0 B9R1.15 CC1=C(CCl)C=CN=C1 4010334 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.15 CC1=C(CCl)N=CC=C1 4088897 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.15 CC1=C(CN)C=CN=C1 4088420 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.15 CC1=C(NN)C=CN=C1 4088209 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.15 CC1=NC=CC=C1CCl 4088270 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.15 CC1=NC=CN=C1C=O 4030187 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.15 CCC1=CC=CN=C1Cl 4037222 [0,0,0,0,0,0|3,0,1]=4 7 B8R1.2 BrCC1=CN=CC=C1 4090400 [1,0,0,0,0,0|2,0,1]=4 8 B8R1.2 NNC1=CC=CN=C1 4090882 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.2 NNC1=CC=NC=C1 4089280 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.2 O=CC1=CC=NN=C1 4015481 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.2 CC1=C(Cl)C=CC=C1NN 4088656 [0,1,0,0,0,0|3,0,0]=4 12 B10R1.4 CC1=C(CNN)C=CC=C1 4089820 [0,1,0,0,0,0|2,0,1]=4 13 B10R1.4 CNCC1=CC=CC=C1C 4090872 [0,1,0,0,0,0|2,0,1]=4 14 B10R1.4 NNCC1=C(Cl)C=CC=C1 4090851 [0,1,0,0,0,0|2,0,1]=4 15 B10R1.4 O=C=NC1=CC=CC=C1Br 3020265 [0,1,0,0,0,0|1,0,1]=3 16 B10R1.20 CNC1=NC=CC=C1C=O 4090184 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.20 COC1=CC=CN=C1CCl 4089597 [0,1,0,0,0,0|2,0,1]=4 18 B10R1.25 NCC1=C(O)C=C(O)C=C1 4089662 [0,1,0,0,0,0|1,0,1]=3 19 B10R1.30 CCC1=C(N)C=CC(I)=C1 4091033 [0,1,0,0,0,0|2,0,1]=4 20 B10R1.30 CCC1=CC(Cl)=CC=C1N 4091185 [0,1,0,0,0,0|2,0,1]=4 21 B10R1.61 CC(=O)C1=CC=CN=C1Cl 4031453 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 4090561 [0,1,0,0,0,0|2,0,1]=4 23 B10R1.61 CC(N)C1=C(O)C=CC=C1 4088363 [0,1,0,0,0,0|1,0,1]=3 24 B9R1.2 CNC1=CC(Cl)=CC=C1 3020438 [1,1,0,0,0,0|2,0,0]=4 25 B9R1.2 O=CC1=CC(O)=NC=N1 4110682 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.6 CC(=O)C1=NC=CN=C1 3020083 [1,1,0,0,0,0|2,0,0]=4 27 B9R1.3 NC1=C(O)C(Cl)=NC=C1 4054311 [1,1,0,0,0,0|2,0,0]=4 28 B9R1.69 CC1=CC(=O)C(O)=CO1 4045348 [1,1,0,0,0,0|1,0,0]=3 29 B9R1.27 CC1=NNC(O)=C1C=O 3001850 [0,1,0,0,1,0|2,0,0]=4 30 B9R1.41 CC1=C(C(=O)O)SC=C1 3020058 [0,1,0,0,1,0|2,0,0]=4 31 B9R1.41 CN1C=CC=C1C(=O)O 3020106 [0,1,0,0,1,0|2,0,0]=4 32 B9R1.41 NC(=O)C1=C(N)SC=C1 3014696 [0,1,0,0,1,0|2,0,0]=4 33 B11R1.17 C=CCOC1=CC=CC=C1N 4090105 [0,2,0,0,0,0|2,0,0]=4 34 B11R1.41 COC1=CC=CC=C1N=C=O 3020271 [0,2,0,0,0,0|0,0,1]=3 35 B11R1.81 CC1=CC(Cl)=C(N=C=O)C=C1 3001940 [0,2,0,0,0,0|1,0,1]=4 36 B11R1.37 COC1=C(C=O)C=C(C)N=C1 4067969 [0,2,0,0,0,0|1,0,0]=3 37 B11R1.53 NCC1=CC=CC=C1C(=O)O 4090789 [0,2,0,0,0,0|1,0,0]=3 38 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 4089795 [0,2,0,0,0,0|2,0,0]=4 39 B11R1.167 NC(=O)C1=C(Br)C=CC(N)=C1 4089536 [0,2,0,0,0,0|1,0,0]=3 40 B11R2.106 BrC1=C2C=COC2=CC=C1 4018336 [0,1,0,1,0,0|1,0,0]=3 41 B11R2.106 ClC1=CC=CC2=C1C=CN2 3020086 [0,1,0,1,0,0|2,0,0]=4 42 B11R2.106 OC1=C2ON=CC2=CC=C1 4041159 [0,1,0,1,0,0|1,0,0]=3 43 B11R2.1 CC1=NNC2=CC=CC=C21 4088223 [0,1,0,1,0,0|2,0,0]=4 44 B11R2.1 NC1=NOC2=CC=CC=C21 3020311 [0,1,0,1,0,0|1,0,0]=3 45 B11R2.1 NC1COC2=CC=CC=C21 4088614 [0,1,0,1,0,0|1,0,1]=4 46 B11R2.36 BrC1=CC2=C(C=C1)OC=N2 4002139 [0,1,0,1,0,0|2,0,0]=4 47 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 3020104 [0,1,0,1,0,0|2,0,0]=4 48 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 3020088 [0,1,0,1,0,0|2,0,0]=4 49 B7R1.1 O=CC1=CC=NS1 4030495 [1,0,0,0,1,0|2,0,0]=4 50 B7R1.1 O=CC1=CSN=C1 4030020 [1,0,0,0,1,0|2,0,0]=4