home← all results complex #43

Complex #43 — Ru(2) [3b,1,3]

GT: {"N": 8} → Top-1: {"N": 2}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
93
Candidates
{"N": 8}
Ground Truth
{"N": 2}
Top-1 Prediction
0.790
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 0.79 ± 0.19
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]<-[n]5cccc(c2[nH]1)c5c34
#1 TOP-1 0.09 ± 0.19
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[n]6cccc7ccc8ccc[n]->5c8c76)<-[n]5cccc(c2[nH]1)c5c34
#1 TOP-1 0.15 ± 0.34
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[n]7cccc8ccc9ccc[n]->5c9c87)(<-[n]5cccc7ccc8ccc[n]->6c8c75)<-[...
#2 0.16 ± 0.15
COc1ccccc1-c1[nH]c2c3ccc[n]4->[Ru+2]5<-[n]6cccc(c6c34)c2[n]->51
#2 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[n]6cccc(c2[nH]1)c6c34)[CH]1C=Nc2c(ccc3cccnc23)[CH]15
#2 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[n]6cccc7ccc8cccnc8c76)(<-[n]6cccc7ccc8ccc[n]->5c8c76)<-[n]5ccc...
#3 0.06 ± 0.06
COc1ccccc1-c1[nH]c2c3ccc[n]4->[Ru+2]<-[n]1c2c1cccnc1c34
#3 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2](<-[n]5cccc6ccc7cccnc7c65)<-[n]5cccc(c2[nH]1)c5c34
#3 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[n]7cccc8ccc9ccc[n]->5c9c87)(<-[n]5cccc(c2[nH]1)c5c34)[CH]1C=N...
#4 0.06 ± 0.06
COc1ccccc1-c1[nH]c2c3cccnc3c3c4ccc[n]3->[Ru+2]<-[n]1c42
#4 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7c8cccnc8c8c(ccc[n]->58)[cH]->67)<-[n]5cccc(c2[nH]1)c5c34
#4 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]567(<-[cH]8c9cccnc9c9c(ccc[n]->59)[cH]->68)(<-[n]5cccc6ccc8ccc[n]->...
#5 0.02 ± 0.02
COc1ccccc1-c1[nH]c2c3cccnc3c3ncccc3c2[n]1->[Ru+2]
#5 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7cnc8c(ccc9ccc[n]->5c98)[cH]->67)<-[n]5cccc(c2[nH]1)c5c34
#5 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7c8cccnc8c8ncccc8[cH]->57)(<-[n]5cccc7ccc8ccc[n]->6c8c75)<...
#6 0.02 ± 0.02
COc1ccccc1-c1nc2c3cccnc3c3c(ccc[n]3->[Ru+2])c2[nH]1
#6 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[cH]6c7cccnc7c7ncccc7[cH]->56)<-[n]5cccc(c2[nH]1)c5c34
#6 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]567(<-[cH]8cnc9c(ccc%10ccc[n]->5c%109)[cH]->68)(<-[n]5cccc6ccc8ccc[...
#7 0.00 ± 0.01
COc1ccccc1-c1nc2c3ccc[n](->[Ru+2])c3c3ncccc3c2[nH]1
#7 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[cH]6cnc7c8ncccc8ccc7[cH]->56)<-[n]5cccc(c2[nH]1)c5c34
#7 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7cnc8c9ncccc9ccc8[cH]->57)(<-[n]5cccc7ccc8ccc[n]->6c8c75)<...
#8 0.00 ± 0.00
COc1c2-c3[nH]c4c5cccnc5c5ncccc5c4[n]3->[Ru+2]3<-[cH](cc2)[cH]->31
#8 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2](<-[cH]5cc6cccnc6c6ncccc65)<-[n]5cccc(c2[nH]1)c5c34
#8 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[cH]6ccnc7c8ncccc8ccc76)(<-[n]6cccc7ccc8ccc[n]->5c8c76)<-[n]5cc...
#9 0.00 ± 0.00
COc1ccccc1-c1[nH]c2c3cccnc3c3nc[cH]4->[Ru+2]5<-[cH]4c3c2[n]->51
#9 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7ccnc8c9nc[cH]->5[cH]->6c9ccc87)<-[n]5cccc(c2[nH]1)c5c34
#9 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[cH]6cc7cccnc7c7ncccc76)(<-[n]6cccc7ccc8ccc[n]->5c8c76)<-[n]5cc...
#10 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]2c1-c1[nH]c2c4cccnc4c4ncccc4c2[n]->31
#10 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7cc8c(nc[cH]->5[cH]->68)c5ncccc57)<-[n]5cccc(c2[nH]1)c5c34
#10 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]567(<-[cH]8cc9c(nc[cH]->5[cH]->69)c5ncccc58)(<-[n]5cccc6ccc8ccc[n]-...
#11 0.00 ± 0.00
COc1ccccc1-c1[nH]c2c3c4nc[cH]5->[Ru+2](<-[cH]35)<-[n]1c2c1cccnc14
#11 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2](<-[cH]5ccnc6c7ncccc7ccc65)<-[n]5cccc(c2[nH]1)c5c34
#11 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]567(<-[cH]8cnc9c%10ncccc%10[cH]->5[cH]->6c9c8)(<-[n]5cccc6ccc8ccc[n...
#12 0.00 ± 0.00
COc1c2-c3nc4c5cccnc5c5c(ccc[n]5->[Ru+2]5<-[cH](cc2)[cH]->51)c4[nH]3
#12 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2](<-[cH]5cnc6c(ccc7cccnc76)c5)<-[n]5cccc(c2[nH]1)c5c34
#12 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]567(<-[cH]8ccnc9c%10nc[cH]->5[cH]->6c%10ccc98)(<-[n]5cccc6ccc8ccc[n...
#13 0.00 ± 0.00
COc1ccccc1-c1nc2c([nH]1)c1c(c3ncccc32)N=C[CH]2[Ru+2][CH]12
#13 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7cnc8c9ncccc9[cH]->5[cH]->6c8c7)<-[n]5cccc(c2[nH]1)c5c34
#13 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]567(<-[cH]8cnc9c(ccc%10c9nc[cH]->5[cH]->6%10)c8)(<-[n]5cccc6ccc8ccc...
#14 0.00 ± 0.00
COc1ccccc1-c1nc2c3c(c4ncccc4c2[nH]1)N=C[CH]1[Ru+2][CH]31
#14 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]56(<-[cH]7cnc8c(ccc9c8nc[cH]->5[cH]->69)c7)<-[n]5cccc(c2[nH]1)c5c34
#14 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5(<-[cH]6cnc7c(ccc8cccnc87)c6)(<-[n]6cccc7ccc8ccc[n]->5c8c76)<-[n]5...
#15 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]2c1-c1nc2c4cccnc4c4c(ccc[n]->34)c2[nH]1
#16 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]2cc1-c1[nH]c2c4cccnc4c4ncccc4c2[n]->31
#17 0.00 ± 0.00
COC1=C(c2nc3c4cccnc4c4ncccc4c3[nH]2)[CH]2[Ru+2][CH]2C=C1
#18 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]2cc1-c1nc2c4cccnc4c4c(ccc[n]->34)c2[nH]1
#19 0.00 ± 0.00
COc1ccccc1-c1nc2c([nH]1)c1ccc[n]3->[Ru+2]4<-[cH]5cnc(c2[cH]->45)c13
#20 0.00 ± 0.00
COc1ccccc1-c1nc2c3ccc[n]4->[Ru+2]5<-[cH]6cnc(c(c2[nH]1)[cH]->56)c34
#21 0.00 ± 0.00
COc1c2-c3nc4c5ccc[n](->[Ru+2]6<-[cH](cc2)[cH]->61)c5c1ncccc1c4[nH]3
#22 0.00 ± 0.00
COc1ccccc1-c1nc2c3cccnc3c3nc[cH]4->[Ru+2]<-[cH]4c3c2[nH]1
#23 0.00 ± 0.00
COc1c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc[cH]2->[Ru+2]<-[cH]12
#24 0.00 ± 0.00
COC1=C(c2nc3c4cccnc4c4ncccc4c3[nH]2)C=C[CH]2[Ru+2][CH]12
#25 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]<-[cH]2c1-c1nc2c3cccnc3c3ncccc3c2[nH]1
#26 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]2c1-c1nc2c4ccc[n]->3c4c3ncccc3c2[nH]1
#27 0.00 ± 0.00
COc1c[cH]2->[Ru+2]<-[cH]2cc1-c1nc2c3cccnc3c3ncccc3c2[nH]1
#28 0.00 ± 0.00
COc1ccccc1-c1nc2c([nH]1)c1cccnc1c1nc[cH]3->[Ru+2]<-[cH]3c12
#29 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]2cc1-c1nc2c4ccc[n]->3c4c3ncccc3c2[nH]1
#30 0.00 ± 0.00
COc1c[cH]2->[Ru+]3<-[cH](c1-c1nc4c5cccnc5c5ncccc5c4[nH]1)[cH]->32
#31 0.00 ± 0.00
COc1c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c[cH]2->[Ru+]3<-[cH]1[cH]->32
#32 0.00 ± 0.00
COc1c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)[cH]2->[Ru+2]34<-[cH]1[cH]->3[cH]->42
#33 0.00 ± 0.00
COC1=C(c2nc3c4cccnc4c4ncccc4c3[nH]2)[CH]2[CH]3[CH]4[CH]1[Ru+2]243
#34 0.00 ± 0.00
COc1c2-c3nc4c5cccnc5c5nc[cH]6->[Ru+2](<-[cH]1ccc2)<-[cH]6c5c4[nH]3
#35 0.00 ± 0.00
COc1c2-c3nc4c5cccnc5c5ncc[cH](->[Ru+2]6<-[cH](cc2)[cH]->61)c5c4[nH]3
#36 0.00 ± 0.00
COc1ccc[cH]2->[Ru+2]3<-[cH]4cnc5c6ncccc6c6nc(-c12)[nH]c6c5[cH]->34
#37 0.00 ± 0.00
COc1ccccc1-c1nc2c([nH]1)c1c3nc[cH]4->[Ru+2](<-[cH]5ccnc3c25)<-[cH]14
#38 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]4cnc5c6ncccc6c6nc(-c1cc2)[nH]c6c5[cH]->34
#39 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]4cnc5c6ncccc6c6nc(-c1c2)[nH]c6c5[cH]->34
#40 0.00 ± 0.00
COc1c2-c3nc4c([nH]3)c3cccnc3c3ncc[cH](->[Ru+2]5<-[cH](cc2)[cH]->51)c34
#41 0.00 ± 0.00
COc1ccccc1-c1nc2c3c[cH]4->[Ru+2]5<-[cH]6cnc(c3nc4)c(c2[nH]1)[cH]->56
#42 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]4ccnc5c6ncccc6c6nc(-c1[cH]->32)[nH]c6c54
#43 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]4ccnc5c6ncccc6c6nc(-c1c[cH]->32)[nH]c6c54
#44 0.00 ± 0.00
COc1c2-c3nc4c5cccnc5c5nc[cH](->[Ru+2]6<-[cH](cc2)[cH]->61)cc5c4[nH]3
#45 0.00 ± 0.00
COc1ccccc1-c1nc2c([nH]1)c1c3ncc[cH]1->[Ru+2]1<-[cH]4cnc3c2[cH]->14
#46 0.00 ± 0.00
COc1c2-c3nc4c5c[cH](->[Ru+2]6<-[cH](cc2)[cH]->61)cnc5c1ncccc1c4[nH]3
#47 0.00 ± 0.00
COc1c2-c3nc4c([nH]3)c3cccnc3c3nc[cH]5->[Ru+2](<-[cH]1ccc2)<-[cH]5c34
#48 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]4ccnc5c6ncccc6c6[nH]c(-c1[cH]->32)nc6c54
#49 0.00 ± 0.00
COc1ccc[cH]2->[Ru+2]3<-[cH]4cnc5c6ncccc6c6[nH]c(-c12)nc6c5[cH]->34
#50 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]4ccnc5c6ncccc6c6[nH]c(-c1c[cH]->32)nc6c54
#51 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]4cnc5c6ncccc6c6[nH]c(-c1cc2)nc6c5[cH]->34
#52 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]4cnc5c(c4)c4[nH]c(-c1[cH]->32)nc4c1cccnc15
#53 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]4cnc5c6ncccc6c6[nH]c(-c1c2)nc6c5[cH]->34
#54 0.00 ± 0.00
COc1cc[cH]2->[Ru+2]3<-[cH]4cnc5c(c4)c4nc(-c1[cH]->32)[nH]c4c1cccnc15
#55 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]4cnc5c(c4)c4[nH]c(-c1c[cH]->32)nc4c1cccnc15
#56 0.00 ± 0.00
COc1ccccc1-c1nc2c([nH]1)c1c[cH]3->[Ru+2]4<-[cH]5cnc(c1nc3)c2[cH]->45
#57 0.00 ± 0.00
COc1c[cH]2->[Ru+2]3<-[cH]4cnc5c(c4)c4nc(-c1c[cH]->32)[nH]c4c1cccnc15
#58 0.00 ± 0.00
COc1ccccc1-c1nc2c3c[cH](->[Ru+2])cnc3c3ncccc3c2[nH]1
#59 0.00 ± 0.00
COc1c[cH](->[Ru+2])ccc1-c1nc2c3cccnc3c3ncccc3c2[nH]1
#60 0.00 ± 0.00
COc1ccccc1-c1nc2c3cccnc3c3nc[cH](->[Ru+2])cc3c2[nH]1
#61 0.00 ± 0.00
COc1cc[cH](->[Ru+2])cc1-c1nc2c3cccnc3c3ncccc3c2[nH]1
#62 0.00 ± 0.00
COc1c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)ccc[cH]1->[Ru+2]
#63 0.00 ± 0.00
COc1ccccc1-c1nc2c3cccnc3c3ncc[cH](->[Ru+2])c3c2[nH]1
#64 0.00 ± 0.00
COc1ccc[cH](->[Ru+2])c1-c1nc2c3cccnc3c3ncccc3c2[nH]1
#65 0.00 ± 0.00
COc1ccccc1-c1nc2c([nH]1)c1cccnc1c1ncc[cH](->[Ru+2])c12