home← all results complex #114

Complex #114 — Ru(2) [5]

GT: {"O": 1, "N": 2} → Top-1: {"O": 1, "N": 1, "S": 1}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
2
Candidates
{"O": 1, "N": 2}
Ground Truth
{"O": 1, "N": 1, "S": 1}
Top-1 Prediction
0.000
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
⚠ Per-candidate scores unavailable for sequential. Showing 30 candidates from single-ligand scoring. For sequential results only top-1 prediction is stored.
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.97 ± 0.00
C(/c1cccs1)=[N]1/N=C([O][Ru+]<-1)c1ccccc1
#1 TOP-1 0.35 ± 0.20
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#1 TOP-1 0.15 ± 0.33
CC(C)[c]12->[Ru+]3456([O]/C(=N\N=C/c7cccs7)c7ccccc7)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.00 ± 0.00
[Ru+2]<-[O-]/C(=N\N=C/c1cccs1)c1ccccc1
#2 0.11 ± 0.13
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#2 0.01 ± 0.03
CC(C)[c]12->[Ru+]34567([O]C(=N/[N]->3=C\c3cccs3)c3ccccc3)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->72
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#3 0.00 ± 0.00
[O-]/C(=N\N=C/c1cccs1)[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62