home← all results complex #329

Complex #329 — Ru(2) [4j]

GT: {"O": 1, "N": 4} → Top-1: {}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
55
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 0.04 ± 0.06
CC(C)[c]12->[Ru+2]345678(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[n]1cccc2c3[nH]c(-c4cc([N+](=O)[...
#2 0.11 ± 0.13
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#2 0.03 ± 0.06
CC(C)[c]12->[Ru+]34567([O][N+](=O)c8ccc(O)c(-c9[nH]c%10c%11cccnc%11c%11ncccc%11c%10[n]->39)c8)<-[cH]...
#3 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#3 0.02 ± 0.05
CC(C)[c]12->[Ru+]345678([O][N+](=O)c9ccc(O)c(-c%10[nH]c%11c%12ccc[n]->3c%12c3ncccc3c%11[n]->4%10)c9)...
#4 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#4 0.02 ± 0.05
CC(C)[c]12->[Ru+]345678([O][N+](=O)c9ccc(O)c(-c%10[nH]c%11c%12cccnc%12c%12c(ccc[n]->3%12)c%11[n]->4%...
#5 0.01 ± 0.03
CC(C)[c]12->[Ru+]345678([O][N+](=O)c9ccc(O)c(-c%10nc%11c%12ccc[n]->3c%12c3c(ccc[n]->43)c%11[nH]%10)c...
#6 0.01 ± 0.02
CC(C)[c]12->[Ru+]34567([O][N+](=O)c8ccc(O)c(-c9nc%10c%11cccnc%11c%11c(ccc[n]->3%11)c%10[nH]9)c8)<-[c...
#7 0.00 ± 0.01
CC(C)[c]12->[Ru+]3456([O][N+](=O)c7ccc(O)c(-c8nc9c%10cccnc%10c%10ncccc%10c9[nH]8)c7)<-[cH]([cH]->31)...
#8 0.00 ± 0.01
CC(C)[c]12->[Ru+]34567([O][N+](=O)c8ccc(O)c(-c9nc%10c%11ccc[n]->3c%11c3ncccc3c%10[nH]9)c8)<-[cH]([cH...
#9 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-])...
#10 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(...
#11 0.00 ± 0.00
CC(C)[c]12->[Ru+]34567([O][N+](=[O]->3)c3ccc(O)c(-c8nc9c%10cccnc%10c%10ncccc%10c9[nH]8)c3)<-[cH]([cH...
#12 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...
#13 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-...
#14 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-])ccc2O)[nH...
#15 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-])c...
#16 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]-...
#17 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%12O)[n]->3c%11c...
#18 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...
#19 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c%11nc(-c%12cc([N+](=O)[O-])ccc%12O)[nH]c%11c%11ccc[n]->3c%1...
#20 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%12O)[n]->3%11...
#21 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[OH]c7ccc([N+](=O)[O-])cc7-c7nc8c9cccnc9c9ncccc9c8[nH]7)<-[cH]([cH]->31)[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(c3[nH]c(-c4cc([N+](=O)[...
#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(c3nc(-c4cc([N+](=O)[O-]...
#24 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...
#25 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]%...
#26 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7ccnc8c9ncccc9c9[nH]c(-c%10cc([N+](=O)[O-])ccc%10O)nc9c87)<-[cH]([cH]->...
#27 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c%11[nH]c(-c%12cc([N+](=O)[O-])ccc%12O)nc%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%10O)[nH]c9c87)<-[cH]([cH]->...
#29 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8cnc9c%10ncccc%10c%10nc(-c%11cc([N+](=O)[O-])ccc%11O)[nH]c%10c9[cH]->3...
#30 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...
#31 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...
#32 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cnc8c(c7)c7[nH]c(-c9cc([N+](=O)[O-])ccc9O)nc7c7cccnc78)<-[cH]([cH]->31...
#33 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cnc8c(c7)c7nc(-c9cc([N+](=O)[O-])ccc9O)[nH]c7c7cccnc78)<-[cH]([cH]->31...
#34 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8cnc9c%10ncccc%10c%10[nH]c(-c%11cc([N+](=O)[O-])ccc%11O)nc%10c9[cH]->3...
#35 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cc([N+](=O)[O-])cc(-c8nc9c%10cccnc%10c%10ncccc%10c9[nH]8)c7O)<-[cH]([c...
#36 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]-...
#37 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)[...
#38 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-])ccc4O)nc3c...
#39 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccnc%10c%11nc[cH]->3[cH]->4c%11c3nc(-c4cc([N+](=O)[O-])ccc4O)[nH]c3c...
#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...
#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%12O)[...
#42 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c9)c9nc(-c%11cc([N+](=O)[O-])ccc%11O)[nH]c9c9c%10nc[cH]->3[c...
#43 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)cc9...
#44 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cnc%10c(c9)c9[nH]c(-c%11cc([N+](=O)[O-])ccc%11O)nc9c9c%10nc[cH]->3[c...
#45 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%11)c...
#46 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%1...
#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]...
#48 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...
#49 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%11O)nc9c3ccc...
#50 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%11O)[nH]c9c3ccc...
#51 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%...