0 B6R1.2 BrC1=CN=CO1 AT11056 [0,1,0,0,0,0|1,0,1]=3 1 B6R1.2 BrC1=COC=N1 AT11057 [0,1,0,0,0,0|1,0,1]=3 2 B6R1.2 CC1=NNCC1 D76466 [0,1,0,0,0,0|1,0,2]=4 3 B6R1.2 CN1CC=CC1 A10777 [0,1,0,0,0,0|0,0,2]=3 4 B6R1.2 FC1=NC=CN1 73631 [0,1,0,0,0,0|1,0,0]=2 5 B6R1.2 IC1=CNN=N1 AT22836 [0,1,0,0,0,0|2,0,0]=3 6 B6R1.2 NC1=COC=C1 AC9528 [0,1,0,0,0,0|1,0,0]=2 7 B6R1.2 NC1=NSN=C1 AT12134 [0,1,0,0,0,0|2,0,1]=4 8 B6R1.2 O=C1C=COC1 D75288 [0,1,0,0,0,0|1,0,1]=3 9 B6R1.2 O=C1NC=CO1 C74434 [0,1,0,0,0,0|1,0,0]=2 10 B6R1.2 OC1=CC=CS1 AC4704 [0,1,0,0,0,0|1,0,0]=2 11 B6R1.2 SC1=NN=CO1 AT18825 [0,1,0,0,0,0|2,0,1]=4 12 B6R1.1 C1=NN=CN=N1 F52551 [0,0,0,0,0,1|2,0,1]=4 13 B6R1.1 [13CH]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 41443 [0,0,0,0,0,1|1,0,0]=2 14 B5R0.2 C=CCNOC AT24925 [0,1,1,0,0,0|0,0,2]=4 15 B7R1.3 SC1=CN=CC=C1 AT26584 [0,1,0,0,0,1|0,0,1]=3 16 B7R1.1 C#CC1=CC=CO1 AC9158 [0,2,0,0,0,0|1,0,0]=3 17 B7R1.1 CCC1=NNC=C1 D77034 [0,2,0,0,0,0|1,0,0]=3 18 B7R1.1 CNC1=CN=CN1 57325 [0,2,0,0,0,0|1,0,0]=3 19 B7R1.1 CNC1=NN=CN1 AT21326 [0,2,0,0,0,0|2,0,0]=4 20 B7R1.1 COC1=CNC=N1 AT24767 [0,2,0,0,0,0|1,0,0]=3 21 B7R1.1 COC1=CNN=C1 AT16003 [0,2,0,0,0,0|1,0,0]=3 22 B7R1.1 CSC1=NNC=C1 W10957 [0,2,0,0,0,0|1,0,0]=3 23 B7R1.1 N#CC1=NSC=C1 F14136 [0,2,0,0,0,0|1,0,1]=4 24 B7R1.1 NCC1=CC=NS1 C77431 [0,2,0,0,0,0|1,0,1]=4 25 B7R1.1 NCC1=CN=CO1 P10824 [0,2,0,0,0,0|1,0,1]=4 26 B7R1.1 NCC1=CON=C1 P10602 [0,2,0,0,0,0|1,0,1]=4 27 B7R1.1 O=CC1=CC=NO1 C73163 [0,2,0,0,0,0|1,0,1]=4 28 B7R1.1 O=CC1=NNC=N1 C15565 [0,2,0,0,0,0|2,0,0]=4 29 B7R1.2 BrC1=COC(Br)=N1 AT18462 [0,2,0,0,0,0|1,0,1]=4 30 B7R1.2 CC1=CC=C(N)S1 32908 [0,2,0,0,0,0|1,0,0]=3 31 B7R1.2 CC1=CN(N)C=C1 AT24000 [0,2,0,0,0,0|0,0,0]=2 32 B7R1.2 CC1=CN=C(Br)O1 F20659 [0,2,0,0,0,0|1,0,1]=4 33 B7R1.2 CC1=CN=C(N)N1 28111 [0,2,0,0,0,0|1,0,0]=3 34 B7R1.2 CC1=COC(Cl)=N1 AT18557 [0,2,0,0,0,0|1,0,1]=4 35 B7R1.2 CC1=NOC(Br)=C1 AT19745 [0,2,0,0,0,0|1,0,1]=4 36 B7R1.2 CN1C=CC(S)=N1 AT15835 [0,2,0,0,0,0|1,0,0]=3 37 B7R1.2 CN1N=CC(N)=N1 AC9457 [0,2,0,0,0,0|2,0,0]=4 38 B7R1.2 NC1=CC(Br)=NO1 D72556 [0,2,0,0,0,0|1,0,1]=4 39 B7R1.2 NC1=CC(F)=CS1 AT16866 [0,2,0,0,0,0|1,0,0]=3 40 B7R1.2 NC1=CC=C(N)N1 F52185 [0,2,0,0,0,0|0,0,0]=2 41 B7R1.2 NC1=CSC(Br)=C1 P11848 [0,2,0,0,0,0|1,0,0]=3 42 B7R1.2 NC1=NC=C(Br)O1 D76175 [0,2,0,0,0,0|1,0,1]=4 43 B7R1.4 BrC1=NSC=C1I AT21082 [0,2,0,0,0,0|1,0,1]=4 44 B7R1.4 CC1=C(Br)N=CO1 AT18589 [0,2,0,0,0,0|1,0,1]=4 45 B7R1.4 CC1=C(Br)N=CO1 AT26832 [0,2,0,0,0,0|1,0,1]=4 46 B7R1.4 CC1=C(Br)OC=N1 AT18669 [0,2,0,0,0,0|1,0,1]=4 47 B7R1.4 CC1=C(Br)OC=N1 AT18693 [0,2,0,0,0,0|1,0,1]=4 48 B7R1.4 CC1=C(Br)SN=C1 C15876 [0,2,0,0,0,0|1,0,1]=4 49 B7R1.4 CC1=C(N)C=CS1 86771 [0,2,0,0,0,0|1,0,0]=3 50 B7R1.4 CC1=C(N)C=CS1 AT25979 [0,2,0,0,0,0|1,0,0]=3 51 B7R1.4 CC1=C(N)SN=C1 AT21117 [0,2,0,0,0,0|1,0,1]=4 52 B7R1.4 CC1=C(O)C=CS1 AT26691 [0,2,0,0,0,0|1,0,0]=3 53 B7R1.4 CC1=CON=C1Br 95082 [0,2,0,0,0,0|1,0,1]=4 54 B7R1.4 FC1=C(Br)SC=C1 AT16344 [0,2,0,0,0,0|1,0,0]=3 55 B7R1.4 IC1=C(I)NN=N1 AT22830 [0,2,0,0,0,0|2,0,0]=4 56 B7R1.4 NC1=C(Br)C=NO1 AT19727 [0,2,0,0,0,0|1,0,1]=4 57 B7R1.4 NC1=C(Br)C=NS1 AT21096 [0,2,0,0,0,0|1,0,1]=4 58 B7R1.4 NC1=C(Br)N=CS1 92248 [0,2,0,0,0,0|1,0,1]=4 59 B7R1.4 NC1=C(Br)SC=C1 AT14950 [0,2,0,0,0,0|1,0,0]=3 60 B7R1.4 NC1=C(Br)SC=N1 92252 [0,2,0,0,0,0|1,0,1]=4 61 B7R1.4 NC1=C(F)NN=C1 C92333 [0,2,0,0,0,0|1,0,0]=3 62 B7R1.4 NC1=CSC=C1Br P13982 [0,2,0,0,0,0|1,0,0]=3 63 B7R1.4 NC1=CSC=C1Cl P10601 [0,2,0,0,0,0|1,0,0]=3 64 B7R1.4 NC1=CSN=C1Br AT21080 [0,2,0,0,0,0|1,0,1]=4 65 B7R1.4 NC1=NSC=C1Br AT26505 [0,2,0,0,0,0|1,0,1]=4 66 B7R1.4 O=C1CCNC1=O AT24684 [0,2,0,0,0,0|0,0,2]=4 67 B7R1.4 OC1=NOC=C1Br AT19728 [0,2,0,0,0,0|1,0,1]=4 68 B7R1.4 OC1=NSC=C1Br AT11778 [0,2,0,0,0,0|1,0,1]=4