home← all results complex #61

Complex #61 — Ru(2) [Ru2]

GT: {"N": 6} → Top-1: {"N": 1}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
56
Candidates
{"N": 6}
Ground Truth
{"N": 1}
Top-1 Prediction
0.690
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 0.69 ± 0.29
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]<-[c-]32)cc1
#1 TOP-1 0.26 ± 0.43
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]4(<-[c-]32)<-[n]2ccccc2-c2cccc[n]->42)cc1
#2 0.20 ± 0.18
c1ccc(Cn2cc[n+]3-c4cccc[n]4->[Ru+2]<-[c-]23)cc1
#2 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2ccnc(-c3cccc[n]->43)[cH]->52)cc1
#3 0.03 ± 0.04
[Ru+2]<-[c-]1n(Cc2ccccc2)cc[n+]1-c1ccccn1
#3 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+]45(<-[c-]32)<-[cH]2cnc(-c3ccccn3)[cH]->4[cH]->52)cc1
#4 0.00 ± 0.00
c1ccc(-[n+]2ccn3C[c]45->[Ru+2]6789(<-[c-]32)<-[cH]([cH]->6[cH]->74)[cH]->8[cH]->95)nc1
#4 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2](<-[c-]32)<-[n]2ccccc2-c2ccccn2)cc1
#5 0.00 ± 0.00
[c-]1n2-c3cccc[n]3->[Ru+2]34567<-[cH]8[cH]->3[cH]->4[c]->5(C[n+]1cc2)[cH]->6[cH]->78
#5 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2cnc(-c3cccc[n]->43)c[cH]->52)cc1
#6 0.00 ± 0.00
[Ru+2]<-[n]1ccccc1-n1[c-][n+](Cc2ccccc2)cc1
#6 0.00 ± 0.00
C1=NC(c2ccccn2)=C[CH]2[CH]1[Ru+2]21<-[c-]2n(-c3cccc[n]->13)cc[n+]2Cc1ccccc1
#7 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1C[c]12->[Ru+2]3456<-[cH]([cH]->3[cH]->41)[cH]->5[cH]->62
#7 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]4(<-[c-]32)<-[cH]2ccnc(-c3ccccn3)[cH]->42)cc1
#8 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1Cc1c[cH]2->[Ru+2]34<-[cH]1[cH]->3[cH]->42
#8 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2cccnc2-c2ncc[cH]->4[cH]->52)cc1
#9 0.00 ± 0.00
[c-]1n2-c3cccc[n]3->[Ru+2]3<-[cH]4ccc(C[n+]1cc2)c[cH]->34
#9 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]4(<-[c-]32)<-[cH]2cnc(-c3ccccn3)c[cH]->42)cc1
#10 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1Cc1ccc[cH]2->[Ru+2]<-[cH]12
#10 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2ccc(-c3ncc[cH]->4[cH]->53)nc2)cc1
#11 0.00 ± 0.00
[c-]1n2-c3cccc[n]3->[Ru+2]3<-[cH]4cccc(C[n+]1cc2)[cH]->34
#11 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2cccnc2-c2c[cH]->4[cH]->5cn2)cc1
#12 0.00 ± 0.00
[c-]1n(-c2ncc[cH]3->[Ru+2]<-[cH]23)cc[n+]1Cc1ccccc1
#12 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2ccc(-c3c[cH]->4[cH]->5cn3)nc2)cc1
#13 0.00 ± 0.00
[c-]1n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)cc[n+]1Cc1ccccc1
#13 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2ccnc(-c3ncc[cH]->4[cH]->53)c2)cc1
#14 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1Cc1cc[cH]2->[Ru+]3<-[cH]1[cH]->32
#14 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2]45(<-[c-]32)<-[cH]2ccnc(-c3c[cH]->4[cH]->5cn3)c2)cc1
#15 0.00 ± 0.00
[c-]1n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)cc[n+]1Cc1ccccc1
#15 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2](<-[c-]32)<-[cH]2ccc(-c3ccccn3)nc2)cc1
#16 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1Cc1cc[cH]2->[Ru+2]<-[cH]2c1
#16 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2](<-[c-]32)<-[cH]2cccnc2-c2ccccn2)cc1
#17 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1Cc1c[cH]2->[Ru+]3<-[cH](c1)[cH]->32
#17 0.00 ± 0.00
c1ccc(C[n+]2ccn3-c4cccc[n]4->[Ru+2](<-[c-]32)<-[cH]2ccnc(-c3ccccn3)c2)cc1
#18 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1CC1=C[CH]2[Ru+2][CH]2C=C1
#19 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1CC1=CC=C[CH]2[Ru+2][CH]12
#20 0.00 ± 0.00
[c-]1n(C2=C[CH]3[Ru+2][CH]3C=N2)cc[n+]1Cc1ccccc1
#21 0.00 ± 0.00
[c-]1n2-c3cc[cH](->[Ru+2]4<-[cH]5cccc(C[n+]1cc2)[cH]->45)cn3
#22 0.00 ± 0.00
[c-]1n2-c3ncc[cH]4->[Ru+2](<-[cH]5ccccc5C[n+]1cc2)<-[cH]34
#23 0.00 ± 0.00
[c-]1n2-c3ncc[cH]4->[Ru+2](<-[cH]5cccc(C[n+]1cc2)c5)<-[cH]34
#24 0.00 ± 0.00
[c-]1n2-c3ncc[cH]4->[Ru+2](<-[cH]5ccc(C[n+]1cc2)cc5)<-[cH]34
#25 0.00 ± 0.00
[c-]1n(-c2ccccn2)cc[n+]1CC1=C[CH]2[CH]3[CH]4[CH]1[Ru+2]234
#26 0.00 ± 0.00
[c-]1n2-c3nccc[cH]3->[Ru+2]3<-[cH]4ccc(C[n+]1cc2)c[cH]->34
#27 0.00 ± 0.00
[c-]1n2-c3cc[cH](->[Ru+2]4<-[cH]5ccc(C[n+]1cc2)c[cH]->45)cn3
#28 0.00 ± 0.00
[c-]1n2-c3nccc[cH]3->[Ru+2]3<-[cH]4cccc(C[n+]1cc2)[cH]->34
#29 0.00 ± 0.00
[c-]1n2-c3c[cH]4->[Ru+2](<-[cH]5cccc(C[n+]1cc2)c5)<-[cH]4cn3
#30 0.00 ± 0.00
[c-]1n2-c3c[cH]4->[Ru+2](<-[cH]5ccc(C[n+]1cc2)cc5)<-[cH]4cn3
#31 0.00 ± 0.00
[Ru+2]<-[cH]1ccc(-n2[c-][n+](Cc3ccccc3)cc2)nc1
#32 0.00 ± 0.00
[c-]1n2-c3c[cH]4->[Ru+2](<-[cH]5ccccc5C[n+]1cc2)<-[cH]4cn3
#33 0.00 ± 0.00
[Ru+2]<-[cH]1ccc(C[n+]2[c-]n(-c3ccccn3)cc2)cc1
#34 0.00 ± 0.00
[Ru+2]<-[cH]1cccc(C[n+]2[c-]n(-c3ccccn3)cc2)c1
#35 0.00 ± 0.00
[c-]1n2-c3c[cH](->[Ru+2]4<-[cH]5ccc(C[n+]1cc2)c[cH]->45)ccn3
#36 0.00 ± 0.00
[Ru+2]<-[cH]1cccnc1-n1[c-][n+](Cc2ccccc2)cc1
#37 0.00 ± 0.00
[Ru+2]<-[cH]1ccccc1C[n+]1[c-]n(-c2ccccn2)cc1
#38 0.00 ± 0.00
[c-]1n2-c3c[cH](->[Ru+2]4<-[cH]5cccc(C[n+]1cc2)[cH]->45)ccn3
#39 0.00 ± 0.00
[Ru+2]<-[cH]1ccnc(-n2[c-][n+](Cc3ccccc3)cc2)c1