home← all results complex #4847

Complex #4847 — Ir(3) [5]

GT: {"O": 1} → Top-1: {"O": 2}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
2
Candidates
{"O": 1}
Ground Truth
{"O": 2}
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 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#1 TOP-1 0.70 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1[N]1=NN=[N](->[Ru+2]<-1)[C@H]1[C@H](OC(C)=O)O[C...
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#2 0.68 ± 0.00
C[C]12[C]3(C)[C]4(C)[C]5(C)[C]1(C)[Ru+]2345
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#3 0.26 ± 0.00
Cc1[c-](C)[c]2(C)->[Ru+]3<-[c]1(C)[c]->32C
#4 0.05 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1N=N/N=N/[C@H]1[C@H](OC(C)=[O]->[Ru+2])O[C@H](CF...
#4 0.05 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1N=N/N=N/[C@H]1[C@H](OC(C)=[O]->[Ru+2])O[C@H](CF...
#4 0.05 ± 0.00
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1N=N/N=N/[C@H]1[C@H](OC(C)=[O]->[Ru+2])O[C@H](CF...