0  B9R1.69  CC1=CC(N)=NC=C1Br HY-17562 [0,0,0,0,0,0|3,1,0]=4
1  B9R1.69  CC1=CNC(=O)NC1=O HY-W010450R [0,0,0,0,0,0|2,0,1]=3
2  B9R1.69  NC1=NC(=O)NC=C1F HY-B0139 [0,0,0,0,0,0|0,0,2]=2
3  B9R1.69  O=C1NCC(F)C(=O)N1 HY-134160 [0,0,0,0,0,0|1,0,3]=4
4  B9R1.69  O=C1[15NH]C=C(F)C(=O)[15NH]1 HY-90006S2 [0,0,0,0,0,0|1,0,1]=2
5  B8R1.3  ClC1=NC=C(Br)C=N1 HY-76897 [1,0,0,0,0,0|1,1,1]=4
6  B8R1.3  FC1=CN=C(Br)C=C1 HY-32748 [1,0,0,0,0,0|2,0,0]=3
7  B8R1.3  NC1=NC=C(F)C=C1 HY-Y0107 [1,0,0,0,0,0|2,0,0]=3
8  B8R1.4  CC1=CC(Br)=NC=C1 HY-W007579 [1,0,0,0,0,0|3,0,0]=4
9  B8R1.4  NC1=NC(=O)NC=C1 HY-I0626R [1,0,0,0,0,0|0,0,2]=3
10  B8R1.4  O=C1C=NNC(=O)N1 HY-W008232 [1,0,0,0,0,0|2,0,1]=4
11  B8R1.4  O=[13C]1[13CH]=[13CH]N[13C](=O)N1 HY-I0960S1 [1,0,0,0,0,0|1,0,1]=3
12  B8R1.5  NC1=C(O)C=NC=C1 HY-W008188 [1,0,0,0,0,0|2,0,0]=3
13  B10R1.22  NC1=NC(=O)C(Br)=C(N)N1 HY-W012467 [0,1,0,0,0,0|1,1,0]=3
14  B10R1.22  [2H]C1=C(F)C(=O)NC(=O)N1 HY-90006S [0,1,0,0,0,0|1,0,1]=3
15  B10R1.25  NC1=C(CO)C=NC(=O)N1 HY-W018324 [0,1,0,0,0,0|1,0,0]=2
16  B7R1.3  ClC1=CC=NC=C1 HY-Y0178 [2,0,0,0,0,0|2,0,0]=4
17  B7R1.3  OC1=CC=NC=C1 HY-W007690 [2,0,0,0,0,0|2,0,0]=4
18  B9R1.34  NC1=CC(Cl)=NC(Cl)=C1 HY-W008199 [1,1,0,0,0,0|2,0,0]=4
19  B9R1.34  N[13C]1=N[13C](=O)N[13C](=O)N1 HY-W010421S [1,1,0,0,0,0|1,0,1]=4