0 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CS2 D75547 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.3683 CC1=CC=C2N=C(Br)C=CC2=C1 33556 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.3683 NC1=CC2=C(C=C1)OC(=O)CC2 D78716 [0,0,0,0,0,0|2,0,2]=4 3 B13R2.3683 O=C1CSC2=C(C=CC(Cl)=C2)N1 AT25445 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.3683 OC1=CC=C2C=C(Br)C=NC2=N1 O11533 [0,0,0,0,0,0|3,0,1]=4 5 B13R2.3683 OC1=CN=C2C=C(Cl)C=CC2=N1 S10160 [0,0,0,0,0,0|3,0,1]=4 6 B12R2.24 CC1=CC2=CC=CC=C2C=N1 63496 [1,0,0,0,0,0|2,0,0]=3 7 B12R2.24 CC1=CC=C2N=CC=CC2=C1 20449 [1,0,0,0,0,0|2,0,0]=3 8 B12R2.24 OC1=NC2=CC=CC=C2N=C1 P50007 [1,0,0,0,0,0|2,0,1]=4 9 B14R2.2332 CC1=CC=C2N=C(CCl)C=CC2=C1 C15371 [0,1,0,0,0,0|3,0,0]=4 10 B14R2.2332 COC1=CC=C2C=C(Cl)C=CC2=N1 98076 [0,1,0,0,0,0|2,0,1]=4 11 B14R2.2332 ClCC1=CC=C2C=C(Br)C=CC2=C1 A50712 [0,1,0,0,0,0|2,0,0]=3 12 B14R2.8235 CC1=CC(N)=C2C=C(Cl)C=CC2=N1 52226 [0,1,0,0,0,0|3,0,0]=4 13 B14R2.8235 CC1=CC=C2N=C(C)C=C(O)C2=C1 D74571 [0,1,0,0,0,0|3,0,0]=4 14 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(Cl)=C1 77509 [0,1,0,0,0,0|3,0,0]=4 15 B14R2.8235 NC1=CC2=C(C=C1)NC(=O)OC2=O 56056 [0,1,0,0,0,0|3,0,0]=4 16 B14R2.8235 O=C1C=C(O)NC2=C1C=C(Br)C=C2 O11540 [0,1,0,0,0,0|2,0,1]=4 17 B14R2.29369 OC1=NC=C2C(=C1)C=CC(F)=C2Cl E72036 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.49 C=CC(=O)NC1=CC=C(Br)C=C1 N11714 [0,0,1,0,0,0|2,0,0]=3 19 B12R1.49 C=CC(=O)NC1=CC=C(F)C=C1 N11717 [0,0,1,0,0,0|2,0,0]=3 20 B12R1.226 CC(=O)\C=C\C1=CC=CC(Br)=C1 D78766 [0,0,1,0,0,0|1,0,1]=3 21 B12R1.226 O=[N+]([O-])\C=C\C1=CC=CC(Br)=C1 D85851 [0,0,1,0,0,0|3,0,0]=4 22 B12R2.606 O=C1CC2=C(C=C(O)C=C2)N1 S11541 [0,0,0,0,1,0|1,0,2]=4 23 B12R2.606 O=C1NC2=C(C=C(I)C=C2)O1 D78645 [0,0,0,0,1,0|3,0,0]=4 24 B11R1.40 O=CC(Cl)=CC1=CC=CC=C1 D94582 [1,0,1,0,0,0|2,0,0]=4 25 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 H10800 [1,0,1,0,0,0|1,0,0]=3 26 B11R2.20 C1=CC=C2N=CC=CC2=C1 D95380 [2,0,0,0,0,0|1,0,0]=3 27 B11R2.20 C1=CC=C2N=CC=CC2=C1 H10805 [2,0,0,0,0,0|1,0,0]=3 28 B13R1.15 COC(=O)\C=C\C1=CC=CC(F)=C1 W12104 [0,1,1,0,0,0|1,0,1]=4 29 B13R1.511 O=C(O)\C=C\C1=CC(Cl)=C(Cl)C=C1 29228 [0,1,1,0,0,0|2,0,0]=4 30 B13R1.893 O=C(O)\C=C\C1=C(Br)C=CC(F)=C1 77769 [0,1,1,0,0,0|2,0,0]=4 31 B13R2.32 CC1=C(C)C2=CC=CC=C2C=C1 D89712 [1,1,0,0,0,0|1,0,0]=3 32 B13R2.32 CC1=C(N)C2=CC=CC=C2C=C1 D88419 [1,1,0,0,0,0|1,0,0]=3 33 B13R2.32 ClC1=C(Cl)C2=CC=CC=C2N=C1 C15430 [1,1,0,0,0,0|2,0,0]=4 34 B13R2.32 FC1=C(Br)C=CC2=CC=CC=C21 78739 [1,1,0,0,0,0|1,0,0]=3 35 B13R2.32 FC1=C(Br)C=CC2=CC=CN=C21 AT25793 [1,1,0,0,0,0|2,0,0]=4 36 B13R2.32 O=C1C(I)=COC2=C1C=CC=C2 C91063 [1,1,0,0,0,0|2,0,0]=4 37 B13R2.32 O=C1C=CC2=C(C=CC=C2)C1=O F30116 [1,1,0,0,0,0|0,0,0]=2 38 B13R2.155 NC1=CC=C2C=CC(=O)N=C2N1 F17549 [1,1,0,0,0,0|2,0,0]=4 39 B13R2.155 [O-][N+]1=CC=C2C=CC(Br)=CC2=C1 F31382 [1,1,0,0,0,0|1,0,1]=4 40 B13R2.162 OC1=C2C=C(Br)C=CC2=CC=N1 BL001896 [1,1,0,0,0,0|2,0,0]=4 41 B13R2.162 OC1=NC2=C(O)C=CC=C2C=C1 65650 [1,1,0,0,0,0|1,0,1]=4 42 B13R2.328 CC1=CC(C)=C2N=CC=CC2=C1 D74941 [1,1,0,0,0,0|2,0,0]=4 43 B13R2.328 O=C1C=C(O)NC2=C1C=CC=C2 O10804 [1,1,0,0,0,0|1,0,1]=4 44 B13R2.328 [O-]C1=CC(O)=NC2=CC=CC=C12 D89686 [1,1,0,0,0,0|1,0,1]=4 45 B13R2.328 [O-][N+]1=CC(Br)=CC2=CC=CC=C21 78439 [1,1,0,0,0,0|2,0,0]=4 46 B13R2.369 CC1=CC2=CC=CC=C2N=C1N 71190 [1,1,0,0,0,0|2,0,0]=4 47 B13R2.369 ClC1=CC2=CC=CN=C2C=C1Cl 84458 [1,1,0,0,0,0|2,0,0]=4 48 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O W10297 [1,1,0,0,0,0|2,0,0]=4 49 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1Cl D89502 [1,1,0,0,0,0|1,0,0]=3 50 B13R2.369 O=C1OC2=C(C=CC=C2)C=C1O T73087 [1,1,0,0,0,0|1,0,0]=3 51 B13R2.5179 ClC1=CC=C2C(I)=CC=NC2=C1 AT14803 [1,1,0,0,0,0|2,0,0]=4 52 B13R2.5179 NC1=C2C=CC(O)=CC2=CC=C1 A51116 [1,1,0,0,0,0|0,0,1]=3 53 B13R2.43 O=CC1=CC2=C(C=CC(Br)=C2)O1 A12307 [0,1,0,0,1,0|2,0,0]=4 54 B13R2.3028 O=C1NC2=C(C=C(O)C=C2)C1=O D86154 [0,1,0,0,1,0|1,0,1]=4 55 B15R2.1754 CC1=CC=C2C=C(C=O)C(Cl)=NC2=C1 31116 [0,2,0,0,0,0|2,0,0]=4 56 B15R2.4780 COC1=CC2=CC=C(CO)C=C2C=C1 T72686 [0,2,0,0,0,0|0,0,2]=4 57 B15R2.4780 OCC1=CC=C2C=C(CO)C=CC2=C1 T71102 [0,2,0,0,0,0|0,0,2]=4 58 B15R2.59733 CC1=CC(=O)OC2=CC(O)=C(Cl)C=C12 T70505 [0,2,0,0,0,0|2,0,0]=4 59 B15R2.59733 CC1=CC2=C(C=C1N)C(C)=CC(=O)O2 AT20469 [0,2,0,0,0,0|2,0,0]=4 60 B13R2.342 CC1=CC=CC2=C1C=CNC2=O 26570 [0,0,1,1,0,0|2,0,0]=4 61 B13R2.342 O=C1C=CNC2=C(Br)C=CC=C12 F10438 [0,0,1,1,0,0|2,0,0]=4 62 B13R2.342 O=C1C=CNC2=C(F)C=CC=C12 O11675 [0,0,1,1,0,0|2,0,0]=4 63 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 23340 [0,0,1,0,1,0|2,0,0]=4 64 B11R1.22 O=CC(=O)C1=CC=C(F)C=C1 75255 [0,0,1,0,1,0|2,0,0]=4 65 B11R2.1 SC1=CNC2=C1C=CC=C2 H10966 [1,0,0,0,1,0|1,1,0]=4 66 B11R2.36 CC1=CC2=C(C=C1)OC=C2 AC2085 [1,0,0,0,1,0|2,0,0]=4 67 B11R2.36 ClC1=CC2=C(C=CS2)C=C1 78113 [1,0,0,0,1,0|2,0,0]=4 68 B11R2.36 NC1=CC2=C(C=C1)SC=C2 AC7464 [1,0,0,0,1,0|2,0,0]=4 69 B11R2.36 O=C1C=CC2=CNNC2=C1 29235 [1,0,0,0,1,0|2,0,0]=4