ZINC ID
| Supplier information; Representations
Properties:xLogP, ap & p desolvation, HBD,HBA,Charge,Mwt,NRB
Annotations; Similarity | Structure
Click for quick 3D display |
|---|
Done
169187
#1
  
 | PBMR Labs Building Blocks: RBK_029451
|  |
84480345
#2
| eMolecules: 1529106
PBMR Labs Building Blocks: RBK_009642
Princeton BioMolecular Research: OSSK_617700
ChEMBL19: CHEMBL1350714, CHEMBL1626164
Mcule Make-on-demand: MCULE-6635992935...6 total
|  |
75835810
#3
| PBMR Labs Building Blocks: RBK_007685
|  |
3017649
#4
| eMolecules: 4115906, 2493936
Molport: MolPort-002-285-685, MolPort-000-863-369
AKOS: AKOS001477081
ChemBridge: 7938921
Mcule: MCULE-2945367044...23 total
ref: mol2,
SDF,
SMILES,
flexibase
4.28,-5.81,-54.23,4,5,1, 431.965, 9
Similar to: 19922733,
|  |
85347276
#5
| PBMR Labs Building Blocks: RBK_064679
Princeton BioMolecular Research: OSSL_833086
lo: mol2,
SDF,
SMILES,
flexibase
4.55,10.03,-37.83,2,7,1, 336.327, 4
|  |
85346895
#6
| eMolecules: 42265029
Molport: MolPort-025-495-040
Enamine Building Blocks: EN300-115345
Molport BB: MolPort-025-495-040
PBMR Labs Building Blocks: RBK_065901...7 total
ref: mol2,
SDF,
SMILES,
flexibase
0.73,5.76,-47.42,0,2,-1, 137.158, 2
|  |
85346893
#7
| PBMR Labs Building Blocks: RBK_065878
PubChem: 66276288
Enamine BB Make on Demand: BBV-41584961, BBV-41815481
UORSY BB Make-on-demand: BBV-41584961
ref: mol2,
SDF,
SMILES,
flexibase
0.39,0.78,-41.7,3,2,1, 158.143, 4
hi: mol2,
SDF,
SMILES,
flexibase
0.39,0.32,-4.67,2,2,0, 157.135, 4
|  |
85346890
#8
| PBMR Labs Building Blocks: RBK_065878
PubChem: 66276288
Enamine BB Make on Demand: BBV-41584961, BBV-41815481
UORSY BB Make-on-demand: BBV-41584961
ref: mol2,
SDF,
SMILES,
flexibase
0.39,0.78,-43,3,2,1, 158.143, 4
hi: mol2,
SDF,
SMILES,
flexibase
0.39,0.32,-4.53,2,2,0, 157.135, 4
|  |
85346889
#9
| PBMR Labs Building Blocks: RBK_065793
Princeton BioMolecular Research: OSSL_833229
ref: mol2,
SDF,
SMILES,
flexibase
3.86,8.65,-42.35,0,4,-1, 329.788, 2
mid: mol2,
SDF,
SMILES,
flexibase
3.40,9.77,-14.66,1,4,0, 330.796, 2
|  |
85346887
#10
| PBMR Labs Building Blocks: RBK_065792
Princeton BioMolecular Research: OSSL_833228
ref: mol2,
SDF,
SMILES,
flexibase
3.18,8.13,-45.18,0,4,-1, 295.343, 2
mid: mol2,
SDF,
SMILES,
flexibase
2.72,9.25,-15.15,1,4,0, 296.351, 2
|  |
85346885
#11
| PBMR Labs Building Blocks: RBK_065788
Princeton BioMolecular Research: OSSL_833224
ref: mol2,
SDF,
SMILES,
flexibase
3.32,6.7,-43.26,0,4,-1, 261.326, 3
mid: mol2,
SDF,
SMILES,
flexibase
2.86,7.82,-13.64,1,4,0, 262.334, 3
|  |
85346883
#12
| PBMR Labs Building Blocks: RBK_065784
Princeton BioMolecular Research: OSSL_833220
ref: mol2,
SDF,
SMILES,
flexibase
4.59,11.21,-12.5,0,6,0, 366.167, 6
|  |
85346881
#13
| PBMR Labs Building Blocks: RBK_065783
Princeton BioMolecular Research: OSSL_833219
ref: mol2,
SDF,
SMILES,
flexibase
4.86,11.78,-12.43,0,6,0, 378.178, 7
|  |
85346879
#14
| PBMR Labs Building Blocks: RBK_065782
Princeton BioMolecular Research: OSSL_833218
ref: mol2,
SDF,
SMILES,
flexibase
4.38,11.74,-13.66,0,6,0, 376.162, 6
|  |
85346877
#15
| PBMR Labs Building Blocks: RBK_065781
Princeton BioMolecular Research: OSSL_833217
ref: mol2,
SDF,
SMILES,
flexibase
4.25,11.64,-13.86,0,6,0, 331.711, 6
|  |
85346875
#16
| PBMR Labs Building Blocks: RBK_065780
Princeton BioMolecular Research: OSSL_833216
ref: mol2,
SDF,
SMILES,
flexibase
4.73,11.68,-12.67,0,6,0, 333.727, 7
|  |
85346872
#17
| PBMR Labs Building Blocks: RBK_065778
Princeton BioMolecular Research: OSSL_833214
ref: mol2,
SDF,
SMILES,
flexibase
4.09,10.17,-12.83,0,6,0, 307.689, 5
|  |
85346869
#18
| PBMR Labs Building Blocks: RBK_065777
Princeton BioMolecular Research: OSSL_833213
ref: mol2,
SDF,
SMILES,
flexibase
4.22,10.28,-12.57,0,6,0, 352.14, 5
|  |
85346867
#19
| PBMR Labs Building Blocks: RBK_065776
Princeton BioMolecular Research: OSSL_833212
ref: mol2,
SDF,
SMILES,
flexibase
3.09,6.34,-13.25,2,6,0, 337.129, 4
|  |
85346865
#20
| PBMR Labs Building Blocks: RBK_065775
Princeton BioMolecular Research: OSSL_833211
ref: mol2,
SDF,
SMILES,
flexibase
2.96,6.24,-13.38,2,6,0, 292.678, 4
|  |
85346862
#21
| PBMR Labs Building Blocks: RBK_065773
Princeton BioMolecular Research: OSSL_833209
ref: mol2,
SDF,
SMILES,
flexibase
3.60,8.64,-61.88,0,6,-1, 337.105, 4
|  |
85346860
#22
| PBMR Labs Building Blocks: RBK_065772
Princeton BioMolecular Research: OSSL_833208
ref: mol2,
SDF,
SMILES,
flexibase
4.02,9.89,-12.45,0,6,0, 340.129, 5
|  |
85346858
#23
| PBMR Labs Building Blocks: RBK_065771
Princeton BioMolecular Research: OSSL_833207
ref: mol2,
SDF,
SMILES,
flexibase
4.29,10.46,-12.43,0,6,0, 352.14, 6
|  |
85346855
#24
| PBMR Labs Building Blocks: RBK_065770
Princeton BioMolecular Research: OSSL_833206
ref: mol2,
SDF,
SMILES,
flexibase
3.80,10.42,-13.81,0,6,0, 350.124, 5
|  |
85346853
#25
| PBMR Labs Building Blocks: RBK_065769
Princeton BioMolecular Research: OSSL_833205
ref: mol2,
SDF,
SMILES,
flexibase
3.67,10.32,-13.94,0,6,0, 305.673, 5
|  |
85346850
#26
| PBMR Labs Building Blocks: RBK_065768
Princeton BioMolecular Research: OSSL_833204
ref: mol2,
SDF,
SMILES,
flexibase
4.16,10.36,-12.66,0,6,0, 307.689, 6
|  |
85346848
#27
| PBMR Labs Building Blocks: RBK_065765
Princeton BioMolecular Research: OSSL_833203
ref: mol2,
SDF,
SMILES,
flexibase
1.50,4.85,-14.74,3,5,0, 258.277, 2
|  |
85346846
#28
| PBMR Labs Building Blocks: RBK_065764
Princeton BioMolecular Research: OSSL_833202
ref: mol2,
SDF,
SMILES,
flexibase
1.98,7.54,-18.5,1,7,0, 288.259, 3
|  |
85346844
#29
| PBMR Labs Building Blocks: RBK_065763
Princeton BioMolecular Research: OSSL_833201
ref: mol2,
SDF,
SMILES,
flexibase
2.00,7.49,-19.65,1,7,0, 288.259, 3
|  |
85346841
#30
| PBMR Labs Building Blocks: RBK_065762
Princeton BioMolecular Research: OSSL_833200
ref: mol2,
SDF,
SMILES,
flexibase
1.61,6.95,-22.71,1,8,0, 304.258, 4
|  |
85346839
#31
| PBMR Labs Building Blocks: RBK_065761
Princeton BioMolecular Research: OSSL_833199
ref: mol2,
SDF,
SMILES,
flexibase
1.14,3.46,-16.06,3,6,0, 274.276, 3
|  |
85346836
#32
| PBMR Labs Building Blocks: RBK_065760
Princeton BioMolecular Research: OSSL_833198
ref: mol2,
SDF,
SMILES,
flexibase
1.53,4.8,-15.27,3,5,0, 258.277, 2
|  |
85346834
#33
| PBMR Labs Building Blocks: RBK_065759
Princeton BioMolecular Research: OSSL_833197
ref: mol2,
SDF,
SMILES,
flexibase
1.12,4.71,-14.65,3,5,0, 258.277, 2
|  |
85346832
#34
| PBMR Labs Building Blocks: RBK_065758
Princeton BioMolecular Research: OSSL_833196
ref: mol2,
SDF,
SMILES,
flexibase
0.73,3.48,-16.68,3,6,0, 274.276, 3
|  |
85346830
#35
| PBMR Labs Building Blocks: RBK_065757
Princeton BioMolecular Research: OSSL_833195
ref: mol2,
SDF,
SMILES,
flexibase
1.61,6.3,-19.13,1,8,0, 304.258, 4
|  |
85346828
#36
| PBMR Labs Building Blocks: RBK_065756
Princeton BioMolecular Research: OSSL_833194
ref: mol2,
SDF,
SMILES,
flexibase
2.00,7.55,-18.28,1,7,0, 288.259, 3
|  |
85346826
#37
| PBMR Labs Building Blocks: RBK_065755
Princeton BioMolecular Research: OSSL_833193
ref: mol2,
SDF,
SMILES,
flexibase
1.89,4.89,-14.23,3,5,0, 323.146, 2
|  |
85346824
#38
| PBMR Labs Building Blocks: RBK_065754
Princeton BioMolecular Research: OSSL_833192
ref: mol2,
SDF,
SMILES,
flexibase
1.76,4.79,-14.33,3,5,0, 278.695, 2
|  |
85346822
#39
| PBMR Labs Building Blocks: RBK_065753
Princeton BioMolecular Research: OSSL_833191
ref: mol2,
SDF,
SMILES,
flexibase
1.53,4.94,-14.43,3,5,0, 258.277, 2
|  |
85346820
#40
| PBMR Labs Building Blocks: RBK_065752
Princeton BioMolecular Research: OSSL_833190
ref: mol2,
SDF,
SMILES,
flexibase
1.14,3.57,-15.55,3,6,0, 274.276, 3
|  |
85346819
#41
| PBMR Labs Building Blocks: RBK_065751
Princeton BioMolecular Research: OSSL_833189
ref: mol2,
SDF,
SMILES,
flexibase
1.51,4.5,-15.21,3,6,0, 288.303, 4
|  |
85346816
#42
| PBMR Labs Building Blocks: RBK_065750
Princeton BioMolecular Research: OSSL_833188
ref: mol2,
SDF,
SMILES,
flexibase
1.99,7.7,-19.78,1,8,0, 318.285, 5
|  |
85346814
#43
| PBMR Labs Building Blocks: RBK_065749
Princeton BioMolecular Research: OSSL_833187
ref: mol2,
SDF,
SMILES,
flexibase
1.61,6.77,-20.11,1,8,0, 304.258, 4
|  |
85346810
#44
| PBMR Labs Building Blocks: RBK_065748
Princeton BioMolecular Research: OSSL_833186
ref: mol2,
SDF,
SMILES,
flexibase
2.36,8.1,-18.27,1,7,0, 353.128, 3
|  |
85346807
#45
| PBMR Labs Building Blocks: RBK_065747
Princeton BioMolecular Research: OSSL_833185
ref: mol2,
SDF,
SMILES,
flexibase
2.23,7.99,-18.45,1,7,0, 308.677, 3
|  |
85346805
#46
| PBMR Labs Building Blocks: RBK_065746
Princeton BioMolecular Research: OSSL_833184
ref: mol2,
SDF,
SMILES,
flexibase
2.00,8.15,-19.53,1,7,0, 288.259, 3
|  |
85346803
#47
| PBMR Labs Building Blocks: RBK_065745
Princeton BioMolecular Research: OSSL_833183
ref: mol2,
SDF,
SMILES,
flexibase
1.99,7.25,-17.77,1,8,0, 318.285, 5
|  |
85346801
#48
| PBMR Labs Building Blocks: RBK_065744
Princeton BioMolecular Research: OSSL_833182
ref: mol2,
SDF,
SMILES,
flexibase
1.61,6.32,-18.2,1,8,0, 304.258, 4
|  |
85346799
#49
| PBMR Labs Building Blocks: RBK_065743
Princeton BioMolecular Research: OSSL_833181
ref: mol2,
SDF,
SMILES,
flexibase
2.00,7.55,-17.28,1,7,0, 288.259, 3
|  |
85346798
#50
| PBMR Labs Building Blocks: RBK_065742
Princeton BioMolecular Research: OSSL_833180
ref: mol2,
SDF,
SMILES,
flexibase
2.23,7.42,-17.22,1,7,0, 308.677, 3
|  |
85346796
#51
| PBMR Labs Building Blocks: RBK_065741
Princeton BioMolecular Research: OSSL_833179
ref: mol2,
SDF,
SMILES,
flexibase
2.36,7.52,-17.12,1,7,0, 353.128, 3
|  |
85346793
#52
| PBMR Labs Building Blocks: RBK_065740
Princeton BioMolecular Research: OSSL_833178
ref: mol2,
SDF,
SMILES,
flexibase
1.48,4.69,-15.68,3,5,0, 323.146, 2
|  |
85346791
#53
| PBMR Labs Building Blocks: RBK_065739
Princeton BioMolecular Research: OSSL_833177
ref: mol2,
SDF,
SMILES,
flexibase
1.35,4.6,-15.8,3,5,0, 278.695, 2
|  |
85346788
#54
| PBMR Labs Building Blocks: RBK_065738
Princeton BioMolecular Research: OSSL_833176
ref: mol2,
SDF,
SMILES,
flexibase
1.10,4.39,-16.97,3,6,0, 288.303, 4
|  |
85346786
#55
| PBMR Labs Building Blocks: RBK_065737
Princeton BioMolecular Research: OSSL_833175
ref: mol2,
SDF,
SMILES,
flexibase
0.73,3.48,-17.27,3,6,0, 274.276, 3
|  |
85346783
#56
| PBMR Labs Building Blocks: RBK_065736
Princeton BioMolecular Research: OSSL_833174
ref: mol2,
SDF,
SMILES,
flexibase
1.12,4.71,-15.11,3,5,0, 258.277, 2
|  |
85346781
#57
| PBMR Labs Building Blocks: RBK_065735
Princeton BioMolecular Research: OSSL_833173
ref: mol2,
SDF,
SMILES,
flexibase
0.74,4.03,-15.78,3,5,0, 244.25, 2
|  |
85346778
#58
| PBMR Labs Building Blocks: RBK_065734
Princeton BioMolecular Research: OSSL_833172
ref: mol2,
SDF,
SMILES,
flexibase
1.63,6.87,-18.54,1,7,0, 274.232, 3
|  |
85346777
#59
| PBMR Labs Building Blocks: RBK_065733
Princeton BioMolecular Research: OSSL_833171
ref: mol2,
SDF,
SMILES,
flexibase
0.72,4.03,-15.24,3,5,0, 244.25, 2
|  |
85346775
#60
| PBMR Labs Building Blocks: RBK_065732
Princeton BioMolecular Research: OSSL_833170
ref: mol2,
SDF,
SMILES,
flexibase
1.60,6.86,-19.8,1,7,0, 274.232, 3
|  |
85346773
#61
| PBMR Labs Building Blocks: RBK_065731
Princeton BioMolecular Research: OSSL_833169
ref: mol2,
SDF,
SMILES,
flexibase
1.10,4.28,-14.57,3,5,0, 244.25, 2
|  |
85346771
#62
| PBMR Labs Building Blocks: RBK_065730
Princeton BioMolecular Research: OSSL_833168
ref: mol2,
SDF,
SMILES,
flexibase
1.58,7.47,-20.47,1,7,0, 274.232, 3
|  |
85346769
#63
| PBMR Labs Building Blocks: RBK_065729
Princeton BioMolecular Research: OSSL_833167
ref: mol2,
SDF,
SMILES,
flexibase
2.85,7.46,-13.9,1,4,0, 322.158, 2
|  |
85346768
#64
| PBMR Labs Building Blocks: RBK_065728
Princeton BioMolecular Research: OSSL_833166
ref: mol2,
SDF,
SMILES,
flexibase
2.85,7.34,-14.48,1,4,0, 322.158, 2
|  |
85346765
#65
| PBMR Labs Building Blocks: RBK_065727
Princeton BioMolecular Research: OSSL_833165
ref: mol2,
SDF,
SMILES,
flexibase
2.85,7.32,-14.4,1,4,0, 322.158, 2
|  |
85346763
#66
| PBMR Labs Building Blocks: RBK_065726
Princeton BioMolecular Research: OSSL_833164
ref: mol2,
SDF,
SMILES,
flexibase
2.72,7.25,-14.63,1,4,0, 277.707, 2
|  |
85346762
#67
| PBMR Labs Building Blocks: RBK_065725
Princeton BioMolecular Research: OSSL_833163
ref: mol2,
SDF,
SMILES,
flexibase
2.70,7.31,-14.27,1,4,0, 277.707, 2
|  |
85346759
#68
| PBMR Labs Building Blocks: RBK_065724
Princeton BioMolecular Research: OSSL_833162
ref: mol2,
SDF,
SMILES,
flexibase
3.08,7.33,-14.14,1,4,0, 342.576, 2
|  |
85346758
#69
| PBMR Labs Building Blocks: RBK_065723
Princeton BioMolecular Research: OSSL_833161
ref: mol2,
SDF,
SMILES,
flexibase
3.08,7.33,-14.21,1,4,0, 342.576, 2
|  |
85346756
#70
| PBMR Labs Building Blocks: RBK_065722
Princeton BioMolecular Research: OSSL_833160
ref: mol2,
SDF,
SMILES,
flexibase
2.44,6.72,-15.97,1,4,0, 281.67, 2
|  |
85346754
#71
| PBMR Labs Building Blocks: RBK_065721
Princeton BioMolecular Research: OSSL_833159
ref: mol2,
SDF,
SMILES,
flexibase
2.95,7.22,-13.86,1,4,0, 298.125, 2
|  |
85346753
#72
| PBMR Labs Building Blocks: RBK_065720
Princeton BioMolecular Research: OSSL_833157
ref: mol2,
SDF,
SMILES,
flexibase
2.95,7.12,-15.29,1,4,0, 298.125, 2
|  |
85346750
#73
| PBMR Labs Building Blocks: RBK_065719
Princeton BioMolecular Research: OSSL_833156
ref: mol2,
SDF,
SMILES,
flexibase
2.93,7.19,-15.86,1,4,0, 298.125, 2
|  |
85346748
#74
| PBMR Labs Building Blocks: RBK_065718
Princeton BioMolecular Research: OSSL_833155
ref: mol2,
SDF,
SMILES,
flexibase
2.95,7.22,-14.25,1,4,0, 298.125, 2
|  |
85346746
#75
| PBMR Labs Building Blocks: RBK_065716
Princeton BioMolecular Research: OSSL_833153
PubChem: 12227142
ref: mol2,
SDF,
SMILES,
flexibase
2.48,6.79,-14.62,1,4,0, 308.131, 2
|  |
85346742
#76
| PBMR Labs Building Blocks: RBK_065715
Princeton BioMolecular Research: OSSL_833152
ref: mol2,
SDF,
SMILES,
flexibase
2.45,6.78,-15.05,1,4,0, 308.131, 2
|  |
85346739
#77
| PBMR Labs Building Blocks: RBK_065714
Princeton BioMolecular Research: OSSL_833151
ref: mol2,
SDF,
SMILES,
flexibase
2.32,6.67,-15.03,1,4,0, 263.68, 2
|  |
85346737
#78
| PBMR Labs Building Blocks: RBK_065713
Princeton BioMolecular Research: OSSL_833150
ref: mol2,
SDF,
SMILES,
flexibase
2.30,6.71,-15.02,1,4,0, 263.68, 2
|  |
85346735
#79
| PBMR Labs Building Blocks: RBK_065712
Princeton BioMolecular Research: OSSL_833149
ref: mol2,
SDF,
SMILES,
flexibase
2.43,6.81,-14.92,1,4,0, 308.131, 2
|  |
85346733
#80
| PBMR Labs Building Blocks: RBK_065711
Princeton BioMolecular Research: OSSL_833148
ref: mol2,
SDF,
SMILES,
flexibase
3.21,7.42,-14.05,1,4,0, 387.027, 2
|  |
85346732
#81
| PBMR Labs Building Blocks: RBK_065710
Princeton BioMolecular Research: OSSL_833147
ref: mol2,
SDF,
SMILES,
flexibase
4.54,9.68,-15.87,0,4,0, 387.027, 4
|  |
85346729
#82
| PBMR Labs Building Blocks: RBK_065709
Princeton BioMolecular Research: OSSL_833146
ref: mol2,
SDF,
SMILES,
flexibase
2.94,9.21,-27.73,0,8,0, 304.258, 6
|  |
85346727
#83
| PBMR Labs Building Blocks: RBK_065708
Princeton BioMolecular Research: OSSL_833145
ref: mol2,
SDF,
SMILES,
flexibase
3.33,9.75,-24.81,0,7,0, 288.259, 5
|  |
85346725
#84
| PBMR Labs Building Blocks: RBK_065707
Princeton BioMolecular Research: OSSL_833144
ref: mol2,
SDF,
SMILES,
flexibase
3.31,9.8,-20.76,0,7,0, 288.259, 5
|  |
85346721
#85
| PBMR Labs Building Blocks: RBK_065706
Princeton BioMolecular Research: OSSL_833143
ref: mol2,
SDF,
SMILES,
flexibase
3.56,9.55,-18.4,0,7,0, 308.677, 5
|  |
85346720
#86
| PBMR Labs Building Blocks: RBK_065705
Princeton BioMolecular Research: OSSL_833142
ref: mol2,
SDF,
SMILES,
flexibase
2.94,8.55,-18.81,0,8,0, 304.258, 6
|  |
85346717
#87
| PBMR Labs Building Blocks: RBK_065704
Princeton BioMolecular Research: OSSL_833141
ref: mol2,
SDF,
SMILES,
flexibase
3.33,9.81,-16.47,0,7,0, 288.259, 5
|  |
85346715
#88
| PBMR Labs Building Blocks: RBK_065703
Princeton BioMolecular Research: OSSL_833140
ref: mol2,
SDF,
SMILES,
flexibase
3.69,10.36,-22.76,0,7,0, 353.128, 5
|  |
85346712
#89
| PBMR Labs Building Blocks: RBK_065702
Princeton BioMolecular Research: OSSL_833139
ref: mol2,
SDF,
SMILES,
flexibase
3.56,10.25,-22.93,0,7,0, 308.677, 5
|  |
85346709
#90
| PBMR Labs Building Blocks: RBK_065701
Princeton BioMolecular Research: OSSL_833138
ref: mol2,
SDF,
SMILES,
flexibase
3.31,9.97,-24.87,0,8,0, 318.285, 7
|  |
85346706
#91
| PBMR Labs Building Blocks: RBK_065700
Princeton BioMolecular Research: OSSL_833137
ref: mol2,
SDF,
SMILES,
flexibase
2.94,9.05,-25.06,0,8,0, 304.258, 6
|  |
85346704
#92
| PBMR Labs Building Blocks: RBK_065699
Princeton BioMolecular Research: OSSL_833136
ref: mol2,
SDF,
SMILES,
flexibase
3.33,10.41,-24.53,0,7,0, 288.259, 5
|  |
85346702
#93
| PBMR Labs Building Blocks: RBK_065698
Princeton BioMolecular Research: OSSL_833135
ref: mol2,
SDF,
SMILES,
flexibase
3.31,9.48,-19.52,0,8,0, 318.285, 7
|  |
85346700
#94
| PBMR Labs Building Blocks: RBK_065697
Princeton BioMolecular Research: OSSL_833134
ref: mol2,
SDF,
SMILES,
flexibase
3.69,9.77,-18.89,0,7,0, 353.128, 5
|  |
85346697
#95
| PBMR Labs Building Blocks: RBK_065696
Princeton BioMolecular Research: OSSL_833133
ref: mol2,
SDF,
SMILES,
flexibase
3.56,9.69,-19.09,0,7,0, 308.677, 5
|  |
85346696
#96
| PBMR Labs Building Blocks: RBK_065695
Princeton BioMolecular Research: OSSL_833132
ref: mol2,
SDF,
SMILES,
flexibase
2.94,8.56,-19.62,0,8,0, 304.258, 6
|  |
85346695
#97
| PBMR Labs Building Blocks: RBK_065694
Princeton BioMolecular Research: OSSL_833131
ref: mol2,
SDF,
SMILES,
flexibase
3.33,9.82,-17.27,0,7,0, 288.259, 5
|  |
85346692
#98
| PBMR Labs Building Blocks: RBK_065692
Princeton BioMolecular Research: OSSL_833129
ref: mol2,
SDF,
SMILES,
flexibase
2.93,9.12,-24.79,0,7,0, 274.232, 5
|  |
85346690
#99
| PBMR Labs Building Blocks: RBK_065691
Princeton BioMolecular Research: OSSL_833128
ref: mol2,
SDF,
SMILES,
flexibase
2.91,9.74,-25.33,0,7,0, 274.232, 5
|  |
85346687
#100
| PBMR Labs Building Blocks: RBK_065690
Princeton BioMolecular Research: OSSL_833127
ref: mol2,
SDF,
SMILES,
flexibase
4.05,9.53,-14.41,0,4,0, 277.707, 4
|  |
Old detail retrieval took 1 seconds.
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 = 652 ) limit 0,100
