57
Candidates
{"N": 8}
Ground Truth
{"N": 2}
Top-1 Prediction
1.000
Match Score
#1
TOP-1
1.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]<-[n]2c1
#1
TOP-1
0.27 ± 0.41
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3(<-[n]2c1)<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31
#1
TOP-1
0.48 ± 0.41
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3456(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1cccc2c1c1c(ccc[n]...
#2
0.00 ± 0.00
Cc1ccc(-c2ccc(C)c[n]2->[Ru+2])nc1
#2
0.00 ± 0.01
Cc1ccc2-c3ncc(C)[cH]4->[Ru+2]5(<-[cH]34)(<-[n]2c1)<-[n]1cc(C)ccc1-c1ccc(C)c[n]->51
#2
0.33 ± 0.38
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1cccc2c1c1ncccc1c1c...
#3
0.00 ± 0.00
Cc1ccc2-c3ncc(C)[cH]4->[Ru+2](<-[cH]34)<-[n]2c1
#3
0.00 ± 0.00
Cc1ccc(-c2ccc(C)c[n]2->[Ru+2]2<-[n]3cc(C)ccc3-c3ccc(C)c[n]->23)nc1
#3
0.27 ± 0.40
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1c2ccccc2[n]->4c2c3c...
#4
0.00 ± 0.00
Cc1ccc(-c2ncc(C)[cH]3->[Ru+2]<-[cH]23)nc1
#4
0.00 ± 0.00
Cc1ccc(-c2ncc(C)[cH]3->[Ru+2]4(<-[cH]23)<-[n]2cc(C)ccc2-c2ccc(C)c[n]->42)nc1
#4
0.20 ± 0.37
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1cccc2c3nc6ccccc6[n...
#5
0.00 ± 0.00
Cc1cnc2-c3ncc(C)[cH]4->[Ru+2](<-[cH]1c2)<-[cH]34
#5
0.00 ± 0.00
Cc1cnc2-c3ncc(C)[cH]4->[Ru+2]5(<-[cH]2c1)(<-[cH]34)<-[n]1cc(C)ccc1-c1ccc(C)c[n]->51
#5
0.19 ± 0.36
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1cccc2c3nc5ccccc5nc3...
#6
0.00 ± 0.00
Cc1ccc(-c2ncc(C)c[cH]2->[Ru+2])nc1
#6
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[cH]5cc(-c6ncc(C)[cH]->3[cH]->46)ncc5C)<-[n]2c1
#6
0.14 ± 0.30
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1cccc2c1c1ncccc1c1nc...
#7
0.00 ± 0.00
Cc1cnc2-c3ncc(C)[cH]4->[Ru+2](<-[cH]2c1)<-[cH]34
#7
0.00 ± 0.00
Cc1ccc(-c2c[cH](->[Ru+2]3<-[n]4cc(C)ccc4-c4ccc(C)c[n]->34)c(C)cn2)nc1
#7
0.12 ± 0.25
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1cccc2c3nc5ccccc5[n]...
#8
0.00 ± 0.00
Cc1ccc(-c2c[cH](->[Ru+2])c(C)cn2)nc1
#8
0.00 ± 0.00
Cc1ccc(-c2ncc(C)c[cH]2->[Ru+2]2<-[n]3cc(C)ccc3-c3ccc(C)c[n]->23)nc1
#8
0.06 ± 0.14
Cc1ccc2-c3ccc(C)c[n]3->[Ru+]345(<-[cH]6cc7nc8c9cccnc9c9ncccc9c8nc7[cH]->3[cH]->46)(<-[n]2c1)<-[n]1cc...
#9
0.06 ± 0.12
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)[CH]1C=Nc2c(c3nc5ccccc5nc...
#10
0.02 ± 0.05
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1cccc2c3nc4ccccc4nc3c...
#11
0.02 ± 0.03
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)[CH]1C=Cc2nc3c5cccnc5c5nc...
#12
0.01 ± 0.02
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3456(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)[CH]1c2nc3c7cccnc7c7ncc...
#13
0.01 ± 0.01
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3(<-[n]2c1)(<-[n]1cc(C)ccc1-c1ccc(C)c[n]->31)<-[n]1c2ccccc2nc2c3cccnc3c...
#14
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cnc7c8ncccc8c8nc9ccccc9[n]->3c8c7[cH]->46)(<-[n]2c1)<-[n]1cc...
#15
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccc7c(nc8c9cccnc9c9ncccc9c8[n]->37)[cH]->46)(<-[n]2c1)<-[n]1...
#16
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cnc7c(c8nc9ccccc9nc8c8ccc[n]->3c87)[cH]->46)(<-[n]2c1)<-[n]1...
#17
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccc7nc8c9ccc[n]->3c9c3ncccc3c8nc7[cH]->46)(<-[n]2c1)<-[n]1cc...
#18
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccc7nc8c9cccnc9c9c(ccc[n]->39)c8nc7[cH]->46)(<-[n]2c1)<-[n]1...
#19
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[cH]5cnc6c7ncccc7c7nc8ccccc8nc7c6[cH]->35)(<-[n]2c1)<-[n]1cc(C)ccc...
#20
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cnc7c8ncccc8c8c(nc9ccccc9[n]->38)c7[cH]->46)(<-[n]2c1)<-[n]1...
#21
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[cH]5ccc6nc7c8cccnc8c8ncccc8c7nc6[cH]->35)(<-[n]2c1)<-[n]1cc(C)ccc...
#22
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cc7nc8c9cccnc9c9c(ccc[n]->39)c8nc7c[cH]->46)(<-[n]2c1)<-[n]1...
#23
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cc7nc8c9cccnc9c9ncccc9c8[n]->3c7c[cH]->46)(<-[n]2c1)<-[n]1cc...
#24
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3456(<-[cH]7c8nc9c%10cccnc%10c%10ncccc%10c9nc8[cH]->3[cH]->4[cH]->57)(<...
#25
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]34(<-[cH]5cc6nc7c8cccnc8c8ncccc8c7nc6c[cH]->35)(<-[n]2c1)<-[n]1cc(C)ccc...
#26
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cccc7nc8c9cccnc9c9nc[cH]->3[cH]->4c9c8nc76)(<-[n]2c1)<-[n]1c...
#27
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cccc7nc8c(nc76)c6cccnc6c6nc[cH]->3[cH]->4c68)(<-[n]2c1)<-[n]...
#28
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3(<-[cH]4ccnc5c6ncccc6c6nc7ccccc7nc6c54)(<-[n]2c1)<-[n]1cc(C)ccc1-c1ccc...
#29
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccnc7c8ncccc8c8nc9cc[cH]->3[cH]->4c9nc8c76)(<-[n]2c1)<-[n]1c...
#30
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccnc7c8nc[cH]->3[cH]->4c8c3nc4ccccc4nc3c76)(<-[n]2c1)<-[n]1c...
#31
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccnc7c8ncccc8c8nc9c(cc[cH]->3[cH]->49)nc8c76)(<-[n]2c1)<-[n]...
#32
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cnc7c(c6)c6nc8c(cc[cH]->3[cH]->48)nc6c3cccnc37)(<-[n]2c1)<-[...
#33
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cnc7c(c6)c6nc8cc[cH]->3[cH]->4c8nc6c3cccnc37)(<-[n]2c1)<-[n]...
#34
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cnc7c(c6)c6nc8ccccc8nc6c6c7nc[cH]->3[cH]->46)(<-[n]2c1)<-[n]...
#35
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3(<-[cH]4cccc5nc6c7cccnc7c7ncccc7c6nc54)(<-[n]2c1)<-[n]1cc(C)ccc1-c1ccc...
#36
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccnc7c8ncccc8c8nc9c[cH]->3[cH]->4cc9nc8c76)(<-[n]2c1)<-[n]1c...
#37
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccc7nc8c(nc7c6)c6cccnc6c6nc[cH]->3[cH]->4c68)(<-[n]2c1)<-[n]...
#38
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6ccc7nc8c9cccnc9c9nc[cH]->3[cH]->4c9c8nc7c6)(<-[n]2c1)<-[n]1c...
#39
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]345(<-[cH]6cnc7c(c6)c6nc8c[cH]->3[cH]->4cc8nc6c3cccnc37)(<-[n]2c1)<-[n]...
#40
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3(<-[cH]4cnc5c(c4)c4nc6ccccc6nc4c4cccnc45)(<-[n]2c1)<-[n]1cc(C)ccc1-c1c...
#41
0.00 ± 0.00
Cc1ccc2-c3ccc(C)c[n]3->[Ru+2]3(<-[cH]4ccc5nc6c7cccnc7c7ncccc7c6nc5c4)(<-[n]2c1)<-[n]1cc(C)ccc1-c1ccc...