0 B12R2.1081 CC1=CC=NC2=CC=CC=C12 H10212 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.1081 ClC1=CC=CC2=CC=CC=C12 D89503 [0,0,0,0,0,0|3,0,0]=3 2 B12R2.1081 NC1=C2N=CC=NC2=CC=C1 81317 [0,0,0,0,0,0|1,0,0]=1 3 B12R2.1081 NC1=CN=CC2=CC=CC=C12 F14134 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.1081 O=C1NC=NC2=C1C=CC=N2 37327 [0,0,0,0,0,0|4,0,0]=4 5 B12R2.1081 OC1=C2CC=CCC2=CC=C1 C15471 [0,0,0,0,0,0|3,0,0]=3 6 B12R2.1081 [O-]C1=CC=CC2=CC=CN=C12 74357 [0,0,0,0,0,0|2,0,0]=2 7 B12R2.1081 [O-]C1=CC=CC2=CC=CN=C12 D88841 [0,0,0,0,0,0|2,0,0]=2 8 B11R2.20 C1=CC=C2N=CC=CC2=C1 D95380 [1,0,0,0,0,0|1,0,0]=2 9 B11R2.20 C1=CC=C2N=CC=CC2=C1 H10805 [1,0,0,0,0,0|1,0,0]=2 10 B13R2.32 CC1=C(C)C2=CC=CC=C2C=C1 D89712 [0,1,0,0,0,0|2,0,0]=3 11 B13R2.32 CC1=C(N)C2=CC=CC=C2C=C1 D88419 [0,1,0,0,0,0|3,0,0]=4 12 B13R2.32 FC1=C(Br)C=CC2=CC=CC=C21 78739 [0,1,0,0,0,0|3,0,0]=4 13 B13R2.32 FC1=C(Br)C=CC2=CC=CN=C21 AT25793 [0,1,0,0,0,0|2,0,0]=3 14 B13R2.32 NC1=C(I)C2=NC=CN=C2C=C1 E71233 [0,1,0,0,0,0|1,0,0]=2 15 B13R2.32 O=C1C=CC2=C(C=CC=C2)C1=O F30116 [0,1,0,0,0,0|3,0,0]=4 16 B13R2.162 CC1=CC2=C(N)C=CC=C2N=N1 CS1104 [0,1,0,0,0,0|3,0,0]=4 17 B13R2.162 OC1=NC2=C(O)C=CC=C2C=C1 65650 [0,1,0,0,0,0|2,0,0]=3 18 B13R2.328 CC1=CC(C)=C2N=CC=CC2=C1 D74941 [0,1,0,0,0,0|1,0,0]=2 19 B13R2.342 CC1=CC=CC2=C1C=CNC2=O 26570 [0,1,0,0,0,0|3,0,0]=4 20 B13R2.342 O=C1C=CNC2=C(Br)C=CC=C12 F10438 [0,1,0,0,0,0|2,0,1]=4 21 B13R2.342 O=C1C=CNC2=C(F)C=CC=C12 O11675 [0,1,0,0,0,0|2,0,1]=4 22 B13R2.342 OC1=C2C=CC=C(Cl)C2=NC=C1 F19997 [0,1,0,0,0,0|2,0,0]=3 23 B13R2.342 OC1=CC=CC2=C(O)C=CN=C12 75991 [0,1,0,0,0,0|2,0,0]=3 24 B13R2.371 CC1=CC=C(F)C2=CC=CN=C12 F13837 [0,1,0,0,0,0|1,0,0]=2 25 B13R2.371 NC1=CC=C(O)C2=CC=CC=C12 C15486 [0,1,0,0,0,0|3,0,0]=4 26 B13R2.371 NC1=CC=C(O)C2=NC=CC=C12 F16215 [0,1,0,0,0,0|2,0,0]=3 27 B13R2.1613 CNC1=CC=CC2=CC=CC=C21 D91455 [0,1,0,0,0,0|2,0,0]=3 28 B13R2.1613 NCC1=C2C=CC=NC2=CC=C1 24143 [0,1,0,0,0,0|1,0,0]=2 29 B13R2.1613 NCC1=CN=CC2=CC=CC=C21 D82919 [0,1,0,0,0,0|3,0,0]=4 30 B13R2.1613 NNC1=C2N=CC=CC2=CC=C1 C16674 [0,1,0,0,0,0|2,0,0]=3 31 B13R2.1613 SCC1=CC=CC2=CC=CC=C21 C80040 [0,1,0,0,0,0|2,0,0]=3 32 B13R2.4818 IC1=CC=CC2=CC=CC(I)=C12 AT25680 [0,1,0,0,0,0|3,0,0]=4 33 B13R2.4818 NC1=C2C(=CC=C1)C=CC=[N+]2[O-] T71462 [0,1,0,0,0,0|2,0,1]=4 34 B13R2.4818 NC1=C2C(F)=CC=CC2=NC=N1 D74557 [0,1,0,0,0,0|3,0,0]=4 35 B13R2.4818 O=C1NC=NC2=CC=CC(Cl)=C12 29751 [0,1,0,0,0,0|3,0,0]=4 36 B13R2.4818 OC1=C2C(F)=CC=CC2=NC=N1 I12007 [0,1,0,0,0,0|3,0,0]=4 37 B13R2.5179 NC1=C2C=CC(O)=CC2=CC=C1 A51116 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.17 C=CCOC1=C(C)C=CC=C1 D88409 [0,0,1,0,0,0|2,0,1]=4 39 B11R2.1 BrC1=COC2=CC=CN=C12 F52702 [0,0,0,0,1,0|3,0,0]=4 40 B11R2.106 BrC1=C2N=CNC2=CN=C1 P12260 [0,0,0,0,1,0|2,0,1]=4 41 B11R2.106 CC1=C2NCCC2=CC=C1 O11660 [0,0,0,0,1,0|0,0,3]=4 42 B11R2.106 CC1=CC=CC2=C1N=CS2 F18224 [0,0,0,0,1,0|1,0,0]=2 43 B11R2.106 CC1=CC=CC2=NC=CN12 76316 [0,0,0,0,1,0|1,0,0]=2 44 B11R2.106 CC1=CC=CC2=NON=C12 29947 [0,0,0,0,1,0|1,0,0]=2 45 B11R2.106 ClC1=CC=CC2=NC=CN12 25523 [0,0,0,0,1,0|2,0,0]=3 46 B11R2.106 IC1=C2N=CN=C2N=CN1 C15422 [0,0,0,0,1,0|3,0,0]=4 47 B11R2.106 NC1=CC=NC2=NC=NN12 D74285 [0,0,0,0,1,0|3,0,0]=4 48 B10R1.4 C=CCC1=C(C)C=CC=C1 D97323 [1,0,1,0,0,0|1,0,0]=3 49 B10R1.4 C=CCC1=C(N)C=CC=C1 D88543 [1,0,1,0,0,0|1,0,1]=4 50 B10R1.4 CC1=C(N=NN)C=CC=C1 D88287 [1,0,1,0,0,0|1,0,1]=4 51 B10R1.245 C=CC1=C(F)C=CC=C1F 35625 [1,0,1,0,0,0|2,0,0]=4 52 B12R2.24 CC1=CC=C2N=CC=CC2=C1 20449 [1,1,0,0,0,0|1,0,0]=3 53 B12R2.24 NC1=NC2=CC=CC=C2N=N1 D78676 [1,1,0,0,0,0|1,0,0]=3 54 B12R2.24 OC1=NC2=CC=CC=C2N=C1 P50007 [1,1,0,0,0,0|0,0,0]=2 55 B12R2.202 CC1=NC2=C(C=CC=C2N)O1 AC5951 [0,1,0,0,1,0|2,0,0]=4 56 B12R2.202 CC1=NC2=C(N1)C(N)=CC=C2 D84092 [0,1,0,0,1,0|1,0,1]=4 57 B12R2.202 NC1=NC2=C(C=CC=C2O)S1 72870 [0,1,0,0,1,0|2,0,0]=4 58 B12R2.246 BrC1=CC(Br)=C2SC=NC2=C1 D74924 [0,1,0,0,1,0|2,0,0]=4 59 B12R2.246 ClC1=CC(Cl)=C2OC=CC2=C1 O10795 [0,1,0,0,1,0|2,0,0]=4 60 B12R2.246 ClC1=CC2=NSN=C2C(Br)=C1 91180 [0,1,0,0,1,0|2,0,0]=4 61 B12R2.315 COC1=CC=CC2=C1C=NS2 D86294 [0,1,0,0,1,0|2,0,0]=4 62 B12R2.315 OCC1=CC=CN2C=CN=C12 81213 [0,1,0,0,1,0|1,0,0]=3 63 B14R2.8045 CC1=CC(N)=C2C=CC=C(F)C2=N1 52224 [0,2,0,0,0,0|2,0,0]=4 64 B14R2.8045 CC1=CC(O)=C2C=CC=C(F)C2=N1 61170 [0,2,0,0,0,0|2,0,0]=4 65 B14R2.8045 CC1=CC=CC2=C1NC(=O)C=C2O N12493 [0,2,0,0,0,0|1,0,1]=4 66 B14R2.8045 CC1=NC2=C(C)C=CC=C2C(O)=C1 L10079 [0,2,0,0,0,0|1,0,0]=3 67 B14R2.28472 CC1=C(C)N=C2C(=O)NC=CC2=N1 D80961 [0,2,0,0,0,0|2,0,0]=4 68 B14R2.28480 CC1=NC2=CC=CC(F)=C2C(Cl)=C1 L10112 [0,2,0,0,0,0|2,0,0]=4 69 B14R2.1078 COC1=CC=CC2=C(N)C=CN=C12 D81817 [0,2,0,0,0,0|1,0,0]=3 70 B14R2.1131 COC1=CC=C(C)C2=CC=CC=C12 T72156 [0,2,0,0,0,0|2,0,0]=4 71 B14R2.1131 OC1=CC=C(CCl)C2=CC=CN=C12 80256 [0,2,0,0,0,0|1,0,0]=3 72 B14R2.7150 BrCCC1=CC=CC2=CC=CC=C21 C80041 [0,2,0,0,0,0|2,0,0]=4 73 B14R2.7150 CCNC1=CC=CC2=CC=CC=C21 AT25692 [0,2,0,0,0,0|2,0,0]=4 74 B14R2.7150 CCNC1=CC=CC2=CC=CC=C21 D90444 [0,2,0,0,0,0|2,0,0]=4 75 B14R2.31359 C[C@@H](N)C1=CC=CC2=CC=CC=C21 C12992 [0,2,0,0,0,0|2,0,0]=4 76 B14R2.31359 C[C@H](N)C1=CC=CC2=CC=CC=C21 F19297 [0,2,0,0,0,0|2,0,0]=4 77 B10R2.7 C1=CC2=C(C=C1)OC=C2 D88596 [1,0,0,0,1,0|1,0,0]=3 78 B10R2.7 C1=CC2=C(C=C1)[S+]=CS2 D88761 [1,0,0,0,1,0|2,0,0]=4 79 B10R2.7 C1=CC2=CNN=C2C=N1 O10791 [1,0,0,0,1,0|2,0,0]=4 80 B10R2.7 C1=CC2=NNC=C2C=N1 F18249 [1,0,0,0,1,0|2,0,0]=4 81 B10R2.7 C1=CN=C2NC=NC2=C1 62602 [1,0,0,0,1,0|1,0,1]=4