home← all results complex #1555

Complex #1555 — Ru(2) [2]

GT: {"N": 8} → Top-1: {"N": 2}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
40
Candidates
{"N": 8}
Ground Truth
{"N": 2}
Top-1 Prediction
0.990
Match Score
#1 TOP-1 0.99 ± 0.00
O=C(O)CCCCCNC(=O)c1cc[n]2->[Ru+2]<-[n]3ccccc3-c2n1
#2 0.19 ± 0.11
O=C(O)CCCCCNC(=O)c1ccnc2-c3cccc[n]3->[Ru+2]<-[n]12
#3 0.01 ± 0.02
O=C(O)CCCCC[NH]1C(=O)c2ccnc3-c4cccc[n]4->[Ru+]<-1<-[n]23
#4 0.01 ± 0.01
O=C(O)CCCCC[NH]1C(=O)c2ccnc3-c4cccc[n]4->[Ru+2]<-1<-[n]23
#5 0.01 ± 0.01
O=C(O)CCCCCNC1=[O]->[Ru+2]<-[n]2c1ccnc2-c1ccccn1
#6 0.01 ± 0.01
O=C(O)CCCCCNC(=O)c1cc[n](->[Ru+2])c(-c2ccccn2)n1
#7 0.00 ± 0.00
O=C(O)CCCCC[NH]1C(=O)c2cc[n]3->[Ru+2]<-1<-[n]1ccccc1-c3n2
#8 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1cc[n]2->[Ru+2]<-[n]1c2-c1ccccn1
#9 0.00 ± 0.00
O=C(O)CCCCC[NH]1->[Ru+]<-[n]2c(C1=O)ccnc2-c1ccccn1
#10 0.00 ± 0.00
O=C(NCCCCCC(O)=[O]->[Ru+2])c1ccnc(-c2ccccn2)n1
#11 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2cccc[n]2->[Ru+2])n1
#12 0.00 ± 0.00
O=C(O)CCCCC[NH]1->[Ru+2]<-[n]2c(C1=O)ccnc2-c1ccccn1
#13 0.00 ± 0.00
O=C(O)CCCCCNC(=[O]->[Ru+2])c1ccnc(-c2ccccn2)n1
#14 0.00 ± 0.00
OC1CCCCCNC(=[O]->[Ru+2]<-[O]=1)c1ccnc(-c2ccccn2)n1
#15 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(C2=C[CH]3[Ru+2][CH]3C=N2)n1
#16 0.00 ± 0.00
O=C(CCCCCNC(=O)c1ccnc(-c2ccccn2)n1)[OH]->[Ru+2]
#17 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2c[cH]3->[Ru+2]<-[cH]3cn2)n1
#18 0.00 ± 0.00
O=C1CCCCCNC(=O)c2cc[n](->[Ru+2]<-[OH]1)c(-c1ccccn1)n2
#19 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2ccccn2)[n]1->[Ru+2]
#20 0.00 ± 0.00
O=C1CCCCCNC(=[O]->[Ru+2]<-[OH]1)c1ccnc(-c2ccccn2)n1
#21 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)n1
#22 0.00 ± 0.00
O=C1CCCCCNC(=O)c2ccnc(-c3cccc[n]3->[Ru+2]<-[OH]1)n2
#23 0.00 ± 0.00
O=C(O)CCCCCNC1=[O]->[Ru+2]<-[n]2ccccc2-c2nccc1n2
#24 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2ncc[cH]3->[Ru+2]<-[cH]23)n1
#25 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1cc[n]2->[Ru+2]3<-[cH]4ccnc(-c2n1)[cH]->34
#26 0.00 ± 0.00
O=C(O)CCCCCNC1=[O]->[Ru+2]<-[n]2ccc1nc2-c1ccccn1
#27 0.00 ± 0.00
O=C(O)CCCCCNC(=O)[c]12->[Ru+2]<-[n]1c(-c1ccccn1)ncc2
#28 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1cc[n]2->[Ru+2]3<-[cH]4cnc(-c2n1)c[cH]->34
#29 0.00 ± 0.00
O=C(O)CCCCC[NH](->[Ru+2])C(=O)c1ccnc(-c2ccccn2)n1
#30 0.00 ± 0.00
O=C1CCCCCNC(=O)c2ccnc(-c3ccccn3)[n]2->[Ru+2]<-[OH]1
#31 0.00 ± 0.00
O=C(O)CCCCC[NH]1->[Ru+2]<-[n]2ccccc2-c2nccc(C1=O)n2
#32 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc2-c3ncc[cH]4->[Ru+2](<-[cH]34)<-[n]12
#33 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2cc[cH](->[Ru+2])cn2)n1
#34 0.00 ± 0.00
O=C(O)CCCCC[NH]1->[Ru+2]<-[n]2ccc(C1=O)nc2-c1ccccn1
#35 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1nc(-c2ccccn2)nc[cH]1->[Ru+2]
#36 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc2-c3c[cH]4->[Ru+2](<-[cH]4cn3)<-[n]12
#37 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2nccc[cH]2->[Ru+2])n1
#38 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1nc2-c3c[cH]4->[Ru+2](<-[cH]1cn2)<-[cH]4cn3
#39 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1ccnc(-c2c[cH](->[Ru+2])ccn2)n1
#40 0.00 ± 0.00
O=C(O)CCCCCNC(=O)c1nc2-c3ncc[cH]4->[Ru+2](<-[cH]1cn2)<-[cH]34