home← all results complex #443

Complex #443 — Ru(2) [6 a]

GT: {"N": 1, "O": 5} → Top-1: {"P": 1}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
22
Candidates
{"N": 1, "O": 5}
Ground Truth
{"P": 1}
Top-1 Prediction
0.000
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN1C3)C2
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#3 0.41 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.29 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#5 0.16 ± 0.00
[Ru+2]<-[N]12CN3CN(C1)P(C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#6 0.08 ± 0.00
O=C([O-])C(=O)[O][Ru+]<-[P]12CN3CN(CN1C3)C2
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#7 0.08 ± 0.00
CNC(=O)CC[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#8 0.07 ± 0.00
CNC(=O)CCc1ccc(C)[cH]2->[Ru+2]<-[cH]12
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#9 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#10 0.01 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+][O]C(=O)C(=O)[O-]
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N]1(CP2C3)C4
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#13 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+2])cc1
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#14 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#15 0.00 ± 0.00
Cc1ccc(CCC(=O)[NH](C)->[Ru+][O]C(=O)C(=O)[O-])cc1
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#16 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#17 0.00 ± 0.00
CNC(=O)CCc1ccc(C)c[cH]1->[Ru+2]
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#18 0.00 ± 0.00
CNC(=O)CCc1ccc(C)[cH](->[Ru+2])c1
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#19 0.00 ± 0.00
CNC(CCc1ccc(C)cc1)=[O]->[Ru+2]<-[O]=C([O-])C(=O)[O-]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#20 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#21 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]