43
Candidates
{"N": 5, "P": 1}
Ground Truth
{"N": 1}
Top-1 Prediction
0.990
Match Score
#1
TOP-1
0.99 ± 0.01
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2])cn2)cc1
#1
TOP-1
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(C#N)cc4)c3)cc2)n2cncn2)cc1
#1
TOP-1
0.04 ± 0.05
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3(<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(C#N)cc4)c3)<-[P](c3ccccc3)(c3ccccc3...
#2
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2cnc[n]2->[Ru+2])cc1
#2
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(C#N)cc4)c3)cn2)cc1
#2
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3456(<-[n]3cnn(C(c7ccc(C#N)cc7)c7ccc(C#N)cc7)c3)[CH]3C=CC=C([CH]34)P(...
#3
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#[N]->[Ru+2])cc2)n2cncn2)cc1
#3
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]<-[n]3cncn3C(c3ccc(C#N)cc3)c3ccc(C#N)cc3)cn2)cc1
#3
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+]345(<-[cH]3ccc(P(c6ccccc6)c6ccccc6)[cH]->4[cH]->53)<-[n]3cnn(C(c4ccc(C...
#4
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3)cc2)n2cncn2)cc1
#4
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#[N]->[Ru+2]<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(C#N)cc4)c3)cc2)n2cncn2)cc1
#4
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3456(<-[n]3cnn(C(c7ccc(C#N)cc7)c7ccc(C#N)cc7)c3)[CH]3C=C(P(c7ccccc7)c...
#5
0.00 ± 0.00
C1#[N]->[Ru+2]<-[N]#Cc2ccc(C(c3ccc1cc3)n1cncn1)cc2
#5
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]3<-[cH]4c(C#N)ccc(C(c5ccc(C#N)cc5)n5cncn5)[cH]->34)cn2)cc1
#5
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3456(<-[n]3cnn(C(c7ccc(C#N)cc7)c7ccc(C#N)cc7)c3)[CH]3C=CC(=C[CH]34)P(...
#6
0.00 ± 0.00
N#Cc1ccc(C2c3ccc(C#N)[cH]4->[Ru+2](<-[cH]34)<-[n]3cnn2c3)cc1
#6
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]34<-[cH]5c(C#N)ccc(C(c6ccc(C#N)cc6)n6c[n]->3cn6)[cH]->45)cn2...
#6
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+]345(<-[cH]3cc(P(c6ccccc6)c6ccccc6)c[cH]->4[cH]->53)<-[n]3cnn(C(c4ccc(C...
#7
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)[cH]3->[Ru+2]<-[cH]23)n2cncn2)cc1
#7
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]<-[cH]3cc(C#N)ccc3C(c3ccc(C#N)cc3)n3cncn3)cn2)cc1
#7
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]34(<-[n]3cnn(C(c5ccc(C#N)cc5)c5ccc(C#N)cc5)c3)[CH]3C=CC=C(P(c5ccccc5)...
#8
0.00 ± 0.00
N#Cc1ccc2C(c3ccc(C#N)[cH]4->[Ru+2](<-[cH]2c1)<-[cH]34)n1cncn1
#8
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]3<-[N]#Cc4ccc(C(c5ccc(C#[N]->3)cc5)n3cncn3)cc4)cn2)cc1
#8
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3456(<-[n]3cnn(C(c7ccc(C#N)cc7)c7ccc(C#N)cc7)c3)[CH]3C=CC(=C[CH]34)P(...
#9
0.00 ± 0.00
N#Cc1ccc2C(c3ccc(C#N)[cH]4->[Ru+2](<-[cH]1c2)<-[cH]34)n1cncn1
#9
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)[cH](->[Ru+2]<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(C#N)cc4)c3)c2)n2cncn2)cc1
#9
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]34(<-[n]3cnn(C(c5ccc(C#N)cc5)c5ccc(C#N)cc5)c3)[CH]3C=CC(P(c5ccccc5)c5...
#10
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)c[cH]2->[Ru+2])n2cncn2)cc1
#10
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]34<-[cH]5cc(C#N)ccc5C(c5ccc(C#N)[cH]->3[cH]->45)n3cncn3)cn2)...
#10
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]34(<-[cH]3cccc(P(c5ccccc5)c5ccccc5)[cH]->43)<-[n]3cnn(C(c4ccc(C#N)cc4...
#11
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)[cH](->[Ru+2])c2)n2cncn2)cc1
#11
0.00 ± 0.00
N#Cc1ccc(C(c2ccc(C#N)cc2)n2c[n](->[Ru+2]34<-[cH]5cc(C(c6ccc(C#N)[cH]->3[cH]->46)n3cncn3)ccc5C#N)cn2)...
#11
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]345(<-[cH]3ccccc3P(c3ccccc3)c3ccc[cH]->4[cH]->53)<-[n]3cnn(C(c4ccc(C#...
#12
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3456(<-[cH]3cc(P(c7ccccc7)c7ccccc7)[cH]->4[cH]->5[cH]->63)<-[n]3cnn(C...
#13
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]345(<-[cH]3ccccc3P(c3ccccc3)c3cc[cH]->4[cH]->5c3)<-[n]3cnn(C(c4ccc(C#...
#14
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]345(<-[cH]3cccc(P(c6ccccc6)c6ccc[cH]->4[cH]->56)c3)<-[n]3cnn(C(c4ccc(...
#15
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]345(<-[cH]3ccc(P(c6ccccc6)c6ccc[cH]->4[cH]->56)cc3)<-[n]3cnn(C(c4ccc(...
#16
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3(<-[cH]3ccccc3P(c3ccccc3)c3ccccc3)<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(C#...
#17
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]34(<-[cH]3ccc(P(c5ccccc5)c5ccccc5)c[cH]->43)<-[n]3cnn(C(c4ccc(C#N)cc4...
#18
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]345(<-[cH]3cccc(P(c6ccccc6)c6cc[cH]->4[cH]->5c6)c3)<-[n]3cnn(C(c4ccc(...
#19
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]345(<-[cH]3ccc(P(c6ccccc6)c6cc[cH]->4[cH]->5c6)cc3)<-[n]3cnn(C(c4ccc(...
#20
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3(<-[cH]3ccc(P(c4ccccc4)c4ccccc4)cc3)<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(...
#21
0.00 ± 0.00
N#Cc1ccc(C(c2ccc([C]3=[N][Ru+2]3(<-[cH]3cccc(P(c4ccccc4)c4ccccc4)c3)<-[n]3cnn(C(c4ccc(C#N)cc4)c4ccc(...