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8204642
 
#1

ChemMol: 44004244, 30104779
APIChem: AC-753
Boerchem Pharmatech BB: BC209345
Bosche Scientific: T0006
Element Store BB: b2star-171596-29-5...33 total

ref: mol2, SDF, SMILES, flexibase
2.36,6.9,-12.89,1,7,0, 389.411, 1

Similar to: 13489195, 13527997, 13528021, 13528028, 34011673, ... 69 in total.
3993855
 
#2

ChemMol: 30104779, 44004244
AKOS: AKOS015892559
American Custom Chemicals Corp.: API0002003
APIChem: AC-753
BePharm Building Blocks: B41369...142 total

ref: mol2, SDF, SMILES, flexibase
2.36,6.81,-13.33,1,7,0, 389.411, 1

Similar to: 8204637, 8204642, 13489195, 13527997, 13528001, ... 71 in total.
4172337
 
#3

TCM Database @ Taiwan: 26309
Acros Organics: 42106, 42107
AK Scientific: N020
Alfa-Aesar: A14505
American Custom Chemicals Corp.: VIT0000048...65 total

ref: mol2, SDF, SMILES, flexibase
8.96,19.82,-8.65,0,3,0, 472.754, 14

Similar to: 11616507, 11616508, 32191354, 32191356, 32191358, ... 72 in total.
4474460
 
#4

ChemMol: 30101562, 44028117
Acros Organics: 14094
AK Scientific: K119
Alfa-Aesar: B22524
APIChem: AC-8884...175 total

ref: mol2, SDF, SMILES, flexibase
7.68,13.53,-2.24,1,1,0, 384.648, 6

Similar to: 44830200, 44830203, 3830353, 3830354, 3830355, ... 11 in total.
12484965
 
#5

ChemMol: 44002333
Boerchem Pharmatech BB: BC204153
Bosche Scientific: H0014
EndoTherm: EN75
FineTech: FT-0602913...77 total

ref: mol2, SDF, SMILES, flexibase
6.76,10.23,-3.75,2,2,0, 400.647, 6

Similar to: 38791795, 3776232, 3790758, 3790762, 3799897, ... 10 in total.
4629876
 
#6

Bosche Scientific: V0016
ref: mol2, SDF, SMILES, flexibase
7.42,14.04,-2.32,1,1,0, 396.659, 5

Similar to: 5294779, 5294783, 7997527, 7998023, 9212316, ... 36 in total.
16125284
 
#7

APIChem: AC-14163
Bosche Scientific: C0019
Chembo Pharma: KB-97775, KB-230177, KB-290221
Combi-Blocks: SS-4615
Molport BB: MolPort-001-770-956...20 total

ref: mol2, SDF, SMILES, flexibase
2.34,3.82,-4.13,0,2,0, 192.045, 2

Similar to: 34337995, 39038289,
2569921
 
#8

ChemMol: 30106541, 96708091, 44005400, 83601264
Acros Organics: 33541
AKOS: AKOS015838712
Anward: ANW-40822
APIChem: AC-7742...33 total

ref: mol2, SDF, SMILES, flexibase
2.50,2.34,-14.6,0,4,0, 280.082, 5
21301131
 
#9

ChemMol: 96710368, 44031739, 30112727
AK Scientific: V2197
APIChem: AC-7741
Ark Pharm Building Blocks: AK-36990
Bosche Scientific: E0023...22 total

ref: mol2, SDF, SMILES, flexibase
1.52,9.62,-14.14,0,5,0, 310.712, 4

Similar to: 34325830, 34348542, 34348543, 34384622, 36472404, ... 6 in total.
390894
 
#10

ChemMol: 44003677, 96700525, 30104001
Molport: MolPort-001-812-137
AK Scientific: Y6626
Aldrich CPR: CDS003858|ALDRICH
Angene Building Blocks: AGN-PC-0R030N...56 total

ref: mol2, SDF, SMILES, flexibase
2.09,6.83,-36.08,2,3,1, 258.128, 3
mid: mol2, SDF, SMILES, flexibase
2.09,6.32,-9.49,1,3,0, 257.12, 3

Similar to: 38285594, 38285595, 38440226, 39280667, 39280669, ... 8 in total.
390893
 
#11

ChemMol: 96700525, 44003677, 30104001
Molport: MolPort-001-812-137
Aldrich CPR: CDS003858|ALDRICH
Angene Building Blocks: AGN-PC-0R030N
Anward: ANW-25339...55 total

ref: mol2, SDF, SMILES, flexibase
2.09,6.87,-34.37,2,3,1, 258.128, 3

Similar to: 38285594, 38285595, 38440226, 39280667, 39280669, ... 8 in total.
241954
 
#12

ChemMol: 44004557, 30105350
eMolecules: 1844533
Molport: MolPort-001-759-831
AK Scientific: Y9162
Anward: ANW-60519...56 total

ref: mol2, SDF, SMILES, flexibase
2.43,1.82,-14.93,0,3,0, 255.104, 3
mid: mol2, SDF, SMILES, flexibase
-1.11,2.11,-41.34,1,3,1, 256.112, 3
4241114
 
#13

ChemMol: 97300875, 97801682, 44005476, 96705550, 2000102
ACT Chemical BB: ACT01702
AK Scientific: W3845
AKOS: AKOS005146242
Alfa-Aesar: H29306...56 total

ref: mol2, SDF, SMILES, flexibase
0.56,3.96,-12.01,0,5,0, 210.233, 2

Similar to: 4241109,
4241109
 
#14

ChemMol: 97300875, 97801682, 44005476, 96705550, 2000102
A&J Pharmtech: AJ-00637
ACT Chemical BB: ACT01702
AK Scientific: W3845
AKOS: AKOS005146242...57 total

ref: mol2, SDF, SMILES, flexibase
0.56,3.98,-10.5,0,5,0, 210.233, 2

Similar to: 4241114,
579472
 
#15

ChemMol: 44014461
AK Scientific: V1697
Amadis Chemical: A848896
Ark Pharm Building Blocks: AK115816
BePharm Building Blocks: B129880...91 total

ref: mol2, SDF, SMILES, flexibase
3.01,6.23,-12.54,0,4,0, 358.85, 3

Similar to: 34043211, 34044138, 34044139, 34228889, 34339232, ... 9 in total.
2584360
 
#16

ChemMol: 98001214, 44005732, 1201108, 30107193, 1036858
eMolecules: 911810
Acorn PharmaTech: ACN-S003780
AK Scientific: I229
AKOS: AKOS000111237...65 total

ref: mol2, SDF, SMILES, flexibase
2.60,-0.72,-3.01,2,1,0, 237.015, 0
2028663
 
#17

ChemMol: 1201493, 98001367, 30102645, 42305441, 44002770, 96700568
eMolecules: 520212
Acros Organics: 34255
Alfa-Aesar: L06051
Anward: ANW-26243...58 total

ref: mol2, SDF, SMILES, flexibase
2.96,-0.53,-6.22,0,4,0, 259.092, 2

Similar to: 36451165, 39340834,
4203726
 
#18

ChemMol: 44001320, 44026507, 30106154, 96700605
AK Scientific: R070
AKOS: AKOS015851963
Angene Building Blocks: AGN-PC-0JNVB1
Anward: ANW-27498...53 total

ref: mol2, SDF, SMILES, flexibase
1.81,5.44,-5.98,0,2,0, 176.215, 1

Similar to: 33835511, 39285701,
11535828
 
#19

ChemMol: 44015388, 96700384
Acros Organics: 10951
AK Scientific: Y6233, P467
AKOS: AKOS015850529
Aldrich CPR: TMT00192|ALDRICH...68 total

ref: mol2, SDF, SMILES, flexibase
2.59,0.15,-6.98,0,1,0, 177.634, 1
lo: mol2, SDF, SMILES, flexibase
2.59,0.2,-28.19,1,1,1, 178.642, 1

Similar to: 34359990, 34359991, 34359996, 34359997, 39261287, ... 6 in total.
4008794
 
#20

ChemMol: 1034349, 44003205, 30103388
eMolecules: 45488740
Molport: MolPort-002-200-359
Alfa-Aesar: H61887
Anward: ANW-38314...53 total

ref: mol2, SDF, SMILES, flexibase
0.86,7.71,-20.94,0,4,0, 223.182, 3

Similar to: 38778716, 39041973, 39042359,
896740
 
#21

ChemMol: 97900324, 44002312
eMolecules: 591843, 902133
Molport: MolPort-003-665-537
Active BioPharma: 629
AK Scientific: I742...204 total

ref: mol2, SDF, SMILES, flexibase
5.72,13.6,-35.01,1,3,1, 417.143, 6
mid: mol2, SDF, SMILES, flexibase
5.72,13.09,-6.46,0,3,0, 416.135, 6

Similar to: 3944782, 4214672, 5854237, 5881960, 5881965, ... 23 in total.
607971
 
#22

ChemMol: 97900324, 44002312
eMolecules: 902133, 591843
Molport: MolPort-003-665-537
Active BioPharma: 629
AK Scientific: I742...198 total

ref: mol2, SDF, SMILES, flexibase
5.72,14.15,-35.65,1,3,1, 417.143, 6
mid: mol2, SDF, SMILES, flexibase
5.72,13.63,-6.4,0,3,0, 416.135, 6

Similar to: 643055, 896740, 3872945, 3944782, 4214672, ... 22 in total.
643055
 
#23

ChemMol: 44002238, 30101914, 44008192
Molport: MolPort-003-666-381
AK Scientific: H755, M369
APIChem: AC-1113
Ark Pharm Building Blocks: AK163676...127 total

ref: mol2, SDF, SMILES, flexibase
5.12,12.79,-38.94,1,3,1, 382.698, 6
mid: mol2, SDF, SMILES, flexibase
5.12,12.28,-5.6,0,3,0, 381.69, 6

Similar to: 896740, 3872945, 3944782, 4214672, 5854237, ... 22 in total.
596881
 
#24

ChemMol: 44002238, 30101914, 44008192
Molport: MolPort-003-666-381
AK Scientific: H755, M369
APIChem: AC-1113
Ark Pharm Building Blocks: AK163676...134 total

ref: mol2, SDF, SMILES, flexibase
5.12,13.39,-39,1,3,1, 382.698, 6
mid: mol2, SDF, SMILES, flexibase
5.12,12.87,-6.09,0,3,0, 381.69, 6

Similar to: 607934, 607971, 643055, 896740, 3872945, ... 22 in total.
1696262
 
#25

ChemMol: 42306963, 30110625, 97801393, 44003884, 1201414, 1033304, 42306772
eMolecules: 527449
Molport: MolPort-000-003-499
Acros Organics: 44322
ACT Chemical BB: ACT01407...85 total

ref: mol2, SDF, SMILES, flexibase
2.12,-0.07,-3.28,0,2,0, 166.97, 0
968276
 
#26

ChemMol: 44012442, 97900787
Active BioPharma: 1633
AKOS: AKOS000281116
Amadis Chemical: A845704
Boerchem Pharmatech BB: BC686826...90 total

ref: mol2, SDF, SMILES, flexibase
5.03,7.5,-12.36,2,6,0, 441.549, 5

Similar to: 3913925, 3960827, 34610403, 34610404, 34610405, ... 18 in total.
968277
 
#27

ChemMol: 97900787, 44012442
Active BioPharma: 1633
AKOS: AKOS000281116
Amadis Chemical: A845704
Boerchem Pharmatech BB: BC686826...85 total

ref: mol2, SDF, SMILES, flexibase
5.03,7.29,-12.45,2,6,0, 441.549, 5

Similar to: 3913925, 3960827, 34610403, 34610404, 34610405, ... 18 in total.
968278
 
#28

ChemMol: 97900787, 44012442
Active BioPharma: 1633
AKOS: AKOS000281116
Amadis Chemical: A845704
Boerchem Pharmatech BB: BC686826...90 total

ref: mol2, SDF, SMILES, flexibase
5.03,7.5,-12.94,2,6,0, 441.549, 5

Similar to: 3913925, 3960827, 34610403, 34610404, 34610405, ... 18 in total.
968279
 
#29

ChemMol: 97900787, 44012442
Active BioPharma: 1633
AKOS: AKOS000281116
Amadis Chemical: A845704
Boerchem Pharmatech BB: BC686826...86 total

ref: mol2, SDF, SMILES, flexibase
5.03,7.3,-12.93,2,6,0, 441.549, 5

Similar to: 3913925, 3960827, 34356465, 34356466, 34394039, ... 22 in total.
164811
 
#30

ChemMol: 30116346, 98000858, 1033553, 44008054, 1032250, 1033840, 97806499, 1201185
eMolecules: 495118
Acorn PharmaTech: ACN-S003530
Acros Organics: 24196, SB01786
Alfa-Aesar: A12596...63 total

ref: mol2, SDF, SMILES, flexibase
1.71,1.76,-5.23,1,1,0, 130.093, 0
2584330
 
#31

ChemMol: 97806706, 98002822, 1032251, 1033554, 30100134, 1202727, 1033841, 44000162
Acros Organics: 44258
AK Scientific: L416
AKOS: AKOS005063842
Alfa-Aesar: B23718...67 total

ref: mol2, SDF, SMILES, flexibase
1.81,1.82,-5.33,1,1,0, 148.083, 0
388530
 
#32

ChemMol: 1201172, 1033810, 1032220, 30110249, 44000163, 98000245
Acros Organics: 31163
AK Scientific: S123
Alfa-Aesar: A16034
Angene Building Blocks: AGN-PC-0JM0NP...67 total

ref: mol2, SDF, SMILES, flexibase
1.95,1.78,-5.91,1,1,0, 130.093, 0
388393
 
#33

ChemMol: 98002773, 44000164, 1037714
Acorn PharmaTech: ACN-S002278
Alfa-Aesar: A10931
Angene Building Blocks: AGN-PC-04RKLW
Anward: ANW-30337...57 total

ref: mol2, SDF, SMILES, flexibase
2.13,3.87,-3.5,0,1,0, 126.13, 1

Similar to: 34563029,
2512335
 
#34

ChemMol: 30100135, 1037637, 44010075, 1202520, 98001722
AK Scientific: Q415
Alfa-Aesar: B23750
Angene Building Blocks: AGN-PC-0KK857
Anward: ANW-30024...44 total

ref: mol2, SDF, SMILES, flexibase
2.23,4.05,-5.96,0,1,0, 144.12, 1
2140804
 
#35

ChemMol: 44013371, 98000084, 1034434
Acros Organics: 30353
Alfa-Aesar: A11401
Anward: ANW-37195
Apollo Scientific: PC3104...47 total

ref: mol2, SDF, SMILES, flexibase
4.11,5.61,-3.18,0,1,0, 276.563, 3
161696
 
#36

ChemMol: 98001842, 1031262, 96700807, 1031275, 1201179, 30110066, 44000174, 83600433
eMolecules: 506359
Acorn PharmaTech: ACN-S003560
Acros Organics: KM10855
AK Scientific: K465...79 total

ref: mol2, SDF, SMILES, flexibase
1.31,2.08,-7.65,1,2,0, 137.113, 0
164450
 
#37

ChemMol: 1200372, 98000306, 83602573, 30110637, 1031231, 44008933
eMolecules: 487515
Acros Organics: 25005
AKOS: AKOS001171792
Alfa-Aesar: A14375...83 total

ref: mol2, SDF, SMILES, flexibase
1.81,4.92,-7.31,0,1,0, 121.114, 0
159425
 
#38

ChemMol: 44015487, 1200398, 1031216, 30110775, 44000176, 98000916, 97800487
eMolecules: 493150
Scientific Exchange (make on demand): POD_02/0149
Alfa-Aesar: A14113
Angene Building Blocks: AGN-PC-0JLQRR...71 total

ref: mol2, SDF, SMILES, flexibase
1.95,4.98,-5.71,0,1,0, 139.104, 0

Similar to: 164883, 38292570, 39278278,
2579308
 
#39

ChemMol: 44000464, 30100322
Alfa-Aesar: H26456
APIChem: AC-10346
Boerchem Pharmatech BB: BC200643
Bosche Scientific: D0069...19 total

ref: mol2, SDF, SMILES, flexibase
2.08,3.16,-13.42,0,2,0, 186.157, 2

Similar to: 39128310, 43504841,
56366
 
#40

ChemMol: 30100143, 96707714
eMolecules: 46473682, 886390
Scientific Exchange (make on demand): F-394029
AK Scientific: Z0565
AKOS: AKOS000101573...62 total

ref: mol2, SDF, SMILES, flexibase
1.89,2.75,-5.97,2,2,0, 191.152, 2
119927
 
#41

ChemMol: 30100145, 1202016, 98000575, 1036833, 83600213, 44003214, 30103401
eMolecules: 489060
Acorn PharmaTech: ACN-S002077
AK Scientific: T254
Alfa-Aesar: B22714...72 total

ref: mol2, SDF, SMILES, flexibase
2.92,1.31,-3.13,2,1,0, 195.571, 1

Similar to: 6091910,
164442
 
#42

ChemMol: 30100148, 1034499, 1202015, 44008545, 1034498, 98001550
eMolecules: 476569
Acorn PharmaTech: ACN-S002605, ACN-S002080
Acros Organics: SB00719, 17418, 20891
AK Scientific: 2810AF...133 total

ref: mol2, SDF, SMILES, flexibase
1.91,3.37,-3.6,2,1,0, 161.126, 1

Similar to: 34974896,
157542
 
#43

ChemMol: 1201895, 1201994, 1034189, 98000629, 1034313
eMolecules: 476385
Acros Organics: 16077
AKOS: AKOS000119494
Alfa-Aesar: A12503...80 total

ref: mol2, SDF, SMILES, flexibase
0.89,2.83,-7.35,2,2,0, 135.166, 1

Similar to: 3676531, 5167632, 5833499, 39244520, ... 4 in total.
2031394
 
#44

ChemMol: 30111743, 44000194
Molport: MolPort-001-770-820
Acros Organics: 27547
Alfa-Aesar: B23537
Angene Building Blocks: AGN-PC-03L5CC...68 total

ref: mol2, SDF, SMILES, flexibase
1.97,4.54,-4.46,0,1,0, 121.183, 0
lo: mol2, SDF, SMILES, flexibase
1.97,4.79,-26.19,1,1,1, 122.191, 0

Similar to: 31484307, 32162386, 32162388, 32166578, 39048653, ... 7 in total.
336108
 
#45

ChemMol: 83601827, 96705614, 30100153, 44008181, 44000196
eMolecules: 518422, 1838903
Molport: MolPort-001-800-895, MolPort-002-041-351
Scientific Exchange (make on demand): M-965959
AK Scientific: N553...95 total

ref: mol2, SDF, SMILES, flexibase
2.54,1.15,-5.2,0,2,0, 185.654, 2
mid: mol2, SDF, SMILES, flexibase
2.54,1.21,-30.45,1,2,1, 186.662, 2

Similar to: 6694231, 39051303,
2566176
 
#46

ChemMol: 44022099, 30100154, 98001030, 1201804, 2000383
Alfa-Aesar: B23548
Angene Building Blocks: AGN-PC-0C170G
Anward: ANW-32571
APIChem: AC-23553...52 total

ref: mol2, SDF, SMILES, flexibase
1.62,2.15,-4.28,1,2,0, 152.193, 3

Similar to: 33787715, 34572558,
155429
 
#47

ChemMol: 30109076, 44007498
AK Scientific: X3117
AKOS: AKOS015910722, AKOS015852046
Alfa-Aesar: H56077
American Custom Chemicals Corp.: CHM0034737...52 total

ref: mol2, SDF, SMILES, flexibase
1.10,-1.76,-3.42,0,4,0, 184.239, 3

Similar to: 34326142, 34457527, 34457528, 34548636, 34558279, ... 13 in total.
1681580
 
#48

ChemMol: 30100156, 2000172
eMolecules: 498722
Molport: MolPort-002-070-314
Acros Organics: 11474
AK Scientific: P225...54 total

ref: mol2, SDF, SMILES, flexibase
3.52,8.77,-8.47,0,1,0, 208.26, 0

Similar to: 5948460, 34469577, 39243442, 39256731, 39370009, ... 5 in total.
243148
 
#49

ChemMol: 1034338, 30100159
AKOS: AKOS000120857
Alfa-Aesar: L06338
Angene Building Blocks: AGN-PC-0JKBGI
Anward: ANW-14671...50 total

ref: mol2, SDF, SMILES, flexibase
3.86,0.21,-6.62,1,2,0, 245.709, 3

Similar to: 5849484, 32166396, 33790772, 34571841, 34615661, ... 6 in total.
2579309
 
#50

ChemMol: 1037619
Bosche Scientific: B0093
Capot Chemical: 8722
Chembo Pharma: KB-180901
Molport BB: MolPort-003-984-805...9 total

ref: mol2, SDF, SMILES, flexibase
4.58,8.79,-6.91,0,2,0, 243.693, 2

Similar to: 31887843, 31887891, 31887894, 31888239, 31888261, ... 7 in total.
2023479
 
#51

ChemMol: 30100162
AK Scientific: Z3009
APIChem: AC-4717
Bosche Scientific: H0094
Chembo Pharma: KB-198758...14 total

ref: mol2, SDF, SMILES, flexibase
-1.19,-3.16,-13.08,2,6,0, 199.21, 3

Similar to: 5726317, 39262847,
157062
 
#52

Amidohydrolase AH-EFI: Thymine, Pyramethanil
ChemMol: 44015341, 44008598, 1033429, 96700072, 30100164
eMolecules: 532426, 929924
Molport: MolPort-001-766-701, MolPort-016-728-797
TCM Database @ Taiwan: 42690...260 total

ref: mol2, SDF, SMILES, flexibase
-0.47,-0.63,-13.07,2,4,0, 126.115, 0

Similar to: 39121233,
162484
 
#53

ChemMol: 80101186, 30100165, 44008575, 83601584
eMolecules: 886612, 536830, 4399203
Molport: MolPort-001-788-525
Scientific Exchange (make on demand): Z-001821
Acorn PharmaTech: ACN-P000745...104 total

ref: mol2, SDF, SMILES, flexibase
-0.46,-0.72,-11.44,2,4,0, 126.115, 0
1038918
 
#54

ChemMol: 1034217, 30103334
eMolecules: 534919
Molport: MolPort-000-881-302
AKOS: AKOS000277063
Alfa-Aesar: A15573...65 total

ref: mol2, SDF, SMILES, flexibase
5.19,11.14,-8.12,0,1,0, 258.32, 3

Similar to: 2173384, 34396555, 34400619,
1586423
 
#55

ChemMol: 30100167, 44000213, 83603257
eMolecules: 722423
Acros Organics: SB01223
AK Scientific: H094
Angene Building Blocks: AGN-PC-0JKCK5...56 total

ref: mol2, SDF, SMILES, flexibase
4.18,5.83,-3.03,1,1,0, 178.275, 1
19736831
 
#56

ChemMol: 44002941, 96706530, 51501888, 97802277, 30102918
eMolecules: 728990
Molport: MolPort-003-987-839
A&J Pharmtech: AJ-01120
Acorn PharmaTech: ACN-S003165...67 total

ref: mol2, SDF, SMILES, flexibase
0.92,-0.09,-6.59,2,3,0, 124.143, 1
164476
 
#57

ChemMol: 44008322, 1033838, 1203095, 98000244, 1032248
eMolecules: 508452
Acros Organics: 11954
AKOS: AKOS000118964
Alfa-Aesar: A14979...89 total

ref: mol2, SDF, SMILES, flexibase
1.83,1.71,-5.26,1,1,0, 112.103, 0
155456
 
#58

ChemMol: 96707542, 44008205, 1200264, 98000380, 1037492, 30100184
eMolecules: 481790
Molport: MolPort-000-871-214
TCM Database @ Taiwan: tcm03_005899
Acros Organics: 16261...122 total

ref: mol2, SDF, SMILES, flexibase
1.37,3.45,-9.04,0,3,0, 166.176, 3
8283845
 
#59

CCP W191G binders: MFCD00005201
ChemMol: 1035983, 44000244, 30110286
eMolecules: 487834
Molport: MolPort-001-770-273
Acros Organics: 19033...115 total

ref: mol2, SDF, SMILES, flexibase
0.15,3.22,-30.67,2,2,1, 83.114, 0
ref: mol2, SDF, SMILES, flexibase
0.15,3.19,-30.65,2,2,1, 83.114, 0
mid: mol2, SDF, SMILES, flexibase
0.15,2.7,-6.46,1,2,0, 82.106, 0
mid: mol2, SDF, SMILES, flexibase
0.15,2.73,-6.87,1,2,0, 82.106, 0
1574332
 
#60

ChemMol: 30100187
eMolecules: 890383
Molport: MolPort-001-770-221
Aldrich CPR: S412724|ALDRICH
Angene Building Blocks: AGN-PC-0JK8T6...41 total

ref: mol2, SDF, SMILES, flexibase
1.87,7.28,-6.56,0,2,0, 174.247, 4

Similar to: 31945925, 31945926, 34616868, 34959037, 36677046, ... 10 in total.
1688228
 
#61

ChemMol: 30100188
AK Scientific: K689
Alfa-Aesar: L11183
Anward: ANW-39873
APIChem: AC-10205...39 total

ref: mol2, SDF, SMILES, flexibase
0.87,4.05,-7.8,1,3,0, 190.246, 5

Similar to: 37784714,
105176
 
#62

ChemMol: 2001056, 83600785, 30100192, 44009244, 96700241, 1035719
eMolecules: 492830
L99A non-binders: 8-AMINOQUINOLINE
Scientific Exchange (make on demand): M-698174
Acros Organics: 12371...141 total

ref: mol2, SDF, SMILES, flexibase
1.38,2.96,-5.86,2,2,0, 144.177, 0
85658
 
#63

ChemMol: 97800789, 44000256, 30100196, 83600737, 30200760, 1031196
eMolecules: 506687
Acros Organics: 27112
Alfa-Aesar: A18308
Anward: ANW-29798...63 total

ref: mol2, SDF, SMILES, flexibase
2.38,0.89,-5.91,0,1,0, 166.607, 0

Similar to: 345232, 39222165, 39222167,
158586
 
#64

ChemMol: 97806480, 1201339, 1203099, 44008659
eMolecules: 486213
Acros Organics: 10740
ACT Chemical BB: ACT05539
AKOS: AKOS000119182...111 total

ref: mol2, SDF, SMILES, flexibase
1.85,3.24,-4.98,0,1,0, 157.998, 0
lo: mol2, SDF, SMILES, flexibase
1.85,3.52,-29.78,1,1,1, 159.006, 0
3861008
 
#65

ChemMol: 30100197, 1201375, 1032493, 83600898
eMolecules: 480323
Acorn PharmaTech: ACN-S002251
Acros Organics: 15634
Alfa-Aesar: B23579...101 total

ref: mol2, SDF, SMILES, flexibase
0.31,0.81,-5.37,1,2,0, 123.155, 2
lo: mol2, SDF, SMILES, flexibase
0.31,1.09,-30.62,2,2,1, 124.163, 2

Similar to: 34549831, 34549832,
19801062
 
#66

ChemMol: 30102924, 44002945, 51505071
eMolecules: 2726033
Molport: MolPort-002-344-430
AK Scientific: Y4042
APIChem: AC-13283...26 total

ref: mol2, SDF, SMILES, flexibase
1.30,0.85,-6.53,2,3,0, 138.17, 2
164466
 
#67

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

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

Similar to: 39051799,
19015383
 
#68

ChemMol: 30100201, 2100400, 42306979, 44016238, 97800947, 51500654, 1201335, 44008637, 97805171
eMolecules: 516984
Acorn PharmaTech: ACN-F000787
Acros Organics: 34545
AKOS: AKOS001407522...101 total

ref: mol2, SDF, SMILES, flexibase
0.74,1.02,-5.39,2,2,0, 128.562, 0
402776
 
#69

ChemMol: 97800548, 30100202, 44008633, 1201345
Molport: MolPort-001-769-685
Acorn PharmaTech: ACN-C000938
Acros Organics: 11003
ACT Chemical BB: ACT01622...126 total

ref: mol2, SDF, SMILES, flexibase
1.33,3.24,-3.07,0,1,0, 113.547, 0
119820
 
#70

ChemMol: 30100205, 1202014, 98000090, 1034433, 1202416
eMolecules: 483120
Acros Organics: 18569
Alfa-Aesar: A15289
Anward: ANW-27480...69 total

ref: mol2, SDF, SMILES, flexibase
2.73,3.47,-3.63,2,1,0, 229.123, 2
1081248
 
#71

ChemMol: 30100206, 97800323, 1201427, 1033319, 44008519, 1201726
eMolecules: 476764
Scientific Exchange (make on demand): POD_05/0570
Acros Organics: 10349
ACT Chemical BB: ACT01426...95 total

ref: mol2, SDF, SMILES, flexibase
1.64,2.76,-3.5,2,3,0, 163.995, 0
132738
 
#72

ChemMol: 30100207, 44008520, 1201426, 1033347, 97804571
eMolecules: 502535
AKOS: AKOS000119873
Alfa-Aesar: B20152
Angene Building Blocks: AGN-PC-0052LB...92 total

ref: mol2, SDF, SMILES, flexibase
0.39,-1.18,-5.35,2,5,0, 155.157, 2

Similar to: 25491661, 25491666, 25491683, 39121197, ... 4 in total.
49152
 
#73

ChemMol: 1033338, 44035292, 30100208
eMolecules: 502537
Molport: MolPort-001-783-538
Alfa-Aesar: H66190
Alinda Building Blocks: ALBB-014669...63 total

ref: mol2, SDF, SMILES, flexibase
0.39,-3.47,-7.19,2,5,0, 155.157, 2
lo: mol2, SDF, SMILES, flexibase
0.39,-2.26,-24.72,3,5,1, 156.165, 2
lo: mol2, SDF, SMILES, flexibase
0.39,-6.66,-29.06,3,5,1, 156.165, 2

Similar to: 34452859, 35785315, 38264820,
967399
 
#74

ChemMol: 83600441, 97804503, 1033365, 30100209, 44009466, 30103573
Acros Organics: BTB10268
AKOS: AKOS009031355
Alfa-Aesar: A17780
Angene Building Blocks: AGN-PC-09T858...80 total

ref: mol2, SDF, SMILES, flexibase
0.44,1.09,-5.84,4,4,0, 144.565, 0

Similar to: 25491572,
2028665
 
#75

ChemMol: 30100210, 42305463, 44000274, 1203088, 96700569, 97800888, 98001368
eMolecules: 516587
Alfa-Aesar: A14952
Alinda Building Blocks: ALBB-005949
Angene Building Blocks: AGN-PC-0D1UJ5...93 total

ref: mol2, SDF, SMILES, flexibase
1.77,2.59,-10.36,2,5,0, 239.662, 2

Similar to: 5733028, 34554345, 39340837, 39340838, ... 4 in total.
1667478
 
#76

ChemMol: 1033416, 97800300, 30100211
Acros Organics: 33352
AK Scientific: L042
AKOS: AKOS015851187
Angene Building Blocks: AGN-PC-0JKCG0...50 total

ref: mol2, SDF, SMILES, flexibase
3.44,-1.22,-0.95,0,2,0, 217.87, 0
1845799
 
#77

ChemMol: 1033329, 30100212, 44009446
Acros Organics: 33353
AK Scientific: V7358
Anward: ANW-35772
APIChem: AC-10229...35 total

ref: mol2, SDF, SMILES, flexibase
1.90,2.37,-0.76,0,2,0, 168.505, 0

Similar to: 34343457,
16981047
 
#78

ChemMol: 1037574, 44000278, 83602994
eMolecules: 490332
Scientific Exchange (make on demand): X-047804
Acorn PharmaTech: ACN-S002498
ACT Chemical BB: ACT07207...80 total

ref: mol2, SDF, SMILES, flexibase
0.25,1.6,-6.24,2,3,0, 98.105, 0

Similar to: 39249634,
335976
 
#79

ChemMol: 83601998, 97801297, 1033220, 30100216, 44000281
eMolecules: 516003
Acorn PharmaTech: ACN-S002247
Acros Organics: 34552
AKOS: AKOS005216045...69 total

ref: mol2, SDF, SMILES, flexibase
1.31,3.55,-7.82,0,2,0, 118.139, 0
lo: mol2, SDF, SMILES, flexibase
1.31,3.81,-37.14,1,2,1, 119.147, 0
127542
 
#80

ChemMol: 1201437, 30100219, 44008518, 44017705, 97806597
eMolecules: 521367
Molport: MolPort-002-317-271
Angene Building Blocks: AGN-PC-00E9VA
Apexmol Building Blocks: AM81325...37 total

ref: mol2, SDF, SMILES, flexibase
2.07,-2.36,-5.06,0,4,0, 186.236, 3

Similar to: 39121072, 39121176,
164542
 
#81

ChemMol: 1035458
eMolecules: 500347
Acorn PharmaTech: ACN-S003328
Acros Organics: 43692
Alfa-Aesar: A10974...69 total

ref: mol2, SDF, SMILES, flexibase
0.23,1.18,-7.35,0,3,0, 105.1, 0

Similar to: 33836214,
155428
 
#82

ChemMol: 30108618, 44008240, 1030813
Acros Organics: 38996
AK Scientific: W8445
AKOS: AKOS015851530
Alfa-Aesar: H56077...59 total

ref: mol2, SDF, SMILES, flexibase
1.10,-1.57,-3.38,0,4,0, 184.239, 3

Similar to: 34326142, 34457527, 34457528, 34548636, 34558279, ... 13 in total.
1693280
 
#83

ChemMol: 44001100, 30100221
eMolecules: 529366
Molport: MolPort-000-871-184
Acros Organics: 12809
AK Scientific: X7020...130 total

ref: mol2, SDF, SMILES, flexibase
2.89,1.71,-6.68,0,1,0, 156.184, 1

Similar to: 34223604, 34457657, 39263082,
1673411
 
#84

ChemMol: 1031638, 30111452, 44012919
Molport: MolPort-019-375-339
Acros Organics: 14868
AK Scientific: L085
Alfa-Aesar: A13406...65 total

ref: mol2, SDF, SMILES, flexibase
3.46,-1.28,-0.93,0,0,0, 241.935, 0
164526
 
#85

ChemMol: 44000301, 1202005, 1036764, 30100226, 98000950
eMolecules: 496416
Acros Organics: 26893
AKOS: AKOS000119730
Alfa-Aesar: A10254...71 total

ref: mol2, SDF, SMILES, flexibase
1.77,2.57,-6.51,2,1,0, 147.099, 0
280905
 
#86

eMolecules: 1018328
Molport: MolPort-001-797-447
Scientific Exchange (make on demand): Z-049825
AKOS: AKOS003409135
Anward: ANW-26777...153 total

ref: mol2, SDF, SMILES, flexibase
-0.42,-1.95,-15.68,4,4,0, 164.164, 2

Similar to: 3394334, 39245204,
391971
 
#87

ChemMol: 1036843, 30116795
eMolecules: 500587
Molport: MolPort-000-871-473
AK Scientific: P327
Alfa-Aesar: B21113...65 total

ref: mol2, SDF, SMILES, flexibase
3.31,-1.14,-2.39,2,1,0, 196.464, 0

Similar to: 39237089,
157165
 
#88

ChemMol: 30100249
eMolecules: 492147
Scientific Exchange (make on demand): F-297308
Acros Organics: 33908
AK Scientific: U693...101 total

ref: mol2, SDF, SMILES, flexibase
-0.19,-0.85,-9.27,4,3,0, 136.154, 1

Similar to: 34604201,
157169
 
#89

ChemMol: 83600498, 30100250
eMolecules: 494675
Molport: MolPort-000-871-535
Scientific Exchange (make on demand): POD_26/0515
Acorn PharmaTech: ACN-S002282...113 total

ref: mol2, SDF, SMILES, flexibase
-0.17,-0.84,-9.62,4,3,0, 136.154, 1

Similar to: 6092688, 39248556,
18276088
 
#90

ChemMol: 30100255, 1035984, 44000351, 97806549
eMolecules: 1296453
Molport: MolPort-002-500-356
Scientific Exchange (make on demand): H-033559
AKOS: AKOS000103534...91 total

ref: mol2, SDF, SMILES, flexibase
0.13,-0.83,-8.64,4,4,0, 149.153, 0
164206
 
#91

ChemMol: 30100256, 1036897, 44012206, 1202659, 98001081
eMolecules: 45486748
Scientific Exchange (make on demand): H-033498
AK Scientific: 5791AB
AKOS: AKOS000111245...59 total

ref: mol2, SDF, SMILES, flexibase
3.11,-1.69,-2.34,2,1,0, 253.47, 0
3861099
 
#92

ChemMol: 30100258, 1202667, 98000231
eMolecules: 481218
Molport: MolPort-001-791-600
Acros Organics: 16200
AKOS: AKOS000114320...82 total

ref: mol2, SDF, SMILES, flexibase
2.39,8.13,-7.85,0,1,0, 184.238, 2
ref: mol2, SDF, SMILES, flexibase
3.84,6.2,-4.8,1,1,0, 184.238, 2

Similar to: 32142013, 32234529, 39592213,
155209
 
#93

ChemMol: 1034266, 30100260
Molport: MolPort-001-757-201
AKOS: AKOS009156780
Alfa-Aesar: A15867
Anward: ANW-13949...59 total

ref: mol2, SDF, SMILES, flexibase
4.02,1.69,-8.85,0,1,0, 216.667, 2

Similar to: 2392542, 38525455, 39257425, 39338602, ... 4 in total.
56397
 
#94

ChemMol: 30100264
eMolecules: 477971
Molport: MolPort-001-759-977
Scientific Exchange (make on demand): F-033610
AKOS: AKOS000120909...69 total

ref: mol2, SDF, SMILES, flexibase
4.11,6.9,-7.84,2,2,0, 266.127, 2

Similar to: 34344978,
1187543
 
#95

ChemMol: 30108867, 44002328
eMolecules: 496094, 1971965
Scientific Exchange (make on demand): X-046427, X-046443
Acros Organics: 12550
AK Scientific: Q813...161 total

ref: mol2, SDF, SMILES, flexibase
-0.02,3.82,-17.6,1,2,0, 114.173, 0
1091
 
#96

ChemMol: 44000369, 30100267
AK Scientific: H765
AKOS: AKOS001647527
Aldrich CPR: CDS000349|ALDRICH
Alfa-Aesar: L08218...70 total

ref: mol2, SDF, SMILES, flexibase
0.27,6.16,-22.06,0,4,0, 186.236, 2
19850183
 
#97

ChemMol: 30108755, 1201892, 1033852, 83603657, 44010181, 1032262, 1033565, 98000633
Acros Organics: 10468
AK Scientific: N680
AKOS: AKOS009156582
Alfa-Aesar: A14082...94 total

ref: mol2, SDF, SMILES, flexibase
1.24,2.5,-4.18,2,1,0, 125.196, 0

Similar to: 34226922, 157600, 8435690, 8436573, ... 4 in total.
18825330
 
#98

AfroDb Natural Products: AN_UY_030
ChemMol: 44000384, 97900288, 30100274
eMolecules: 532754
Molport: MolPort-000-003-911
TCM Database @ Taiwan: 26188...192 total

ref: mol2, SDF, SMILES, flexibase
2.27,1.08,-13.3,3,5,0, 270.24, 1

Similar to: 33835369, 33835388, 2149675, 6472605, ... 4 in total.
13440025
 
#99

American Custom Chemicals Corp.: NUC0000463
BioSynth: W-202600
Bosche Scientific: A0197
Chembo Pharma: KB-46630
FineTech: FT-0621497...26 total

ref: mol2, SDF, SMILES, flexibase
-2.21,-5.54,-23.28,8,11,0, 298.259, 2

Similar to: 17013444, 44699068, 4916515, 4916518, 4916522, ... 6 in total.
2146907
 
#100

ChemMol: 30100276
eMolecules: 889426
Molport: MolPort-000-998-735
Acorn PharmaTech: ACN-S001921
AK Scientific: 5957AE...49 total

ref: mol2, SDF, SMILES, flexibase
1.41,2.19,-11.79,0,4,0, 180.159, 2

Similar to: 34560134,

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 = 319 ) limit 0,100

Smiles were