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ZINC ID
Supplier information; Representations
Properties:xLogP, ap & p desolvation, HBD,HBA,Charge,Mwt,NRB
Annotations; Similarity
Structure

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154237
 
#1

AK Scientific: 8684AE
AKOS: AKOS015853275
Apollo Scientific: PC0880
Chembo Pharma: KB-85190
Combi-Blocks: SS-5966...26 total

ref: mol2, SDF, SMILES, flexibase
2.43,1.26,-45.55,0,4,-1, 227.142, 2

Similar to: 44221564, 44259934,
154240
 
#2

AK Scientific: 5099AE
AKOS: AKOS015852581
American Custom Chemicals Corp.: CHM0022997
Ark Pharm Building Blocks: AK-36793
Chembo Pharma: KB-85969...25 total

ref: mol2, SDF, SMILES, flexibase
0.78,2.88,-55,0,4,-1, 225.245, 3

Similar to: 8579838, 34523203, 39122589, 44138443, 44221934, ... 5 in total.
1495012
 
#3

AK Scientific: 2409AE
AKOS: AKOS015837746
Chembo Pharma: KB-309925, KB-85267
Fluorochem: 023734
Matrix Scientific: 009406...19 total

ref: mol2, SDF, SMILES, flexibase
4.12,-0.12,-51.6,2,4,1, 364.513, 5

Similar to: 7075,
154333
 
#4

AK Scientific: 2227AE
AKOS: AKOS000270643
Bosche Scientific: O10696
Chembo Pharma: KB-85174
Fluorochem: 023761...31 total

ref: mol2, SDF, SMILES, flexibase
1.39,6.73,-69.11,0,4,-1, 240.238, 2

Similar to: 44223212, 44263264,
1495017
 
#5

AK Scientific: 3862AE
AKOS: AKOS015855894
Chembo Pharma: KB-85579, KB-92864
Combi-Blocks: SS-5967
Fluorochem: 023776...23 total

ref: mol2, SDF, SMILES, flexibase
0.92,-6.54,-50.51,0,8,-1, 293.303, 3
16125516
 
#6

Molport: MolPort-002-497-886
AK Scientific: 4243AE
Apollo Scientific: PC0307
Chembo Pharma: KB-221497, KB-14290
Fluorochem: 010573...29 total

ref: mol2, SDF, SMILES, flexibase
1.27,4.69,-29.93,0,2,-1, 183.133, 2
ref: mol2, SDF, SMILES, flexibase
1.27,4.67,-30.97,0,2,-1, 183.133, 2
mid: mol2, SDF, SMILES, flexibase
2.28,3.75,-18.02,0,2,0, 184.141, 3

Similar to: 41669282,
1495018
 
#7

Asinex: BAS07763614
ChemBridge BuildingBlocks: 4032562
Peakdale: 3002949
Apollo Scientific (Depleted): OR0186
Fluorochem (Depleted): 023796...5 total

ref: mol2, SDF, SMILES, flexibase
0.78,7.02,-113.83,2,4,1, 227.328, 2

Similar to: 4202636, 16941825,
1495019
 
#8

eMolecules: 24676625
AK Scientific: W8401, 9905AC
AKOS: AKOS000302870
Aldrich CPR: CDS004424|ALDRICH
Anward: ANW-52086...58 total

ref: mol2, SDF, SMILES, flexibase
0.47,6.07,-64.99,1,4,0, 220.272, 3
lo: mol2, SDF, SMILES, flexibase
0.47,6.35,-111.32,2,4,1, 221.28, 3

Similar to: 36776545,
154209
 
#9

Aldrich CPR: CDS002985|ALDRICH
Capot Chemical: 15608
Chembo Pharma: KB-85192
Combi-Blocks: SS-5779
Fluorochem: 023696...28 total

ref: mol2, SDF, SMILES, flexibase
1.09,3.23,-43.64,0,4,-1, 187.178, 1
lo: mol2, SDF, SMILES, flexibase
1.09,3.51,-59,1,4,0, 188.186, 1
154211
 
#10

AK Scientific: 8109AD
AKOS: AKOS015852962
Aldrich CPR: CDS002961|ALDRICH
Apollo Scientific: PC5321
BOC Sciences BB: 240408-97-3...28 total

ref: mol2, SDF, SMILES, flexibase
2.00,3.65,-45.5,0,4,-1, 241.148, 2
lo: mol2, SDF, SMILES, flexibase
2.00,3.94,-67.41,1,4,0, 242.156, 2

Similar to: 38295047,
154212
 
#11

ChemMol: 83603188
AK Scientific: 2260AE
AKOS: AKOS015854715
BroadPharm: BP-10559
Chembo Pharma: KB-90303...23 total

ref: mol2, SDF, SMILES, flexibase
1.99,5.76,-36.41,3,3,1, 221.324, 4
154213
 
#12

AK Scientific: 2620AC
AKOS: AKOS002674902
Aldrich CPR: CDS004450|ALDRICH
Ark Pharm Building Blocks: AK112539
BePharm Building Blocks: B13994...33 total

ref: mol2, SDF, SMILES, flexibase
2.06,-1.72,-7.82,3,4,0, 214.272, 2
154215
 
#13

AK Scientific: 7550AD
AKOS: AKOS015855023
Aldrich CPR: CDS015004|ALDRICH
Bosche Scientific: D10231
Chembo Pharma: KB-83844...26 total

ref: mol2, SDF, SMILES, flexibase
1.87,7.58,-8.26,2,4,0, 228.299, 2
154217
 
#14

AK Scientific: 2259AE
AKOS: AKOS015855024
Chembo Pharma: KB-85201
Fluorochem: 023700
Matrix Scientific: 006976...17 total

ref: mol2, SDF, SMILES, flexibase
2.25,-0.22,-8.04,2,4,0, 242.326, 3
154218
 
#15

AK Scientific: 9159AC
AKOS: AKOS015854106
Aldrich CPR: CDS002843|ALDRICH
Chembo Pharma: KB-81714
Fluorochem: 023701...21 total

ref: mol2, SDF, SMILES, flexibase
2.12,-2.48,-10.59,1,3,0, 204.254, 1

Similar to: 34463576, 34463578, 36456606, 36456947, ... 4 in total.
154219
 
#16

AKOS: AKOS009158837
Aldrich CPR: CDS016181|ALDRICH
Chembo Pharma: KB-100171, KB-86574
Combi-Blocks: QA-9693
Fluorochem: 016079...31 total

ref: mol2, SDF, SMILES, flexibase
2.35,-0.52,-60.49,0,4,-1, 217.229, 1

Similar to: 34519206, 36456606, 38286550, 39044089, ... 4 in total.
154220
 
#17

AK Scientific: 2258AE
AKOS: AKOS009158362
Bosche Scientific: D10356
Chembo Pharma: KB-85200
Fluorochem: 023703...22 total

ref: mol2, SDF, SMILES, flexibase
2.18,-2.28,-8.66,2,3,0, 231.324, 2
154221
 
#18

AK Scientific: 7614AC
AKOS: AKOS001354686
Aldrich CPR: CDS006943|ALDRICH
BOC Sciences BB: 102243-12-9
Bosche Scientific: D10357...30 total

ref: mol2, SDF, SMILES, flexibase
2.20,-2.28,-8.61,2,3,0, 231.324, 2

Similar to: 34462967,
154223
 
#19

Fluorochem: 023705
Peakdale: 3000156
Apollo Scientific (Depleted): OR8229
ref: mol2, SDF, SMILES, flexibase
1.33,3.97,-56.02,2,3,1, 186.238, 0
lo: mol2, SDF, SMILES, flexibase
1.33,4.25,-91.9,3,3,2, 187.246, 0
154224
 
#20

AK Scientific: 2310AE
AKOS: AKOS015854472
Aldrich CPR: CDS002471|ALDRICH
Chembo Pharma: KB-85222
Chemstep: 4502...20 total

ref: mol2, SDF, SMILES, flexibase
0.68,5.8,-55.37,0,6,-1, 284.295, 3
lo: mol2, SDF, SMILES, flexibase
0.68,6.08,-68.91,1,6,0, 285.303, 3
154226
 
#21

AK Scientific: 7446AE
AKOS: AKOS015854268
Bosche Scientific: N9983
Chembo Pharma: KB-86585
Combi-Blocks: SS-5684...28 total

ref: mol2, SDF, SMILES, flexibase
2.97,5.21,-14.92,1,3,0, 222.247, 1
lo: mol2, SDF, SMILES, flexibase
2.97,5.86,-28.68,2,3,1, 223.255, 1
lo: mol2, SDF, SMILES, flexibase
2.97,6.17,-92.5,3,3,2, 224.263, 1
lo: mol2, SDF, SMILES, flexibase
2.97,5.49,-34.26,2,3,1, 223.255, 1
154228
 
#22

AKOS: AKOS009158379
Aldrich CPR: CDS002827|ALDRICH
Bosche Scientific: D10396
Chembo Pharma: KB-80752
Fluorochem: 023708...24 total

ref: mol2, SDF, SMILES, flexibase
2.65,-2.21,-8.73,1,3,0, 232.308, 2
154230
 
#23

AKOS: AKOS015852186
Aldrich CPR: CDS002492|ALDRICH
Ark Pharm Building Blocks: AK-55850
BOC Sciences BB: 110284-78-1
Chembo Pharma: KB-81634...28 total

ref: mol2, SDF, SMILES, flexibase
2.61,-3.69,-59.7,0,7,-1, 275.24, 5

Similar to: 713232, 34318670, 34331657, 34335063, 34335065, ... 14 in total.
154232
 
#24

AKOS: AKOS015852163
Chembo Pharma: KB-268025, KB-95571
Fluorochem: 047998, 390447
Matrix Scientific: 009394, 066766
Molport BB: MolPort-006-709-287...31 total

ref: mol2, SDF, SMILES, flexibase
1.41,-4.63,-62.93,0,8,-1, 276.228, 5

Similar to: 34335060, 34425910,
154234
 
#25

AKOS: AKOS015852217
Chembo Pharma: KB-81635
Fluorochem: 023712
Matrix Scientific: 006927
Molport BB: MolPort-000-159-675...21 total

ref: mol2, SDF, SMILES, flexibase
2.57,-2.76,-56.07,0,6,-1, 291.308, 5

Similar to: 34328636,
154235
 
#26

AK Scientific: 2318AE
AKOS: AKOS009158470
Aldrich CPR: CDS015002|ALDRICH
Apollo Scientific: PC11200
Chembo Pharma: KB-85227...23 total

ref: mol2, SDF, SMILES, flexibase
-0.14,-3.22,-54.39,1,6,-1, 288.276, 5

Similar to: 25922694,
154242
 
#27

AK Scientific: 0635AF
AKOS: AKOS015852478
Chembo Pharma: KB-87499
Fluorochem: 023716
Matrix Scientific: 009397...16 total

ref: mol2, SDF, SMILES, flexibase
0.86,-3.65,-18.08,0,5,0, 267.306, 4
154243
 
#28

AK Scientific: 0635AF
AKOS: AKOS015852478
Chembo Pharma: KB-87499
Fluorochem: 023716
Matrix Scientific: 009397...16 total

ref: mol2, SDF, SMILES, flexibase
0.86,-3.65,-18.04,0,5,0, 267.306, 4
154245
 
#29

AK Scientific: 8213AD
AKOS: AKOS015852793
Apollo Scientific: PC8252
Chembo Pharma: KB-84094
Fluorochem: 023717...25 total

ref: mol2, SDF, SMILES, flexibase
2.86,0.84,-48.56,0,3,-1, 246.189, 2
154246
 
#30

AK Scientific: 5970AD
AKOS: AKOS015854267
Chembo Pharma: KB-83233
Chemstep: 4626
Fluorochem: 023718...21 total

ref: mol2, SDF, SMILES, flexibase
2.76,6.92,-67.71,0,4,-1, 249.249, 2
lo: mol2, SDF, SMILES, flexibase
2.76,7.21,-61.16,1,4,0, 250.257, 2
lo: mol2, SDF, SMILES, flexibase
2.76,7.2,-44.91,1,4,0, 250.257, 2
lo: mol2, SDF, SMILES, flexibase
2.76,7.5,-85.52,2,4,1, 251.265, 2

Similar to: 36155062,
154249
 
#31

AKOS: AKOS015854280
Chembo Pharma: KB-161602, KB-90963
Fluorochem: 023719, 390448
KeyOrganics: PS-7300
Matrix Scientific: 066767...23 total

ref: mol2, SDF, SMILES, flexibase
2.57,6.09,-59.45,0,4,-1, 249.249, 2
lo: mol2, SDF, SMILES, flexibase
2.57,6.36,-69.75,1,4,0, 250.257, 2

Similar to: 31997355, 31997541, 36155062,
154251
 
#32

Fluorochem: 023720
Peakdale: 3000314
Apollo Scientific (Depleted): OR9338
ref: mol2, SDF, SMILES, flexibase
1.14,3.14,-53.78,2,3,1, 186.238, 0
lo: mol2, SDF, SMILES, flexibase
1.14,3.42,-96.96,3,3,2, 187.246, 0

Similar to: 34579777,
154253
 
#33

AK Scientific: 2376AE
AKOS: AKOS015840923
Chembo Pharma: KB-85250
Fluorochem: 023721
Matrix Scientific: 009401...18 total

ref: mol2, SDF, SMILES, flexibase
0.49,4.96,-50.92,0,6,-1, 284.295, 3
lo: mol2, SDF, SMILES, flexibase
0.49,5.25,-73.45,1,6,0, 285.303, 3
154256
 
#34

AK Scientific: 1624AB
AKOS: AKOS015840534
Aldrich CPR: CDS003443|ALDRICH
Amadis Chemical: A848212
Apollo Scientific: PC2355...32 total

ref: mol2, SDF, SMILES, flexibase
3.09,0.94,-49.51,0,4,-1, 256.159, 3
150076
 
#35

eMolecules: 49407574, 918962
Molport: MolPort-027-850-099
AK Scientific: 0054AF
AKOS: AKOS000111568
Aldrich CPR: CDS018583|ALDRICH...54 total

ref: mol2, SDF, SMILES, flexibase
2.87,-0.16,-53.68,1,5,-1, 242.258, 3
150077
 
#36

eMolecules: 918964
AK Scientific: 0055AF
AKOS: AKOS000538198
Aldrich CPR: CDS006782|ALDRICH
Asinex: BAS09524989...52 total

ref: mol2, SDF, SMILES, flexibase
2.90,8.78,-52.49,1,5,-1, 242.258, 3
lo: mol2, SDF, SMILES, flexibase
2.90,9.21,-66.07,2,5,0, 243.266, 3

Similar to: 8700995,
154269
 
#37

AK Scientific: X4563
AKOS: AKOS015842628
Chembo Pharma: KB-85188
Fluorochem: 023728
KeyOrganics: PS-7391...22 total

ref: mol2, SDF, SMILES, flexibase
2.70,1.21,-52.77,0,5,-1, 256.285, 3
154270
 
#38

AKOS: AKOS015851952
Aldrich CPR: CDS015001|ALDRICH
Ark Pharm Building Blocks: AK113041
BePharm Building Blocks: B0744
Chembo Pharma: KB-87355...29 total

ref: mol2, SDF, SMILES, flexibase
3.19,0.39,-50.67,0,3,-1, 233.268, 3

Similar to: 4541893, 34639589, 39344155,
154271
 
#39

AK Scientific: 2400AE
AKOS: AKOS009038310
Chembo Pharma: KB-85259
Fluorochem: 023730
Matrix Scientific: 009403...18 total

ref: mol2, SDF, SMILES, flexibase
2.90,-0.32,-10.84,0,4,0, 252.73, 2

Similar to: 37022335,
154273
 
#40

Acorn PharmaTech: ACN-P001101
AK Scientific: 1560AB
AKOS: AKOS002433793
Aldrich CPR: CDS005250|ALDRICH
Alfa-Aesar: H54158...40 total

ref: mol2, SDF, SMILES, flexibase
1.93,3.74,-3.72,1,1,0, 137.157, 0

Similar to: 33978800, 36779532, 36779534,
154275
 
#41

AK Scientific: 2401AE
AKOS: AKOS015853207
Apollo Scientific: PC11203
Bosche Scientific: F10552
Chembo Pharma: KB-85260...24 total

ref: mol2, SDF, SMILES, flexibase
0.61,6,-47.58,0,4,-1, 236.222, 3
154276
 
#42

eMolecules: 835958
AK Scientific: 4674AF
AKOS: AKOS000118133
Aldrich CPR: CDS000807|ALDRICH
Alfa-Aesar: H50715...57 total

ref: mol2, SDF, SMILES, flexibase
1.08,1.63,-9.84,1,4,0, 226.301, 2

Similar to: 34955523, 34955596, 34955610, 34955638, 34955705, ... 7 in total.
154278
 
#43

AK Scientific: 2403AE
AKOS: AKOS015850787
American Custom Chemicals Corp.: CHM0292044
Chembo Pharma: KB-85263
Fluorochem: 023733...20 total

ref: mol2, SDF, SMILES, flexibase
-0.24,-3.48,-53.5,0,7,-1, 325.366, 5
154280
 
#44

ACB Blocks: MIX-0381
AK Scientific: 7012AC
AKOS: AKOS001476750
Aldrich CPR: CDS005783|ALDRICH
Apexmol Building Blocks: AM804638...36 total

ref: mol2, SDF, SMILES, flexibase
1.55,7.19,-45.08,0,3,-1, 190.222, 3

Similar to: 36668764, 36668782, 36668784, 43699988, 43699989, ... 5 in total.
154282
 
#45

AK Scientific: 2410AE
AKOS: AKOS015837716
Chembo Pharma: KB-85268
Fluorochem: 023736
Matrix Scientific: 009407...17 total

ref: mol2, SDF, SMILES, flexibase
0.31,-0.05,-58.53,1,6,-1, 275.284, 4
154283
 
#46

AK Scientific: 2421AE
Aldrich CPR: CDS006450|ALDRICH
Chembo Pharma: KB-85271
Fluorochem: 023738
KeyOrganics: FS-1759...23 total

ref: mol2, SDF, SMILES, flexibase
1.25,5.41,-40.24,0,3,-1, 166.2, 3

Similar to: 34534207, 36981639, 36981641,
15894680
 
#47

ChemMol: 97900661
Active BioPharma: 1428
AK Scientific: X5937
AKOS: AKOS015854224
Ark Pharm Building Blocks: AK-35014...40 total

ref: mol2, SDF, SMILES, flexibase
2.81,7.33,-10.83,1,4,0, 272.311, 2

Similar to: 34219992, 34645301, 34646132, 34646133, 38513195, ... 7 in total.
154288
 
#48

AK Scientific: 2447AE
Apollo Scientific: PC11197
Chembo Pharma: KB-97469, KB-85279
Fluorochem: 023740
KeyOrganics: PS-7174...15 total

ref: mol2, SDF, SMILES, flexibase
3.32,7.16,-7.81,1,3,0, 289.26, 3
ref: mol2, SDF, SMILES, flexibase
3.32,7.31,-6.45,1,3,0, 289.26, 3
lo: mol2, SDF, SMILES, flexibase
3.32,1.4,-40.46,2,3,1, 290.268, 3

Similar to: 34553000,
77600
 
#49

ChemMol: 44009846
Molport: MolPort-000-002-271
AK Scientific: W6918
AKOS: AKOS001031295
Angene Building Blocks: AGN-PC-0JOEYT...44 total

ref: mol2, SDF, SMILES, flexibase
0.98,4.85,-46.32,2,3,1, 205.281, 2

Similar to: 5878981, 25911106, 25934266, 26476021, 34929440, ... 9 in total.
154298
 
#50

AK Scientific: 5010AB
Aldrich CPR: CDS002995|ALDRICH
Anward: ANW-56117
Apexmol Building Blocks: AM805732
Ark Pharm Building Blocks: AK-34963...25 total

ref: mol2, SDF, SMILES, flexibase
0.63,1.23,-11.4,1,3,0, 197.259, 1
154299
 
#51

AK Scientific: X5276
AKOS: AKOS015852542
Aldrich CPR: CDS015288|ALDRICH
Chembo Pharma: KB-85278
Fluorochem: 023744...21 total

ref: mol2, SDF, SMILES, flexibase
-0.68,-3.13,-56.56,0,6,-1, 296.324, 4
154301
 
#52

AK Scientific: 2463AE
AKOS: AKOS015837715
Chembo Pharma: KB-90495, KB-85282
Combi-Blocks: SS-5233
Fluorochem: 023745...24 total

ref: mol2, SDF, SMILES, flexibase
3.71,-0.29,-47.25,2,4,1, 350.486, 4
154302
 
#53

ChemMol: 44011335, 51500481
AK Scientific: V3881
AKOS: AKOS002664172
Aldrich CPR: CDS001647|ALDRICH
Anward: ANW-74508...40 total

ref: mol2, SDF, SMILES, flexibase
0.45,2.08,-7.19,2,3,0, 145.165, 0
154304
 
#54

AK Scientific: 2464AE
AKOS: AKOS015854402
Aldrich CPR: CDS005407|ALDRICH
Bosche Scientific: N10854
Chembo Pharma: KB-85283...21 total

ref: mol2, SDF, SMILES, flexibase
-0.06,4.26,-55.81,1,6,-1, 244.23, 4
154306
 
#55

ChemMol: 30201108
eMolecules: 919493
AK Scientific: 2247AE
AKOS: AKOS009159363
Aldrich CPR: CDS005236|ALDRICH...38 total

ref: mol2, SDF, SMILES, flexibase
0.75,3.27,-52.76,0,4,-1, 227.261, 4

Similar to: 34873633, 34873634, 34961621, 36476038, ... 4 in total.
154307
 
#56

eMolecules: 31405420, 31411193
Molport: MolPort-016-634-329, MolPort-004-129-611
AK Scientific: 0897AA, 5009AB
Aldrich CPR: CDS015287|ALDRICH
Alinda Building Blocks: ALBB-027095...70 total

ref: mol2, SDF, SMILES, flexibase
-1.33,-4.94,-54.52,3,3,1, 200.283, 2

Similar to: 3705660, 3705661, 34972087, 34972089, ... 4 in total.
154312
 
#57

AK Scientific: 2246AE
AKOS: AKOS015852714
Aldrich CPR: CDS008966|ALDRICH
Apollo Scientific: PC4479
Chembo Pharma: KB-85186...27 total

ref: mol2, SDF, SMILES, flexibase
1.37,4.51,-45.37,0,3,-1, 236.194, 4
lo: mol2, SDF, SMILES, flexibase
1.37,4.79,-64.02,1,3,0, 237.202, 4
154316
 
#58

Fluorochem: 023751
Matrix Scientific: 009417
Peakdale: 3000877
Apollo Scientific (Depleted): OR7940
ref: mol2, SDF, SMILES, flexibase
1.33,1.63,-36.4,1,4,1, 250.318, 4
154319
 
#59

AK Scientific: 2473AE
AKOS: AKOS015851881
Chembo Pharma: KB-85288
Fluorochem: 023753
Matrix Scientific: 009418...18 total

ref: mol2, SDF, SMILES, flexibase
2.75,-5.01,-51.57,2,7,-1, 345.356, 5
hi: mol2, SDF, SMILES, flexibase
2.75,-4.43,-102.72,1,7,-2, 344.348, 5
154321
 
#60

AK Scientific: 9973AE
AKOS: AKOS015851280
Chembo Pharma: KB-87284
Fluorochem: 023754
Matrix Scientific: 006914...20 total

ref: mol2, SDF, SMILES, flexibase
2.37,-1.11,-39.28,0,3,-1, 237.087, 3
154322
 
#61

AK Scientific: 2254AE
AKOS: AKOS015854462
Apollo Scientific: PC8663
Chembo Pharma: KB-85199, KB-102585
Combi-Blocks: SS-5739...24 total

ref: mol2, SDF, SMILES, flexibase
4.68,-4.57,-49.19,3,4,1, 309.333, 4
154323
 
#62

AK Scientific: 2245AE
AKOS: AKOS005145673
Aldrich CPR: CDS003046|ALDRICH
Ark Pharm Building Blocks: AK135154
Chembo Pharma: KB-85185...28 total

ref: mol2, SDF, SMILES, flexibase
0.96,6.2,-69.45,1,4,0, 220.272, 4
154325
 
#63

eMolecules: 917743
Scientific Exchange (make on demand): T-057821
AKOS: AKOS000223254
Aldrich CPR: CDS002442|ALDRICH
Alinda: IBS-L0037682...59 total

ref: mol2, SDF, SMILES, flexibase
0.46,1.08,-11.29,2,4,0, 212.274, 1

Similar to: 39021729,
154328
 
#64

AK Scientific: 2228AE
AKOS: AKOS015850241
Aldrich CPR: CDS002023|ALDRICH
Chembo Pharma: KB-85175
Combi-Blocks: SS-6158...28 total

ref: mol2, SDF, SMILES, flexibase
3.81,0.23,-48.81,0,2,-1, 237.687, 2
154329
 
#65

AK Scientific: 2488AE
AKOS: AKOS015837907
Chembo Pharma: KB-85291
Fluorochem: 023758
KeyOrganics: PS-5945...18 total

ref: mol2, SDF, SMILES, flexibase
4.43,-2.58,-43.93,4,3,1, 272.416, 3
154330
 
#66

AK Scientific: 2253AE
AKOS: AKOS015852138
Ark Pharm Building Blocks: AK-37440
Bosche Scientific: D10349
Chembo Pharma: KB-85198...25 total

ref: mol2, SDF, SMILES, flexibase
1.78,0.81,-6.66,2,5,0, 231.255, 3
154332
 
#67

AK Scientific: 2252AE
AKOS: AKOS015852110
Bosche Scientific: D10350
Chembo Pharma: KB-85197
Fluorochem: 023760...21 total

ref: mol2, SDF, SMILES, flexibase
1.76,0.82,-6.39,2,5,0, 231.255, 3
154338
 
#68

ChemMol: 83602610
eMolecules: 45491540
AK Scientific: 2229AE
AKOS: AKOS000269754
Aldrich CPR: CDS001951|ALDRICH...44 total

ref: mol2, SDF, SMILES, flexibase
1.39,6.98,-22.75,0,3,0, 199.209, 1

Similar to: 34333669, 34418477, 44406455, 44406459, ... 4 in total.
154339
 
#69

AK Scientific: 2225AE
AKOS: AKOS000274345
Aldrich CPR: CDS019985|ALDRICH
Bosche Scientific: O9688
Chembo Pharma: KB-85172...28 total

ref: mol2, SDF, SMILES, flexibase
1.17,6.41,-69.9,0,4,-1, 214.2, 1

Similar to: 44199955, 44200838,
154341
 
#70

ChemMol: 83602529
eMolecules: 834759
AK Scientific: 2230AE
AKOS: AKOS002336171
Aldrich CPR: CDS005182|ALDRICH...42 total

ref: mol2, SDF, SMILES, flexibase
1.90,7.56,-21.01,0,3,0, 213.236, 1

Similar to: 44405274, 44405277,
154343
 
#71

eMolecules: 932203
AKOS: AKOS000274344
BioBlocks: A4398/0187745
BioBlocks BB: ZERO/009159
Capot Chemical: 23166...38 total

ref: mol2, SDF, SMILES, flexibase
1.69,7.01,-68.79,0,4,-1, 228.227, 1

Similar to: 44200840,
154344
 
#72

eMolecules: 832855
AK Scientific: 2212AE, 2213AE
AKOS: AKOS000269888
BioBlocks: A4398/0187739
BioBlocks BB: ZERO/009152...38 total

ref: mol2, SDF, SMILES, flexibase
1.45,3.93,-10.07,1,3,0, 215.252, 1

Similar to: 40165797, 40165798,
154345
 
#73

AKOS: AKOS015840784
Chembo Pharma: KB-85196
Combi-Blocks: SS-7783
Fluorochem: 023768
KeyOrganics: PS-4839...22 total

ref: mol2, SDF, SMILES, flexibase
1.44,-4.82,-46.28,2,4,1, 281.401, 4

Similar to: 27970898, 36731608, 36731630,
154350
 
#74

AK Scientific: 2251AE
AKOS: AKOS015840782
Apollo Scientific: PC9239
Chembo Pharma: KB-85194
Combi-Blocks: SS-5701...26 total

ref: mol2, SDF, SMILES, flexibase
2.31,-2.65,-50.16,2,4,1, 349.398, 5

Similar to: 34225083,
154352
 
#75

AK Scientific: 2223AE
AKOS: AKOS015852141
Aldrich CPR: CDS005365|ALDRICH
Bosche Scientific: D9537
Chembo Pharma: KB-85171...22 total

ref: mol2, SDF, SMILES, flexibase
0.39,-0.17,-45.56,0,6,-1, 211.197, 5

Similar to: 34450408, 34450410, 39121182,
154353
 
#76

AKOS: AKOS015852139
Chembo Pharma: KB-91861
Combi-Blocks: SS-5722
Fluorochem: 023771
KeyOrganics: PS-7310...21 total

ref: mol2, SDF, SMILES, flexibase
1.70,-1.7,-50.32,0,6,-1, 265.289, 4

Similar to: 34450400, 34450402, 34450408, 34450410, ... 4 in total.
154354
 
#77

AKOS: AKOS015852139
Chembo Pharma: KB-91861
Combi-Blocks: SS-5722
Fluorochem: 023771
KeyOrganics: PS-7310...21 total

ref: mol2, SDF, SMILES, flexibase
1.70,-2.33,-52.65,0,6,-1, 265.289, 4

Similar to: 34450400, 34450402, 34450408, 34450410, ... 4 in total.
154356
 
#78

AKOS: AKOS015852139
Chembo Pharma: KB-91861
Combi-Blocks: SS-5722
Fluorochem: 023771
KeyOrganics: PS-7310...21 total

ref: mol2, SDF, SMILES, flexibase
1.70,-2.33,-52.64,0,6,-1, 265.289, 4

Similar to: 34450400, 34450402, 34450408, 34450410, ... 4 in total.
154357
 
#79

AKOS: AKOS015852139
Chembo Pharma: KB-91861
Combi-Blocks: SS-5722
Fluorochem: 023771
KeyOrganics: PS-7310...21 total

ref: mol2, SDF, SMILES, flexibase
1.70,-2.07,-50.05,0,6,-1, 265.289, 4

Similar to: 34450400, 34450402, 34450408, 34450410, ... 4 in total.
154358
 
#80

ChemMol: 1033406
AK Scientific: 6452AE
Ark Pharm Building Blocks: AK139319
Asinex: BAS02085805
Asinex Building Blocks: BAS02085805...40 total

ref: mol2, SDF, SMILES, flexibase
0.60,-1.64,-43.14,0,6,-1, 183.143, 3

Similar to: 38251209,
154359
 
#81

AK Scientific: 2222AE
AKOS: AKOS015852111
Aldrich CPR: CDS008772|ALDRICH
Chembo Pharma: KB-85170
Fluorochem: 023773...22 total

ref: mol2, SDF, SMILES, flexibase
2.62,-1.7,-47.85,0,6,-1, 259.241, 4

Similar to: 39270426,
154360
 
#82

Fluorochem: 023774
Peakdale: 3001542
Apollo Scientific (Depleted): OR5664
ref: mol2, SDF, SMILES, flexibase
1.23,6.3,-53.9,0,6,-1, 209.229, 3
154361
 
#83

AK Scientific: 0637AF
AKOS: AKOS015838388
Aldrich CPR: CDS002763|ALDRICH
Chembo Pharma: KB-87501
Fluorochem: 023777...19 total

ref: mol2, SDF, SMILES, flexibase
2.14,2.04,-36.52,1,4,0, 270.332, 2

Similar to: 39236187,
154363
 
#84

AK Scientific: 0637AF
AKOS: AKOS015838388
Aldrich CPR: CDS002763|ALDRICH
Chembo Pharma: KB-87501
Fluorochem: 023777...19 total

ref: mol2, SDF, SMILES, flexibase
2.14,1.97,-37.28,1,4,0, 270.332, 2

Similar to: 39236187,
154371
 
#85

AK Scientific: 0640AF
AKOS: AKOS015854434
Chembo Pharma: KB-87503
Fluorochem: 023780
Matrix Scientific: 009424...20 total

ref: mol2, SDF, SMILES, flexibase
1.25,0.74,-51.89,0,6,-1, 265.252, 3
84072
 
#86

ChemMol: 44013848, 96708242, 2000860
eMolecules: 722289
Molport: MolPort-000-004-396
AK Scientific: Y7831
AKOS: AKOS001320752...66 total

ref: mol2, SDF, SMILES, flexibase
1.90,6.06,-43.37,3,2,1, 201.293, 1

Similar to: 34455622,
154373
 
#87

AK Scientific: 0641AF
AKOS: AKOS015852140
Aldrich CPR: CDS001690|ALDRICH
Bosche Scientific: D10033
Chembo Pharma: KB-87504...23 total

ref: mol2, SDF, SMILES, flexibase
0.50,0.23,-44.29,2,5,1, 224.284, 3
154378
 
#88

AK Scientific: 3510AF
Aldrich CPR: CDS014805|ALDRICH
Chembo Pharma: KB-87505
Combi-Blocks: QB-6182
Fluorochem: 023785...24 total

ref: mol2, SDF, SMILES, flexibase
0.03,0.95,-51.98,2,6,1, 232.267, 2
154381
 
#89

eMolecules: 932183
AK Scientific: 9867AE
AKOS: AKOS000273510
Bosche Scientific: D10498
Chembo Pharma: KB-87258...47 total

ref: mol2, SDF, SMILES, flexibase
1.65,8.91,-50.57,0,5,-1, 234.279, 2
lo: mol2, SDF, SMILES, flexibase
1.65,9.19,-55.48,1,5,0, 235.287, 2
154382
 
#90

Fluorochem: 023788
Peakdale: 3002716
Apollo Scientific (Depleted): OR7686
ref: mol2, SDF, SMILES, flexibase
0.94,6.84,-179.05,4,3,3, 214.377, 2

Similar to: 4226737, 19881888, 19881890, 19883749, 42409240, ... 7 in total.
154385
 
#91

Aldrich CPR: CDS014793|ALDRICH
Ark Pharm Building Blocks: AK-43512, AK-41411
Chembo Pharma: KB-34645
Combi-Blocks: SS-5784
Fluorochem: 023791...30 total

ref: mol2, SDF, SMILES, flexibase
1.17,2.02,-47.56,2,4,1, 230.291, 2

Similar to: 32110343, 32119553, 32120020, 32120467, 32120468, ... 7 in total.
154386
 
#92

eMolecules: 932031
AK Scientific: HTS008622, 0645AF, HTS000845
AKOS: AKOS005638195
Aldrich CPR: CDS016721|ALDRICH
BioBlocks: A4519/0193324...31 total

ref: mol2, SDF, SMILES, flexibase
1.74,-3,-51.22,2,6,1, 274.3, 2

Similar to: 4924658, 6669261, 31892445,
154388
 
#93

AKOS: AKOS015853504
Aldrich CPR: CDS010866|ALDRICH
Anward: ANW-56015
Apollo Scientific: PC0207
Ark Pharm Building Blocks: AK-74350...32 total

ref: mol2, SDF, SMILES, flexibase
1.33,2.09,-47.63,2,4,1, 248.281, 2

Similar to: 32120468, 32128077, 32209361,
154390
 
#94

AK Scientific: 8684AB, 8223AA
Aldrich CPR: CDS001889|ALDRICH
Anward: ANW-59411
Ark Pharm Building Blocks: AK-38409, AK-38599
BePharm Building Blocks: B163308...39 total

ref: mol2, SDF, SMILES, flexibase
1.18,5.85,-41.42,2,3,1, 217.292, 1

Similar to: 34978580, 34978581, 41671281, 41671283, 42409974, ... 7 in total.
154394
 
#95

eMolecules: 932215
AK Scientific: 0647AF
AKOS: AKOS004119186
Chembo Pharma: KB-97351, KB-87511
Combi-Blocks: SS-5725...39 total

ref: mol2, SDF, SMILES, flexibase
1.80,4.17,-51.25,0,5,-1, 237.26, 5
154317
 
#96

Fluorochem: 023798
Peakdale: 3003064
Apollo Scientific (Depleted): OR7723
Peakdale (Depleted): 3000890
ref: mol2, SDF, SMILES, flexibase
1.02,-1.44,-98.6,4,4,2, 252.358, 4

Similar to: 37011500,
154196
 
#97

ChemMol: 30116139
AK Scientific: X3128
Aldrich CPR: CDS015859|ALDRICH
Anward: ANW-74583
APIChem: AC-23818...41 total

ref: mol2, SDF, SMILES, flexibase
1.29,4.07,-49.69,0,4,-1, 187.178, 1
hi: mol2, SDF, SMILES, flexibase
1.82,5.67,-18.82,0,6,0, 276.271, 3
lo: mol2, SDF, SMILES, flexibase
1.29,4.35,-56.36,1,4,0, 188.186, 1
154198
 
#98

AK Scientific: 8135AD
AKOS: AKOS015852963
Aldrich CPR: CDS003003|ALDRICH
Apollo Scientific: PC5999
BOC Sciences BB: 241154-08-5...29 total

ref: mol2, SDF, SMILES, flexibase
2.20,4.47,-51.7,0,4,-1, 241.148, 2
lo: mol2, SDF, SMILES, flexibase
2.20,4.75,-62.9,1,4,0, 242.156, 2
151271
 
#99

ChemMol: 30110914
eMolecules: 45492466
AKOS: AKOS000267485
Aldrich CPR: CDS009343|ALDRICH, CDS013868|ALDRICH
APIChem: AC-5727...65 total

ref: mol2, SDF, SMILES, flexibase
0.99,4.49,-60.96,0,4,-1, 173.151, 1

Similar to: 8764200, 31894434, 34925577, 39306755, ... 4 in total.
154200
 
#100

ChemMol: 30108811, 44007677
Molport: MolPort-000-005-063
AK Scientific: W4186
Aldrich CPR: CDS007534|ALDRICH
Angene Building Blocks: AGN-PC-0JVO4G...48 total

ref: mol2, SDF, SMILES, flexibase
0.79,2.68,-54.31,0,4,-1, 173.151, 1

Similar to: 1526634,

Old detail retrieval took 1 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 = 117 ) limit 0,100

Smiles were