0 B7R1.4 CC1=C(Br)SN=C1 ACI-NI-00748 [0,0,0,0,0,0|3,1,0]=4 1 B7R1.4 CC1=C([S-])SN=N1 ACI-00617 [0,0,0,0,0,0|3,0,1]=4 2 B7R1.4 CC1=NSC=C1Br ACI-NI-00720 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.4 CC1=NSC=C1N ACI-NI-00743 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.4 CN1N=CC=C1N RH-05E-001 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.4 ClC1=C(Br)SC=C1 ACI-02394 [0,0,0,0,0,0|2,1,0]=3 6 B7R1.4 NC1=NNC=C1I FD-09B-002 [0,0,0,0,0,0|4,0,0]=4 7 B6R1.2 BrC1=CC=NS1 ACI-NI-00773 [1,0,0,0,0,0|2,1,0]=4 8 B6R1.2 BrC1=CNN=C1 ACI-00753 [1,0,0,0,0,0|3,0,0]=4 9 B6R1.2 BrC1=NNC=C1 ACI-01841 [1,0,0,0,0,0|3,0,0]=4 10 B6R1.2 CC1=CC=NS1 ACI-NI-00772 [1,0,0,0,0,0|1,1,0]=3 11 B6R1.2 CC1=CSN=C1 ACI-NI-00745 [1,0,0,0,0,0|2,1,0]=4 12 B6R1.2 CC1=CSN=N1 ACI-05802 [1,0,0,0,0,0|3,0,0]=4 13 B6R1.2 CC1=NSC=C1 ACI-00539 [1,0,0,0,0,0|2,0,0]=3 14 B6R1.2 ClC1=CNN=C1 ACI-00754 [1,0,0,0,0,0|3,0,0]=4 15 B6R1.2 NC1=CC=NO1 ACI-00943 [1,0,0,0,0,0|2,0,0]=3 16 B6R1.2 NC1=NC=CO1 ACI-00944 [1,0,0,0,0,0|2,0,0]=3 17 B6R1.2 NC1=NNC=C1 ACI-03851 [1,0,0,0,0,0|3,0,0]=4 18 B6R1.2 O=C1C=CSN1 ACI-04102 [1,0,0,0,0,0|1,2,0]=4 19 B6R1.2 OC1=CC=NN1 ACI-00667 [1,0,0,0,0,0|2,1,0]=4 20 B6R1.2 OC1=NOC=C1 ACI-04840 [1,0,0,0,0,0|1,1,0]=3 21 B6R1.2 OC1=NSC=C1 ACI-04841 [1,0,0,0,0,0|1,2,0]=4 22 B8R1.11 CC1=C(CCl)ON=C1 ACI-04860 [0,1,0,0,0,0|2,0,0]=3 23 B8R1.11 CC1=C(CN)C=CO1 JM-10L-001 [0,1,0,0,0,0|1,0,0]=2 24 B8R1.11 CC1=C(CN)SC=C1 ACI-04730 [0,1,0,0,0,0|1,1,0]=3 25 B8R1.11 CC1=C(CO)NN=C1 ACI-04855 [0,1,0,0,0,0|3,0,0]=4 26 B8R1.11 CC1=C(CO)OC=C1 ACI-02282 [0,1,0,0,0,0|1,0,0]=2 27 B8R1.11 CC1=C(CO)ON=C1 ACI-04859 [0,1,0,0,0,0|2,0,0]=3 28 B8R1.11 CC1=C(CO)SC=N1 ACI-00573 [0,1,0,0,0,0|2,1,0]=4 29 B8R1.11 CC1=NSC=C1C#N ACI-NI-00747 [0,1,0,0,0,0|3,0,0]=4 30 B8R1.11 CN1N=CC=C1C=O ACI-00851 [0,1,0,0,0,0|2,1,0]=4 31 B8R1.11 O=CC1=C(Br)C=CS1 ACI-00955 [0,1,0,0,0,0|1,1,1]=4 32 B8R1.11 O=CC1=C(Br)SC=C1 ACI-01273 [0,1,0,0,0,0|1,2,0]=4 33 B8R1.11 OCC1=C(Br)SC=C1 RH-08D-002 [0,1,0,0,0,0|1,2,0]=4 34 B8R1.18 CC1=C(Cl)SC(Cl)=C1 ACI-04717 [0,1,0,0,0,0|2,1,0]=4 35 B8R1.18 CC1=CC(C)=NN1C ACI-00025 [0,1,0,0,0,0|3,0,0]=4 36 B8R1.18 CC1=NN(C)C(Cl)=C1 ACI-01470 [0,1,0,0,0,0|3,0,0]=4 37 B8R1.18 CC1=NN(C)C(O)=C1 ACI-01469 [0,1,0,0,0,0|2,1,0]=4 38 B8R1.50 CC1=C(Br)C(N)=NO1 ACI-01227 [0,1,0,0,0,0|2,0,0]=3 39 B8R1.50 CC1=C(Cl)C(N)=NO1 ACI-00541 [0,1,0,0,0,0|2,0,0]=3 40 B8R1.50 CC1=NC=C(Br)N1C JM-08L-001 [0,1,0,0,0,0|3,0,0]=4 41 B8R1.50 CC1=NNC(C)=C1Br ACI-01464 [0,1,0,0,0,0|3,0,0]=4 42 B8R1.50 CC1=NNC(N)=C1Br ACI-03773 [0,1,0,0,0,0|3,0,0]=4 43 B8R1.50 CC1=NOC(C)=C1I ACI-02249 [0,1,0,0,0,0|2,0,0]=3 44 B8R1.50 CC1=NSC(N)=C1Br ACI-NI-00728 [0,1,0,0,0,0|3,0,0]=4 45 B8R1.50 CC1=NSC(N)=C1Cl ACI-00532 [0,1,0,0,0,0|3,0,0]=4 46 B8R1.4 BrC1=CC=CC(Br)=N1 ACI-00415 [0,0,0,0,0,1|3,0,0]=4 47 B8R1.4 CC1=CC(F)=NC=C1 ACI-00433 [0,0,0,0,0,1|3,0,0]=4 48 B8R1.4 CC1=CC(O)=NC=N1 ACI-01031 [0,0,0,0,0,1|2,1,0]=4 49 B8R1.4 CC1=NC(I)=CC=C1 FD-10L-002 [0,0,0,0,0,1|2,0,0]=3 50 B8R1.4 CC1=NC(N)=CC=N1 ACI-03853 [0,0,0,0,0,1|2,0,0]=3 51 B8R1.4 CC1=NC(N)=NC=C1 ACI-01353 [0,0,0,0,0,1|3,0,0]=4 52 B8R1.4 CC1=NC(O)=NC=C1 ACI-01352 [0,0,0,0,0,1|2,1,0]=4 53 B8R1.4 CC1=NC(S)=NC=C1 ACI-01351 [0,0,0,0,0,1|2,0,0]=3 54 B8R1.4 CC1=NC(S)=NC=C1 ACI-03785 [0,0,0,0,0,1|2,0,0]=3 55 B8R1.4 CC1=NC=NC(N)=C1 ACI-03854 [0,0,0,0,0,1|3,0,0]=4 56 B8R1.4 NC1=NC(Cl)=CC=C1 ACI-00840 [0,0,0,0,0,1|3,0,0]=4 57 B8R1.4 SC1=NC(S)=NN=C1 ACI-01792 [0,0,0,0,0,1|3,0,0]=4 58 B8R1.5 ClC1=CC=CN=C1Cl ACI-00410 [0,0,0,0,0,1|3,0,0]=4 59 B8R1.5 NC1=CC=CN=C1Cl ACI-00447 [0,0,0,0,0,1|3,0,0]=4 60 B8R1.5 OC1=CC=CN=C1F ACI-01438 [0,0,0,0,0,1|2,1,0]=4 61 B7R1.1 NCC1=CSC=C1 ACI-00305 [1,1,0,0,0,0|1,1,0]=4 62 B7R1.1 O=CC1=CC=NO1 ACI-04961 [1,1,0,0,0,0|1,0,1]=4 63 B7R1.1 OCC1=CN=CN1 ACI-01502 [1,1,0,0,0,0|2,0,0]=4 64 B7R1.1 OCC1=CN=CS1 ACI-00689 [1,1,0,0,0,0|1,1,0]=4 65 B7R1.2 CC1=CC(C)=NN1 ACI-00749 [1,1,0,0,0,0|2,0,0]=4 66 B7R1.2 CC1=COC(N)=N1 ACI-00543 [1,1,0,0,0,0|2,0,0]=4 67 B7R1.2 CC1=CSC(N)=N1 RJC-04J-001 [1,1,0,0,0,0|2,0,0]=4 68 B7R1.2 CC1=NSC(Br)=C1 ACI-00534 [1,1,0,0,0,0|2,0,0]=4 69 B7R1.2 CC1=NSC(I)=C1 ACI-NI-00723 [1,1,0,0,0,0|2,0,0]=4 70 B7R1.2 CC1=NSC(N)=C1 ACI-00530 [1,1,0,0,0,0|2,0,0]=4 71 B7R1.2 CN1C=C(Cl)C=N1 ACI-01463 [1,1,0,0,0,0|2,0,0]=4 72 B7R1.2 CN1C=C(N)C=N1 ACI-03790 [1,1,0,0,0,0|2,0,0]=4 73 B7R1.2 CN1C=CC(Cl)=N1 ACI-02549 [1,1,0,0,0,0|2,0,0]=4 74 B7R1.2 CN1C=CC(N)=N1 ACI-00344 [1,1,0,0,0,0|2,0,0]=4 75 B7R1.2 O=C1CC(O)=CO1 JM-02K-001 [1,1,0,0,0,0|0,1,1]=4 76 B9R1.2 CC1=NC=CC(C#N)=C1 ACI-02494 [0,1,0,0,0,1|2,0,0]=4 77 B9R1.3 CC1=C(Br)C=CC=C1S ACI-02417 [0,1,0,0,0,1|2,0,0]=4 78 B9R1.3 CC1=CC=CC(Br)=C1S ACI-04004 [0,1,0,0,0,1|2,0,0]=4 79 B9R1.3 FC1=C(Br)C=CC=C1S ACI-02552 [0,1,0,0,0,1|2,0,0]=4 80 B9R1.3 FC1=CC=CC(S)=C1Br ACI-02562 [0,1,0,0,0,1|2,0,0]=4 81 B9R1.34 CC1=CC(S)=CC(Br)=C1 ACI-02421 [0,1,0,0,0,1|1,0,0]=3 82 B9R1.34 FC1=CC(Br)=CC(S)=C1 ACI-02565 [0,1,0,0,0,1|2,0,0]=4 83 B9R1.34 FC1=CC(Cl)=CC(S)=C1 ACI-04611 [0,1,0,0,0,1|2,0,0]=4 84 B9R1.34 SC1=CC(Br)=CC(Cl)=C1 ACI-02425 [0,1,0,0,0,1|2,0,0]=4 85 B9R1.34 SC1=CC(S)=CC(S)=C1 JM-11J-004 [0,1,0,0,0,1|2,0,0]=4 86 B9R1.69 CC1=C(Br)C=C(S)C=C1 ACI-02349 [0,1,0,0,0,1|2,0,0]=4 87 B9R1.69 CC1=CC(Br)=C(S)C=C1 ACI-02406 [0,1,0,0,0,1|2,0,0]=4 88 B9R1.69 CC1=CC(S)=CC=C1Br ACI-02413 [0,1,0,0,0,1|1,0,0]=3 89 B9R1.69 CC1=CC=C(N)C(N)=N1 ACI-04395 [0,1,0,0,0,1|2,0,0]=4 90 B9R1.69 CC1=CC=C(N)C(S)=C1 ACI-04795 [0,1,0,0,0,1|1,0,0]=3 91 B9R1.69 CC1=CC=C(O)C(Br)=N1 ACI-00986 [0,1,0,0,0,1|2,0,0]=4 92 B9R1.69 CC1=CC=C(O)C(I)=N1 ACI-01009 [0,1,0,0,0,1|2,0,0]=4 93 B9R1.69 FC1=CC(S)=CC=C1Br ACI-02581 [0,1,0,0,0,1|2,0,0]=4 94 B9R1.69 FC1=CC=C(Br)C(S)=C1 ACI-02557 [0,1,0,0,0,1|2,0,0]=4 95 B9R1.69 FC1=CC=C(Br)C=C1S ACI-02554 [0,1,0,0,0,1|2,0,0]=4 96 B9R1.69 FC1=CC=C(S)C=C1Br ACI-02567 [0,1,0,0,0,1|2,0,0]=4 97 B9R1.69 NC1=CC=C(Br)C=C1S ACI-04794 [0,1,0,0,0,1|2,0,0]=4 98 B9R1.69 NC1=CC=C(Cl)C=C1S ACI-04793 [0,1,0,0,0,1|2,0,0]=4 99 B9R1.15 CC1=C(C#N)C=CN=C1 ACI-02495 [0,1,0,0,0,1|2,0,0]=4 100 B9R1.15 CC1=CC=CN=C1NN ACI-01436 [0,1,0,0,0,1|2,0,0]=4 101 B9R1.15 CNC1=CC=CC=C1O ACI-05339 [0,1,0,0,0,1|1,1,0]=4 102 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06376 [0,1,0,0,0,1|2,0,0]=4 103 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06377 [0,1,0,0,0,1|2,0,0]=4 104 B9R1.15 COC1=CC=CN=C1Br ACI-01447 [0,1,0,0,0,1|2,0,0]=4 105 B9R1.15 ClCC1=CC=CC=C1Br ACI-03860 [0,1,0,0,0,1|2,0,0]=4 106 B9R1.15 ClCC1=CC=CN=C1Cl WS-02I-002 [0,1,0,0,0,1|2,0,0]=4 107 B9R1.15 NCC1=CC=CC=C1O ACI-02209 [0,1,0,0,0,1|1,1,0]=4 108 B9R1.15 OCC1=CC=CN=C1Cl ACI-NI-00467 [0,1,0,0,0,1|2,0,0]=4 109 B9R1.41 CC1=C(C(=O)Cl)C=CO1 RH-11J-001 [0,2,0,0,0,0|0,1,0]=3 110 B9R1.41 CC1=C(C(=O)Cl)C=NO1 ACI-NI-00036 [0,2,0,0,0,0|1,1,0]=4 111 B9R1.41 CC1=C(C(=O)O)C=NO1 ACI-NI-00035 [0,2,0,0,0,0|1,1,0]=4 112 B9R1.41 CC1=C(C(N)=O)C=CO1 RH-11A-003 [0,2,0,0,0,0|0,1,0]=3 113 B9R1.41 CC1=C(C(N)=O)C=NO1 ACI-05350 [0,2,0,0,0,0|1,1,0]=4 114 B9R1.41 CC1=C(C(N)=O)OC=C1 JM-11A-005 [0,2,0,0,0,0|1,0,1]=4 115 B9R1.23 O=CC1=CC(Br)=C(Br)O1 ACI-04650 [0,2,0,0,0,0|2,0,0]=4