home← all results complex #719

Complex #719 — Ru(2) [[RuCl2(3,3’-dcbpy) (DMSO)2]]

GT: {"O": 6} → Top-1: {"N": 2}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
21
Candidates
{"O": 6}
Ground Truth
{"N": 2}
Top-1 Prediction
0.000
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#1 TOP-1 1.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]<-[n]3cccc(C(=O)O)c3-c12
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#2 0.97 ± 0.00
C[S](C)(=O)->[Ru+2]<-[S](C)(C)=O
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#3 0.65 ± 0.00
CS(C)=[O]->[Ru+2]
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#4 0.61 ± 0.00
CS(C)=[O]->[Ru+2]<-[O]=S(C)C
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#5 0.04 ± 0.00
C[S](C)(=O)->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#6 0.00 ± 0.00
O=C(O)c1cccnc1-c1c(C(=O)O)ccc[n]1->[Ru+2]
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#7 0.00 ± 0.00
OC1=[O]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#8 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[n]2cccc(C(=O)O)c2-c2ncccc21
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#9 0.00 ± 0.00
O=C(O)c1ccc[n]2->[Ru+2]3<-[cH]4cnc(-c12)c(C(=O)O)[cH]->34
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#10 0.00 ± 0.00
O=C(O)c1cccnc1-c1c2C(=O)[OH]->[Ru+2]<-[n]1ccc2
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#11 0.00 ± 0.00
O=C1[OH]->[Ru+2]<-[O]=C(O)c2cccnc2-c2ncccc21
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#12 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(O)=[O]->[Ru+2]
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
O=C(O)C1=C(c2ncccc2C(=O)O)N=C[CH]2[Ru+2][CH]12
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#14 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncccc1C(=O)[OH]->[Ru+2]
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#15 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH]2->[Ru+2]<-[cH]2c1C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#16 0.00 ± 0.00
O=C(O)c1c2-c3nc[cH]4->[Ru+2](<-[cH]1ccn2)<-[cH]4c3C(=O)O
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#17 0.00 ± 0.00
O=C(O)c1c[cH]2->[Ru+2]3<-[cH]4cnc(-c1nc2)c(C(=O)O)[cH]->34
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#18 0.00 ± 0.00
O=C(O)c1cccnc1-c1nc[cH](->[Ru+2])cc1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O
#19 0.00 ± 0.00
O=C(O)c1cccnc1-c1ncc[cH](->[Ru+2])c1C(=O)O