home← all results complex #124

Complex #124 — Ru(2) [8,3e]

GT: {"O": 1} → Top-1: {"O": 2}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
73
Candidates
{"O": 1}
Ground Truth
{"O": 2}
Top-1 Prediction
0.400
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 0.40 ± 0.48
CC(C)[c]12->[Ru+]34567([O]c8c(-c9ccccc9F)oc9ccccc9c8=[O]->3)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->72
#2 0.11 ± 0.13
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#2 0.21 ± 0.36
CC(C)[c]12->[Ru+]3456([O]c7c(-c8ccccc8F)oc8ccccc8c7=O)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#3 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#3 0.14 ± 0.24
CC(C)[c]12->[Ru+]34567([O]c8c(-c9ccccc9F)oc9ccc[cH]->3c9c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->7...
#4 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#4 0.13 ± 0.20
CC(C)[c]12->[Ru+]34567([O]c8c(-c9ccccc9F)oc9c(ccc[cH]->39)c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]-...
#5 0.10 ± 0.16
CC(C)[c]12->[Ru+]34567([O]c8c(-c9ccc[cH]->3c9F)oc3ccccc3c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->7...
#6 0.09 ± 0.13
CC(C)[c]12->[Ru+]34567([O]c8c(-c9c(F)ccc[cH]->39)oc3ccccc3c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]-...
#7 0.04 ± 0.06
CC(C)[c]12->[Ru+]34567([O]c8c(-c9ccccc9F)oc9cc[cH]->3cc9c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->7...
#8 0.04 ± 0.06
CC(C)[c]12->[Ru+]34567([O]c8c(-c9c[cH]->3ccc9F)oc3ccccc3c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->7...
#9 0.04 ± 0.06
CC(C)[c]12->[Ru+]34567([O]c8c(-c9ccccc9F)oc9c[cH]->3ccc9c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->7...
#10 0.04 ± 0.05
CC(C)[c]12->[Ru+]34567([O]c8c(-c9cc[cH]->3cc9F)oc3ccccc3c8=O)<-[cH]([cH]->41)[c]->5(C)[cH]->6[cH]->7...
#11 0.02 ± 0.04
CC(C)[c]12->[Ru]3456789([O]c%10c(-[c]->3%11c(F)cc[cH]->4[cH]->5%11)oc3ccccc3c%10=O)<-[cH]([cH]->61)[...
#12 0.01 ± 0.03
CC(C)[c]12->[Ru+2]34567(<-[O]=c8c([O-]->3)c(-c3ccccc3F)oc3ccccc83)<-[cH]([cH]->41)[c]->5(C)[cH]->6[c...
#13 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[O]=c7c([O-])c(-c8ccccc8F)oc8ccccc78)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->...
#14 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[O-]c7c(-c8ccccc8F)oc8ccccc8c7=O)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#15 0.00 ± 0.00
CC(C)[c]12->[Ru+]345678(<-[cH]9cc%10c(=O)c([O-])c(-c%11ccccc%11F)oc%10[cH]->3[cH]->49)<-[cH]([cH]->5...
#16 0.00 ± 0.00
CC(C)[c]12->[Ru+]345678(<-[cH]9cc(F)c(-c%10oc%11ccccc%11c(=O)c%10[O-])[cH]->3[cH]->49)<-[cH]([cH]->5...
#17 0.00 ± 0.00
CC(C)[c]12->[Ru+]345678(<-[cH]9cc%10oc(-c%11ccccc%11F)c([O-])c(=O)c%10[cH]->3[cH]->49)<-[cH]([cH]->5...
#18 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)<-[o]1c(-c2ccccc2F)c([O-])c(=O)c2ccc...
#19 0.00 ± 0.00
CC(C)[c]12->[Ru+]345678(<-[cH]9cc(-c%10oc%11ccccc%11c(=O)c%10[O-])c(F)[cH]->3[cH]->49)<-[cH]([cH]->5...
#20 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1c2oc(-c3ccccc3F)c([O-])c(=O)...
#21 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=Cc2oc(-c3ccccc3F)c([O-])c(=O...
#22 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cccc8c(=O)c([O-])c(-c9ccccc9F)oc87)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH...
#23 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=Cc2c(oc(-c3ccccc3F)c([O-])c2...
#24 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=CC(F)=C(c2oc3c(c(=O)c2[O-]...
#25 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cccc(F)c7-c7oc8ccccc8c(=O)c7[O-])<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]-...
#26 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cccc8oc(-c9ccccc9F)c([O-])c(=O)c87)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH...
#27 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=CC(F)=C(c2oc3c(c(=O)c2[O-]...
#28 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8ccc9oc(-c%10ccccc%10F)c([O-])c(=O)c9[cH]->38)<-[cH]([cH]->41)[c]->5(C...
#29 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8ccc9c(=O)c([O-])c(-c%10ccccc%10F)oc9[cH]->38)<-[cH]([cH]->41)[c]->5(C...
#30 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C(F)=C(c2oc3ccccc3c(=O)c2[O-...
#31 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]%10c%11oc(-c%12ccccc%12F)c([O-])c(=O)c%11[cH]->3[cH]->4[cH]->5%10)<-...
#32 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=CC(=C(F)[CH]17)c1oc2c(c(=O...
#33 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=CC(=C(F)[CH]17)c1oc2c(c(=O...
#34 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8ccc(F)c(-c9oc%10ccccc%10c(=O)c9[O-])[cH]->38)<-[cH]([cH]->41)[c]->5(C...
#35 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8ccc(-c9oc%10ccccc%10c(=O)c9[O-])c(F)[cH]->38)<-[cH]([cH]->41)[c]->5(C...
#36 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc(F)c9-c9oc%10cc[cH]->3[cH]->4c%10c(=O)c9[O-])<-[cH]([cH]->51)[c]...
#37 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7ccc8c(=O)c([O-])c(-c9ccccc9F)oc8c7)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH...
#38 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7cccc(-c8oc9ccccc9c(=O)c8[O-])c7F)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]-...
#39 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc(F)c9-c9oc%10c(cc[cH]->3[cH]->4%10)c(=O)c9[O-])<-[cH]([cH]->51)[...
#40 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456789(<-[cH]%10c(F)c(-c%11oc%12ccccc%12c(=O)c%11[O-])[cH]->3[cH]->4[cH]->5%10)<-...
#41 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc%10c(=O)c([O-])c(-c%11cc[cH]->3[cH]->4c%11F)oc%109)<-[cH]([cH]->...
#42 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc%10c(=O)c([O-])c(-c%11c(F)cc[cH]->3[cH]->4%11)oc%109)<-[cH]([cH]...
#43 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=CC(F)=C(c2oc3ccccc3c(=O)c2[O...
#44 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7ccc(-c8oc9ccccc9c(=O)c8[O-])c(F)c7)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH...
#45 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7ccc8oc(-c9ccccc9F)c([O-])c(=O)c8c7)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH...
#46 0.00 ± 0.00
CC(C)[c]12->[Ru+2]3456(<-[cH]7ccc(F)c(-c8oc9ccccc9c(=O)c8[O-])c7)<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH...
#47 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc%10oc(-c%11c(F)cc[cH]->3[cH]->4%11)c([O-])c(=O)c%109)<-[cH]([cH]...
#48 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc%10oc(-c%11cc[cH]->3[cH]->4c%11F)c([O-])c(=O)c%109)<-[cH]([cH]->...
#49 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8cc(F)c(-c9oc%10ccccc%10c(=O)c9[O-])c[cH]->38)<-[cH]([cH]->41)[c]->5(C...
#50 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]8cc9oc(-c%10ccccc%10F)c([O-])c(=O)c9c[cH]->38)<-[cH]([cH]->41)[c]->5(C...
#51 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc(-c%10oc%11cc[cH]->3[cH]->4c%11c(=O)c%10[O-])c9F)<-[cH]([cH]->51...
#52 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc(-c%10oc%11c(cc[cH]->3[cH]->4%11)c(=O)c%10[O-])c9F)<-[cH]([cH]->...
#53 0.00 ± 0.00
CC(C)[c]12->[Ru+2]34567(<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62)[CH]1C=CC(c2oc3ccccc3c(=O)c2[O-])=C...
#54 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc%10c(=O)c([O-])c(-c%11c[cH]->3[cH]->4cc%11F)oc%109)<-[cH]([cH]->...
#55 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc(-c%10oc%11cc[cH]->3[cH]->4c%11c(=O)c%10[O-])c(F)c9)<-[cH]([cH]->...
#56 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc(-c%10oc%11c(cc[cH]->3[cH]->4%11)c(=O)c%10[O-])c(F)c9)<-[cH]([cH]...
#57 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc(F)c9-c9oc%10c[cH]->3[cH]->4cc%10c(=O)c9[O-])<-[cH]([cH]->51)[c]...
#58 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc%10c(=O)c([O-])c(-c%11cc[cH]->3[cH]->4c%11F)oc%10c9)<-[cH]([cH]->...
#59 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc%10oc(-c%11c[cH]->3[cH]->4cc%11F)c([O-])c(=O)c%109)<-[cH]([cH]->...
#60 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc%10c(=O)c([O-])c(-c%11c(F)cc[cH]->3[cH]->4%11)oc%10c9)<-[cH]([cH]...
#61 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc(F)c(-c%10oc%11cc[cH]->3[cH]->4c%11c(=O)c%10[O-])c9)<-[cH]([cH]->...
#62 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc(F)c(-c%10oc%11c(cc[cH]->3[cH]->4%11)c(=O)c%10[O-])c9)<-[cH]([cH]...
#63 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc%10oc(-c%11cc[cH]->3[cH]->4c%11F)c([O-])c(=O)c%10c9)<-[cH]([cH]->...
#64 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc%10oc(-c%11c(F)cc[cH]->3[cH]->4%11)c([O-])c(=O)c%10c9)<-[cH]([cH]...
#65 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9cccc(-c%10oc%11c[cH]->3[cH]->4cc%11c(=O)c%10[O-])c9F)<-[cH]([cH]->51...
#66 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc%10c(=O)c([O-])c(-c%11c[cH]->3[cH]->4cc%11F)oc%10c9)<-[cH]([cH]->...
#67 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc(-c%10oc%11c[cH]->3[cH]->4cc%11c(=O)c%10[O-])c(F)c9)<-[cH]([cH]->...
#68 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc%10oc(-c%11c[cH]->3[cH]->4cc%11F)c([O-])c(=O)c%10c9)<-[cH]([cH]->...
#69 0.00 ± 0.00
CC(C)[c]12->[Ru+2]345678(<-[cH]9ccc(F)c(-c%10oc%11c[cH]->3[cH]->4cc%11c(=O)c%10[O-])c9)<-[cH]([cH]->...