0 B13R2.11634 CC1=NNC2=CC(Br)=C(Cl)C=C21 AT21944 [0,0,0,0,0,0|2,1,0]=3 1 B13R2.11634 ClC1=CC2=C(C=C1Br)NN=C2I AT21942 [0,0,0,0,0,0|2,1,0]=3 2 B13R2.11634 NC1=C(Cl)C=C2C(=O)NCC2=C1 F18458 [0,0,0,0,0,0|2,0,2]=4 3 B12R2.100 ClC1=C(I)C=C2C=NNC2=N1 AT18491 [1,0,0,0,0,0|2,1,0]=4 4 B12R2.100 NC1=CC2=C(C=C1N)NN=C2 78774 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.132 ClC1=NSC2=C1C=C(Br)C=C2 AT19019 [1,0,0,0,0,0|1,2,0]=4 6 B12R2.132 FC1=CC2=C(C=C1)SN=C2Cl AT19023 [1,0,0,0,0,0|1,2,0]=4 7 B12R2.132 FC1=NNC2=C1C=C(Br)C=C2 AC2044 [1,0,0,0,0,0|2,1,0]=4 8 B12R2.132 OC1=CC2=C(C=C1)OC[C@@H]2O AT23844 [1,0,0,0,0,0|2,0,1]=4 9 B12R2.132 O[C@H]1COC2=C1C=C(Cl)C=C2 AT23846 [1,0,0,0,0,0|1,0,1]=3 10 B12R2.132 O[C@H]1COC2=C1C=C(F)C=C2 AT23851 [1,0,0,0,0,0|1,1,1]=4 11 B12R2.612 CC1=CC2=C(C=C1)C(Cl)=NO2 O10990 [1,0,0,0,0,0|2,0,0]=3 12 B12R2.612 ClC1=NSC2=C1C=CC(Br)=C2 AT19021 [1,0,0,0,0,0|1,2,0]=4 13 B12R2.612 NC1=CC2=C(C=C1)C(=O)CO2 D76407 [1,0,0,0,0,0|2,0,1]=4 14 B12R2.612 NC1=NNC2=C1C=CC(O)=C2 D86129 [1,0,0,0,0,0|3,0,0]=4 15 B12R2.612 N[C@H]1COC2=C1C=CC(Cl)=C2 59815 [1,0,0,0,0,0|2,0,1]=4 16 B12R2.612 N[C@H]1COC2=C1C=CC(Cl)=C2 F12585 [1,0,0,0,0,0|2,0,1]=4 17 B12R2.612 N[C@H]1COC2=C1C=CC(Cl)=C2 N16513 [1,0,0,0,0,0|2,0,1]=4 18 B12R2.612 OC1=CC2=C(C=C1)[C@@H](O)CO2 AT23843 [1,0,0,0,0,0|2,0,1]=4 19 B12R1.232 CC1=C(Cl)C=C(O)C(C(=O)O)=C1 AC7035 [0,0,1,0,0,0|2,0,0]=3 20 B12R1.232 O=C(O)C1=CC(F)=C(Cl)C=C1O D76073 [0,0,1,0,0,0|1,1,0]=3 21 B12R1.232 O=C(O)C1=CC(O)=C(Cl)C=C1Cl D76122 [0,0,1,0,0,0|3,0,0]=4 22 B12R1.367 CC1=C(Cl)C=C(\C(C)=N\O)C=C1 D72579 [0,0,1,0,0,0|2,0,0]=3 23 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 D74559 [0,0,1,0,0,0|1,1,1]=4 24 B14R2.8239 O=C1COC2=CC(Br)=C(Cl)C=C2N1 D77089 [0,0,0,0,0,1|1,1,1]=4 25 B14R2.28472 ClC1=CC2=NC=NC(Cl)=C2C=C1I AT26724 [0,0,0,0,0,1|2,1,0]=4 26 B11R2.36 BrC1=CC2=C(C=C1)C=NS2 O11556 [2,0,0,0,0,0|0,2,0]=4 27 B11R2.1 BrC1=NOC2=C1C=CC=C2 D77128 [2,0,0,0,0,0|1,0,0]=3 28 B13R1.2398 COC1=CC(C)=C(Cl)C=C1C(=O)O AT26669 [0,1,1,0,0,0|2,0,0]=4 29 B13R2.669 CC1=NOC2=C1C=C(CN)C=C2 F14011 [1,1,0,0,0,0|2,0,0]=4 30 B13R2.2136 N#CC1=NSC2=C1C=C(Cl)C=C2 AT25626 [1,1,0,0,0,0|1,1,0]=4 31 B13R2.2136 NC1=CC2=C(C=C1)ON=C2CO AC9801 [1,1,0,0,0,0|1,0,0]=3 32 B13R2.2136 NCC1=NSC2=C1C=C(Cl)C=C2 AT25624 [1,1,0,0,0,0|1,1,0]=4 33 B13R2.3742 CC1=NOC2=C(C)C=C(N)C=C12 P12456 [1,1,0,0,0,0|2,0,0]=4 34 B13R2.3742 CC1=NOC2=C1N=C(Cl)C=C2Cl D76162 [1,1,0,0,0,0|2,0,0]=4 35 B13R2.3790 O[C@H]1COC2=C1C(F)=C(Cl)C=C2 AT24060 [1,1,0,0,0,0|1,0,1]=4 36 B13R2.662 NCC1=NOC2=C1C=CC(Br)=C2 93321 [1,1,0,0,0,0|1,1,0]=4 37 B13R2.662 NCC1=NOC2=C1C=CC(F)=C2 95568 [1,1,0,0,0,0|1,1,0]=4 38 B13R2.662 O=CC1=NOC2=C1C=CC(F)=C2 93327 [1,1,0,0,0,0|0,1,1]=4 39 B13R2.662 OCC1=NOC2=C1C=CC(Cl)=C2 93317 [1,1,0,0,0,0|0,0,0]=2 40 B13R2.662 OCC1=NOC2=C1C=CC(F)=C2 93326 [1,1,0,0,0,0|0,1,0]=3 41 B13R2.2130 CC1=NOC2=C1C=CC(C=O)=C2 D77028 [1,1,0,0,0,0|2,0,0]=4 42 B13R2.162 O=C1NN=CC2=C1C=C(Cl)C=C2 AT14850 [1,0,0,0,0,1|1,0,1]=4 43 B13R2.3683 ClC1=CC=C2N=C(Br)N=CC2=C1 AC8211 [1,0,0,0,0,1|2,0,0]=4 44 B13R2.3683 OC1=NN=C2C=C(Br)C=CC2=C1 AT20864 [1,0,0,0,0,1|1,1,0]=4 45 B13R2.5179 CC1=C2C=CC(Cl)=CC2=CN=C1 D75502 [1,0,0,0,0,1|2,0,0]=4 46 B13R2.5179 ClC1=CC=C2C(=C1)C=NN=C2Cl P11442 [1,0,0,0,0,1|2,0,0]=4 47 B13R2.5179 O=C1COCC2=C1C=CC(Cl)=C2 AT26633 [1,0,0,0,0,1|1,0,1]=4