home← all results complex #243

Complex #243 — Ru(2) [C3]

GT: {"P": 1, "O": 1} → Top-1: {"P": 1}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
53
Candidates
{"P": 1, "O": 1}
Ground Truth
{"P": 1}
Top-1 Prediction
1.000
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 1.00 ± 0.00
CC[P](->[Ru+2])(CC)CC
#1 TOP-1 0.54 ± 0.28
CC[P](CC)(CC)->[Ru+2]12345<-[cH]6[cH]->1[c]->2(C(C)C)[cH]->3[cH]->4[c]->56C
#1 TOP-1 0.40 ± 0.40
CC[P](CC)(CC)->[Ru+]123456([O]c7c(O)ccc8c7C(=[O]->1)c1ccccc1C8=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4[...
#2 0.18 ± 0.23
CC[P](CC)(CC)->[Ru+2]1<-[cH]2c(C)ccc(C(C)C)[cH]->12
#2 0.31 ± 0.40
CC[P](CC)(CC)->[Ru+]123456([O]c7c(O)ccc8c7C(=O)c7ccccc7C8=[O]->1)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4[...
#3 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]<-[cH]1cc(C)ccc1C(C)C
#3 0.23 ± 0.42
CC[P](CC)(CC)->[Ru+]12345([O]c6c(O)ccc7c6C(=O)c6ccccc6C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]->3[cH]->4...
#4 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]<-[cH]1cc(C(C)C)ccc1C
#4 0.23 ± 0.42
CC[P](CC)(CC)->[Ru+]123456([O]c7c([OH]->1)ccc1c7C(=O)c7ccccc7C1=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4...
#5 0.19 ± 0.38
CC[P](CC)(CC)->[Ru+]123456([O]c7c(O)ccc8c7C(=O)c7c(ccc[cH]->17)C8=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]-...
#6 0.18 ± 0.36
CC[P](CC)(CC)->[Ru+]123456([O]c7c(O)ccc8c7C(=O)c7ccc[cH]->1c7C8=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4...
#7 0.17 ± 0.34
CC[P](CC)(CC)->[Ru+]123456([O]c7c(O)c[cH]->1c1c7C(=O)c7ccccc7C1=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4...
#8 0.17 ± 0.33
CC[P](CC)(CC)->[Ru+]123456([O]c7c8c(c[cH]->1c7O)C(=O)c1ccccc1C8=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4...
#9 0.11 ± 0.21
CC[P](CC)(CC)->[Ru+]123456([O]c7c(O)ccc8c7C(=O)c7cc[cH]->1cc7C8=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4...
#10 0.11 ± 0.20
CC[P](CC)(CC)->[Ru+]123456([O]c7c(O)ccc8c7C(=O)c7c[cH]->1ccc7C8=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4...
#11 0.05 ± 0.04
CC[P](CC)(CC)->[Ru]123456([O]c7c([OH]->1)ccc1c7C(=O)c7ccccc7C1=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]->4[...
#12 0.02 ± 0.03
CC[P](CC)(CC)->[Ru+2]123456(<-[O]=C7c8ccccc8C(=[O]->1)c1c7ccc(O)c1[O-])<-[cH]1[cH]->2[c]->3(C(C)C)[c...
#13 0.01 ± 0.01
CC[P](CC)(CC)->[Ru+]123456(<-[O-]c7c([OH]->1)ccc1c7C(=O)c7ccccc7C1=O)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]...
#14 0.01 ± 0.02
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7[cH]->1[c]->2(C(C)C)[cH]->3[cH]->4[c]->57C)[O][C]61c2ccccc2C(=O)c...
#15 0.01 ± 0.01
CC[P](CC)(CC)->[Ru+2]123456(<-[O]=C7c8ccccc8C(=O)c8ccc(O)c([O-]->1)c87)<-[cH]1[cH]->2[c]->3(C(C)C)[c...
#16 0.00 ± 0.01
CC[P](CC)(CC)->[Ru+2]12345(<-[O]=C6c7ccccc7C(=O)c7ccc(O)c([O-])c76)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]->...
#17 0.00 ± 0.01
CC[P](CC)(CC)->[Ru+2]123456(<-[O]=C7c8ccccc8C(=O)c8c7ccc(O)c8[O-]->1)<-[cH]1[cH]->2[c]->3(C(C)C)[cH]...
#18 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7[cH]->1[c]->2(C(C)C)[cH]->3[cH]->4[c]->57C)[O][C]61c2ccccc2C(=O)c...
#19 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[O]=C6c7ccccc7C(=O)c7c6ccc(O)c7[O-])<-[cH]6[cH]->1[c]->2(C(C)C)[cH]->3[...
#20 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[O-]c6c(O)ccc7c6C(=O)c6ccccc6C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]->3[cH...
#21 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345678(<-[cH]9[cH]->1[c]->2(C(C)C)[cH]->3[cH]->4[c]->59C)[CH]1C2=C(C(=O)c3c(c...
#22 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+]1234567(<-[cH]8cc9c([cH]->1[cH]->28)C(=O)c1c(ccc(O)c1[O-])C9=O)<-[cH]1[cH]->3[c]...
#23 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7c(O)c([O-])c8c([cH]->17)C(=O)c1ccccc1C8=O)<-[cH]1[cH]->2[c]->3(C(...
#24 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+]1234567(<-[cH]8cc9c([cH]->1[cH]->28)C(=O)c1ccc(O)c([O-])c1C9=O)<-[cH]1[cH]->3[c]...
#25 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[OH]c6ccc7c(c6[O-])C(=O)c6ccccc6C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]->3...
#26 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cccc9c8C(=O)c8c([O-])c(O)[cH]->1[cH]->2c8C9=O)<-[cH]1[cH]->3[c]-...
#27 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7[cH]->1[c]->2(C(C)C)[cH]->3[cH]->4[c]->57C)[CH]1C=CC2=C(C(=O)c3c(...
#28 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7[cH]->1[c]->2(C(C)C)[cH]->3[cH]->4[c]->57C)[CH]1C=CC2=C(C(=O)c3cc...
#29 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[cH]6cccc7c6C(=O)c6c(ccc(O)c6[O-])C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]-...
#30 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cccc9c8C(=O)c8c(c([O-])c(O)[cH]->1[cH]->28)C9=O)<-[cH]1[cH]->3[c...
#31 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[cH]6cc7c(c([O-])c6O)C(=O)c6ccccc6C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]-...
#32 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456789%10(<-[cH]%11[cH]->1[cH]->2[c]->31[c]->4([cH]->5%11)C(=O)c2ccc(O)c([O-...
#33 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[cH]6cccc7c6C(=O)c6ccc(O)c([O-])c6C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]-...
#34 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[cH]6cc(O)c([O-])c7c6C(=O)c6ccccc6C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH]-...
#35 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7ccc8c([cH]->17)C(=O)c1c(ccc(O)c1[O-])C8=O)<-[cH]1[cH]->2[c]->3(C(...
#36 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[cH]6ccc7c(c6)C(=O)c6ccc(O)c([O-])c6C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH...
#37 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7ccc8c([cH]->17)C(=O)c1ccc(O)c([O-])c1C8=O)<-[cH]1[cH]->2[c]->3(C(...
#38 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8ccc9c(c8)C(=O)c8c(c([O-])c(O)[cH]->1[cH]->28)C9=O)<-[cH]1[cH]->3...
#39 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345(<-[cH]6ccc7c(c6)C(=O)c6c(ccc(O)c6[O-])C7=O)<-[cH]6[cH]->1[c]->2(C(C)C)[cH...
#40 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8ccc9c(c8)C(=O)c8c([O-])c(O)[cH]->1[cH]->2c8C9=O)<-[cH]1[cH]->3[c...
#41 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]12345678(<-[cH]9c%10c([cH]->1[cH]->2[cH]->39)C(=O)c1c(ccc(O)c1[O-])C%10=O)<-[cH...
#42 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]123456(<-[cH]7cc8c(c[cH]->17)C(=O)c1c(ccc(O)c1[O-])C8=O)<-[cH]1[cH]->2[c]->3(C(...
#43 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cc9c(c([O-])c8O)C(=O)c8c(cc[cH]->1[cH]->28)C9=O)<-[cH]1[cH]->3[c...
#44 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cc(O)c([O-])c9c8C(=O)c8cc[cH]->1[cH]->2c8C9=O)<-[cH]1[cH]->3[c]-...
#45 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cc9c(c([O-])c8O)C(=O)c8cc[cH]->1[cH]->2c8C9=O)<-[cH]1[cH]->3[c]-...
#46 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cc(O)c([O-])c9c8C(=O)c8c(cc[cH]->1[cH]->28)C9=O)<-[cH]1[cH]->3[c...
#47 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cc9c(c([O-])c8O)C(=O)c8c[cH]->1[cH]->2cc8C9=O)<-[cH]1[cH]->3[c]-...
#48 0.00 ± 0.00
CC[P](CC)(CC)->[Ru+2]1234567(<-[cH]8cc(O)c([O-])c9c8C(=O)c8c[cH]->1[cH]->2cc8C9=O)<-[cH]1[cH]->3[c]-...