0 B13R2.1613 BrCC1=CN=CC2=CC=CC=C21 78504 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 12214 [1,0,0,0,0,0|2,0,0]=3 2 B12R2.1081 BrC1=CN=CC2=CC=NC=C12 AT10479 [1,0,0,0,0,0|3,0,0]=4 3 B12R2.1081 BrC1=CN=CC2=CN=CC=C12 AT12766 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.1081 BrC1=NC=CC2=CC=NC=C21 AT12765 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.1081 ClC1=NN=CC2=CN=CC=C21 83751 [1,0,0,0,0,0|2,0,0]=3 6 B12R2.1081 ClC1=NN=CC2=NC=CC=C12 84402 [1,0,0,0,0,0|2,0,0]=3 7 B12R2.1081 NC1=NC=CC2=CN=CC=C21 AT10483 [1,0,0,0,0,0|2,0,0]=3 8 B14R2.203 N#CC1=C(O)N=CC2=CC=CC=C21 C10011 [0,1,0,0,0,0|2,0,1]=4 9 B14R2.1078 CC1=C2C=CN=C(CO)C2=CC=C1 F30683 [0,1,0,0,0,0|3,0,0]=4 10 B14R2.1131 CC1=NN=C(C#N)C2=CC=CC=C21 C91927 [0,1,0,0,0,0|1,0,1]=3 11 B14R2.1131 NCC1=CC=C(N)C2=CC=CC=C12 D75957 [0,1,0,0,0,0|3,0,0]=4 12 B14R2.11684 CC1=CC=C2C=CN=C(CO)C2=C1 F30686 [0,1,0,0,0,0|3,0,0]=4 13 B14R2.11684 N#CC1=C2C=C(Cl)C=CC2=CC=N1 81104 [0,1,0,0,0,0|2,0,1]=4 14 B14R2.11684 NCC1=C2C=C(Cl)C=CC2=CC=N1 AT25637 [0,1,0,0,0,0|2,0,0]=3 15 B14R2.11684 O=CC1=C2C=C(Cl)C=CC2=CC=N1 AT25628 [0,1,0,0,0,0|3,0,0]=4 16 B14R2.31359 O=C(O)C1=NN=CC2=CC=CC=C21 P18648 [0,1,0,0,0,0|2,0,0]=3 17 B12R2.1 O=CC1=C2C=CC=CC2=NO1 AC6722 [0,0,0,0,1,0|3,0,0]=4 18 B11R1.222 CC1=C(C(=S)NN)C=CC=C1 W10975 [1,0,1,0,0,0|1,0,1]=4 19 B13R2.162 CC1=C2C=C(Br)C=CC2=CN=C1 79128 [1,1,0,0,0,0|2,0,0]=4 20 B13R2.162 NC1=C2C=C(F)C=CC2=CC=N1 K10314 [1,1,0,0,0,0|1,0,0]=3 21 B13R2.162 NC1=C2C=C(F)C=CC2=CN=C1 K10184 [1,1,0,0,0,0|1,0,0]=3 22 B13R2.162 NC1=CC=C2C=NC=C(Br)C2=C1 D71265 [1,1,0,0,0,0|2,0,0]=4 23 B13R2.162 O=C1NN=CC2=C1C=C(Cl)C=C2 AT14850 [1,1,0,0,0,0|1,0,1]=4 24 B13R2.162 OC1=CC=C2C=NC=C(Br)C2=C1 K10287 [1,1,0,0,0,0|2,0,0]=4 25 B13R2.342 CC1=NC=CC2=C(N)C=CC=C12 96526 [1,1,0,0,0,0|2,0,0]=4 26 B13R2.342 NC1=C2C=CC=C(F)C2=NC=N1 D74555 [1,1,0,0,0,0|2,0,0]=4 27 B13R2.342 NC1=C2C=NC=C(Cl)C2=CC=C1 33272 [1,1,0,0,0,0|2,0,0]=4 28 B13R2.342 NC1=C2C=NC=C(F)C2=CC=C1 K10001 [1,1,0,0,0,0|2,0,0]=4 29 B13R2.342 O=C1NN=CC2=C(Br)C=CC=C12 AT26853 [1,1,0,0,0,0|1,0,1]=4 30 B13R2.371 ClC1=NN=C(Br)C2=CC=CC=C21 AT14842 [1,1,0,0,0,0|1,0,0]=3 31 B13R2.4818 CC1=C2C(=CC=C1)N=CN=C2N D74587 [1,1,0,0,0,0|2,0,0]=4 32 B13R2.4818 NC1=C2C(O)=CC=CC2=CC=C1 AT25691 [1,1,0,0,0,0|2,0,0]=4 33 B13R2.4818 O=C1NN=CC2=CC=CC(Br)=C12 AT26854 [1,1,0,0,0,0|1,0,1]=4 34 B13R2.4818 OC1=C2C(Cl)=CN=CC2=CC=C1 K10066 [1,1,0,0,0,0|2,0,0]=4 35 B13R2.5179 CC1=C2C=CC(Br)=CC2=CN=C1 D75503 [1,1,0,0,0,0|2,0,0]=4 36 B13R2.5179 CC1=C2C=CC(Cl)=CC2=CN=C1 D75502 [1,1,0,0,0,0|2,0,0]=4 37 B13R2.5179 CC1=CC=C2C(=C1)N=CN=C2N D74591 [1,1,0,0,0,0|2,0,0]=4 38 B13R2.5179 ClC1=CC=C2C(=C1)C=NN=C2Cl P11442 [1,1,0,0,0,0|1,0,0]=3 39 B13R2.5179 NC1=C2C=CC(F)=CC2=CC=C1 AT23037 [1,1,0,0,0,0|2,0,0]=4 40 B13R2.5179 NC1=C2C=CC(F)=CC2=CC=C1 F53478 [1,1,0,0,0,0|2,0,0]=4 41 B13R2.5179 NC1=C2C=CC(F)=CC2=CN=C1 K10009 [1,1,0,0,0,0|1,0,0]=3 42 B13R2.5179 NC1=C2C=CC(F)=CC2=NC=N1 D74556 [1,1,0,0,0,0|2,0,0]=4 43 B13R2.662 NCC1=NOC2=C1C=CC(Br)=C2 93321 [0,1,0,0,1,0|2,0,0]=4 44 B13R2.662 NCC1=NOC2=C1C=CC(F)=C2 95568 [0,1,0,0,1,0|2,0,0]=4 45 B13R2.2136 NCC1=NSC2=C1C=C(Cl)C=C2 AT25624 [0,1,0,0,1,0|2,0,0]=4 46 B11R2.1 BrC1=NOC2=C1C=CC=C2 D77128 [1,0,0,0,1,0|2,0,0]=4 47 B11R2.1 NC1=C2C=CC=CC2=NO1 AC2203 [1,0,0,0,1,0|1,0,0]=3 48 B11R2.106 NC1=C2C=CNC2=CN=C1 I11177 [1,0,0,0,1,0|2,0,0]=4 49 B11R2.106 NC1=C2C=CNC2=CN=C1 P14858 [1,0,0,0,1,0|2,0,0]=4