0 B15R2.33 CC1=CC=C(Br)C=C1C2=CC=CC=C2 SY295199 [0,0,0,0,0,0|3,0,0]=3 1 B15R2.33 CC1=CC=C(Cl)C=C1C2=CC=CC=C2 SY295200 [0,0,0,0,0,0|3,0,0]=3 2 B15R2.33 CC1=CC=C(N)C(C2=CC=CC=C2)=C1 SY226652 [0,0,0,0,0,0|2,0,0]=2 3 B15R2.33 CC1=CN(C2=CC=CC=C2)C(=O)C=C1 SY034783 [0,0,0,0,0,0|0,0,0]=0 4 B15R2.33 ClC1=CC=C(Br)C(C2=CC=CC=C2)=C1 SY272577 [0,0,0,0,0,0|3,0,0]=3 5 B14R2.21 BrC1=CC(C2=CC=CC=C2)=CC=C1 SY015795 [1,0,0,0,0,0|2,0,0]=3 6 B14R2.21 BrC1=CC(C2=CC=CN=C2)=CC=C1 SY033982 [1,0,0,0,0,0|3,0,0]=4 7 B14R2.21 BrC1=NC(C2=CC=CC=C2)=CC=C1 SY040479 [1,0,0,0,0,0|3,0,0]=4 8 B14R2.21 CC1=NC(C2=CC=CC=C2)=CC=C1 SY017680 [1,0,0,0,0,0|2,0,0]=3 9 B14R2.21 IC1=CC(C2=CC=CC=C2)=CC=C1 SY029989 [1,0,0,0,0,0|2,0,0]=3 10 B14R2.21 NC1=CC(C2=CC=CC=C2)=CC=C1 SY029902 [1,0,0,0,0,0|2,0,0]=3 11 B14R2.21 NC1=CC(C2=CC=CC=C2)=CC=C1 SY032951 [1,0,0,0,0,0|2,0,0]=3 12 B14R2.21 NC1=CC(C2=CC=CC=C2)=NC=C1 SY032946 [1,0,0,0,0,0|3,0,0]=4 13 B14R2.21 NC1=CC(C2=NC=CC=C2)=CC=C1 SY003602 [1,0,0,0,0,0|3,0,0]=4 14 B14R2.21 NC1=CC=CC(C2=CC=CC=N2)=C1 SY003399 [1,0,0,0,0,0|3,0,0]=4 15 B14R2.21 NC1=CC=CC(C2=CC=CN=C2)=C1 SY003603 [1,0,0,0,0,0|3,0,0]=4 16 B14R2.21 NC1=NC=CC(C2=CC=CC=C2)=C1 SY032947 [1,0,0,0,0,0|3,0,0]=4 17 B14R2.21 OC1=CC=CC(C2=CC=CC=C2)=C1 SY051510 [1,0,0,0,0,0|2,0,0]=3 18 B14R2.24 BrC1=CC=CC=C1C2=CC=CC=C2 SY013526 [1,0,0,0,0,0|2,0,0]=3 19 B14R2.24 BrC1=CC=CN=C1C2=CC=CC=C2 SY114294 [1,0,0,0,0,0|3,0,0]=4 20 B14R2.24 CC1=CC=CN=C1C2=CC=CC=C2 SY019480 [1,0,0,0,0,0|3,0,0]=4 21 B14R2.24 FC1=CC=CC=C1C2=CC=CC=C2 SY032390 [1,0,0,0,0,0|2,0,0]=3 22 B14R2.24 IC1=CC=CC=C1C2=CC=CC=C2 SY029962 [1,0,0,0,0,0|2,0,0]=3 23 B14R2.24 NC1=C(C2=CC=CC=C2)C=NC=C1 SY045807 [1,0,0,0,0,0|3,0,0]=4 24 B14R2.24 NC1=CC=CN=C1C2=CC=CC=C2 SY064850 [1,0,0,0,0,0|3,0,0]=4 25 B14R2.24 O=C1NC=CN=C1C2=CC=CC=C2 SY027698 [1,0,0,0,0,0|3,0,0]=4 26 B14R2.24 OC1=CC=CC=C1C2=NC=CC=C2 SY013444 [1,0,0,0,0,0|2,0,1]=4 27 B14R2.24 [O-]C1=CC=CC=C1C2=CC=CC=C2 SY030153 [1,0,0,0,0,0|1,0,1]=3 28 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2C=CC=C3 SY029792 [0,0,0,1,0,0|3,0,0]=4 29 B16R3.2583 BrC1=CC=C2OC3=CC=CC=C3C2=C1 SY033174 [0,0,0,1,0,0|2,0,1]=4 30 B16R3.2583 BrC1=CC=C2SC3=CC=CC=C3C2=C1 SY029345 [0,0,0,1,0,0|2,1,0]=4 31 B16R3.2583 IC1=CC2=C(C=C1)NC3=C2C=CC=C3 SY037136 [0,0,0,1,0,0|3,0,0]=4 32 B14R2.277 O=C1CNC(=O)N1C2=CC=CC=C2 SY096657 [0,0,0,0,1,0|2,0,1]=4 33 B14R2.277 O=C1N=NC(=O)N1C2=CC=CC=C2 SY019495 [0,0,0,0,1,0|3,0,0]=4 34 B14R2.277 O=C1NNC(=O)N1C2=CC=CC=C2 SY019481 [0,0,0,0,1,0|3,0,0]=4 35 B14R2.598 CC1=CC(O)=NN1C2=CC=CC=C2 SY262107 [0,0,0,0,1,0|3,0,0]=4 36 B14R2.598 CC1=NN(C2=CC=CC=C2)C(Cl)=C1 SY096751 [0,0,0,0,1,0|2,0,0]=3 37 B14R2.598 CC1=NN(C2=CC=CC=C2)C(N)=C1 SY016186 [0,0,0,0,1,0|2,0,0]=3 38 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 SY049678 [0,0,0,0,1,0|3,0,0]=4 39 B13R2.3 C1=CC=C(C2=CC=NC=C2)C=C1 SY021647 [2,0,0,0,0,0|2,0,0]=4 40 B13R2.3 C1=CC=C(C2=NC=CC=C2)C=C1 SY017662 [2,0,0,0,0,0|2,0,0]=4 41 B13R2.3 C1=CC=C(C2=NC=CC=C2)C=C1 SY100800 [2,0,0,0,0,0|2,0,0]=4 42 B13R2.3 C1=CC=C([N+]2=CC=CC=C2)C=C1 SY265683 [2,0,0,0,0,0|0,0,1]=3 43 B13R2.3 C1=CC=CC=C1C2=NC=CC=C2 SY246291 [2,0,0,0,0,0|2,0,0]=4 44 B15R2.17 NOC1=CC(C2=CC=CC=C2)=CC=C1 SY282244 [1,1,0,0,0,0|2,0,0]=4 45 B15R2.17 NOC1=CC(C2=CC=CC=C2)=CC=C1 SY282245 [1,1,0,0,0,0|2,0,0]=4 46 B15R2.17 O=CC1=CC=CC(C2=CC=CC=C2)=C1 SY004293 [1,1,0,0,0,0|1,0,1]=4 47 B15R2.17 OCC1=CC(C2=CC=CC=C2)=CN=C1 SY056724 [1,1,0,0,0,0|2,0,0]=4 48 B15R2.27 OC1=CC(C2=CC=CC=C2)=CC(Br)=C1 SY285265 [1,1,0,0,0,0|2,0,0]=4 49 B15R2.28 BrC1=CC=C(C2=CC=CC(I)=C2)C=C1 SY233013 [1,1,0,0,0,0|2,0,0]=4 50 B15R2.28 CC1=CC(C2=CC=C(N)C=C2)=CC=C1 SY031757 [1,1,0,0,0,0|1,0,0]=3 51 B15R2.28 NC1=CC(C2=CC=C(F)C=C2)=CC=C1 SY039474 [1,1,0,0,0,0|2,0,0]=4 52 B15R2.28 NC1=CC=C(C2=CC=CC(Cl)=C2)C=C1 SY279619 [1,1,0,0,0,0|2,0,0]=4 53 B15R2.30 BrC1=CC(C2=CC=CC(Br)=C2)=CC=C1 SY038334 [1,1,0,0,0,0|2,0,0]=4 54 B15R2.30 CC1=CC(C2=CC=CC(C)=C2)=CC=C1 SY051747 [1,1,0,0,0,0|1,0,0]=3 55 B15R2.32 CC1=C(O)C=CC=C1C2=CC=CC=C2 SY096689 [1,1,0,0,0,0|2,0,0]=4 56 B15R2.94 CC1=CC(C2=CC=CC=C2)=CC=C1Br SY244445 [1,1,0,0,0,0|1,0,0]=3 57 B15R2.94 CC1=CC(C2=CC=NC=C2)=CC=C1F SY244565 [1,1,0,0,0,0|2,0,0]=4 58 B15R2.332 BrC1=CC=CC=C1C2=CC=CC(I)=C2 SY278975 [1,1,0,0,0,0|2,0,0]=4 59 B15R2.332 CC1=CC=CC=C1C2=CC=CC(N)=C2 SY032942 [1,1,0,0,0,0|2,0,0]=4 60 B15R2.332 NC1=CC=CC=C1C2=CC=CC(Cl)=C2 SY279618 [1,1,0,0,0,0|2,0,0]=4 61 B15R2.21 NOC1=CC=CC=C1C2=CC=CC=C2 SY282440 [1,1,0,0,0,0|1,0,1]=4 62 B15R2.21 NOC1=CC=CC=C1C2=CC=CC=C2 SY282441 [1,1,0,0,0,0|1,0,1]=4 63 B15R2.21 O=CC1=CC=CC=C1C2=CC=CC=C2 SY003223 [1,1,0,0,0,0|1,0,0]=3 64 B15R2.21 O=CC1=CC=CC=C1C2=CC=CN=C2 SY109752 [1,1,0,0,0,0|2,0,0]=4 65 B15R2.308 CC1=CC=CC=C1C2=CC=C(Br)C=C2 SY273494 [1,1,0,0,0,0|2,0,0]=4 66 B15R2.308 CC1=CC=CC=C1C2=CC=C(N)C=C2 SY031758 [1,1,0,0,0,0|2,0,0]=4 67 B15R2.308 ClC1=CC=C(C2=CC=CC=C2Br)C=C1 SY039768 [1,1,0,0,0,0|2,0,0]=4 68 B15R2.389 NC1=CC(Cl)=CC=C1C2=CC=CC=C2 SY236695 [1,1,0,0,0,0|2,0,0]=4 69 B15R2.389 OC1=CC=C(C2=CC=CC=C2)C(O)=C1 SY209174 [1,1,0,0,0,0|1,0,1]=4 70 B15R2.555 BrC1=CC=CC=C1C2=CC=CC=C2Br SY030335 [1,1,0,0,0,0|2,0,0]=4 71 B15R2.555 CC1=CC=CC=C1C2=CC=CC=C2C SY052246 [1,1,0,0,0,0|2,0,0]=4 72 B15R2.555 OC1=CC=CC=C1C2=CC=CC=C2O SY048537 [1,1,0,0,0,0|1,0,1]=4 73 B15R2.7148 CC1=CC=C(C)N1C2=CC(O)=CC=C2 SY041430 [0,1,0,0,1,0|1,0,0]=3 74 B15R2.309 CC1=CC(C)=NN1C2=CC=C(N)C=C2 SY005469 [0,1,0,0,1,0|2,0,0]=4 75 B17R2.3493 CC1=CC=C(Cl)C(NC2=CC=CC=C2Br)=C1 SY262311 [0,1,0,0,0,1|2,0,0]=4 76 B17R2.3479 O=[N+]([O-])C1=CC=C(F)C=C1C2=CC=CC=C2 SY275431 [0,2,0,0,0,0|2,0,0]=4 77 B15R2.38 BrC1=CC=CC=C1NC2=CC=CC=C2 SY039739 [0,0,1,1,0,0|2,0,0]=4 78 B15R2.38 NC1=C(NC2=CC=CC=C2)C=CC=C1 SY013884 [0,0,1,1,0,0|2,0,0]=4 79 B15R2.29 BrC1=CC=C(NC2=CC=CC=C2)C=C1 SY052873 [0,0,1,1,0,0|2,0,0]=4 80 B15R2.29 CC1=CC=C(NC2=CC=CC=C2)C=C1 SY005741 [0,0,1,1,0,0|1,0,0]=3 81 B15R2.29 ClC1=CC=C(NC2=CC=CC=C2)C=C1 SY126150 [0,0,1,1,0,0|2,0,0]=4 82 B15R2.993 CN(C)C=C1C(=O)NC2=C1C=CC=C2 SY058395 [0,0,1,1,0,0|1,0,1]=4 83 B17R3.31627 CC1=CC2=C(C=C1)NC3=C2C=C(C)C=C3 SY055480 [0,1,0,1,0,0|2,0,0]=4 84 B13R2.10 BrC1=CN(C2=CC=CC=C2)N=C1 SY007255 [1,0,0,0,1,0|2,0,0]=4 85 B13R2.10 CC1=NN(C2=CC=CC=C2)C=C1 SY010761 [1,0,0,0,1,0|1,0,0]=3 86 B13R2.10 NC1=CN(C2=CC=CC=C2)C=N1 SY268206 [1,0,0,0,1,0|2,0,0]=4 87 B13R2.13 CC1=CC(C2=CC=CN2)=CC=C1 SY122118 [1,0,0,0,1,0|2,0,0]=4 88 B13R2.15 NC1=CN=CN1C2=CC=CC=C2 SY284981 [1,0,0,0,1,0|2,0,0]=4 89 B15R2.31 BrC1=CC(NC2=CC=CC=C2)=CC=C1 SY152620 [1,0,0,0,0,1|2,0,0]=4 90 B15R2.31 BrC1=CC(OC2=CC=CC=C2)=CC=C1 SY014492 [1,0,0,0,0,1|2,0,0]=4 91 B15R2.31 CC1=CC(NC2=CC=CC=C2)=CC=C1 SY005734 [1,0,0,0,0,1|1,0,0]=3 92 B15R2.31 NC1=CC(NC2=CC=CC=C2)=CC=C1 SY265414 [1,0,0,0,0,1|2,0,0]=4