0 B8R1.1 CC1=CC(CBr)=NO1 ACI-00511 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.1 CC1=CC(CCl)=NO1 ACI-00252 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.1 CC1=CC(CN)=NO1 JM-11D-001 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.1 CC1=CC(CO)=NO1 ACI-00368 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.1 CC1=NC(C=O)=CO1 SB-08H-004 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.1 CC1=NC(CCl)=CS1 ACI-00968 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.1 CC1=NC(CCl)=NO1 ACI-00542 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.1 CC1=NOC(CBr)=C1 ACI-01825 [0,0,0,0,0,0|3,1,0]=4 8 B8R1.1 CC1=NOC(CN)=C1 JM-05I-002 [0,0,0,0,0,0|3,1,0]=4 9 B8R1.1 CC1=NOC(CO)=C1 RH-08E-002 [0,0,0,0,0,0|3,1,0]=4 10 B8R1.1 CC1=NSC(C#N)=C1 ACI-00535 [0,0,0,0,0,0|3,0,1]=4 11 B8R1.1 CC1=NSC(C=O)=C1 ACI-NI-00725 [0,0,0,0,0,0|3,0,1]=4 12 B8R1.1 CN1C=CC(CCl)=N1 ACI-01838 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.1 CN1C=CC(CO)=N1 RH-06L-001 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.1 ClCC1=NSC(Cl)=N1 ACI-00220 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.1 NC1=NC(CCl)=CS1 ACI-00675 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.1 O=CC1=CC(I)=CS1 ACI-02692 [0,0,0,0,0,0|3,0,1]=4 17 B7R1.1 OCC1=CN=CS1 ACI-00689 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.2 CC1=CC(C)=NN1 ACI-00749 [1,0,0,0,0,0|3,0,0]=4 19 B7R1.2 CC1=COC(N)=N1 ACI-00543 [1,0,0,0,0,0|1,1,0]=3 20 B7R1.2 CC1=CSC(N)=N1 RJC-04J-001 [1,0,0,0,0,0|1,0,0]=2 21 B7R1.2 CC1=NOC(N)=N1 ACI-02451 [1,0,0,0,0,0|2,1,0]=4 22 B7R1.2 CC1=NSC(Br)=C1 ACI-00534 [1,0,0,0,0,0|3,0,0]=4 23 B7R1.2 CC1=NSC(I)=C1 ACI-NI-00723 [1,0,0,0,0,0|3,0,0]=4 24 B7R1.2 CC1=NSC(N)=C1 ACI-00530 [1,0,0,0,0,0|3,0,0]=4 25 B7R1.2 CN1C=CC(Cl)=N1 ACI-02549 [1,0,0,0,0,0|3,0,0]=4 26 B7R1.2 CN1C=CC(N)=N1 ACI-00344 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.7 COCC1=NOC(C)=N1 ACI-05013 [0,1,0,0,0,0|2,0,0]=3 28 B9R1.23 CCC1=NN(C)C(Cl)=C1 ACI-04721 [0,1,0,0,0,0|2,0,0]=3 29 B9R1.23 CCC1=NN(C)C(O)=C1 ACI-04719 [0,1,0,0,0,0|2,0,0]=3 30 B9R1.35 CC(=O)C1=CC(C)=NS1 ACI-NI-00751 [0,1,0,0,0,0|2,0,1]=4 31 B9R1.35 CC1=CSC(C(=O)Cl)=C1 RH-06B-005 [0,1,0,0,0,0|2,0,1]=4 32 B9R1.35 CC1=CSC(C(N)=O)=C1 ACI-05409 [0,1,0,0,0,0|2,0,1]=4 33 B9R1.1 CC1=CC=C(C#N)C=N1 SB-06J-002 [0,0,0,0,0,1|2,0,1]=4 34 B9R1.1 CC1=CN=C(C#N)C=C1 SB-02B-002 [0,0,0,0,0,1|2,0,1]=4 35 B9R1.1 ClCC1=CC=C(Cl)C=N1 ACI-04823 [0,0,0,0,0,1|3,0,0]=4 36 B9R1.1 ClCC1=CC=C(Cl)C=N1 JM-011C-001 [0,0,0,0,0,1|3,0,0]=4 37 B9R1.1 ClCC1=CN=C(Cl)C=C1 ACI-01442 [0,0,0,0,0,1|3,0,0]=4 38 B9R1.1 NCC1=CC=C(Cl)N=C1 ACI-01399 [0,0,0,0,0,1|3,0,0]=4 39 B9R1.1 NCC1=NC=C(Cl)C=N1 ACI-02636 [0,0,0,0,0,1|3,0,0]=4 40 B9R1.1 OCC1=CC=C(Cl)C=N1 ACI-04824 [0,0,0,0,0,1|3,0,0]=4 41 B9R1.1 OCC1=CN=C(Cl)C=C1 ACI-00428 [0,0,0,0,0,1|3,0,0]=4 42 B9R1.2 CNC1=NC(Cl)=CN=C1 ACI-02178 [0,0,0,0,0,1|3,0,0]=4 43 B6R1.2 CC1=CC=NS1 ACI-NI-00772 [2,0,0,0,0,0|2,0,0]=4 44 B6R1.2 CC1=CSN=C1 ACI-NI-00745 [2,0,0,0,0,0|2,0,0]=4 45 B6R1.2 CC1=CSN=N1 ACI-05802 [2,0,0,0,0,0|1,0,0]=3 46 B6R1.2 CC1=NSC=C1 ACI-00539 [2,0,0,0,0,0|2,0,0]=4 47 B6R1.2 NC1=NC=CO1 ACI-00944 [2,0,0,0,0,0|1,1,0]=4 48 B8R1.7 NC(=O)C1=NC=CS1 ACI-05426 [1,1,0,0,0,0|1,0,1]=4 49 B8R1.7 O=C(Cl)C1=NC=CS1 ACI-02388 [1,1,0,0,0,0|1,0,1]=4 50 B8R1.7 O=C(O)C1=NC=CS1 ACI-02389 [1,1,0,0,0,0|1,0,1]=4 51 B8R1.8 NCCC1=CC=CS1 SB-11D-001 [1,1,0,0,0,0|1,0,0]=3 52 B8R1.11 CC1=C(CN)SC=C1 ACI-04730 [1,1,0,0,0,0|2,0,0]=4 53 B8R1.18 CC1=C(Cl)SC(Cl)=C1 ACI-04717 [1,1,0,0,0,0|2,0,0]=4 54 B8R1.18 CC1=CC(C)=NN1C ACI-00025 [1,1,0,0,0,0|2,0,0]=4 55 B8R1.18 CC1=NN(C)C(Cl)=C1 ACI-01470 [1,1,0,0,0,0|2,0,0]=4 56 B8R1.18 CC1=NN(C)C(O)=C1 ACI-01469 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.25 CC1=CC=C(CO)C(O)=N1 JM-12C-003 [0,1,0,0,0,1|2,0,0]=4 58 B10R1.8 CC1=CC(O)=NC(CN)=N1 ACI-02457 [0,1,0,0,0,1|2,0,0]=4 59 B10R1.8 CSC1=NC(C)=NC(N)=N1 ACI-00042 [0,1,0,0,0,1|2,0,0]=4 60 B10R1.10 CNCC1=NC(Br)=CC=C1 FD-09B-004 [0,1,0,0,0,1|2,0,0]=4 61 B10R1.31 CC(C)C1=NC(CCl)=CS1 ACI-01279 [0,2,0,0,0,0|0,0,0]=2 62 B10R1.31 CC(C)C1=NOC(CCl)=N1 RH-05G-002 [0,2,0,0,0,0|2,0,0]=4 63 B10R1.31 CCC1=CC(C(=O)O)=CS1 JL-14K-001 [0,2,0,0,0,0|1,0,1]=4 64 B10R1.31 CCC1=NC(C(=O)O)=CN1 ACI-04660 [0,2,0,0,0,0|1,0,1]=4 65 B10R1.58 CC(C)C1=NN(C)C(Cl)=C1 ACI-04720 [0,2,0,0,0,0|2,0,0]=4 66 B10R1.58 CC(C)C1=NN(C)C(O)=C1 ACI-04718 [0,2,0,0,0,0|2,0,0]=4 67 B8R1.4 CC1=NC(S)=NC=C1 ACI-01351 [0,0,1,1,0,0|1,0,1]=4 68 B8R1.4 CC1=NC(S)=NC=C1 ACI-03785 [0,0,1,1,0,0|1,0,1]=4 69 B10R2.14 CC1=NC(C2CC2)=NO1 ACI-15014 [0,1,0,1,0,0|2,0,0]=4