
1.10,3.96,-19.7,0,2,0, 163.991, 0
2031579
 
#81

ChemMol: 97601732, 44014866
eMolecules: 43442896, 536606, 31636677
Molport: MolPort-020-015-103, MolPort-016-638-258
Scientific Exchange Building Blocks: F-405879
TCM Database @ Taiwan: tcm03_001598...97 total

ref: mol2, SDF, SMILES, flexibase
2.43,4.73,-33.01,2,1,1, 128.239, 2

Similar to: 4955767, 4955769, 4955771, 6412117, 6412118, ... 7 in total.
896223
 
#82

ChemMol: 44014866
eMolecules: 536606, 31636677, 43442896
Molport: MolPort-020-015-103, MolPort-016-638-258
Scientific Exchange Building Blocks: F-405879
ACB Blocks: C6A-0001...92 total

ref: mol2, SDF, SMILES, flexibase
2.43,4.73,-33.03,2,1,1, 128.239, 2

Similar to: 4955767, 4955769, 4955771, 6412117, 6412118, ... 7 in total.
895706
 
#83

Molport: MolPort-002-502-024
AK Scientific: X2993, Z4868
AKOS: AKOS015844037, AKOS000187805
Aldrich CPR: CDS013643|ALDRICH, CDS005901|ALDRICH
Alfa-Aesar: H27987...87 total

ref: mol2, SDF, SMILES, flexibase
1.86,3.41,-42.48,3,1,1, 128.239, 2

Similar to: 32005448, 43559337, 43559338, 43559339, 43559340, ... 12 in total.
1614479
 
#84

ChemMol: 2000440, 1036125
eMolecules: 842326
Molport: MolPort-000-887-477
Aldrich CPR: S409944|ALDRICH
Alfa-Aesar: H25848...58 total

ref: mol2, SDF, SMILES, flexibase
2.14,-0.56,-35.94,2,1,1, 128.239, 2

Similar to: 39338621,
64945
 
#85

ChemMol: 97802026, 44020417, 44014404, 30110722
eMolecules: 3762421, 1013088
Molport: MolPort-001-551-230, MolPort-000-935-441
Scientific Exchange (make on demand): M-044224
AK Scientific: V7562...93 total

ref: mol2, SDF, SMILES, flexibase
1.40,3.53,-36.86,2,1,1, 128.22, 2
388196
 
#86

AK Scientific: 2923AE
Chembo Pharma: KB-152707, KB-12117
Combi-Blocks: QA-8212
KaironKem: K37
Labotest: LT03330917...33 total

ref: mol2, SDF, SMILES, flexibase
0.29,4.35,-38.12,1,2,1, 128.195, 1

Similar to: 2579273, 39255261, 39255262,
12953414
 
#87

Aldrich CPR: BBO000374|ALDRICH
American Custom Chemicals Corp.: CHM0164026, CHM0151651
Chemstep: 13770
Sigma Aldrich (Building Blocks): BBO000374|ALDRICH
Synblock: AB03899...13 total

ref: mol2, SDF, SMILES, flexibase
-0.16,-0.56,-42.33,4,2,1, 128.195, 1

Similar to: 32098956, 41701799, 4262161,
2558242
 
#88

ChemMol: 97600265, 30203719, 44028680, 30113678, 44011033
eMolecules: 42889972
Molport: MolPort-019-991-330, MolPort-021-784-587
Acros Organics: 36226
AK Scientific: Y6706...68 total

ref: mol2, SDF, SMILES, flexibase
-0.56,0.99,-69.03,3,3,0, 127.143, 1

Similar to: 39334145, 2389433,
2558241
 
#89

ChemMol: 97600266, 30113677, 30203718, 44001008
eMolecules: 42889972
Molport: MolPort-021-784-586, MolPort-019-991-330
AK Scientific: Y6712, Z2011, X5640
AKOS: AKOS015849510...67 total

ref: mol2, SDF, SMILES, flexibase
-0.56,1.1,-46.53,3,3,0, 127.143, 1

Similar to: 39334145, 2389433,
2385928
 
#90

ChemMol: 97600812, 30114743
Alfa-Aesar: H52010
American Custom Chemicals Corp.: CHM0005147, CCH0005722
APIChem: AC-22135
Ark Pharm Building Blocks: AK114883...29 total

ref: mol2, SDF, SMILES, flexibase
-0.88,1.31,-41.53,3,3,0, 127.143, 3

Similar to: 2385797,
8132748
 
#91

AK Scientific: O653
MicroSource Pharmakon: 01503250
MicroSource US Drugs: 01503250
Prestwick Chemical: Prestw-726, 726
Tetrahedron Building Blocks: TS11761...61 total

ref: mol2, SDF, SMILES, flexibase
2.71,5.77,-37.6,2,1,1, 164.272, 3

Similar to: 33826215, 33826221, 5357274, 5357281, ... 4 in total.
38337193
 
#92

ChemMol: 83602740, 30201239
eMolecules: 846347
Molport: MolPort-000-889-118, MolPort-021-783-791
AK Scientific: 8973AE
AKOS: AKOS000118578...79 total

ref: mol2, SDF, SMILES, flexibase
1.31,5.18,-41.65,3,1,1, 164.272, 2
hi: mol2, SDF, SMILES, flexibase
1.31,4.89,-1.72,2,1,0, 163.264, 2

Similar to: 39017396, 39017397, 2577188, 3394484, ... 4 in total.
10474754
 
#93

eMolecules: 6895877
Molport: MolPort-004-851-549
Scientific Exchange: F-163149
AKOS: AKOS001480956
Ark Pharm Building Blocks: AK153810...20 total

ref: mol2, SDF, SMILES, flexibase
2.73,0.65,-38.11,2,1,1, 164.272, 4

Similar to: 34622082, 39375630, 39375631,
2599327
 
#94

eMolecules: 6895877
Molport: MolPort-004-851-549
Scientific Exchange: F-163149
AKOS: AKOS001480956
Ark Pharm Building Blocks: AK153810...19 total

ref: mol2, SDF, SMILES, flexibase
2.73,0.65,-38.1,2,1,1, 164.272, 4

Similar to: 10474754, 34622082, 39375630, 39375631, ... 4 in total.
1711250
 
#95

eMolecules: 491550
Scientific Exchange (make on demand): M-870652
Acorn PharmaTech: ACN-S003682
AK Scientific: 1721AB
AKOS: AKOS000226128...67 total

ref: mol2, SDF, SMILES, flexibase
2.93,0.23,-38.2,2,1,1, 164.272, 5
19971522
 
#96

ChemMol: 30200248
AKOS: AKOS015842030
American Custom Chemicals Corp.: CCH0000177
Ark Pharm Building Blocks: AK134016
PKChem Building Blocks: PKCBB_00982...22 total

ref: mol2, SDF, SMILES, flexibase
1.13,5.21,-44.33,3,1,1, 164.272, 2

Similar to: 36157834, 36157837, 39952083, 39952084, ... 4 in total.
2579272
 
#97

AK Scientific: 5959AE
AKOS: AKOS009158069
Aldrich CPR: CDS001572|ALDRICH
Alfa-Aesar: B22316
Chembo Pharma: KB-40022...29 total

ref: mol2, SDF, SMILES, flexibase
2.99,-1.12,-42.71,3,1,1, 164.272, 4

Similar to: 44236469, 44248829,
2040587
 
#98

American Custom Chemicals Corp.: CHM0293130
Tetrahedron Building Blocks: TS11746
Toronto Research Chemicals: E678390
BindingDB.org: 50009050, 50368223
BOC Sciences BB (Depleted): 1858-47-5...34 total

ref: mol2, SDF, SMILES, flexibase
2.61,0.74,-32.99,2,1,1, 164.272, 4

Similar to: 32153882, 32153887, 32231074, 32231076, ... 4 in total.
1481840
 
#99

NCI Plated 2007: 54938
Tetrahedron Building Blocks: TS11746
Toronto Research Chemicals: E678395
BindingDB.org: 50009050
BOC Sciences BB (Depleted): 1858-47-5...32 total

ref: mol2, SDF, SMILES, flexibase
2.61,0.74,-32.98,2,1,1, 164.272, 4

Similar to: 32153882, 32153887, 32231074, 32231076, ... 4 in total.
5284177
 
#100

Molport: MolPort-004-326-498
AK Scientific: W7376
Angene Building Blocks: AGN-PC-0T0LNO
Anward: ANW-52014
Apexmol Building Blocks: AM20050540...46 total

ref: mol2, SDF, SMILES, flexibase
1.13,4.89,-41.57,3,1,1, 164.272, 2

Similar to: 39234754, 39234755, 39952109,

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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 = 618 ) limit 0,100

Smiles were