2
Candidates
{"N": 6}
Ground Truth
{"N": 7}
Top-1 Prediction
0.857
Match Score
⚠ 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
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.06 ± 0.00
O=C(CCCCC1SCC2NC(=O)NC21)NCCCOc1ccc(-c2cc(-c3ccccn3)[n]3->[Ru+2]<-[n]4ccccc4-c3c2)cc1
#1
TOP-1
0.98 ± 0.02
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3cc4-c5cccc[n]5->[Ru+2]5<-[n]6ccccc6-c(c3)[n]->54)cc1)c1c(C)cc(C)n1[B-]2...
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.00 ± 0.00
CC1=[N+]2C3=C(c4ccc(-c5cc(-c6ccccn6)nc(-c6cccc[n]6->[Ru+2]6[CH]1[C]36C)c5)cc4)c1c(C)cc(C)n1[B-]2(F)F
#2
0.16 ± 0.11
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3cc(-c4ccccn4)[n]4->[Ru+2]<-[n]5ccccc5-c4c3)cc1)c1c(C)cc(C)n1[B-]2(F)F
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
O=C(CCCCC1C2NC(=O)[NH]3->[Ru+2]<-[S]1CC23)NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1
#3
0.00 ± 0.00
CC1=[N+]2C(=C(c3ccc(-c4cc(-c5ccccn5)nc(-c5ccccn5)c4)cc3)c3c(C)cc(C)n3[B-]2(F)F)[C]2(C)[Ru+2][CH]12