Datasets:
lhallee
/
LD50_selfies_log

Dataset card Viewer Files Community
labels
float64
-1.23
2.32
seqs
stringlengths
6
382
0.208639
[C][C][C][C][O][C][C][C][#N]
0.371564
[C][C][C][C][O][C][C][C][=Branch1][C][=O][O]
0.219136
[C][C][C][C][O][C][C][C][C]
0.29788
[C][C][C][C][O][C][C][C][O]
0.875469
[C][C][C][C][O][C][C][O]
0.352767
[C][=C][C][=Branch1][C][=O][O][C][C][O][C][C][C][C]
0.950499
[C][C][C][C][O][C][C][O][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
0.601032
[C][C][C][C][O][C][C][O][C][Branch1][C][C][=O]
0.511625
[C][=C][O][C][C][O][C][C][C][C]
0.538246
[C][C][C][C][O][C][C][O][C][C]
0.497132
[C][C][C][C][O][C][C][O][C][C][Branch1][C][C][O]
0.547543
[C][C][C][C][O][C][C][O][C][C][C][C]
0.427227
[C][C][C][C][O][C][C][O][C][C][C][O]
0.37638
[C][C][C][C][O][C][C][O][C][C][O]
0.513422
[C][C][C][C][O][C][C][O][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][O][C][C][O][C][C][C][C]
0.55446
[C][C][C][C][O][C][C][O][C][C][O][C][C][=C][C][=C][Branch1][Branch2][C][=C][Ring1][=Branch1][C][C][C][O][C][O][Ring1][#Branch2]
0.558472
[C][C][C][C][O][C][C][O][C][C][O][C][C][C][C]
0.396088
[C][C][C][C][O][C][C][O][C][C][O][C][C][O]
0.514618
[C][C][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][C][C]
1.210154
[C][C][C][C][O][C][C][O][C][C][S][C][#N]
0.75283
[C][C][C][C][O][C][C][O][P][=Branch1][C][=O][Branch1][=Branch2][O][C][C][O][C][C][C][C][O][C][C][O][C][C][C][C]
0.812263
[C][C][C][C][O][C][N][Branch1][#Branch1][C][=Branch1][C][=O][C][Cl][C][=C][Branch1][Ring1][C][C][C][=C][C][=C][Ring1][Branch2][C][C]
1.129465
[C][C][C][C][O][N][=O]
1.336579
[C][C][C][C][O][P][=Branch1][C][=O][Branch1][=Branch1][O][C][C][C][C][O][C][=C][C][=C][C][Branch1][C][C][=C][Branch1][C][Cl][C][=Branch1][C][=O][O][C][Ring1][=Branch2][=C][Ring1][=N]
0.754242
[C][C][C][C][O][P][=Branch1][C][=O][Branch1][=Branch1][O][C][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
0.666803
[C][C][C][C][O][P][=Branch1][C][=O][Branch1][=Branch1][O][C][C][C][C][O][C][C][C][C]
0.933738
[C][C][C][C][O][P][=Branch1][C][=O][Branch1][Ring2][S][C][C][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
0.652846
[C][C][C][C][O][P][Branch1][=Branch1][O][C][C][C][C][O][C][C][C][C]
0.576051
[C][C][C][C][S]
1.219354
[C][C][C][C][S][C][=Branch1][C][=O][O][C][=C][Branch1][#Branch1][C][Branch1][C][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=N][N+1][=Branch1][C][=O][O-1]
0.681075
[C][C][C][C][S][C][=C][C][=C][Branch2][Ring1][Ring2][C][Branch1][=Branch2][S][C][C][N][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring1]
0.598287
[C][C][C][C][S][C][C][C][C]
0.561329
[C][=C][O][C][C][S][C][C][C][C]
1.109552
[C][C][C][C][S][P][=Branch1][C][=O][Branch1][=Branch1][N][Branch1][C][C][C][N][Branch1][C][C][C]
1.200567
[C][C][C][C][S][P][=Branch1][C][=O][Branch1][=Branch1][S][C][C][C][C][S][C][C][C][C]
0.92267
[C][C][C][C][S][P][Branch1][=Branch1][S][C][C][C][C][S][C][C][C][C]
0.995102
[C][C][C][C][S][S][C][Branch1][C][Cl][C][Branch1][C][Cl][Cl]
0.829425
[C][C][C][N+1][=Branch1][C][=O][O-1]
0.201307
[C][C][C][N][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][C][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1]
0.83941
[C][C][C][N][Branch1][Ring2][C][C][C][C][=Branch1][C][=O][S][C][C]
0.638163
[C][C][C][N][Branch1][Ring2][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Branch1][C][C][C][=C][Ring1][#Branch2][N+1][=Branch1][C][=O][O-1]
0.961264
[C][C][C][N][Branch1][Ring2][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Branch1][=Branch1][C][Branch1][C][C][=O][C][=C][Ring1][N][N+1][=Branch1][C][=O][O-1]
0.582774
[C][C][C][N][Branch1][Ring2][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][N][N+1][=Branch1][C][=O][O-1]
0.431782
[C][C][C][N][Branch1][Ring2][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][=N][N+1][=Branch1][C][=O][O-1]
1.193619
[C][C][C][N][Branch1][Ring2][C][C][C][C][C][C]
0.889125
[C][C][C][N][Branch1][Ring2][C][C][C][N][=O]
0.811375
[C][C][C][N][Branch1][Ring2][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2]
0.859085
[C][C][C][N][Branch1][Ring2][C][C][Cl][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][=N][N+1][=Branch1][C][=O][O-1]
0.890357
[C][C][C][N][Branch1][Ring1][N][=O][C][Branch1][C][N][=O]
0.921477
[C][C][C][N][C][=N][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][C][C][C][Branch1][C][C][=O][C][=Branch1][C][=O][N][Ring1][#C][C]
0.962793
[C][C][C][N][C][=Branch1][C][=N][C][Branch1][Ring2][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
0.746688
[C][C][C][N][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
1.235762
[C][C][C][N][=C][Branch1][Branch1][N][C][C][C][C][Branch1][Ring2][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
0.851005
[C][C][C][N][C][C][C]
0.410121
[C][C][C][O]
0.695644
[C][C][C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][=Branch2]
1.091252
[C][C][C][O][C][=Branch1][C][=O][C][C][Branch1][N][S][P][=Branch1][C][=O][Branch1][Ring1][O][C][O][C][C][=Branch1][C][=O][O][C][C][C]
0.574364
[C][C][C][O][C][=Branch1][C][=O][C][C][Branch1][N][S][P][=Branch1][C][=S][Branch1][Ring1][O][C][O][C][C][=Branch1][C][=O][O][C][C][C]
0.986936
[C][C][C][O][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][=C][O][C][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][C][Branch1][Ring1][O][C][=C][Ring1][P]
-0.064005
[C][C][C][O][C][=Branch1][C][=O][C][C][C]
0.198031
[C][C][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C]
0.401457
[C][C][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][C][C]
0.705076
[C][C][C][O][C][=Branch1][C][=O][N][C][=C][C][=C][O][Ring1][Branch1]
0.578297
[C][C][C][O][C][=Branch1][C][=O][O][O][C][=Branch1][C][=O][O][C][C][C]
0.036332
[C][C][C][O][C][Branch1][C][C][=O]
0.296394
[C][C][C][O][C][=O]
0.42396
[C][C][C][O][C][C][O]
0.925845
[C][C][C][O][C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][C][Branch1][C][C][=C][Branch1][N][C][=Branch1][C][=O][O][C][C][O][C][C][C][C][Ring1][P][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2]
0.173113
[C][C][C][O][C][C][O][C][Branch1][C][C][=O]
1.036027
[C][#C][C][O][P][=Branch1][C][=O][Branch1][Branch1][O][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
1.300464
[C][C][C][O][P][=Branch1][C][=O][Branch1][Branch1][O][C][C][C][O][C][=C][C][=C][C][Branch1][C][C][=C][Branch1][C][Cl][C][=Branch1][C][=O][O][C][Ring1][=Branch2][=C][Ring1][=N]
1.405116
[C][C][C][O][P][=Branch1][C][=O][Branch1][Branch2][O][C][=C][Branch1][C][Cl][Cl][O][C][C][Cl]
1.443383
[C][C][C][O][P][=Branch1][C][=S][Branch1][Ring1][C][C][S][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O]
1.296917
[C][C][C][O][P][=Branch1][C][=S][Branch1][Ring1][C][C][S][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
1.279822
[C][C][C][O][P][=Branch1][C][=S][Branch1][Ring1][C][Cl][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
1.276479
[C][C][C][O][P][=Branch1][C][=S][Branch1][Ring1][O][C][S][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O]
1.277874
[C][C][C][O][P][=Branch1][C][=S][Branch1][Ring2][O][C][C][S][C][=N][C][Branch1][C][C][=C][C][Branch1][C][C][=N][Ring1][Branch2]
1.34989
[C][C][C][O][P][=Branch1][C][=S][Branch1][Ring2][O][C][C][S][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O]
1.342342
[C][C][C][O][P][=Branch1][C][=S][Branch1][Branch1][O][C][C][C][O][C][=C][C][=C][Branch1][=Branch1][S+1][Branch1][C][C][O-1][C][=C][Ring1][=Branch2]
1.073294
[C][C][C][O][P][=Branch1][C][=S][Branch1][Branch1][O][C][C][C][O][P][=Branch1][C][=S][Branch1][Branch1][O][C][C][C][O][C][C][C]
1.111199
[C][C][C][O][P][=Branch1][C][=S][Branch1][Branch1][O][C][C][C][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C]
1.60201
[C][C][C][O][P][Branch1][C][C][=Branch1][C][=S][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]
0.598837
[C][C][C][P][=Branch1][C][=O][Branch1][C][O][O][C][C]
0.487966
[C][C][C][S]
1.12493
[C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C]
0.883354
[C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=N][C][Branch1][C][Cl][=C][Ring1][Branch2][Cl]
0.801553
[C][C][C][S][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][C][C][C][C]
1.018125
[C][C][C][S][C][=Branch1][C][=O][O][C][=C][Branch1][#Branch1][C][Branch1][C][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=N][N+1][=Branch1][C][=O][O-1]
0.714909
[C][C][C][S][C][=C][C][=C][NH1][C][Branch1][Branch2][N][C][=Branch1][C][=O][O][C][=N][C][Ring1][#Branch2][=C][Ring1][=C]
1.607636
[C][C][C][S][C][S][P][=Branch1][C][=S][Branch1][Ring2][O][C][C][O][C][C]
1.509839
[C][C][C][S][P][=Branch1][C][=O][Branch1][Ring1][O][C][S][C][C][C]
1.104926
[C][C][C][S][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Cl]
1.181727
[C][C][C][S][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][O][C][=C][Branch1][C][Cl][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][Cl]
1.102604
[C][C][C][S][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
1.348852
[C][C][C][S][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][S][C][C][C]
1.431268
[C][C][C][S][P][=Branch1][C][=S][Branch1][Ring1][O][C][S][C][C][C]
0.953972
[C][C][C][S][P][=Branch1][C][=S][Branch1][Ring2][O][C][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]
1.307251
[C][C][C][S][P][=Branch1][C][=S][Branch1][Ring2][O][C][C][O][C][=C][C][=C][Branch1][Ring1][S][C][C][=C][Ring1][Branch2]
1.624721
[C][C][C][S][P][Branch1][C][C][=Branch1][C][=O][S][C][C][C]
1.178039
[C][C][C][S][P][Branch1][C][C][=Branch1][C][=S][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl]