home← all results complex #55

Complex #55 — Ru(2) [1c]

GT: {"S": 2, "O": 4} → Top-1: {"S": 2, "O": 4}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
20
Candidates
{"S": 2, "O": 4}
Ground Truth
{"S": 2, "O": 4}
Top-1 Prediction
0.990
Match Score
#1 TOP-1 0.98 ± 0.03
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1
#1 TOP-1 0.99 ± 0.01
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-12[O]c1c(C)occc1=[O]->2
#1 TOP-1 0.99 ± 0.02
CC[S]1(=O)CC[S](=O)(CC)->[Ru]<-123([O]c1c(C)occc1=[O]->2)[O]c1c(C)occc1=[O]->3
#2 0.14 ± 0.10
CCS1CCS(CC)=[O]->[Ru+2]<-[O]=1
#2 0.86 ± 0.11
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-1[O]c1c(C)occc1=O
#2 0.98 ± 0.05
CC[S]1(=O)CC[S](=O)(CC)->[Ru]<-12([O]c1c(C)occc1=O)[O]c1c(C)occc1=[O]->2
#3 0.00 ± 0.00
CCS(=O)CCS(CC)=[O]->[Ru+2]
#3 0.05 ± 0.06
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-12[O]c1c(C)oc[cH]->2c1=O
#3 0.66 ± 0.46
CC[S]1(=O)CC[S](=O)(CC)->[Ru]<-123([O]c1c(C)occc1=[O]->2)[O]c1c(C)oc[cH]->3c1=O
#4 0.00 ± 0.00
CCS(=O)CC[S](=O)(->[Ru+2])CC
#4 0.03 ± 0.03
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-12<-[O]=c1ccoc(C)c1[O-]->2
#4 0.62 ± 0.31
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-123([O]c1c(C)occc1=[O]->2)<-[O]=c1ccoc(C)c1[O-]->3
#5 0.00 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1<-[O]=c1ccoc(C)c1[O-]
#5 0.28 ± 0.27
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-12([O]c1c(C)occc1=[O]->2)<-[O-]c1c(C)occc1=O
#6 0.00 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1<-[O-]c1c(C)occc1=O
#6 0.23 ± 0.21
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-12([O]c1c(C)occc1=[O]->2)<-[O]=c1ccoc(C)c1[O-]
#7 0.00 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1<-[o]1ccc(=O)c([O-])c1C
#7 0.01 ± 0.02
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-12([O]c1c(C)occc1=[O]->2)<-[o]1ccc(=O)c([O-])c1C
#8 0.00 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+2]<-1<-[cH]1coc(C)c([O-])c1=O
#8 0.00 ± 0.00
CC[S]1(=O)CC[S](=O)(CC)->[Ru+]<-12([O]c1c(C)occc1=[O]->2)<-[cH]1coc(C)c([O-])c1=O