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38537043
 
#1

AK Scientific: Z6631
AKOS: AKOS015834640
Angene Building Blocks: AGN-PC-03I26T
Anward: ANW-14865
Ark Pharm Building Blocks: AK-93708...22 total

ref: mol2, SDF, SMILES, flexibase
2.59,3.55,-8.06,0,3,0, 225.045, 1
157342
 
#2

ChemMol: 30111514, 44007413, 83603103, 97801259
Acorn PharmaTech: ACN-S002785
AK Scientific: R333
AKOS: AKOS000560390
Aldrich CPR: CDS015081|ALDRICH...55 total

ref: mol2, SDF, SMILES, flexibase
1.88,4.37,-3.78,0,2,0, 223.013, 0
13614
 
#3

ChemMol: 1036885, 30103090, 98000648, 1203313, 44002379
eMolecules: 477661
Scientific Exchange (make on demand): Q-016112
Acros Organics: 40287, 14628
AKOS: AKOS000119091...125 total

ref: mol2, SDF, SMILES, flexibase
1.82,2.99,-2.81,2,1,0, 172.025, 0

Similar to: 6093077,
404316
 
#4

ChemMol: 44008553, 98000209, 44009160, 1202040
eMolecules: 485990
Acros Organics: 30441
Alfa-Aesar: A14873
Angene Building Blocks: AGN-PC-0IJ548...114 total

ref: mol2, SDF, SMILES, flexibase
2.27,-1.53,-3.24,1,1,0, 173.009, 0
19143844
 
#5

ChemMol: 97804506, 1203206, 30101324, 44001742, 42305354, 42307630
eMolecules: 476593
Molport: MolPort-016-637-912, MolPort-019-922-342
Scientific Exchange (make on demand): POD_66/0847
A&J Pharmtech: AJ-02742...132 total

ref: mol2, SDF, SMILES, flexibase
1.50,2.07,-3.85,2,2,0, 173.013, 0
1259344
 
#6

ChemMol: 30105626, 97804113, 1034660
AK Scientific: AMTDA184
AKOS: AKOS004114791
Aldrich CPR: BML00005|ALDRICH
Anward: ANW-16709...42 total

ref: mol2, SDF, SMILES, flexibase
3.96,3.08,-7.23,0,2,0, 226.275, 3

Similar to: 1259548, 4552064, 5701406, 6380065, 16947568, ... 17 in total.
1256886
 
#7

ChemMol: 30100847, 97803960, 1034664
eMolecules: 510614
Molport: MolPort-000-927-507
Acorn PharmaTech: ACN-S002155
Acros Organics: 35820...54 total

ref: mol2, SDF, SMILES, flexibase
3.89,3.21,-6.98,0,1,0, 193.249, 1

Similar to: 1257545, 1259242, 1259384, 1259432, 1259521, ... 8 in total.
35570382
 
#8

ChemMol: 97804459, 1202792, 30114585, 44022235
ACT Chemical BB: ACT04583
AK Scientific: X4097
AKOS: AKOS015834707
Alfa-Aesar: H64212...44 total

ref: mol2, SDF, SMILES, flexibase
5.59,12.4,-5.65,0,1,0, 322.205, 1

Similar to: 34426689,
38074743
 
#9

ChemMol: 97804384
AK Scientific: Z7873
AKOS: AKOS010258551
Anward: ANW-17072
Ark Pharm Building Blocks: AK-24158...17 total

ref: mol2, SDF, SMILES, flexibase
1.43,4.99,-7.94,0,3,0, 238.088, 2
lo: mol2, SDF, SMILES, flexibase
1.43,5.44,-36.43,1,3,1, 239.096, 2
341621
 
#10

eMolecules: 45482463
Acros Organics: CC34810
AK Scientific: X9249
AKOS: AKOS015835650
Aldrich CPR: CDS004289|ALDRICH...41 total

ref: mol2, SDF, SMILES, flexibase
2.84,-0.64,-6.09,0,3,0, 239.072, 1
2547890
 
#11

ChemMol: 1203502, 44033029, 97804171
AK Scientific: Y3855
AKOS: AKOS015853868
Anward: ANW-17764
Ark Pharm Building Blocks: AK-28750...29 total

ref: mol2, SDF, SMILES, flexibase
2.43,5.01,-5.15,0,4,0, 294.092, 2
403447
 
#12

ChemMol: 44028474, 97803498
Scientific Exchange (make on demand): R-045023
Acros Organics: 39855
AK Scientific: X9811
AKOS: AKOS003477424...42 total

ref: mol2, SDF, SMILES, flexibase
3.64,-0.35,-5.23,1,3,0, 272.142, 3

Similar to: 2599339, 5310627, 44238644,
2383978
 
#13

ChemMol: 44500323
eMolecules: 1013261
Molport: MolPort-001-795-023
Aldrich CPR: BML00292|ALDRICH, CDS016654|ALDRICH
Angene Building Blocks: AGN-PC-03ERS7...52 total

ref: mol2, SDF, SMILES, flexibase
2.51,-1.42,-6.58,0,2,0, 198.019, 0

Similar to: 2598024,
19634764
 
#14

ChemMol: 44030386, 97803993
eMolecules: 2072999
AK Scientific: Z0099
AKOS: AKOS000320665
Aldrich CPR: BML00227|ALDRICH...61 total

ref: mol2, SDF, SMILES, flexibase
2.40,4.22,-3.2,0,2,0, 256.143, 2
1621382
 
#15

ChemMol: 97803980, 44026170
eMolecules: 567175
Scientific Exchange (make on demand): F-395474
Acros Organics: 44446
AK Scientific: X9924...58 total

ref: mol2, SDF, SMILES, flexibase
3.49,-0.46,-3.94,2,1,0, 203.672, 1
4198802
 
#16

ChemMol: 44030103, 1033298, 97803966
Acros Organics: 43238
AK Scientific: V0788
AKOS: AKOS000319921
Anward: ANW-20536...50 total

ref: mol2, SDF, SMILES, flexibase
2.44,-1.4,-3.97,0,2,0, 205.08, 1

Similar to: 34331205,
2528936
 
#17

ChemMol: 97804151
AKOS: AKOS004114095
Boroncore: BC000157
Chembo Pharma: KB-29729
EndoTherm: ENU165...18 total

ref: mol2, SDF, SMILES, flexibase
2.54,1.06,-6.34,2,2,0, 194.237, 1

Similar to: 5939301,
731161
 
#18

ChemMol: 97804233
AK Scientific: 7780AA
AKOS: AKOS004116337
Angene Building Blocks: AGN-PC-0Q6SB0
Anward: ANW-73948...23 total

ref: mol2, SDF, SMILES, flexibase
2.96,1.15,-7.51,1,2,0, 195.221, 1

Similar to: 3159260, 26273021,
731160
 
#19

ChemMol: 97804232
AK Scientific: 7781AA
AKOS: AKOS004116338
Angene Building Blocks: AGN-PC-0KZXZA
Anward: ANW-21537...24 total

ref: mol2, SDF, SMILES, flexibase
2.98,5.45,-8,1,2,0, 195.221, 1

Similar to: 40881,
20443243
 
#20

ChemMol: 97804254
Acros Organics: 44477
Ark Pharm Building Blocks: AK-65114
BOC Sciences BB: 157402-44-3
Boroncore: BC000170...16 total

ref: mol2, SDF, SMILES, flexibase
2.61,6.08,-7.31,0,2,0, 201.2, 2

Similar to: 39927777, 39927779,
6072394
 
#21

ChemMol: 30109575, 97801881, 96701161, 44010870
eMolecules: 10534863
AKOS: AKOS000320620
Alfa-Aesar: H64768
Alinda Building Blocks: ALBB-004428...80 total

ref: mol2, SDF, SMILES, flexibase
1.12,2.9,-5.13,0,2,0, 161.002, 0
85632
 
#22

ChemMol: 97803940, 30108271
eMolecules: 519432
Molport: MolPort-001-787-927
AK Scientific: 7997AA
AKOS: AKOS015836412...57 total

ref: mol2, SDF, SMILES, flexibase
3.24,4.49,-9.94,0,2,0, 204.232, 1

Similar to: 1257545, 1257868, 1720496, 34996860, ... 4 in total.
2508659
 
#23

ChemMol: 97803558
Scientific Exchange (make on demand): M-897805
AK Scientific: 5050AD
AKOS: AKOS003477454
Alfa-Aesar: H27839...28 total

ref: mol2, SDF, SMILES, flexibase
3.91,-0.43,-4.98,1,3,0, 319.142, 3

Similar to: 44240263,
1259552
 
#24

ChemMol: 97804098
AK Scientific: V3584
AKOS: AKOS004113655
Aldrich CPR: L480207|ALDRICH
Amadis Chemical: A849103...35 total

ref: mol2, SDF, SMILES, flexibase
2.96,0.82,-7.19,2,3,0, 227.263, 3
12471931
 
#25

AK Scientific: V3596
AKOS: AKOS015835677
Aldrich CPR: CDS008067|ALDRICH
Anward: ANW-21861
Ark Pharm Building Blocks: AK-90651...23 total

ref: mol2, SDF, SMILES, flexibase
2.62,3.7,-6.9,0,3,0, 225.045, 1
7781175
 
#26

eMolecules: 5849521
Acros Organics: CC39110
AK Scientific: Y7699
AKOS: AKOS003369364
Angene Building Blocks: AGN-PC-0MJSA7...39 total

ref: mol2, SDF, SMILES, flexibase
2.81,4.43,-6.94,0,3,0, 239.072, 1
2548341
 
#27

ChemMol: 1030256
eMolecules: 525474
Acros Organics: MO07557
AK Scientific: V3628
Alfa-Aesar: H55190...31 total

ref: mol2, SDF, SMILES, flexibase
3.29,-1.13,-5.84,1,3,0, 286.169, 4

Similar to: 42203794, 42203797, 44240272, 44240275, 44240282, ... 6 in total.
4299211
 
#28

ChemMol: 97803957
eMolecules: 526715
Acros Organics: CC48716
AKOS: AKOS004114088
Ark Pharm Building Blocks: AK-64034...21 total

ref: mol2, SDF, SMILES, flexibase
3.08,2.5,-6.02,0,1,0, 185.251, 1
4207357
 
#29

eMolecules: 2867940
Molport: MolPort-002-469-478
Scientific Exchange Building Blocks: M-720512
AK Scientific: HTS000657, V3789
AKOS: AKOS003605878...35 total

ref: mol2, SDF, SMILES, flexibase
1.04,1.79,-5.45,3,3,0, 215.05, 1
ref: mol2, SDF, SMILES, flexibase
1.04,2,-5.16,3,3,0, 215.05, 1
mid: mol2, SDF, SMILES, flexibase
1.17,2.86,-16.72,3,3,0, 215.05, 2
158664
 
#30

ChemMol: 97803978
eMolecules: 720174
Acros Organics: CC09210
AK Scientific: AMTH068
AKOS: AKOS003197225...47 total

ref: mol2, SDF, SMILES, flexibase
2.82,-2.65,-4.03,0,2,0, 215.075, 0

Similar to: 3199303, 3473497,
6640583
 
#31

ChemMol: 97804153
Molport: MolPort-000-928-314
AKOS: AKOS004113974
Ark Pharm Building Blocks: AK141608
Boroncore: BC000207...18 total

ref: mol2, SDF, SMILES, flexibase
3.69,2.05,-6.44,0,2,0, 218.277, 3

Similar to: 32223139, 38602488,
39565260
 
#32

Molport: MolPort-001-761-645
Boroncore: BC000208
Tetrahedron Building Blocks: TS00119
ref: mol2, SDF, SMILES, flexibase
2.19,1.37,-1.65,0,2,0, 304.767, 0
39565261
 
#33

Molport: MolPort-001-761-645
Boroncore: BC000208
Tetrahedron Building Blocks: TS00119
ref: mol2, SDF, SMILES, flexibase
2.19,1.37,-1.65,0,2,0, 304.767, 0
16945820
 
#34

ChemMol: 97804250
AK Scientific: AMTDA024
AKOS: AKOS004113816
Alfa-Aesar: H51770
Angene Building Blocks: AGN-PC-0LML5J...25 total

ref: mol2, SDF, SMILES, flexibase
3.40,5.71,-9.09,1,3,0, 228.247, 3

Similar to: 6792952,
40881
 
#35

ChemMol: 30100340, 83600431, 1034728, 97803952, 44010549
eMolecules: 502463
Scientific Exchange (make on demand): F-405068
Acorn PharmaTech: ACN-S003540
Acros Organics: 33834...90 total

ref: mol2, SDF, SMILES, flexibase
3.01,1.15,-7.73,1,2,0, 195.221, 1

Similar to: 731160,
2555419
 
#36

ChemMol: 97804207
AK Scientific: 6984AD
AKOS: AKOS004114087
Alfa-Aesar: H27386
Ark Pharm Building Blocks: AK143099...21 total

ref: mol2, SDF, SMILES, flexibase
3.49,2.25,-6.65,0,2,0, 218.277, 3

Similar to: 34521697,
20443231
 
#37

ChemMol: 97804253
Boroncore: BC000248
Chembo Pharma: KB-44217
Combi-Blocks: SS-8035
Element Store BB: b2star-208111-00-6...14 total

ref: mol2, SDF, SMILES, flexibase
2.23,5.07,-6.49,0,2,0, 189.239, 2

Similar to: 34545705,
2141003
 
#38

ChemMol: 1030903, 97803935, 96700175, 44008708, 1203506
Acros Organics: CC02110, 17526
Alfa-Aesar: B23543
Anward: ANW-24681
Apexmol Building Blocks: AM81635...61 total

ref: mol2, SDF, SMILES, flexibase
1.69,3.08,-3.07,0,1,0, 146.971, 0
2525668
 
#39

ChemMol: 97804140
AKOS: AKOS004114083
Anward: ANW-71665
Ark Pharm Building Blocks: AK-77030
BePharm Building Blocks: B87061...20 total

ref: mol2, SDF, SMILES, flexibase
3.67,3.27,-11.13,0,3,0, 240.258, 4

Similar to: 34556084, 1258019, 1258734, 1259385, ... 4 in total.
2024508
 
#40

ChemMol: 97803944
eMolecules: 715910
AK Scientific: Z0454
Aldrich CPR: S168467|ALDRICH
Anward: ANW-43749...38 total

ref: mol2, SDF, SMILES, flexibase
-3.16,-3.32,-15.94,2,6,0, 204.226, 3

Similar to: 12405155,
395625
 
#41

ChemMol: 97803968
AKOS: AKOS015851360
Angene Building Blocks: AGN-PC-0R50KX
BioSynth: D-4690
Boroncore: BC000315...15 total

ref: mol2, SDF, SMILES, flexibase
1.71,7.18,-8.37,0,4,0, 220.224, 4

Similar to: 16971479, 16971484, 16971489, 16971495, 16971500, ... 11 in total.
16945870
 
#42

ChemMol: 44011780, 97804299
AKOS: AKOS004114059
Ark Pharm Building Blocks: AK-29106
Boroncore: BC000317
Bosche Scientific: T6479...18 total

ref: mol2, SDF, SMILES, flexibase
3.04,4.33,-4.78,1,1,0, 176.24, 1
6863403
 
#43

ChemMol: 97804308
AKOS: AKOS004114138
Boroncore: BC000318
Chembo Pharma: KB-239288
Combi-Blocks: YA-1452...14 total

ref: mol2, SDF, SMILES, flexibase
2.84,-0.84,-4.93,1,1,0, 176.24, 1
34454338
 
#44

ChemMol: 97804458
Acros Organics: 44462, NP44462
AK Scientific: Y8665
Aldrich CPR: BML00258|ALDRICH
Anward: ANW-27003...31 total

ref: mol2, SDF, SMILES, flexibase
2.87,3.8,-4.44,1,1,0, 215.09, 1

Similar to: 38436087,
409179
 
#45

ChemMol: 1031316, 30109989, 44002094, 1200124, 97800052, 98000294
Scientific Exchange (make on demand): C-031510
AKOS: AKOS000147089
Alfa-Aesar: B20189
Angene Building Blocks: AGN-PC-0JKOTD...68 total

ref: mol2, SDF, SMILES, flexibase
2.69,2,-8.1,0,1,0, 196.047, 1

Similar to: 33800599, 39127638, 39350490,
1529074
 
#46

ChemMol: 83602897, 1033292, 44004229, 97801492, 30104754, 1033293
eMolecules: 512186
Molport: MolPort-000-002-343
A&J Pharmtech: AJ-00243
Acorn PharmaTech: ACN-S004414...83 total

ref: mol2, SDF, SMILES, flexibase
1.97,2.95,-3.43,0,2,0, 193.431, 0
13514693
 
#47

ChemMol: 97804409
Acros Organics: 44480
AK Scientific: V5279
AKOS: AKOS015853793
Aldrich CPR: BML00216|ALDRICH...26 total

ref: mol2, SDF, SMILES, flexibase
2.49,2.89,-3.14,2,2,0, 249.051, 1
4208967
 
#48

ChemMol: 1033294, 44029356, 97805732
AK Scientific: X7054
AKOS: AKOS013153651
Angene Building Blocks: AGN-PC-0NK2UW
Anward: ANW-28949...41 total

ref: mol2, SDF, SMILES, flexibase
1.93,5.65,-4.36,0,3,0, 202.055, 1
2547891
 
#49

ChemMol: 1203494, 30112116, 97804175
eMolecules: 719124
Molport: MolPort-002-054-983
Acros Organics: 37179
AK Scientific: U858...58 total

ref: mol2, SDF, SMILES, flexibase
1.40,3.37,-4.72,0,2,0, 208.002, 0
1258127
 
#50

ChemMol: 97804148, 44026173
AK Scientific: V5744
AKOS: AKOS004113777
Aldrich CPR: L480592|ALDRICH
Angene Building Blocks: AGN-PC-0K4N7T...32 total

ref: mol2, SDF, SMILES, flexibase
2.96,0.82,-8.29,2,3,0, 227.263, 3

Similar to: 34404235,
8699774
 
#51

ChemMol: 97804295, 44026184
AK Scientific: V5793
Aldrich CPR: BML00042|ALDRICH
Angene Building Blocks: AGN-PC-0MWFCA
Anward: ANW-29427...23 total

ref: mol2, SDF, SMILES, flexibase
4.09,6.81,-3.25,2,1,0, 238.117, 1

Similar to: 5161953, 6092203, 6092188, 6091207, ... 4 in total.
336455
 
#52

ChemMol: 1201709, 51500577, 44005438, 1032566, 1033263, 96706489, 30106593, 97804143
A&J Pharmtech: AJ-01153
Acros Organics: 43742
ACT Chemical BB: ACT01290
Adesis: 2-388...73 total

ref: mol2, SDF, SMILES, flexibase
1.99,3.39,-2.08,0,1,0, 175.988, 0
731156
 
#53

ChemMol: 97804152
AKOS: AKOS004114037
Boroncore: BC000398
Chembo Pharma: KB-36507
Element Store BB: b2star-443998-73-0...17 total

ref: mol2, SDF, SMILES, flexibase
2.54,1.06,-6.7,2,2,0, 194.237, 1
2544768
 
#54

ChemMol: 97804196
AK Scientific: W6329
AKOS: AKOS004117139
Aldrich CPR: L446556|ALDRICH
Angene Building Blocks: AGN-PC-0KL1VM...28 total

ref: mol2, SDF, SMILES, flexibase
4.53,7.79,-3.99,2,1,0, 305.221, 3
246186
 
#55

ChemMol: 30100337, 97803967
AK Scientific: V6149
AKOS: AKOS004114021
Angene Building Blocks: AGN-PC-0JM2CN
Anward: ANW-30669...33 total

ref: mol2, SDF, SMILES, flexibase
2.56,1.06,-6.53,2,2,0, 194.237, 1

Similar to: 6247539,
731162
 
#56

ChemMol: 97804234
AKOS: AKOS004116336
Ark Pharm Building Blocks: AK148925
Boroncore: BC000430
Chembo Pharma: KB-32190...15 total

ref: mol2, SDF, SMILES, flexibase
2.98,1.14,-7.63,1,2,0, 195.221, 1

Similar to: 1679153, 1758852, 6407464, 40829406, ... 4 in total.
2525437
 
#57

ChemMol: 97803576, 96701308
Acorn PharmaTech: ACN-C000780
AK Scientific: AMTH002
Alfa-Aesar: H34454, H32612
Alinda Building Blocks: ALBB-013412...45 total

ref: mol2, SDF, SMILES, flexibase
2.99,0.72,-5.31,0,2,0, 284.1, 2

Similar to: 34529922,
158698
 
#58

ChemMol: 83602972, 2101406, 30110672, 97801603, 44000130, 96700994
eMolecules: 720232
Acorn PharmaTech: ACN-S003138
Acros Organics: CC11710
AKOS: AKOS005145773...61 total

ref: mol2, SDF, SMILES, flexibase
2.52,-1.51,-6.36,0,2,0, 209.046, 0

Similar to: 32266384,
1504183
 
#59

ChemMol: 97804625, 30111390, 83603255, 30106293, 44005258, 44031494, 97804548, 30114343, 44011614, 97804592, 30114344, 30106294, 44005259
Molport: MolPort-023-220-130, MolPort-002-501-395, MolPort-002-501-396
Acros Organics: 40900
ACT Chemical BB: ACT03394, ACT03991
AKOS: AKOS015995549...302 total

ref: mol2, SDF, SMILES, flexibase
4.18,10.65,-7.24,0,1,0, 234.298, 4

Similar to: 26506281, 33575239, 33575240, 34565707, 34573567, ... 9 in total.
158806
 
#60

ChemMol: 97803982
eMolecules: 720374
Acros Organics: CC14711
AK Scientific: AMTH061
AKOS: AKOS000623532...48 total

ref: mol2, SDF, SMILES, flexibase
1.84,4.38,-5.54,0,2,0, 236.056, 0
157316
 
#61

ChemMol: 44002991
Acros Organics: 24964
Alfa-Aesar: A14570
Anward: ANW-31369
Apexmol Building Blocks: AM20040617...58 total

ref: mol2, SDF, SMILES, flexibase
3.57,1.47,-4.1,0,2,0, 276.073, 3

Similar to: 1259685, 2392613, 34343378,
5338776
 
#62

ChemMol: 30116767, 2100141, 97803996, 44013274
Acorn PharmaTech: ACN-C001007
AK Scientific: W6714
AKOS: AKOS015835950
Aldrich CPR: CDS005477|ALDRICH...52 total

ref: mol2, SDF, SMILES, flexibase
1.79,2.59,-9.23,0,3,0, 210.034, 0
lo: mol2, SDF, SMILES, flexibase
1.79,2.88,-30.73,1,3,1, 211.042, 0
12957755
 
#63

ChemMol: 97804297
AK Scientific: V6418
Angene Building Blocks: AGN-PC-006ITO
Anward: ANW-31595
Ark Pharm Building Blocks: AK-90927...25 total

ref: mol2, SDF, SMILES, flexibase
2.02,4.86,-7.96,2,4,0, 217.224, 3
13615
 
#64

ChemMol: 30111300, 83600239, 44002602, 1201081, 98000582
eMolecules: 480355
Scientific Exchange (make on demand): F-066892
Acros Organics: 15661
AKOS: AKOS000119850...101 total

ref: mol2, SDF, SMILES, flexibase
2.10,3.47,-2.54,2,1,0, 219.025, 0

Similar to: 6093080, 34598189,
391103
 
#65

ChemMol: 97800035, 1033621, 1032318, 1201936, 1033908, 30111299, 44008504, 98000233
Molport: MolPort-001-769-161
Acorn PharmaTech: ACN-S002716
Acros Organics: 12239
AKOS: AKOS000120743...94 total

ref: mol2, SDF, SMILES, flexibase
2.54,-1.6,-3.05,1,1,0, 220.009, 0
4245261
 
#66

ChemMol: 44005193, 97804289
eMolecules: 526893
Molport: MolPort-002-054-895
AK Scientific: 7748AB
Ark Pharm Building Blocks: AK-29358...31 total

ref: mol2, SDF, SMILES, flexibase
2.00,4.87,-7.69,2,4,0, 217.224, 3

Similar to: 34592386,
168493
 
#67

ChemMol: 97804072
Molport: MolPort-000-928-195
Scientific Exchange (make on demand): H-007764
AK Scientific: V6705
AKOS: AKOS003273039...35 total

ref: mol2, SDF, SMILES, flexibase
2.98,0.82,-7.51,2,3,0, 227.263, 3

Similar to: 6247540,
6735135
 
#68

ChemMol: 97804251
AKOS: AKOS004114000
Boroncore: BC000465
Sigma Aldrich (Building Blocks): 646504|ALDRICH
Tetrahedron Building Blocks: TS52639...10 total

ref: mol2, SDF, SMILES, flexibase
3.40,0.9,-8.1,1,3,0, 228.247, 3

Similar to: 6407465,
21982168
 
#69

ChemMol: 97802923, 30109650, 44011602
Acorn PharmaTech: ACN-S003177
Acros Organics: 44460
AK Scientific: W7194
Aldrich CPR: L511005|ALDRICH...48 total

ref: mol2, SDF, SMILES, flexibase
2.48,5.05,-5.55,0,2,0, 211.062, 0
15444593
 
#70

ChemMol: 97802901, 44016446
Acros Organics: 44461
AK Scientific: W7195
Angene Building Blocks: AGN-PC-03T8DA
Anward: ANW-33132...38 total

ref: mol2, SDF, SMILES, flexibase
2.48,5.14,-9.47,0,2,0, 211.062, 0
1420726
 
#71

ChemMol: 1035475, 83602455, 30108435, 44007420, 51500006, 97801386
Molport: MolPort-000-000-280
A&J Pharmtech: AJ-02711
Acorn PharmaTech: ACN-S003658, ACN-S001343
Acros Organics: MO00943...89 total

ref: mol2, SDF, SMILES, flexibase
0.77,0.13,-5.45,2,3,0, 174.001, 0
3884295
 
#72

ChemMol: 97805361, 44000895, 2100156
eMolecules: 725220
A&J Pharmtech: AJ-01978
Acorn PharmaTech: ACN-S004643
Adesis: 6-137...94 total

ref: mol2, SDF, SMILES, flexibase
2.06,0.44,-6.24,0,2,0, 197.035, 0
mid: mol2, SDF, SMILES, flexibase
2.06,0.69,-29.29,1,2,1, 198.043, 0
271160
 
#73

ChemMol: 44015273
eMolecules: 2047562
Molport: MolPort-001-488-353
Scientific Exchange: X-095782
AKOS: AKOS003235989...32 total

ref: mol2, SDF, SMILES, flexibase
4.28,2.84,-6.36,0,2,0, 226.275, 4

Similar to: 34343378, 34365019, 34383729, 34383732, 36468040, ... 8 in total.
2024505
 
#74

ChemMol: 97803953, 44007613
eMolecules: 715910
AK Scientific: Z0743
Aldrich CPR: S168467|ALDRICH
Anward: ANW-43749...36 total

ref: mol2, SDF, SMILES, flexibase
-3.16,-3.39,-15.89,2,6,0, 204.226, 3

Similar to: 12405155,
16082759
 
#75

ChemMol: 44007843
eMolecules: 933615
Scientific Exchange (make on demand): POD_69/0287
AK Scientific: V4055
Aldrich CPR: CDS004630|ALDRICH...46 total

ref: mol2, SDF, SMILES, flexibase
1.06,1.79,-6.01,3,3,0, 215.05, 1
ref: mol2, SDF, SMILES, flexibase
1.19,1.84,-33.16,4,3,1, 216.058, 2
mid: mol2, SDF, SMILES, flexibase
1.19,2.87,-17.31,3,3,0, 215.05, 2
780096
 
#76

ChemMol: 83600131, 97804013, 44011776
AK Scientific: V7369
AKOS: AKOS000124613
Alfa-Aesar: H27753
Angene Building Blocks: AGN-PC-0K04EJ...39 total

ref: mol2, SDF, SMILES, flexibase
2.59,-1.12,-4.32,2,1,0, 175.256, 1

Similar to: 34528949, 42736007,
2525669
 
#77

ChemMol: 97804141
Acros Organics: 44478
AK Scientific: V7419
AKOS: AKOS004114082
Angene Building Blocks: AGN-PC-0L952K...23 total

ref: mol2, SDF, SMILES, flexibase
3.69,3.27,-10.96,0,3,0, 240.258, 4

Similar to: 16947566, 16947581, 34571993,
391890
 
#78

ChemMol: 1203069, 97803933, 30111619
eMolecules: 489444
Molport: MolPort-019-857-239, MolPort-001-779-762, MolPort-020-001-051
Scientific Exchange (make on demand): K-030694
Acorn PharmaTech: ACN-S003884...169 total

ref: mol2, SDF, SMILES, flexibase
0.67,-1.31,-4.59,2,2,0, 118.176, 1

Similar to: 33866480, 33866481,
4245591
 
#79

ChemMol: 97804290
AK Scientific: V7908
AKOS: AKOS004114113
Angene Building Blocks: AGN-PC-0UOMYT
Boroncore: BC000560...22 total

ref: mol2, SDF, SMILES, flexibase
2.40,-0.92,-4.23,2,1,0, 175.256, 1

Similar to: 34027488,
12957867
 
#80

AK Scientific: AMTDA002
Alfa-Aesar: H51747
Boroncore: BC000561
Chembo Pharma: KB-257288
Combi-Blocks: QA-3267...13 total

ref: mol2, SDF, SMILES, flexibase
2.70,7.38,-9.72,0,4,0, 227.219, 3

Similar to: 34605278,
25757186
 
#81

ChemMol: 97804361
Boroncore: BC000562
Chembo Pharma: KB-238676
Sigma Aldrich (Building Blocks): 650803|ALDRICH
Tractus: TRA0087489...9 total

ref: mol2, SDF, SMILES, flexibase
2.20,6.4,-9.83,0,3,0, 208.22, 2

Similar to: 39927772, 39927779,
25757768
 
#82

ChemMol: 97804362
Boroncore: BC000563
Chembo Pharma: KB-256045
Sigma Aldrich (Building Blocks): 656089|ALDRICH
Tractus: TRA0087492...8 total

ref: mol2, SDF, SMILES, flexibase
2.60,6.66,-12.92,0,4,0, 241.246, 4

Similar to: 34544436, 6544735,
25758309
 
#83

Boroncore: BC000564
Chembo Pharma: KB-293163
Sigma Aldrich (Building Blocks): 656097|ALDRICH
Tractus: TRA0087493
AKOS BB (make-on-demand): AKOS015960177...7 total

ref: mol2, SDF, SMILES, flexibase
1.32,3.55,-15.29,0,4,0, 261.302, 3
19862889
 
#84

ChemMol: 30109235, 51500689, 44031806, 2100603, 44007984, 1032575, 42307008, 97801734
eMolecules: 830494
Molport: MolPort-000-001-279
Acorn PharmaTech: ACN-S003228, ACN-F000852
AK Scientific: L170...85 total

ref: mol2, SDF, SMILES, flexibase
1.28,2.05,-4.76,2,2,0, 173.013, 0
15042222
 
#85

ChemMol: 97804328
AKOS: AKOS010259096
Aldrich CPR: CDS008200|ALDRICH
Angene Building Blocks: AGN-PC-0UWT26
Anward: ANW-37947...22 total

ref: mol2, SDF, SMILES, flexibase
1.55,4.95,-7.85,0,3,0, 238.088, 2
lo: mol2, SDF, SMILES, flexibase
1.55,5.29,-33.86,1,3,1, 239.096, 2
15042237
 
#86

ChemMol: 97804329
AK Scientific: W8778
AKOS: AKOS010259097
Aldrich CPR: CDS006744|ALDRICH, BML00274|ALDRICH
Angene Building Blocks: AGN-PC-0UWT3C...34 total

ref: mol2, SDF, SMILES, flexibase
1.48,4.97,-7.56,0,3,0, 238.088, 2
lo: mol2, SDF, SMILES, flexibase
1.48,5.25,-36.99,1,3,1, 239.096, 2
35323446
 
#87

ChemMol: 97804436
AK Scientific: V9143
AKOS: AKOS013751753
Aldrich CPR: BML00224|ALDRICH
Anward: ANW-39758...26 total

ref: mol2, SDF, SMILES, flexibase
2.52,5.76,-4.06,0,2,0, 250.083, 2
12359393
 
#88

ChemMol: 97803760
Aldrich CPR: BML00264|ALDRICH
Alfa-Aesar: H27322
Boroncore: BC000677
Combi-Blocks: SS-8047...15 total

ref: mol2, SDF, SMILES, flexibase
3.76,-1.1,-7.23,0,2,0, 269.529, 1
lo: mol2, SDF, SMILES, flexibase
3.76,-1,-38.84,1,2,1, 270.537, 1
12359372
 
#89

ChemMol: 97803758
Alfa-Aesar: H27214
Boroncore: BC000678
Combi-Blocks: SS-8048
Molport BB: MolPort-002-054-731...11 total

ref: mol2, SDF, SMILES, flexibase
3.67,-1.74,-7.86,0,2,0, 313.98, 1
lo: mol2, SDF, SMILES, flexibase
3.67,-1.64,-37.99,1,2,1, 314.988, 1
lo: mol2, SDF, SMILES, flexibase
3.67,-1.53,-91.37,2,2,2, 315.996, 1
lo: mol2, SDF, SMILES, flexibase
3.67,-1.63,-39.26,1,2,1, 314.988, 1
156069
 
#90

ChemMol: 96700629, 30200603, 83600527, 30110308, 30106998, 97801048, 1201513, 30200503, 44010894
Acros Organics: 29943, 30318
ACT Chemical BB: ACT08049
AKOS: AKOS001288036, AKOS015832962
Alfa-Aesar: L13470...164 total

ref: mol2, SDF, SMILES, flexibase
-1.91,4.96,-13.76,0,6,0, 234.283, 1
ref: mol2, SDF, SMILES, flexibase
-2.72,6.91,-27.09,0,6,1, 234.283, 3
mid: mol2, SDF, SMILES, flexibase
-1.91,5.11,-10.15,1,6,0, 235.291, 1
mid: mol2, SDF, SMILES, flexibase
-1.91,6.21,-32.34,1,6,0, 235.291, 1
lo: mol2, SDF, SMILES, flexibase
-1.91,6.34,-40.96,2,6,0, 236.299, 1

Similar to: 34636291, 35819328, 38268375,
1706222
 
#91

ChemMol: 97803238, 97806236, 97806316, 30100965, 97806319, 97806322, 97806325, 97806329, 44010107, 83600425, 44003548, 97806234, 97806237, 97806317, 97806320, 97806323, 83601338, 44032756, 97806326, 44022704, 97806332, 44010108, 97800566, 97802816, 97806235, 97806266, 30100966, 97806318, 97806321, 97806324, 1202767, 97806328, 44021981, 97806339
Molport: MolPort-020-006-418, MolPort-020-006-421, MolPort-020-006-424, MolPort-020-006-427, MolPort-020-006-431, MolPort-020-006-412, MolPort-020-006-416, MolPort-020-006-419, MolPort-020-006-422, MolPort-020-006-425, MolPort-020-006-429, MolPort-020-006-433, MolPort-020-006-413, MolPort-001-768-916, MolPort-020-006-417, MolPort-020-006-420, MolPort-020-006-423, MolPort-020-006-426, MolPort-020-006-430, MolPort-020-006-436, MolPort-020-006-109, MolPort-020-006-415
Scientific Exchange: POD_29/0148, L19/LTRi-263
Scientific Exchange (make on demand): POD_14/0979
Acorn PharmaTech: ACN-S003618...3293 total

ref: mol2, SDF, SMILES, flexibase
2.12,12.53,-28.85,0,1,1, 242.471, 12

Similar to: 1722767, 2026895, 32136911, 32151675, 32153456, ... 13 in total.
3593622
 
#92

ChemMol: 1201455
Acros Organics: 44836, 38775, 16424, 22216, 18013, 34845, 45053, 43455, 17663, 26829, 44640, 32078, 38863, 18150, 32697, 17508
ACT Chemical BB: ACT09264
AKOS: AKOS015833620
Alfa-Aesar: 30760...1201 total

ref: mol2, SDF, SMILES, flexibase
0.70,1.61,-2.11,0,1,0, 72.107, 0

Similar to: 34604141,
2565544
 
#93

ChemMol: 1034711, 97803977
Molport: MolPort-000-004-683
AK Scientific: AMTDA023
AKOS: AKOS002679748
Aldrich CPR: CDS011287|ALDRICH...47 total

ref: mol2, SDF, SMILES, flexibase
4.07,1.64,-53.88,0,2,-1, 211.24, 2

Similar to: 16947604, 32003741, 34884472, 35785283, 39025617, ... 7 in total.
12957450
 
#94

ChemMol: 97804300, 44027939, 30115721
AK Scientific: X0269
Anward: ANW-45268
Apexmol Building Blocks: AM20030317
APIChem: AC-22949...30 total

ref: mol2, SDF, SMILES, flexibase
2.39,4.33,-6.06,2,4,0, 264.022, 1

Similar to: 35847432,
2581021
 
#95

ChemMol: 44017029, 44034628, 97804119, 30202984, 44029454
A&J Pharmtech: AJ-00815
AK Scientific: 1252AB
AKOS: AKOS000314398
Angene Building Blocks: AGN-PC-0KL72A...38 total

ref: mol2, SDF, SMILES, flexibase
3.41,1.72,-53.75,0,3,-1, 225.223, 3

Similar to: 16947604, 32003741, 34884469, 34884470, 34884472, ... 9 in total.
158700
 
#96

ChemMol: 44011779, 97803986
eMolecules: 45819913, 720236
Acros Organics: CC12001
AK Scientific: AMTDA058
AKOS: AKOS000124479...57 total

ref: mol2, SDF, SMILES, flexibase
3.43,0.49,-49.71,0,2,-1, 203.242, 2
26522631
 
#97

ChemMol: 97803954
Aldrich CPR: BML00225|ALDRICH
Boroncore: BC000350
EndoTherm: ENF073
Fluorochem: 046295...12 total

ref: mol2, SDF, SMILES, flexibase
4.45,9.16,-8.54,0,3,0, 278.105, 2
39953816
 
#98

Angene Building Blocks: AGN-PC-0NI5W9
Anward: ANW-29109
Boroncore: BC000376
Chembo Pharma: KB-41782
Synblock: AB10496...7 total

ref: mol2, SDF, SMILES, flexibase
1.83,2.25,-102.46,2,3,2, 213.034, 0
12341353
 
#99

ChemMol: 44027583, 97803994
eMolecules: 527065
Molport: MolPort-002-491-658, MolPort-001-794-322
AK Scientific: Z0649
AKOS: AKOS001081494...59 total

ref: mol2, SDF, SMILES, flexibase
2.17,3.5,-35.59,0,4,-1, 224.041, 1

Similar to: 39937519,
152447
 
#100

ChemMol: 44029524, 96707789, 83601838, 44035256, 42303051, 2000122, 1036277, 30108748, 44002982, 1201443, 97801057
eMolecules: 483605
Molport: MolPort-000-002-253, MolPort-019-878-370
Scientific Exchange (make on demand): M-235539
ACB Blocks: MIX-0872...172 total

ref: mol2, SDF, SMILES, flexibase
0.67,3.12,-45.85,2,4,1, 187.263, 2

Similar to: 357874, 21298735, 22052832, 32139339, 32139340, ... 10 in total.

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 = 752 ) limit 0,100

Smiles were