0 B8R1.18 CC1=C(Cl)SC(Cl)=C1 ACI-04717 [0,0,0,0,0,0|3,1,0]=4 1 B8R1.18 CC1=CC(C)=NN1C ACI-00025 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.18 CC1=NN(C)C(Cl)=C1 ACI-01470 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.18 CC1=NN(C)C(O)=C1 ACI-01469 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.2 CC1=CC(C)=NN1 ACI-00749 [1,0,0,0,0,0|2,0,0]=3 5 B7R1.2 CC1=COC(N)=N1 ACI-00543 [1,0,0,0,0,0|1,0,0]=2 6 B7R1.2 CC1=CSC(N)=N1 RJC-04J-001 [1,0,0,0,0,0|1,1,0]=3 7 B7R1.2 CC1=NOC(N)=N1 ACI-02451 [1,0,0,0,0,0|2,0,0]=3 8 B7R1.2 CC1=NSC(Br)=C1 ACI-00534 [1,0,0,0,0,0|3,0,0]=4 9 B7R1.2 CC1=NSC(I)=C1 ACI-NI-00723 [1,0,0,0,0,0|3,0,0]=4 10 B7R1.2 CC1=NSC(N)=C1 ACI-00530 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.2 CN1C=C(Cl)C=N1 ACI-01463 [1,0,0,0,0,0|3,0,0]=4 12 B7R1.2 CN1C=C(N)C=N1 ACI-03790 [1,0,0,0,0,0|3,0,0]=4 13 B7R1.2 CN1C=CC(Cl)=N1 ACI-02549 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.2 CN1C=CC(N)=N1 ACI-00344 [1,0,0,0,0,0|3,0,0]=4 15 B7R1.2 O=C1CC(O)=CO1 JM-02K-001 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.4 CC1=C([S-])SN=N1 ACI-00617 [1,0,0,0,0,0|2,1,0]=4 17 B7R1.4 CC1=NSC=C1Br ACI-NI-00720 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.4 CC1=NSC=C1N ACI-NI-00743 [1,0,0,0,0,0|3,0,0]=4 19 B7R1.4 CN1N=CC=C1N RH-05E-001 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.22 CC1=NN(C)C(C#N)=C1 ACI-02163 [0,1,0,0,0,0|2,0,1]=4 21 B9R1.22 CC1=NN(C)C(CCl)=C1 ACI-00853 [0,1,0,0,0,0|2,0,0]=3 22 B9R1.22 CC1=NN(C)C(CO)=C1 ACI-00854 [0,1,0,0,0,0|2,0,0]=3 23 B9R1.23 CCC1=NN(C)C(Cl)=C1 ACI-04721 [0,1,0,0,0,0|3,0,0]=4 24 B9R1.23 CCC1=NN(C)C(O)=C1 ACI-04719 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.34 CC1=NC(C)=NC(N)=N1 ACI-00382 [0,0,0,0,0,1|2,0,0]=3 26 B9R1.69 CC1=C(Cl)N=CC(N)=C1 ACI-NI-00759 [0,0,0,0,0,1|3,0,0]=4 27 B9R1.69 CC1=C(Cl)N=NC(Cl)=C1 RJC-03C-001 [0,0,0,0,0,1|3,0,0]=4 28 B9R1.69 CC1=C(O)N=NC(O)=C1 ACI-04737 [0,0,0,0,0,1|3,0,0]=4 29 B9R1.69 CC1=CC(Br)=CN=C1N ACI-00411 [0,0,0,0,0,1|3,0,0]=4 30 B9R1.69 CC1=CC=C(N)C(N)=N1 ACI-04395 [0,0,0,0,0,1|3,0,0]=4 31 B9R1.69 CC1=CC=C(O)C(Br)=N1 ACI-00986 [0,0,0,0,0,1|3,0,0]=4 32 B9R1.69 CC1=CC=C(O)C(I)=N1 ACI-01009 [0,0,0,0,0,1|3,0,0]=4 33 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 ACI-00843 [0,0,0,0,0,1|3,0,0]=4 34 B9R1.69 CC1=CN=C(Cl)C(Br)=C1 ACI-00863 [0,0,0,0,0,1|3,0,0]=4 35 B9R1.69 CC1=CN=C(Cl)N=C1Cl ACI-01013 [0,0,0,0,0,1|3,0,0]=4 36 B9R1.69 CC1=CN=C(N)C(Br)=C1 ACI-00837 [0,0,0,0,0,1|3,0,0]=4 37 B9R1.69 CC1=CN=C(N)C(Br)=C1 ACI-01625 [0,0,0,0,0,1|3,0,0]=4 38 B6R1.2 CC1=CC=NS1 ACI-NI-00772 [2,0,0,0,0,0|2,0,0]=4 39 B6R1.2 CC1=CSN=C1 ACI-NI-00745 [2,0,0,0,0,0|2,0,0]=4 40 B6R1.2 CC1=CSN=N1 ACI-05802 [2,0,0,0,0,0|1,1,0]=4 41 B6R1.2 CC1=NSC=C1 ACI-00539 [2,0,0,0,0,0|2,0,0]=4 42 B6R1.2 NC1=NC=CO1 ACI-00944 [2,0,0,0,0,0|1,0,0]=3 43 B8R1.1 CC1=CC(CBr)=NO1 ACI-00511 [1,1,0,0,0,0|2,0,0]=4 44 B8R1.1 CC1=CC(CCl)=NO1 ACI-00252 [1,1,0,0,0,0|2,0,0]=4 45 B8R1.1 CC1=CC(CN)=NO1 JM-11D-001 [1,1,0,0,0,0|2,0,0]=4 46 B8R1.1 CC1=CC(CO)=NO1 ACI-00368 [1,1,0,0,0,0|2,0,0]=4 47 B8R1.1 CC1=NC(C=O)=CO1 SB-08H-004 [1,1,0,0,0,0|0,0,1]=3 48 B8R1.1 CC1=NC(CCl)=CS1 ACI-00968 [1,1,0,0,0,0|0,1,0]=3 49 B8R1.1 CC1=NC(CCl)=NO1 ACI-00542 [1,1,0,0,0,0|1,0,0]=3 50 B8R1.1 CC1=NC=C(C=O)S1 ACI-00574 [1,1,0,0,0,0|0,1,1]=4 51 B8R1.1 CC1=NOC(CBr)=C1 ACI-01825 [1,1,0,0,0,0|2,0,0]=4 52 B8R1.1 CC1=NOC(CN)=C1 JM-05I-002 [1,1,0,0,0,0|2,0,0]=4 53 B8R1.1 CC1=NOC(CO)=C1 RH-08E-002 [1,1,0,0,0,0|2,0,0]=4 54 B8R1.1 CN1C=CC(CCl)=N1 ACI-01838 [1,1,0,0,0,0|2,0,0]=4 55 B8R1.1 CN1C=CC(CO)=N1 RH-06L-001 [1,1,0,0,0,0|2,0,0]=4 56 B8R1.1 NC1=NC(CCl)=CS1 ACI-00675 [1,1,0,0,0,0|1,1,0]=4 57 B8R1.1 NCC1=CN=C(Br)S1 ACI-04677 [1,1,0,0,0,0|1,1,0]=4 58 B8R1.1 OCC1=CN=C(Br)S1 ACI-03791 [1,1,0,0,0,0|1,1,0]=4 59 B8R1.50 CC1=NC=C(Br)N1C JM-08L-001 [1,1,0,0,0,0|2,0,0]=4 60 B8R1.50 CC1=NN=C(C)N1N JM-07K-004 [1,1,0,0,0,0|2,0,0]=4 61 B8R1.50 CC1=NNC(C)=C1Br ACI-01464 [1,1,0,0,0,0|2,0,0]=4 62 B8R1.50 CC1=NOC(C)=C1I ACI-02249 [1,1,0,0,0,0|2,0,0]=4 63 B8R1.11 CC1=C(CCl)ON=C1 ACI-04860 [1,1,0,0,0,0|2,0,0]=4 64 B8R1.11 CC1=C(CCl)SN=N1 ACI-00620 [1,1,0,0,0,0|1,1,0]=4 65 B8R1.11 CC1=C(CN)C=CO1 JM-10L-001 [1,1,0,0,0,0|1,0,0]=3 66 B8R1.11 CC1=C(CN)SC=C1 ACI-04730 [1,1,0,0,0,0|1,1,0]=4 67 B8R1.11 CC1=C(CO)OC=C1 ACI-02282 [1,1,0,0,0,0|1,0,0]=3 68 B8R1.11 CC1=C(CO)ON=C1 ACI-04859 [1,1,0,0,0,0|2,0,0]=4 69 B8R1.11 CC1=C(CO)SC=N1 ACI-00573 [1,1,0,0,0,0|0,1,0]=3 70 B8R1.11 CC1=C(CO)SN=N1 ACI-00607 [1,1,0,0,0,0|1,1,0]=4 71 B10R1.8 CC1=CC(O)=NC(CN)=N1 ACI-02457 [0,1,0,0,0,1|2,0,0]=4 72 B10R1.8 CSC1=NC(C)=NC(N)=N1 ACI-00042 [0,1,0,0,0,1|2,0,0]=4 73 B10R1.22 CC1=NC(O)=NC(C)=C1Cl ACI-01020 [0,1,0,0,0,1|2,0,0]=4 74 B10R1.25 CC1=CC=C(CO)C(O)=N1 JM-12C-003 [0,1,0,0,0,1|2,0,0]=4 75 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 ACI-00246 [0,2,0,0,0,0|0,1,1]=4 76 B8R1.4 CC1=NC(O)=NC=C1 ACI-01352 [0,0,1,1,0,0|1,0,1]=4 77 B8R1.3 CC1=CN=C(Br)C=C1 ACI-01445 [1,0,0,0,0,1|2,0,0]=4 78 B8R1.3 CC1=CN=C(F)C=C1 ACI-00442 [1,0,0,0,0,1|2,0,0]=4