0 B8R1.2 BrCC1=CCCCC1 SPC-j295 [0,0,0,1,0,0|1,0,2]=4 1 B8R1.2 ClCC1=NN=CC=C1 SPC-j100 [0,0,0,1,0,0|3,0,0]=4 2 B8R1.2 NCC1=CC=CN=N1 SPC-j018 [0,0,0,1,0,0|3,0,0]=4 3 B8R1.2 NCC1=CC=CN=N1 SPC-q241 [0,0,0,1,0,0|3,0,0]=4 4 B8R1.2 OCC1=CN=CC=C1 SPC-g084 [0,0,0,1,0,0|1,0,1]=3 5 B8R1.2 OCC1=CN=CN=C1 SPC-g744 [0,0,0,1,0,0|2,0,1]=4 6 B8R1.2 OCC1=CN=NC=C1 SPC-j088 [0,0,0,1,0,0|2,0,1]=4 7 B8R1.2 OCC1=NC=CC=N1 SPC-g700 [0,0,0,1,0,0|2,0,1]=4 8 B8R1.2 OCC1=NC=CN=C1 SPC-g622 [0,0,0,1,0,0|2,0,1]=4 9 B8R1.2 OCC1=NC=NC=C1 SPC-g987 [0,0,0,1,0,0|2,0,1]=4 10 B8R1.2 OCC1=NN=CC=C1 SPC-g951 [0,0,0,1,0,0|2,0,0]=3 11 B8R1.5 CC1=C(O)C=CC=N1 SPC-g264 [0,0,0,1,0,0|1,0,2]=4 12 B8R1.11 CN1C=CN=C1CN SPC-u748 [0,0,0,1,0,0|3,0,0]=4 13 B8R1.11 CN1C=NC=C1CN SPC-j569 [0,0,0,1,0,0|3,0,0]=4 14 B8R1.11 CN1C=NC=C1CO SPC-k909 [0,0,0,1,0,0|2,0,0]=3 15 B8R1.11 OCC1=C(Br)C=CS1 SPC-m799 [0,0,0,1,0,0|2,0,1]=4 16 B8R1.11 OCC1=C(Cl)C=CS1 SPC-k814 [0,0,0,1,0,0|2,0,1]=4 17 B7R1.1 BrCC1=CCCC1 SPC-n905 [1,0,0,1,0,0|1,0,1]=4 18 B7R1.1 NCC1=CN=CO1 SPC-u502 [1,0,0,1,0,0|2,0,0]=4 19 B7R1.1 OCC1=CNC=N1 SPC-s789 [1,0,0,1,0,0|2,0,0]=4 20 B7R1.1 OCC1=COC=N1 SPC-k823 [1,0,0,1,0,0|2,0,0]=4 21 B7R1.1 OCC1=NNC=C1 SPC-j656 [1,0,0,1,0,0|2,0,0]=4 22 B7R1.1 OCC1=NOC=C1 SPC-k850 [1,0,0,1,0,0|2,0,0]=4 23 B7R1.1 OCC1CC=CC1 SPC-m309 [1,0,0,1,0,0|0,0,2]=4 24 B7R1.3 CC1=CC=CN=N1 SPC-g427 [1,0,0,1,0,0|2,0,0]=4 25 B7R1.3 CC1=CCNCC1 SPC-h455 [1,0,0,1,0,0|1,0,1]=4 26 B9R1.2 CC1=CC(CO)=CN=C1 SPC-j744 [0,1,0,1,0,0|1,0,1]=4 27 B9R1.2 CC1=CC(CO)=NN=C1 SPC-n800 [0,1,0,1,0,0|2,0,0]=4 28 B9R1.2 CC1=CC=NC(CO)=N1 SPC-k971 [0,1,0,1,0,0|1,0,1]=4 29 B9R1.2 CCC1=NC=CC(N)=C1 SPC-p223 [0,1,0,1,0,0|1,0,1]=4 30 B9R1.2 OCC1=CC(Br)=CN=C1 SPC-g623 [0,1,0,1,0,0|1,0,1]=4 31 B9R1.2 OCC1=CC(F)=CN=C1 SPC-h492 [0,1,0,1,0,0|1,0,1]=4 32 B9R1.2 OCC1=NC=CC(Br)=C1 SPC-h210 [0,1,0,1,0,0|1,0,1]=4 33 B9R1.15 CC1=C(CBr)C=CC=N1 SPC-s887 [0,1,0,1,0,0|1,0,1]=4 34 B9R1.15 CC1=C(CCl)C=CN=C1 SPC-p437 [0,1,0,1,0,0|1,0,1]=4 35 B9R1.15 CC1=C(CN)C=NC=C1 SPC-m008 [0,1,0,1,0,0|1,0,1]=4 36 B9R1.15 CC1=C(CO)C=CN=C1 SPC-n741 [0,1,0,1,0,0|0,0,1]=3 37 B9R1.15 CC1=C(CO)C=NC=C1 SPC-r211 [0,1,0,1,0,0|0,0,1]=3 38 B9R1.15 CC1=NC=CN=C1CO SPC-m052 [0,1,0,1,0,0|1,0,1]=4 39 B9R1.15 CCC1=C(Br)C=CN=C1 SPC-i884 [0,1,0,1,0,0|1,0,1]=4 40 B9R1.15 CCC1=C(Br)C=CN=C1 SPC-r184 [0,1,0,1,0,0|1,0,1]=4 41 B9R1.15 CCC1=C(Br)C=NC=C1 SPC-p344 [0,1,0,1,0,0|1,0,1]=4 42 B9R1.15 O=C1NC=CC=C1CO SPC-n030 [0,1,0,1,0,0|1,0,1]=4 43 B9R1.15 OCC1=C(F)C=CC=N1 SPC-h122 [0,1,0,1,0,0|1,0,1]=4 44 B9R1.15 OCC1=C(F)C=CN=C1 SPC-n782 [0,1,0,1,0,0|1,0,1]=4 45 B9R1.15 OCC1=C(F)C=NC=C1 SPC-j545 [0,1,0,1,0,0|1,0,1]=4 46 B9R1.15 OCC1=CC=CN=C1Cl SPC-g018 [0,1,0,1,0,0|1,0,1]=4 47 B9R1.22 CC1=NN(C)C(CO)=C1 SPC-h121 [0,1,0,1,0,0|2,0,0]=4 48 B9R1.1 CCC1=NC=C(Br)C=C1 SPC-n190 [0,1,0,1,0,0|1,0,1]=4 49 B9R1.1 NC1=NC=C(CO)C=C1 SPC-j263 [0,1,0,1,0,0|1,0,1]=4 50 B9R1.1 OCC1=NC=C(F)C=C1 SPC-h241 [0,1,0,1,0,0|1,0,1]=4 51 B9R1.1 OCC1=NN=C(Cl)C=C1 SPC-m095 [0,1,0,1,0,0|2,0,0]=4 52 B9R1.6 CC(C)C1=NC=CC=C1 SPC-g429 [0,1,0,1,0,0|1,0,1]=4 53 B9R1.6 C[C@H](O)C1=CC=CC=C1 SPC-s644 [0,1,0,1,0,0|0,0,2]=4