0 B9R1.23 CC1=C(C)SC(CCl)=N1 4033196 [0,0,0,0,0,0|1,1,0]=2 1 B9R1.23 CC1=C(C)SC(CN)=N1 4089833 [0,0,0,0,0,0|1,1,0]=2 2 B9R1.23 CC1=C(C)SC(CO)=N1 4089722 [0,0,0,0,0,0|1,1,0]=2 3 B9R1.23 CC1=C(C)SC(NN)=N1 4088477 [0,0,0,0,0,0|2,1,0]=3 4 B9R1.23 CC1=NC(C=O)=NN1C 4031273 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.23 CC1=NC(CN)=NN1C 4051237 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.23 CN1N=C(CO)N=C1Br 4086937 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.1 CC1=CC(CN)=NO1 4003548 [1,0,0,0,0,0|3,0,0]=4 8 B8R1.1 CC1=CSC(CCl)=N1 4089233 [1,0,0,0,0,0|1,1,0]=3 9 B8R1.1 CC1=CSC(NN)=N1 4089917 [1,0,0,0,0,0|2,1,0]=4 10 B8R1.1 CC1=NC(CCl)=CO1 4038462 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.1 CC1=NC(CCl)=CS1 4089600 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.1 CC1=NC(CN)=NO1 4089924 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.1 CC1=NN=C(CN)O1 4090166 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.1 CC1=NN=C(CN)S1 4034872 [1,0,0,0,0,0|2,1,0]=4 15 B8R1.1 CC1=NN=C(CN)S1 4110614 [1,0,0,0,0,0|2,1,0]=4 16 B8R1.1 CC1=NNC(CO)=N1 4088491 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.1 CCC1=CSC(N)=N1 4034888 [1,0,0,0,0,0|3,0,0]=4 18 B8R1.1 CCC1=CSC(N)=N1 4090225 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.1 CCC1=NC(N)=NO1 4014409 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.1 CCC1=NC=C(Br)S1 4041002 [1,0,0,0,0,0|1,1,0]=3 21 B8R1.1 CCC1=NC=C(Br)S1 4088439 [1,0,0,0,0,0|1,1,0]=3 22 B8R1.1 CCN1C=C(N)C=N1 4087911 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.1 CCN1C=C(N)C=N1 4089653 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.1 CNC1=NC=C(Br)S1 4039821 [1,0,0,0,0,0|2,1,0]=4 25 B8R1.18 CC1=C(C)OC(N)=N1 4090608 [1,0,0,0,0,0|1,0,0]=2 26 B8R1.18 CC1=NN(C)C=C1N 4087920 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.18 CC1=NN(C)C=C1N 4088249 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.34 COC1=NN(C)C(C)=C1N 4090508 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.35 CCC1=NC(C)=C(CN)S1 4091016 [0,1,0,0,0,0|0,1,0]=2 30 B10R1.35 CCN1C=C(CN)C(C)=N1 4032624 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.58 CC(C)C1=NN(C)C(Br)=C1 4058880 [0,1,0,0,0,0|3,0,0]=4 32 B10R1.58 CC1=C(C)SC(C(C)N)=N1 4089031 [0,1,0,0,0,0|0,1,0]=2 33 B10R1.131 CC1=C(Cl)SC(CCN)=N1 4010250 [0,1,0,0,0,0|1,1,0]=3 34 B10R1.131 CC1=C(Cl)SC(CCN)=N1 4091050 [0,1,0,0,0,0|1,1,0]=3 35 B10R1.131 CNCC1=NN(C)C(C)=N1 4110685 [0,1,0,0,0,0|2,0,0]=3 36 B10R1.8 CC1=CC(C)=NC(CN)=N1 4088137 [0,0,0,0,0,1|2,0,0]=3 37 B10R1.8 CC1=CC(CN)=CC(C)=N1 4021497 [0,0,0,0,0,1|3,0,0]=4 38 B10R1.8 CC1=CC(O)=NC(CN)=N1 4089299 [0,0,0,0,0,1|3,0,0]=4 39 B10R1.8 CC1=NC(CN)=CC(O)=N1 4091101 [0,0,0,0,0,1|3,0,0]=4 40 B7R1.1 CCN1C=CC=N1 3020409 [2,0,0,0,0,0|2,0,0]=4 41 B7R1.1 ClCC1=NC=CS1 4089816 [2,0,0,0,0,0|1,1,0]=4 42 B7R1.1 NCC1=NC=CN1 4089830 [2,0,0,0,0,0|2,0,0]=4 43 B7R1.1 NCC1=NN=CO1 4042037 [2,0,0,0,0,0|2,0,0]=4 44 B7R1.1 OCC1=NC=NO1 4043622 [2,0,0,0,0,0|2,0,0]=4 45 B7R1.2 CC1=COC(C)=C1 4091270 [2,0,0,0,0,0|1,0,0]=3 46 B7R1.2 CC1=NN(C)C=C1 3020421 [2,0,0,0,0,0|2,0,0]=4 47 B7R1.2 CC1=NOC(Br)=N1 4036004 [2,0,0,0,0,0|2,0,0]=4 48 B9R1.7 CC1=CC=C(CCN)S1 4004130 [1,1,0,0,0,0|1,1,0]=4 49 B9R1.7 CC1=CN(CCN)N=C1 4089607 [1,1,0,0,0,0|2,0,0]=4 50 B9R1.7 CC1=CN(CCO)N=C1 4090132 [1,1,0,0,0,0|2,0,0]=4 51 B9R1.7 CC1=NC(CCCl)=CS1 4088359 [1,1,0,0,0,0|2,0,0]=4 52 B9R1.7 CC1=NC(CCN)=NO1 4088883 [1,1,0,0,0,0|2,0,0]=4 53 B9R1.7 CC1=NN(CCN)C=C1 4016693 [1,1,0,0,0,0|2,0,0]=4 54 B9R1.7 CC1=NN=C(CCN)S1 4088819 [1,1,0,0,0,0|1,1,0]=4 55 B9R1.7 CNCC1=CC(C)=NO1 4089254 [1,1,0,0,0,0|2,0,0]=4 56 B9R1.7 CNCC1=CSC(C)=N1 4087958 [1,1,0,0,0,0|2,0,0]=4 57 B9R1.7 CNCC1=CSC(C)=N1 4088268 [1,1,0,0,0,0|2,0,0]=4 58 B9R1.7 CNCC1=NC(C)=CN1 4090830 [1,1,0,0,0,0|1,0,0]=3 59 B9R1.7 CNCC1=NC(C)=CS1 4090988 [1,1,0,0,0,0|0,1,0]=3 60 B9R1.7 CNCC1=NNC(C)=C1 4090898 [1,1,0,0,0,0|2,0,0]=4 61 B9R1.7 CNCC1=NNC(C)=C1 4110852 [1,1,0,0,0,0|2,0,0]=4 62 B9R1.7 COCC1=NC(N)=NO1 4039775 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.21 CCC1=NC(CCl)=CS1 4088461 [1,1,0,0,0,0|0,1,0]=3 64 B9R1.21 CCC1=NC(CN)=CS1 4089874 [1,1,0,0,0,0|0,1,0]=3 65 B9R1.21 CCC1=NC(CN)=NO1 4090589 [1,1,0,0,0,0|1,0,0]=3 66 B9R1.21 CCC1=NC(CO)=CS1 4090454 [1,1,0,0,0,0|0,1,0]=3 67 B9R1.21 CCC1=NN=C(CN)S1 4088121 [1,1,0,0,0,0|1,1,0]=4 68 B9R1.21 CCC1=NNC(CC)=N1 4088674 [1,1,0,0,0,0|2,0,0]=4 69 B9R1.21 CCC1=NOC(CN)=N1 4088358 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.21 CCN1C=C(CCl)C=N1 4089507 [1,1,0,0,0,0|2,0,0]=4 71 B9R1.21 CCN1C=CC(CCl)=N1 4090802 [1,1,0,0,0,0|2,0,0]=4 72 B9R1.21 CNC1=NC(CCl)=CS1 4090284 [1,1,0,0,0,0|1,1,0]=4 73 B9R1.22 CCN1N=C(C)C=C1C 3020385 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.35 CC(C)C1=NC=C(Br)S1 4040489 [1,1,0,0,0,0|1,1,0]=4 75 B9R1.35 CC1=CNC(C(C)N)=N1 4090866 [1,1,0,0,0,0|1,0,0]=3 76 B9R1.35 CC1=NN=C(C(C)N)O1 4088435 [1,1,0,0,0,0|1,0,0]=3 77 B9R1.35 CC1=NOC(C(C)N)=N1 4089961 [1,1,0,0,0,0|1,0,0]=3 78 B11R1.34 CC1=CC(C)=NC(CCN)=N1 4089424 [0,1,0,0,0,1|1,0,0]=3 79 B11R1.34 CC1=NC(CCN)=CC(O)=N1 4090402 [0,1,0,0,0,1|2,0,0]=4 80 B11R1.48 CC1=C(CN)SC(C(C)C)=N1 4027553 [0,2,0,0,0,0|0,1,0]=3 81 B11R1.48 CC1=C(CN)SC(C(C)C)=N1 4088350 [0,2,0,0,0,0|0,1,0]=3 82 B11R1.187 COCC1=NC(C)=C(CN)S1 4090742 [0,2,0,0,0,0|0,1,0]=3 83 B9R1.1 CC1=CN=C(CN)C=C1 4010338 [1,0,0,0,0,1|2,0,0]=4 84 B9R1.1 CC1=CN=C(CN)C=C1 4089721 [1,0,0,0,0,1|2,0,0]=4 85 B9R1.1 CC1=NC=C(CCl)N=C1 4090045 [1,0,0,0,0,1|2,0,0]=4