0 B13R2.1069 BrC1=CC=C(CC2CCC2)C=C1 AT11366 [0,0,0,0,0,0|3,0,0]=3 1 B13R2.1069 BrC1=CC=C(CC2CNC2)C=C1 P10689 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.1069 BrC1=CC=C(OC2CNC2)C=C1 P10809 [0,0,0,0,0,0|2,0,0]=2 3 B12R2.2058 C1=CC(CC2CNC2)=CC=N1 E72899 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.2058 C1=CC(NC2CCC2)=CC=N1 D74722 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 P15109 [1,0,0,0,0,0|2,0,0]=3 6 B12R2.2058 C1=CN=C(NC2CCC2)C=C1 D74717 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.2058 C1=CN=CC(CC2CNC2)=C1 D74724 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.2058 C1=CN=CC(NC2CCC2)=C1 D74719 [1,0,0,0,0,0|3,0,0]=4 9 B14R2.10606 O=C(C1=CC=C(F)C=C1)C2CNC2 P12835 [0,1,0,0,0,0|3,0,0]=4 10 B12R2.2302 BrC1=CC=C([C@@H]2CCN2)C=C1 F53752 [0,0,0,0,1,0|3,0,0]=4 11 B12R2.2302 BrC1=CN=C(C2COC2)C=C1 AT26738 [0,0,0,0,1,0|2,0,0]=3 12 B12R2.2302 BrC1=NC=C(C2CCC2)C=C1 D76681 [0,0,0,0,1,0|3,0,0]=4 13 B12R2.2302 BrC1=NC=C(C2COC2)N=C1 P20650 [0,0,0,0,1,0|3,0,0]=4 14 B12R2.2302 CC1=CC=C(C2CCC2)C=C1 F53454 [0,0,0,0,1,0|2,0,0]=3 15 B12R2.2302 FC1=CN=C(C2CNC2)C=C1 AT19987 [0,0,0,0,1,0|3,0,0]=4 16 B12R2.2302 FC1=NC=C(C2CNC2)C=C1 55513 [0,0,0,0,1,0|3,0,0]=4 17 B12R2.2302 IC1=CC=C(C2COC2)C=C1 AT17229 [0,0,0,0,1,0|1,0,0]=2 18 B12R2.2302 NC1=CC=C(C2CCC2)C=C1 D85595 [0,0,0,0,1,0|1,0,0]=2 19 B12R2.2302 NC1=CC=C([C@@H]2CCO2)C=C1 AT23927 [0,0,0,0,1,0|2,0,0]=3 20 B12R2.2302 OC1=CC=C(C2CNC2)C=C1 D75514 [0,0,0,0,1,0|2,0,0]=3 21 B12R2.2302 OC1=CC=C(C2COC2)C=C1 88186 [0,0,0,0,1,0|1,0,0]=2 22 B14R2.72 FC1=CC=C(S[C@H]2CCNC2)C=C1 C72420 [0,0,0,0,0,1|2,1,0]=4 23 B11R1.1 NC1=CN=C(OCCO)C=N1 AT21045 [1,0,1,0,0,0|2,0,0]=4 24 B11R1.28 NOCCNC1=CC=CC=C1 AT21708 [1,0,1,0,0,0|2,0,0]=4 25 B13R2.31 Br[C@H]1C[C@@H](OC2=CC=CC=C2)C1 E73063 [1,1,0,0,0,0|1,0,0]=3 26 B13R2.31 NC1CC(CC2=CC=CC=C2)C1 67221 [1,1,0,0,0,0|2,0,0]=4 27 B13R2.5225 BrC1=C(CC2CNC2)C=CC=C1 E73106 [1,1,0,0,0,0|2,0,0]=4 28 B13R2.5225 BrC1=C(CC2COC2)C=CC=C1 86792 [1,1,0,0,0,0|1,0,0]=3 29 B13R2.5225 NC1=C(OC2CCC2)C=CC=C1 AT26868 [1,1,0,0,0,0|1,0,0]=3 30 B13R2.8137 CN(C1=CC=CC=C1)C2CNC2 E10006 [1,1,0,0,0,0|2,0,0]=4 31 B13R2.520 N[C@H](C1=CC=C(F)C=C1)C2CC2 S11068 [0,1,0,0,1,0|2,0,0]=4 32 B13R2.521 CC1=C(Br)C=NC(OC2CC2)=C1 AT10175 [0,1,0,0,1,0|2,0,0]=4 33 B13R2.5400 ClC1=C(NC2CC2)C=CC(Br)=C1 AT16675 [0,1,0,0,1,0|2,0,0]=4 34 B13R2.5400 ClC1=CC(Cl)=NC=C1OC2CC2 AC3337 [0,1,0,0,1,0|2,0,0]=4 35 B13R2.146 NC1CCC1C2=CC=C(Br)C=C2 AT20239 [0,1,0,0,1,0|2,0,0]=4 36 B13R2.147 N[C@H]1C[C@@H](C2=CC=C(Br)C=C2)C1 91845 [0,1,0,0,1,0|2,0,0]=4 37 B13R2.147 N[C@H]1C[C@@H](C2=CC=C(F)C=C2)C1 91844 [0,1,0,0,1,0|2,0,0]=4 38 B13R2.147 N[C@H]1C[C@H](C2=CC=C(Br)C=C2)C1 91828 [0,1,0,0,1,0|2,0,0]=4 39 B13R2.147 N[C@H]1C[C@H](C2=CC=C(F)C=C2)C1 91827 [0,1,0,0,1,0|2,0,0]=4 40 B13R2.147 O[C@H]1C[C@@H](C2=CC=C(Br)C=C2)C1 AT11011 [0,1,0,0,1,0|2,0,0]=4 41 B13R2.185 C#CC1=CC=C(C2COC2)C=C1 AT17217 [0,1,0,0,1,0|1,0,0]=3 42 B13R2.185 COC1=CC=C(C2CNC2)C=C1 F53441 [0,1,0,0,1,0|2,0,0]=4 43 B13R2.1066 FC1=C(F)C=C(C2CNC2)C=C1 85617 [0,1,0,0,1,0|2,0,0]=4 44 B13R2.2986 CC1(C2=CC=C(Br)C=C2)CNC1 AT12571 [0,1,0,0,1,0|2,0,0]=4 45 B13R2.2986 CC1(C2=CC=C(F)C=C2)CNC1 AT19995 [0,1,0,0,1,0|2,0,0]=4 46 B13R2.2986 CC1(C2=CC=C(N)C=C2)CNC1 AT20029 [0,1,0,0,1,0|1,0,0]=3 47 B13R2.2986 CC1=CC=C(C2(N)CCC2)C=C1 69084 [0,1,0,0,1,0|2,0,0]=4 48 B13R2.2986 CC1=CC=C(C2(N)CCC2)C=C1 AC2904 [0,1,0,0,1,0|2,0,0]=4 49 B13R2.2986 NC1(C2=CC=C(Br)C=C2)COC1 CS2073 [0,1,0,0,1,0|1,0,0]=3 50 B13R2.2986 NC1(C2=CC=C(I)C=C2)CCC1 AC3599 [0,1,0,0,1,0|2,0,0]=4 51 B13R2.2986 NC1=CC=C(C2(N)CCC2)C=C1 AC3598 [0,1,0,0,1,0|1,0,0]=3 52 B13R2.13518 CC1=CC(C)=C(C2CNC2)C=C1 AT15447 [0,1,0,0,1,0|2,0,0]=4 53 B13R2.13518 FC1=CC(F)=C(C2CNC2)C=C1 85618 [0,1,0,0,1,0|2,0,0]=4 54 B15R2.98 CN1CC[C@H](OC2=CC=C(Br)C=C2)C1 F13499 [0,1,0,0,0,1|2,0,0]=4 55 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 AT17335 [0,0,1,0,1,0|2,0,0]=4 56 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 AT17408 [0,0,1,0,1,0|2,0,0]=4 57 B11R2.239 C1=CN=CC(C2CNC2)=C1 AT10105 [1,0,0,0,1,0|2,0,0]=4 58 B11R2.34 FC1=CC=C(C2CC2)C=C1 AC9033 [0,0,0,0,2,0|1,0,0]=3 59 B11R2.34 FC1=CN=C(C2CC2)C=C1 AC8048 [0,0,0,0,2,0|2,0,0]=4 60 B11R2.34 OC1=CN=C(C2CC2)C=C1 D76530 [0,0,0,0,2,0|2,0,0]=4 61 B15R2.29 BrC1=CC=C(C[C@H]2COCCN2)C=C1 94331 [0,0,0,0,0,2|2,0,0]=4 62 B15R2.29 BrC1=CC=C(C[C@H]2COCCN2)C=C1 94332 [0,0,0,0,0,2|2,0,0]=4 63 B15R2.29 FC1=CC=C(C[C@H]2COCCN2)C=C1 94329 [0,0,0,0,0,2|2,0,0]=4 64 B15R2.29 FC1=CC=C(C[C@H]2COCCN2)C=C1 94330 [0,0,0,0,0,2|2,0,0]=4