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9915115
 
#1

Life Chemicals (Virtual): F2815-0557
PubChem: 41274560
ref: mol2, SDF, SMILES, flexibase
-0.54,-6.16,-31.26,1,9,0, 397.384, 7
9915065
 
#2

Life Chemicals (Virtual): F2815-0498
PubChem: 41274559
ref: mol2, SDF, SMILES, flexibase
3.90,-4.06,-21.72,1,5,0, 426.922, 6
9915062
 
#3

Life Chemicals (Virtual): F2815-0497
PubChem: 41274558
ref: mol2, SDF, SMILES, flexibase
3.67,-3.5,-27.15,1,5,0, 406.504, 6
9915060
 
#4

Life Chemicals (Virtual): F2815-0495
PubChem: 41274557
ref: mol2, SDF, SMILES, flexibase
3.67,-3.45,-26.65,1,5,0, 406.504, 6
9915058
 
#5

Life Chemicals (Virtual): F2815-0493
PubChem: 41274556
ref: mol2, SDF, SMILES, flexibase
4.13,-4.43,-26.25,1,5,0, 447.34, 6
9915056
 
#6

Life Chemicals (Virtual): F2815-0492
PubChem: 41274555
ref: mol2, SDF, SMILES, flexibase
3.90,-4.07,-21.69,1,5,0, 426.922, 6
9915033
 
#7

Life Chemicals (Virtual): F2815-0475
PubChem: 41274551
ref: mol2, SDF, SMILES, flexibase
3.10,-2.68,-27.46,1,5,0, 414.43, 6
9915030
 
#8

Life Chemicals (Virtual): F2815-0473
PubChem: 41274549
ref: mol2, SDF, SMILES, flexibase
2.31,-5.39,-28.28,1,7,0, 389.408, 7

Similar to: 12515449,
9915028
 
#9

Life Chemicals (Virtual): F2815-0472
PubChem: 41274548
ref: mol2, SDF, SMILES, flexibase
2.99,-5.54,-26.96,1,7,0, 423.853, 7
9915027
 
#10

Life Chemicals (Virtual): F2815-0470
PubChem: 41274547
ref: mol2, SDF, SMILES, flexibase
2.35,-5.35,-29.57,1,9,0, 449.46, 9
9915025
 
#11

Life Chemicals (Virtual): F2815-0469
PubChem: 41274546
ref: mol2, SDF, SMILES, flexibase
2.35,-4.99,-31.61,1,9,0, 449.46, 9
9915023
 
#12

Life Chemicals (Virtual): F2815-0468
PubChem: 41274545
ref: mol2, SDF, SMILES, flexibase
2.37,-5.37,-28.66,1,8,0, 419.434, 8
9915020
 
#13

Life Chemicals (Virtual): F2815-0467
PubChem: 16823733
ref: mol2, SDF, SMILES, flexibase
2.34,-5.37,-30.45,1,8,0, 419.434, 8
9915017
 
#14

Life Chemicals (Virtual): F2815-0466
PubChem: 41274542
ref: mol2, SDF, SMILES, flexibase
2.32,-5.02,-31.45,1,8,0, 419.434, 8
9915014
 
#15

Life Chemicals (Virtual): F2815-0465
PubChem: 41274541
ref: mol2, SDF, SMILES, flexibase
2.47,-4.66,-27.24,1,7,0, 407.398, 7
9915010
 
#16

Life Chemicals (Virtual): F2815-0464
PubChem: 41274539
ref: mol2, SDF, SMILES, flexibase
2.94,-5.14,-30.24,1,7,0, 423.853, 7
9915007
 
#17

Life Chemicals (Virtual): F2815-0463
PubChem: 41274538
ref: mol2, SDF, SMILES, flexibase
1.67,-4.06,-23.61,2,8,0, 442.49, 9

Similar to: 9915004,
9915002
 
#18

Life Chemicals (Virtual): F2815-0459
PubChem: 41274536
ref: mol2, SDF, SMILES, flexibase
2.24,-2.11,-18.21,1,6,0, 399.465, 9
9914997
 
#19

Life Chemicals (Virtual): F2815-0457
PubChem: 41274534
ref: mol2, SDF, SMILES, flexibase
1.86,-2.08,-18.44,1,6,0, 385.438, 8
9914993
 
#20

Life Chemicals (Virtual): F2815-0454
PubChem: 41274533
ref: mol2, SDF, SMILES, flexibase
3.14,-1.93,-20.03,1,4,0, 349.427, 6
9914991
 
#21

Life Chemicals (Virtual): F2815-0450
PubChem: 41274532
ref: mol2, SDF, SMILES, flexibase
2.48,-2.05,-20.58,1,4,0, 339.363, 6
9914989
 
#22

Life Chemicals (Virtual): F2815-0449
PubChem: 41274531
ref: mol2, SDF, SMILES, flexibase
3.14,-2.16,-20.04,1,4,0, 349.427, 6

Similar to: 9914949,
1930581
 
#23

Scientific Exchange (make on demand): X-023859
Innovapharm Make-on-Demand: VT-00379653
Life Chemicals (Virtual): F2590-0780
ChemDB: 6392522
PubChem: 1656865...6 total

ref: mol2, SDF, SMILES, flexibase
3.03,2.66,-15.96,1,8,0, 359.363, 6

Similar to: 6254216, 6254262,
9914984
 
#24

Life Chemicals (Virtual): F2815-0446
PubChem: 41274528
ref: mol2, SDF, SMILES, flexibase
4.02,-2.62,-27.66,1,6,0, 451.475, 6
9914982
 
#25

Life Chemicals (Virtual): F2815-0444
PubChem: 41274527
ref: mol2, SDF, SMILES, flexibase
2.26,-2.15,-21.34,1,8,0, 396.396, 8
9914980
 
#26

Life Chemicals (Virtual): F2815-0441
PubChem: 41274526
ref: mol2, SDF, SMILES, flexibase
3.60,-2.81,-21.79,1,4,0, 397.471, 6
9914977
 
#27

Life Chemicals (Virtual): F2815-0440
PubChem: 41274524
ref: mol2, SDF, SMILES, flexibase
2.19,-2.41,-28.82,1,5,0, 363.41, 7
9914974
 
#28

Life Chemicals (Virtual): F2815-0439
PubChem: 41274522
ref: mol2, SDF, SMILES, flexibase
2.21,-2.43,-22.65,1,5,0, 363.41, 7
9914971
 
#29

Life Chemicals (Virtual): F2815-0437
PubChem: 41274521
ref: mol2, SDF, SMILES, flexibase
3.60,-2.92,-18.23,1,4,0, 390.263, 6
9914969
 
#30

Life Chemicals (Virtual): F2815-0436
PubChem: 41274518
ref: mol2, SDF, SMILES, flexibase
3.12,-2.02,-20.14,1,4,0, 349.427, 6
9914964
 
#31

Life Chemicals (Virtual): F2815-0432
PubChem: 41274514
ref: mol2, SDF, SMILES, flexibase
1.01,-9.04,-28.06,3,7,0, 400.453, 7
9914961
 
#32

Life Chemicals (Virtual): F2815-0431
PubChem: 41274513
ref: mol2, SDF, SMILES, flexibase
2.86,-1.7,-22.71,1,6,0, 393.436, 9
9914959
 
#33

Life Chemicals (Virtual): F2815-0430
PubChem: 41274512
ref: mol2, SDF, SMILES, flexibase
3.10,-3.55,-21.44,1,4,0, 400.269, 6
9914957
 
#34

Life Chemicals (Virtual): F2815-0429
PubChem: 41274511
ref: mol2, SDF, SMILES, flexibase
3.13,-3.55,-19.9,1,4,0, 400.269, 6
9914955
 
#35

Life Chemicals (Virtual): F2815-0426
PubChem: 41274510
ref: mol2, SDF, SMILES, flexibase
2.35,-2.77,-23.28,1,5,0, 351.399, 7
9914952
 
#36

Life Chemicals (Virtual): F2815-0425
PubChem: 41274508
ref: mol2, SDF, SMILES, flexibase
2.37,-2.78,-21.61,1,5,0, 351.399, 7
9914949
 
#37

Life Chemicals (Virtual): F2815-0424
PubChem: 41274506
ref: mol2, SDF, SMILES, flexibase
2.74,-2.48,-19.85,1,4,0, 335.4, 6

Similar to: 9914989,
9914946
 
#38

Life Chemicals (Virtual): F2815-0423
PubChem: 41274505
ref: mol2, SDF, SMILES, flexibase
2.76,-2.47,-19.97,1,4,0, 335.4, 6
9914943
 
#39

Life Chemicals (Virtual): F2815-0422
PubChem: 41274503
ref: mol2, SDF, SMILES, flexibase
2.57,-1.28,-17.38,1,4,0, 357.353, 6
9914939
 
#40

Life Chemicals (Virtual): F2815-0420
PubChem: 41274500
ref: mol2, SDF, SMILES, flexibase
2.99,-2.94,-19.91,1,4,0, 355.818, 6
9914936
 
#41

Life Chemicals (Virtual): F2815-0419
PubChem: 41274498
ref: mol2, SDF, SMILES, flexibase
2.97,-2.94,-21.58,1,4,0, 355.818, 6
9914934
 
#42

Life Chemicals (Virtual): F2815-0418
PubChem: 41274497
ref: mol2, SDF, SMILES, flexibase
2.32,-2.79,-19.92,1,4,0, 321.373, 6
9914930
 
#43

Life Chemicals (Virtual): F2815-0417
PubChem: 41274493
ref: mol2, SDF, SMILES, flexibase
3.67,-3.62,-23.48,1,5,0, 406.504, 6
9914928
 
#44

Life Chemicals (Virtual): F2815-0416
PubChem: 41274490
ref: mol2, SDF, SMILES, flexibase
3.40,-3.06,-26.74,1,7,0, 450.513, 9
9914926
 
#45

Life Chemicals (Virtual): F2815-0415
PubChem: 41274489
ref: mol2, SDF, SMILES, flexibase
3.02,-3.03,-27.04,1,7,0, 436.486, 8
9914924
 
#46

Life Chemicals (Virtual): F2815-0413
PubChem: 41274488
ref: mol2, SDF, SMILES, flexibase
3.36,-2.8,-52.46,3,6,1, 464.608, 6

Similar to: 36633064,
9914919
 
#47

Life Chemicals (Virtual): F2815-0409
PubChem: 41274486
ref: mol2, SDF, SMILES, flexibase
2.24,-2.62,-22.88,1,8,0, 479.555, 8
9914917
 
#48

Life Chemicals (Virtual): F2815-0408
PubChem: 41274485
ref: mol2, SDF, SMILES, flexibase
2.70,-2.96,-24,1,9,0, 526.608, 11
9914914
 
#49

Life Chemicals (Virtual): F2815-0407
PubChem: 41274484
ref: mol2, SDF, SMILES, flexibase
2.32,-2.93,-24.2,1,9,0, 512.581, 10
9914912
 
#50

Life Chemicals (Virtual): F2815-0406
PubChem: 16823732
ref: mol2, SDF, SMILES, flexibase
1.31,-6.96,-25.41,3,9,0, 497.57, 9
9914910
 
#51

Life Chemicals (Virtual): F2815-0404
PubChem: 41274483
ref: mol2, SDF, SMILES, flexibase
1.23,-3.34,-26.55,1,8,0, 482.555, 8
9914908
 
#52

Life Chemicals (Virtual): F2815-0403
PubChem: 41274482
ref: mol2, SDF, SMILES, flexibase
1.61,-3.37,-26.35,1,8,0, 496.582, 9
9914904
 
#53

Life Chemicals (Virtual): F2815-0400
PubChem: 41274480
ref: mol2, SDF, SMILES, flexibase
3.70,-3.57,-23.08,1,6,0, 462.568, 9

Similar to: 39709726,
9914902
 
#54

Life Chemicals (Virtual): F2815-0399
PubChem: 41274479
ref: mol2, SDF, SMILES, flexibase
3.32,-3.58,-23.23,1,6,0, 448.541, 8

Similar to: 39709726,
9914900
 
#55

Life Chemicals (Virtual): F2815-0398
PubChem: 41274478
ref: mol2, SDF, SMILES, flexibase
3.13,-4.27,-27.43,1,7,0, 417.462, 7
9914896
 
#56

Life Chemicals (Virtual): F2815-0396
PubChem: 41274476
ref: mol2, SDF, SMILES, flexibase
1.81,-5.42,-23.28,2,7,0, 390.392, 6
9914894
 
#57

Life Chemicals (Virtual): F2815-0394
PubChem: 41274475
ref: mol2, SDF, SMILES, flexibase
1.54,-3.14,-19.92,1,7,0, 404.419, 6
9914893
 
#58

Life Chemicals (Virtual): F2815-0393
PubChem: 41274474
ref: mol2, SDF, SMILES, flexibase
3.06,-1.06,-25.14,1,7,0, 470.569, 10
9914891
 
#59

Life Chemicals (Virtual): F2815-0392
PubChem: 41274473
ref: mol2, SDF, SMILES, flexibase
5.00,-2.8,-23.18,1,5,0, 494.613, 9

Similar to: 9914709, 9914746,
9914888
 
#60

Life Chemicals (Virtual): F2815-0390
PubChem: 41274472
ref: mol2, SDF, SMILES, flexibase
3.13,-4.27,-27.38,1,7,0, 417.462, 7
9914885
 
#61

Life Chemicals (Virtual): F2815-0389
PubChem: 41274471
ref: mol2, SDF, SMILES, flexibase
3.59,-5.29,-27.75,1,7,0, 458.298, 7
9914882
 
#62

Life Chemicals (Virtual): F2815-0386
PubChem: 41274469
ref: mol2, SDF, SMILES, flexibase
4.23,-3.59,-22.11,1,5,0, 458.58, 7
9914875
 
#63

Life Chemicals (Virtual): F2815-0383
PubChem: 41274466
ref: mol2, SDF, SMILES, flexibase
3.01,-6.03,-23.38,0,6,0, 447.557, 6
9914871
 
#64

Life Chemicals (Virtual): F2815-0380
PubChem: 41274465
ref: mol2, SDF, SMILES, flexibase
3.08,-3.02,-24.67,1,7,0, 464.54, 9
9914870
 
#65

Life Chemicals (Virtual): F2815-0379
PubChem: 41274464
ref: mol2, SDF, SMILES, flexibase
3.12,-6.15,-26.84,1,7,0, 468.304, 7
9914868
 
#66

Life Chemicals (Virtual): F2815-0378
PubChem: 41274463
ref: mol2, SDF, SMILES, flexibase
3.54,-2.64,-21.03,1,6,0, 453.557, 8
9914866
 
#67

Life Chemicals (Virtual): F2815-0377
PubChem: 41274462
ref: mol2, SDF, SMILES, flexibase
2.52,-2.69,-21.86,1,6,0, 425.503, 8
9914865
 
#68

Life Chemicals (Virtual): F2815-0376
PubChem: 44009874
ref: mol2, SDF, SMILES, flexibase
3.51,-2.33,-20.97,1,6,0, 453.557, 8

Similar to: 9914863,
9914863
 
#69

Life Chemicals (Virtual): F2815-0376
PubChem: 44009874
ref: mol2, SDF, SMILES, flexibase
3.51,-2.33,-20.95,1,6,0, 453.557, 8

Similar to: 9914865,
9914861
 
#70

Life Chemicals (Virtual): F2815-0375
PubChem: 41274459
ref: mol2, SDF, SMILES, flexibase
3.04,-2.7,-21.32,1,6,0, 439.53, 8
9914860
 
#71

Life Chemicals (Virtual): F2815-0374
PubChem: 41274458
ref: mol2, SDF, SMILES, flexibase
4.33,-3.29,-21.47,1,5,0, 473.378, 7
9914857
 
#72

Life Chemicals (Virtual): F2815-0373
PubChem: 41274457
ref: mol2, SDF, SMILES, flexibase
2.92,-2.4,-24.17,1,6,0, 413.492, 9
9914853
 
#73

Life Chemicals (Virtual): F2815-0369
PubChem: 41274455
ref: mol2, SDF, SMILES, flexibase
3.92,-2.67,-20.73,1,6,0, 467.584, 9
9914845
 
#74

Life Chemicals (Virtual): F2815-0361
PubChem: 41274451
ref: mol2, SDF, SMILES, flexibase
3.98,-6.37,-26.68,1,6,0, 481.621, 7
9914843
 
#75

Life Chemicals (Virtual): F2815-0359
PubChem: 41274449
ref: mol2, SDF, SMILES, flexibase
3.89,-2.09,-19.09,1,6,0, 461.536, 9
9914840
 
#76

Life Chemicals (Virtual): F2815-0358
PubChem: 41274447
ref: mol2, SDF, SMILES, flexibase
4.00,-4.56,-29.13,1,6,0, 438.48, 7
9914835
 
#77

Life Chemicals (Virtual): F2815-0353
PubChem: 41274445
ref: mol2, SDF, SMILES, flexibase
3.21,-2.37,-24.89,1,7,0, 462.524, 9
9914833
 
#78

Life Chemicals (Virtual): F2815-0349
PubChem: 41274444
ref: mol2, SDF, SMILES, flexibase
3.08,7.02,-24.99,1,7,0, 464.54, 9
9914831
 
#79

Life Chemicals (Virtual): F2815-0348
PubChem: 41274443
ref: mol2, SDF, SMILES, flexibase
3.03,-3.16,-18.15,0,7,0, 428.507, 8
9914829
 
#80

Life Chemicals (Virtual): F2815-0347
PubChem: 41274442
ref: mol2, SDF, SMILES, flexibase
3.07,-4.63,-29.56,1,10,0, 521.567, 13
9914826
 
#81

Life Chemicals (Virtual): F2815-0343
PubChem: 41274439
ref: mol2, SDF, SMILES, flexibase
2.83,-2.03,-21.16,1,6,0, 427.519, 9
9914824
 
#82

Life Chemicals (Virtual): F2815-0341
PubChem: 41274438
ref: mol2, SDF, SMILES, flexibase
4.27,-2.11,-18.8,1,6,0, 475.563, 10
9914821
 
#83

Life Chemicals (Virtual): F2815-0340
PubChem: 41274436
ref: mol2, SDF, SMILES, flexibase
3.06,-1.42,-22.74,1,8,0, 485.555, 12
9914818
 
#84

Life Chemicals (Virtual): F2815-0338
PubChem: 41274434
ref: mol2, SDF, SMILES, flexibase
2.46,-7.28,-31.27,1,10,0, 513.55, 9
9914805
 
#85

Life Chemicals (Virtual): F2815-0334
PubChem: 41274425
ref: mol2, SDF, SMILES, flexibase
5.56,-4.42,-21.87,1,5,0, 514.669, 7

Similar to: 36717812, 36717973,
9914804
 
#86

Life Chemicals (Virtual): F2815-0330
PubChem: 41274424
ref: mol2, SDF, SMILES, flexibase
2.89,-2.72,-21.54,1,6,0, 439.53, 9
9914801
 
#87

Life Chemicals (Virtual): F2815-0329
PubChem: 41274422
ref: mol2, SDF, SMILES, flexibase
1.88,-3.24,-23.51,1,7,0, 404.419, 6
9914797
 
#88

Life Chemicals (Virtual): F2815-0326
PubChem: 41274419
ref: mol2, SDF, SMILES, flexibase
3.41,-2.73,-21.02,1,6,0, 453.557, 9
9914794
 
#89

Life Chemicals (Virtual): F2815-0325
PubChem: 44009871
ref: mol2, SDF, SMILES, flexibase
3.89,-2.36,-20.62,1,6,0, 467.584, 9

Similar to: 9914792,
9914792
 
#90

Life Chemicals (Virtual): F2815-0325
PubChem: 44009871
ref: mol2, SDF, SMILES, flexibase
3.89,-2.36,-20.66,1,6,0, 467.584, 9

Similar to: 9914794,
9914786
 
#91

Life Chemicals (Virtual): F2815-0320
PubChem: 41274411
ref: mol2, SDF, SMILES, flexibase
5.01,-2.26,-19.2,1,5,0, 494.371, 8

Similar to: 36717806,
9914784
 
#92

Life Chemicals (Virtual): F2815-0319
PubChem: 41274410
ref: mol2, SDF, SMILES, flexibase
4.38,-2.15,-18.64,1,5,0, 459.926, 8
9914782
 
#93

Life Chemicals (Virtual): F2815-0316
PubChem: 41274408
ref: mol2, SDF, SMILES, flexibase
4.51,-2.76,-18.69,1,5,0, 504.377, 8

Similar to: 36717245, 36717804, 36717967,
9914780
 
#94

Life Chemicals (Virtual): F2815-0315
PubChem: 41274407
ref: mol2, SDF, SMILES, flexibase
3.52,-2.71,-27.83,1,6,0, 440.496, 7
9914777
 
#95

Life Chemicals (Virtual): F2815-0314
PubChem: 41274406
ref: mol2, SDF, SMILES, flexibase
4.00,-2.19,-19.87,1,6,0, 451.475, 6
9914774
 
#96

Life Chemicals (Virtual): F2815-0313
PubChem: 41274404
ref: mol2, SDF, SMILES, flexibase
4.80,-2.84,-23.2,1,6,0, 496.585, 9
9914772
 
#97

Life Chemicals (Virtual): F2815-0312
PubChem: 41274402
ref: mol2, SDF, SMILES, flexibase
1.82,-3.15,-22.56,1,7,0, 400.453, 9
9914771
 
#98

Life Chemicals (Virtual): F2815-0310
PubChem: 41274401
ref: mol2, SDF, SMILES, flexibase
3.49,-3.04,-24.32,1,7,0, 476.551, 10
9914769
 
#99

Life Chemicals (Virtual): F2815-0309
PubChem: 41274399
ref: mol2, SDF, SMILES, flexibase
4.33,-3.76,-21.16,1,5,0, 473.378, 7
9914764
 
#100

Life Chemicals (Virtual): F2815-0307
PubChem: 41274396
ref: mol2, SDF, SMILES, flexibase
2.04,-3.11,-22.6,1,7,0, 414.48, 9

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 = 27 ) limit 0,100

Smiles were