home← all results complex #320

Complex #320 — Ru(2) [RuL7]

GT: {"O": 1, "N": 4} → Top-1: {}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
57
Candidates
{"O": 1, "N": 4}
Ground Truth
{}
Top-1 Prediction
0.350
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 0.35 ± 0.20
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#1 TOP-1 0.11 ± 0.25
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)cc8-c8[nH]c9c%10cccnc%10c%10ncccc%10c9[n]->38)<-[cH]([cH]-...
#2 0.11 ± 0.13
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#2 0.02 ± 0.04
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)cc8-c8nc9c%10cccnc%10c%10c(ccc[n]->3%10)c9[nH]8)<-[cH]([cH...
#3 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#3 0.01 ± 0.02
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)cc8-c8nc9c%10ccc[n]->3c%10c3ncccc3c9[nH]8)<-[cH]([cH]->41)...
#4 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#4 0.01 ± 0.02
CC(C)[c]12->[Ru+]3456([O]c7ccc([N+](=O)O)cc7-c7nc8c9cccnc9c9ncccc9c8[nH]7)<-[cH]([cH]->31)[c]->4(C)[...
#5 0.00 ± 0.01
CC(C)[c]12->[Ru+]34567([O]c8c[cH]->3c([N+](=O)O)cc8-c3nc8c9cccnc9c9ncccc9c8[nH]3)<-[cH]([cH]->41)[c]...
#6 0.00 ± 0.00
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)cc8-c8nc9c%10cccnc%10c%10nc[cH]->3cc%10c9[nH]8)<-[cH]([cH]...
#7 0.00 ± 0.00
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)cc8-c8nc9c%10c[cH]->3cnc%10c3ncccc3c9[nH]8)<-[cH]([cH]->41...
#8 0.00 ± 0.00
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)cc8-c8nc9c%10cccnc%10c%10ncc[cH]->3c%10c9[nH]8)<-[cH]([cH]...
#9 0.00 ± 0.00
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)[cH]->3c8-c3nc8c9cccnc9c9ncccc9c8[nH]3)<-[cH]([cH]->41)[c]...
#10 0.00 ± 0.00
CC(C)[c]12->[Ru+]34567([O]c8ccc([N+](=O)O)cc8-c8nc9c([nH]8)c8cccnc8c8ncc[cH]->3c89)<-[cH]([cH]->41)[...
#11 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1cccc2c3[nH]c(-c4cc([N+](=O)O...
#12 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[O-]c7ccc([N+](=O)O)cc7-c7nc8c9cccnc9c9ncccc9c8[nH]7)<-[cH]([cH]->31)[c]->4...
#13 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1cccc2c1c1ncccc1c1[nH]c(-c3cc(...
#14 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1cccc2c3[nH]c(-c4cc([N+](=O)O)...
#15 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1cccc2c3nc(-c4cc([N+](=O)O)ccc...
#16 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1cccc2c3[nH]c(-c4cc([N+](=O)O)c...
#17 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1c(-c2cc([N+](=O)O)ccc2[O-])[nH...
#18 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1cccc2c3nc(-c4cc([N+](=O)O)ccc4...
#19 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9c([N+](=O)O)cc(-c%10nc%11c%12cccnc%12c%12c(ccc[n]->3%12)c%11[nH]%10)...
#20 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[O]=[N+](O)c7ccc([O-])c(-c8nc9c%10cccnc%10c%10ncccc%10c9[nH]8)c7)<-[cH]([cH...
#21 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9c([N+](=O)O)cc(-c%10[nH]c%11c%12cccnc%12c%12ncccc%12c%11[n]->3%10)c(...
#22 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=Nc2c(c3nc(-c4cc([N+](=O)O)cc...
#23 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=Nc2c(c3[nH]c(-c4cc([N+](=O)O...
#24 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[OH][N+](=O)c7ccc([O-])c(-c8nc9c%10cccnc%10c%10ncccc%10c9[nH]8)c7)<-[cH]([c...
#25 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9c([N+](=O)O)cc(-c%10nc%11c%12ccc[n]->3c%12c3ncccc3c%11[nH]%10)c([O-]...
#26 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7ccnc8c9ncccc9c9[nH]c(-c%10cc([N+](=O)O)ccc%10[O-])nc9c87)<-[cH]([cH]->...
#27 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c%11nc(-c%12cc([N+](=O)O)ccc%12[O-])[nH]c%11c%11ccc[n]->3c%1...
#28 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7ccnc8c9ncccc9c9nc(-c%10cc([N+](=O)O)ccc%10[O-])[nH]c9c87)<-[cH]([cH]->...
#29 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c%11ncccc%11c%11[nH]c(-c%12cc([N+](=O)O)ccc%12[O-])[n]->3c%11c...
#30 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c%11ncccc%11c%11c([nH]c(-c%12cc([N+](=O)O)ccc%12[O-])[n]->3%11...
#31 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c%11[nH]c(-c%12cc([N+](=O)O)ccc%12[O-])nc%11c%11ccc[n]->3c%1...
#32 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8c([N+](=O)O)cc(-c9nc%10c%11cccnc%11c%11ncccc%11c%10[nH]9)c([O-])[cH]-...
#33 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cc([N+](=O)O)cc(-c8nc9c%10cccnc%10c%10ncccc%10c9[nH]8)c7[O-])<-[cH]([c...
#34 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7c([N+](=O)O)ccc([O-])c7-c7nc8c9cccnc9c9ncccc9c8[nH]7)<-[cH]([cH]->31)[...
#35 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8cnc9c%10ncccc%10c%10nc(-c%11cc([N+](=O)O)ccc%11[O-])[nH]c%10c9[cH]->3...
#36 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cnc8c(c7)c7[nH]c(-c9cc([N+](=O)O)ccc9[O-])nc7c7cccnc78)<-[cH]([cH]->31...
#37 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cc([O-])c(-c8nc9c%10cccnc%10c%10ncccc%10c9[nH]8)cc7[N+](=O)O)<-[cH]([c...
#38 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cnc8c(c7)c7nc(-c9cc([N+](=O)O)ccc9[O-])[nH]c7c7cccnc78)<-[cH]([cH]->31...
#39 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8cnc9c%10ncccc%10c%10[nH]c(-c%11cc([N+](=O)O)ccc%11[O-])nc%10c9[cH]->3...
#40 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccnc%10c%11ncccc%11c%11[nH]c(-c%12cc([N+](=O)O)[cH]->3[cH]->4c%12[O-...
#41 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccnc%10c%11ncccc%11c%11nc(-c%12cc([N+](=O)O)[cH]->3[cH]->4c%12[O-])[...
#42 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccnc%10c%11nc[cH]->3[cH]->4c%11c3[nH]c(-c4cc([N+](=O)O)ccc4[O-])nc3c...
#43 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cc([N+](=O)O)cc(-c%10nc%11c%12cccnc%12c%12nc[cH]->3[cH]->4c%12c%11[n...
#44 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccnc%10c%11nc[cH]->3[cH]->4c%11c3nc(-c4cc([N+](=O)O)ccc4[O-])[nH]c3c...
#45 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9c([N+](=O)O)ccc([O-])c9-c9nc%10c%11cccnc%11c%11nc[cH]->3[cH]->4c%11c...
#46 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c9)c9[nH]c(-c%11cc([N+](=O)O)[cH]->3[cH]->4c%11[O-])nc9c3ccc...
#47 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cc([N+](=O)O)cc(-c%10nc%11c([nH]%10)c%10cccnc%10c%10nc[cH]->3[cH]->4...
#48 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c9)c9nc(-c%11cc([N+](=O)O)[cH]->3[cH]->4c%11[O-])[nH]c9c3ccc...
#49 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9c([N+](=O)O)ccc([O-])c9-c9nc%10c([nH]9)c9cccnc9c9nc[cH]->3[cH]->4c9%...
#50 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cc([O-])c(-c%10nc%11c%12cccnc%12c%12nc[cH]->3[cH]->4c%12c%11[nH]%10)...
#51 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c9)c9nc(-c%11cc([N+](=O)O)ccc%11[O-])[nH]c9c9c%10nc[cH]->3[c...
#52 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c9)c9[nH]c(-c%11cc([N+](=O)O)ccc%11[O-])nc9c9c%10nc[cH]->3[c...
#53 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cc([O-])c(-c%10nc%11c([nH]%10)c%10cccnc%10c%10nc[cH]->3[cH]->4c%10%1...