home← all results complex #57

Complex #57 — Ru(2) [3]

GT: {"O": 6, "N": 2} → Top-1: {"S": 2}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
17
Candidates
{"O": 6, "N": 2}
Ground Truth
{"S": 2}
Top-1 Prediction
0.000
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#2 0.98 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#3 0.62 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#4 0.18 ± 0.00
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#5 0.09 ± 0.00
Cc1n2CC[OH]->[Ru+2]<-[n]1cc2[N+](=O)[O-]
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#6 0.03 ± 0.00
Cc1n(CCO)c2[N+](=O)[O][Ru+]<-[n]1c2
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#7 0.01 ± 0.00
Cc1n(CCO)c([N+](=O)[O-])c[n]1->[Ru+]1[O][N+](=O)c2c[n]->1c(C)n2CCO
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#8 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#9 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#10 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+])n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#11 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru+]<-[n]2cc([N+](=O)[O-])n(CCO)c2C)n1CCO
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#12 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]<-[n]1cc([N+](=O)[O-])n(CCO)c1C
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#13 0.00 ± 0.00
Cc1ncc([N+](=O)[O-])n1CC[OH]->[Ru+2]
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#14 0.00 ± 0.00
Cc1ncc([N+](=O)[O-]->[Ru+2])n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#15 0.00 ± 0.00
Cc1ncc([N+]2[O][Ru+]<-[O]=2)n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#16 0.00 ± 0.00
Cc1ncc([N+]([O-])=[O]->[Ru+2])n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO
#17 0.00 ± 0.00
Cc1ncc([N+](=O)[O][Ru][O][N+](=O)c2cnc(C)n2CCO)n1CCO