13
Candidates
{"N": 6, "S": 1}
Ground Truth
{"S": 2}
Top-1 Prediction
0.210
Match Score
#1
TOP-1
0.21 ± 0.20
C[C@@H]1CC[C@]2(C(=O)N3CCN(C4[S][Ru+]<-[S]=4)CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]...
#2
0.02 ± 0.01
C[C@@H]1CC[C@]2(C(=O)N3CCN(C(=S)[S][Ru+])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)...
#3
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)N3CCN(C4=[S]->[Ru+2]<-[SH-]4)CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5C...
#4
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)N3CCN(C(=S)[SH-]->[Ru+2])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@...
#5
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)N3CCN(C(=S)[S-])CC3)CC[C@]3(C)[C]4([Ru+2][CH]4CC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC...
#6
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)N3CC[N](->[Ru+2])(C(=S)[S-])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC...
#7
0.00 ± 0.00
C[C@@H]1CC[C@@]23C(=[O]->[Ru+2]<-[OH][C@H]4CC[C@@]5(C)C(CC[C@]6(C)C5CC=C(C2[C@H]1C)[C@@]6(C)CC3)C4(C...
#8
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=[O]->[Ru+2])N3CCN(C(=S)[S-])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C...
#9
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)[N]34->[Ru+2]<-[N](C(=S)[S-])(CC3)CC4)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(...
#10
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)N3CCN(C(=S)[S-])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H]([OH]->[Ru+2])C(C)(C)C5CC[...
#11
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)N3CCN(C([S-])=[S]->[Ru+2])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C...
#12
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)N3CCN(C(=S)[S-])CC3)CC[C@]3(C)C(=[CH](->[Ru+2])CC4[C@@]5(C)CC[C@H](O)C(C)(C)C5C...
#13
0.00 ± 0.00
C[C@@H]1CC[C@]2(C(=O)[N]3(->[Ru+2])CCN(C(=S)[S-])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC...