0 B15R2.33 CC1=CN(C2=CC=CC=C2)C(=O)C=C1 63596 [0,0,0,0,0,0|0,0,0]=0 1 B15R2.33 CC1=NN(C2=CC=CC=C2)C(=O)CC1 N10033 [0,0,0,0,0,0|1,0,2]=3 2 B15R2.33 NC1=CC(C2=CC=CC=C2)=C(Cl)C=C1 D82885 [0,0,0,0,0,0|3,0,0]=3 3 B14R2.21 BrC1=CC(C2=CC=CC=C2)=CC=C1 21748 [1,0,0,0,0,0|2,0,0]=3 4 B14R2.21 BrC1=CC(C2=CC=NC=C2)=CC=C1 T70921 [1,0,0,0,0,0|3,0,0]=4 5 B14R2.21 BrC1=CC(C2=CN=CC=C2)=CC=C1 74294 [1,0,0,0,0,0|3,0,0]=4 6 B14R2.21 BrC1=CC(C2=NC=CC=C2)=CC=C1 56648 [1,0,0,0,0,0|3,0,0]=4 7 B14R2.21 BrC1=CN=CC(C2=CC=CC=C2)=C1 F13548 [1,0,0,0,0,0|3,0,0]=4 8 B14R2.21 BrC1=NC(C2=CC=CC=C2)=CC=C1 F30275 [1,0,0,0,0,0|3,0,0]=4 9 B14R2.21 BrC1=NC=CC(C2=CC=CC=C2)=C1 25594 [1,0,0,0,0,0|3,0,0]=4 10 B14R2.21 CC1=CC(C2=CC=CC=C2)=NC=C1 F52194 [1,0,0,0,0,0|2,0,0]=3 11 B14R2.21 CC1=CC=CC(C2=CC=CC=C2)=C1 64243 [1,0,0,0,0,0|1,0,0]=2 12 B14R2.21 CC1=CC=CC(C2=CC=CC=C2)=N1 T72489 [1,0,0,0,0,0|2,0,0]=3 13 B14R2.21 CC1=CN=CC(C2=CC=CC=C2)=C1 D91443 [1,0,0,0,0,0|2,0,0]=3 14 B14R2.21 ClC1=NC=CC(C2=CC=CC=C2)=C1 AR3614 [1,0,0,0,0,0|3,0,0]=4 15 B14R2.21 IC1=CC(C2=CC=CC=C2)=CC=C1 63020 [1,0,0,0,0,0|2,0,0]=3 16 B14R2.21 NC1=CC(C2=CC=CC=C2)=CC=C1 30646 [1,0,0,0,0,0|2,0,0]=3 17 B14R2.21 NC1=CC(C2=CC=CC=C2)=CC=C1 54000 [1,0,0,0,0,0|2,0,0]=3 18 B14R2.21 NC1=CC(C2=CC=CC=C2)=NC=C1 25138 [1,0,0,0,0,0|3,0,0]=4 19 B14R2.21 NC1=CC=CC(C2=CC=CN=C2)=C1 71641 [1,0,0,0,0,0|3,0,0]=4 20 B14R2.21 NC1=CC=CC(C2=NC=CC=C2)=C1 C71547 [1,0,0,0,0,0|3,0,0]=4 21 B14R2.21 NC1=NC(C2=CC=CC=C2)=CC=C1 54183 [1,0,0,0,0,0|3,0,0]=4 22 B14R2.21 OC1=CC(C2=CC=CC=C2)=CC=C1 D70321 [1,0,0,0,0,0|2,0,0]=3 23 B14R2.24 BrC1=C(C2=CC=CC=C2)C=CC=C1 CX1316 [1,0,0,0,0,0|2,0,0]=3 24 B14R2.24 BrC1=C(C2=CC=CC=C2)C=CN=C1 BL000497 [1,0,0,0,0,0|3,0,0]=4 25 B14R2.24 BrC1=C(C2=CC=CC=C2)N=CC=C1 O10955 [1,0,0,0,0,0|3,0,0]=4 26 B14R2.24 CC1=C(C2=CC=CC=C2)C=CC=C1 C10585 [1,0,0,0,0,0|2,0,0]=3 27 B14R2.24 CC1=C(C2=CC=CC=C2)C=NC=C1 F19754 [1,0,0,0,0,0|3,0,0]=4 28 B14R2.24 CC1=CC=CN=C1C2=CC=CC=C2 29662 [1,0,0,0,0,0|3,0,0]=4 29 B14R2.24 FC1=C(C2=CC=CC=C2)C=CC=C1 AC8710 [1,0,0,0,0,0|2,0,0]=3 30 B14R2.24 IC1=C(C2=CC=CC=C2)C=CC=C1 CX1313 [1,0,0,0,0,0|2,0,0]=3 31 B14R2.24 NC1=C(C2=CC=CC=C2)C=CC=C1 32581 [1,0,0,0,0,0|2,0,0]=3 32 B14R2.24 NC1=C(C2=CC=CC=C2)C=CC=C1 CX1301 [1,0,0,0,0,0|2,0,0]=3 33 B14R2.24 NC1=C(C2=CC=CC=C2)C=CN=C1 97502 [1,0,0,0,0,0|3,0,0]=4 34 B14R2.24 NC1=C(C2=CC=CC=[C-]2)C=CC=C1 D90261 [1,0,0,0,0,0|2,0,1]=4 35 B14R2.24 NC1=C(C2=CC=CN=C2)C=CC=C1 D94574 [1,0,0,0,0,0|3,0,0]=4 36 B14R2.24 NC1=CC=CN=C1C2=CC=CC=C2 46025 [1,0,0,0,0,0|3,0,0]=4 37 B14R2.24 NC1=CC=CN=C1C2=CC=CC=C2 N10445 [1,0,0,0,0,0|3,0,0]=4 38 B14R2.24 NC1=NC=CC=C1C2=CC=CC=C2 27495 [1,0,0,0,0,0|3,0,0]=4 39 B14R2.24 OC1=NC=CC=C1C2=CC=CC=C2 O11050 [1,0,0,0,0,0|2,0,1]=4 40 B16R2.2443 COC1=C(C2=CC=CC=C2)C=C(N)C=C1 S10897 [0,1,0,0,0,0|2,0,1]=4 41 B14R1.423 O=C(O)\C=C/C(=O)NC1=CC=CC=C1 31800 [0,0,1,0,0,0|2,0,0]=3 42 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2C=CC=C3 FD14042 [0,0,0,1,0,0|3,0,0]=4 43 B16R3.2583 BrC1=CC2=C(C=C1)OC3=C2C=CC=C3 74272 [0,0,0,1,0,0|2,0,1]=4 44 B16R3.2583 BrC1=CC2=C(C=C1)SC3=C2C=CC=C3 24689 [0,0,0,1,0,0|2,1,0]=4 45 B16R3.2583 IC1=CC2=C(C=C1)NC3=C2C=CC=C3 FD14045 [0,0,0,1,0,0|3,0,0]=4 46 B16R3.2583 NC1=CC2=C(C=C1)OC3=C2C=CC=C3 W10066 [0,0,0,1,0,0|2,0,1]=4 47 B16R3.2583 OC1=CC2=C(C=C1)OC3=C2C=CC=C3 C10429 [0,0,0,1,0,0|2,0,1]=4 48 B14R2.277 CC1=CC=C(C)N1C2=CC=CC=C2 D92139 [0,0,0,0,1,0|1,0,0]=2 49 B14R2.277 O=C1C=CC(=O)N1C2=CC=CC=C2 D77858 [0,0,0,0,1,0|1,0,0]=2 50 B14R2.277 O=C1CCC(=O)N1C2=CC=CC=C2 D70370 [0,0,0,0,1,0|1,0,2]=4 51 B14R2.277 O=C1CNC(=S)N1C2=CC=CC=C2 W13699 [0,0,0,0,1,0|2,0,1]=4 52 B14R2.277 O=C1NNC(=O)N1C2=CC=CC=C2 O11279 [0,0,0,0,1,0|3,0,0]=4 53 B14R2.598 CC1=CC(C)=C(C2=CC=CC=C2)S1 T71071 [0,0,0,0,1,0|3,0,0]=4 54 B14R2.598 CC1=CC(C)=NN1C2=CC=CC=C2 H10417 [0,0,0,0,1,0|2,0,0]=3 55 B14R2.598 CC1=NN(C2=CC=CC=C2)C(=O)C1 D86209 [0,0,0,0,1,0|1,0,1]=3 56 B14R2.598 CC1=NN(C2=CC=CC=C2)C(N)=C1 51283 [0,0,0,0,1,0|2,0,0]=3 57 B14R2.598 NC1=CC(=O)N(C2=CC=CC=C2)N1 D97376 [0,0,0,0,1,0|2,0,0]=3 58 B14R2.598 NC1=CC(O)=NN1C2=CC=CC=C2 D82372 [0,0,0,0,1,0|3,0,0]=4 59 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 C10691 [0,0,0,0,1,0|3,0,0]=4 60 B14R2.598 O=C1CC(=O)N(C2=CC=CC=C2)N1 W18012 [0,0,0,0,1,0|2,0,1]=4 61 B16R2.317 O=C1C=CC(Br)=CN1CC2=CC=CC=C2 W10940 [0,0,0,0,0,1|1,0,0]=2 62 B16R2.317 OC1=C(CC2=CC=CC=C2)C=C(Cl)C=C1 D88696 [0,0,0,0,0,1|2,0,1]=4 63 B13R2.3 C1=CC=C(C2=CC=CN=C2)C=C1 75900 [2,0,0,0,0,0|2,0,0]=4 64 B13R2.3 C1=CC=C(C2=CC=NC=C2)C=C1 28435 [2,0,0,0,0,0|2,0,0]=4 65 B13R2.3 C1=CC=C(C2=NC=CC=C2)C=C1 O10850 [2,0,0,0,0,0|2,0,0]=4 66 B13R2.3 C1=CC=[N+](C2=CC=NC=C2)C=C1 C93488 [2,0,0,0,0,0|1,0,1]=4 67 B15R2.17 BrCC1=CC(C2=CC=CC=C2)=CC=C1 54502 [1,1,0,0,0,0|1,0,0]=3 68 B15R2.17 CCC1=CC=CC(C2=CC=CC=C2)=C1 D90544 [1,1,0,0,0,0|1,0,0]=3 69 B15R2.17 N#CC1=CC(C2=CC=CC=C2)=CC=C1 68665 [1,1,0,0,0,0|1,0,1]=4 70 B15R2.17 NCC1=CC(C2=CC=CC=C2)=CC=C1 AR1643 [1,1,0,0,0,0|1,0,0]=3 71 B15R2.17 O=CC1=CC(C2=CC=CC=C2)=CC=C1 61414 [1,1,0,0,0,0|1,0,1]=4 72 B15R2.17 OCC1=CC(C2=CC=CC=C2)=CC=C1 68663 [1,1,0,0,0,0|1,0,0]=3 73 B15R2.27 BrC1=CC(Br)=CC(C2=CC=CC=C2)=C1 CX1328 [1,1,0,0,0,0|2,0,0]=4 74 B15R2.28 BrC1=CC=C(C2=CC=CC(Br)=C2)C=C1 A11121 [1,1,0,0,0,0|2,0,0]=4 75 B15R2.28 CC1=CC=C(C2=CC(C)=CC=C2)C=C1 79370 [1,1,0,0,0,0|1,0,0]=3 76 B15R2.28 ClC1=CC=C(C2=CC=CC(Br)=C2)C=C1 D89165 [1,1,0,0,0,0|2,0,0]=4 77 B15R2.30 BrC1=CC=CC(C2=CC=CC(Br)=C2)=C1 CK2348 [1,1,0,0,0,0|2,0,0]=4 78 B15R2.30 CC1=CC=CC(C2=CC(C)=CC=C2)=C1 60036 [1,1,0,0,0,0|1,0,0]=3 79 B15R2.30 ClC1=CC=CC(C2=CC=CC(Br)=C2)=C1 F16146 [1,1,0,0,0,0|2,0,0]=4 80 B15R2.30 ClC1=CC=CC(C2=CC=CC(I)=C2)=C1 D93655 [1,1,0,0,0,0|2,0,0]=4 81 B15R2.30 NC1=CC=CC(C2=CC=CC(Cl)=C2)=C1 C13754 [1,1,0,0,0,0|2,0,0]=4 82 B15R2.32 CC1=CC=CC(C2=CC=CC=C2)=C1O F19850 [1,1,0,0,0,0|1,0,0]=3 83 B15R2.94 CC1=C(N)C=C(C2=CC=CC=C2)C=C1 S11024 [1,1,0,0,0,0|2,0,0]=4 84 B15R2.94 FC1=C(Br)C=C(C2=CC=CC=C2)C=C1 79635 [1,1,0,0,0,0|2,0,0]=4 85 B15R2.94 NC1=C(F)C=CC(C2=CC=CC=C2)=C1 D82991 [1,1,0,0,0,0|2,0,0]=4 86 B15R2.94 OC1=C(Cl)C=C(C2=CC=CC=C2)C=C1 D89225 [1,1,0,0,0,0|2,0,0]=4 87 B15R2.332 CC1=C(C2=CC=CC(N)=C2)C=CC=C1 AC1625 [1,1,0,0,0,0|2,0,0]=4 88 B15R2.21 BrCC1=C(C2=CC=CC=C2)C=CC=C1 97393 [1,1,0,0,0,0|2,0,0]=4 89 B15R2.21 COC1=C(C2=CC=CC=C2)C=CC=C1 D84060 [1,1,0,0,0,0|1,0,1]=4 90 B15R2.21 O=CC1=C(C2=CC=CC=C2)C=CC=C1 61416 [1,1,0,0,0,0|1,0,0]=3 91 B15R2.21 O=CC1=C(C2=CC=NC=C2)C=CC=C1 AR1223 [1,1,0,0,0,0|2,0,0]=4 92 B15R2.21 O=CC1=C(C2=CN=CC=C2)C=CC=C1 AR1220 [1,1,0,0,0,0|2,0,0]=4 93 B15R2.21 OCC1=C(C2=CC=CC=C2)C=CC=C1 73968 [1,1,0,0,0,0|1,0,1]=4 94 B15R2.308 CC1=CC=C(C2=C(C)C=CC=C2)C=C1 79368 [1,1,0,0,0,0|2,0,0]=4 95 B15R2.308 ClC1=CC=C(C2=C(Br)C=CC=C2)C=C1 11230 [1,1,0,0,0,0|2,0,0]=4 96 B15R2.308 NC1=C(C2=CC=C(Cl)C=C2)C=CC=C1 F20479 [1,1,0,0,0,0|2,0,0]=4 97 B15R2.308 NC1=CC=C(N2C=CC=CC2=O)C=C1 O10283 [1,1,0,0,0,0|0,0,0]=2 98 B15R2.308 O=C1C=CC=CN1C2=CC=C(Br)C=C2 D80645 [1,1,0,0,0,0|0,0,0]=2 99 B15R2.389 CC1=C(C2=CC=CC=C2)C=CC(Br)=C1 F19555 [1,1,0,0,0,0|2,0,0]=4 100 B15R2.389 FC1=C(C2=CC=CC=C2)C=CC(Br)=C1 36856 [1,1,0,0,0,0|2,0,0]=4 101 B15R2.389 FC1=CC(F)=C(C2=CC=CC=C2)C=C1 D90192 [1,1,0,0,0,0|2,0,0]=4 102 B15R2.389 NC1=CC(=O)N(C2=CC=CC=C2)N=C1 D82760 [1,1,0,0,0,0|1,0,0]=3 103 B15R2.389 OC1=CC(O)=C(C2=CC=CC=C2)C=C1 C72368 [1,1,0,0,0,0|1,0,1]=4 104 B15R2.555 BrC1=C(C2=C(Br)C=CC=C2)C=CC=C1 35211 [1,1,0,0,0,0|2,0,0]=4 105 B15R2.555 CC1=C(C2=C(C)C=CC=C2)C=CC=C1 79369 [1,1,0,0,0,0|2,0,0]=4 106 B15R2.555 ClC1=C(C2=C(Br)C=CC=C2)C=CC=C1 W17326 [1,1,0,0,0,0|2,0,0]=4 107 B15R2.555 FC1=C(C2=C(F)C=CC=C2)C=CC=C1 34893 [1,1,0,0,0,0|2,0,0]=4 108 B15R2.555 NC1=C(C2=C(N)C=CC=C2)C=CC=C1 T70293 [1,1,0,0,0,0|2,0,0]=4 109 B15R2.555 OC1=C(C2=C(O)C=CC=C2)C=CC=C1 D71070 [1,1,0,0,0,0|1,0,1]=4 110 B15R2.323 CC1=CC(=O)N(C2=CC=CC=C2)N1C H11233 [0,1,0,0,1,0|1,0,0]=3 111 B15R2.7458 O=C1C=CC(=O)N1C2=C(Br)C=CC=C2 75056 [0,1,0,0,1,0|1,0,0]=3 112 B15R2.18925 CC1=CC=C(C)N1C2=CC=C(Br)C=C2 D88944 [0,1,0,0,1,0|1,0,0]=3 113 B15R2.18925 CC1=CC=C(C)N1C2=NC=C(Br)C=C2 84352 [0,1,0,0,1,0|2,0,0]=4 114 B15R2.18925 NC1=CC=C(N2C(=O)C=CC2=O)C=C1 D81890 [0,1,0,0,1,0|1,0,0]=3 115 B15R2.18925 O=C1C=CC(=O)N1C2=CC=C(Br)C=C2 31054 [0,1,0,0,1,0|1,0,0]=3 116 B15R2.18925 O=C1C=CC(=O)N1C2=CC=C(F)C=C2 T72798 [0,1,0,0,1,0|1,0,0]=3 117 B15R2.18925 O=C1C=CC(=O)N1C2=CC=C(O)C=C2 31352 [0,1,0,0,1,0|1,0,0]=3 118 B15R2.309 CC1=CC=C(N2N=C(C)C=C2N)C=C1 70777 [0,1,0,0,1,0|2,0,0]=4 119 B15R2.309 CC1=CC=C(N2N=C(C)CC2=O)C=C1 H10774 [0,1,0,0,1,0|1,0,1]=4 120 B15R2.321 CC1=NN(C2=CC=CC=C2)C(N)=C1Br T71242 [0,1,0,0,1,0|2,0,0]=4 121 B15R2.334 CC1=NN(C2=CC=CC(Cl)=C2)C(=O)C1 S10604 [0,1,0,0,1,0|1,0,1]=4 122 B15R2.557 CC1=NN(C2=C(Cl)C=CC=C2)C(=O)C1 F12773 [0,1,0,0,1,0|1,0,1]=4 123 B17R2.5356 CC1=CC(C(=O)C2=CC=CC=C2)=C(O)C=C1 D90989 [0,1,0,0,0,1|1,0,1]=4 124 B15R2.38 CC1=C(NC2=CC=CC=C2)C=CC=C1 S12003 [0,0,1,1,0,0|1,0,0]=3 125 B15R2.38 ClC1=C(NC2=CC=CC=C2)C=CC=C1 CL8454 [0,0,1,1,0,0|2,0,0]=4 126 B15R2.38 NC1=C(NC2=CC=CC=C2)C=CC=C1 I10187 [0,0,1,1,0,0|2,0,0]=4 127 B15R2.29 BrC1=CC=C(NC2=CC=CC=C2)C=C1 O11193 [0,0,1,1,0,0|2,0,0]=4 128 B15R2.29 CC1=CC=C(NC2=CC=CC=C2)C=C1 D70378 [0,0,1,1,0,0|1,0,0]=3 129 B15R2.29 CC1=CC=C(OC2=CC=CC=C2)C=C1 63666 [0,0,1,1,0,0|2,0,0]=4 130 B15R2.29 ClC1=CC=C(NC2=CC=CC=C2)C=C1 57251 [0,0,1,1,0,0|2,0,0]=4 131 B15R2.29 NC1=CC=C(NC2=CC=CC=C2)C=C1 D91922 [0,0,1,1,0,0|2,0,0]=4 132 B15R2.29 NC1=CC=C(NC2=CC=CC=C2)C=C1 D97825 [0,0,1,1,0,0|2,0,0]=4 133 B15R2.29 OC1=CC=C(NC2=CC=CC=C2)C=C1 I10247 [0,0,1,1,0,0|2,0,0]=4 134 B15R2.988 O=C1C=C(C(=O)O)C2=C(C=CC=C2)N1 39316 [0,0,1,1,0,0|2,0,0]=4 135 B15R2.993 CN(C)\C=C1/C(=O)NC2=C1C=CC=C2 AC7913 [0,0,1,1,0,0|1,0,1]=4 136 B15R3.3 C1=CC2=C(C=C1)C3=C(C=CC=C3)N2 AT24454 [1,0,0,1,0,0|2,0,0]=4 137 B15R3.3 C1=CC2=C(C=C1)C3=C(C=CC=C3)O2 28498 [1,0,0,1,0,0|1,0,1]=4 138 B15R3.3 C1=CC2=C(C=C1)C3=C(C=CC=C3)S2 FD14022 [1,0,0,1,0,0|1,1,0]=4 139 B17R3.34483 CC1=CC(C)=C2NC3=C(C=CC=C3)C2=C1 D81502 [0,1,0,1,0,0|2,0,0]=4 140 B13R1.45 CN(C)\C=C\C(=O)C1=CC=CC=C1 N10791 [0,0,1,0,1,0|1,0,1]=4 141 B13R1.45 O=C(O)\C=C\C(=O)C1=CC=CC=C1 C10738 [0,0,1,0,1,0|2,0,0]=4 142 B13R2.10 BrC1=CN(C2=CC=CC=C2)N=C1 23923 [1,0,0,0,1,0|2,0,0]=4 143 B13R2.10 CC1=NN(C2=CC=CC=C2)C=C1 F17240 [1,0,0,0,1,0|1,0,0]=3 144 B13R2.10 NC1=NN(C2=CC=CC=C2)C=C1 F17287 [1,0,0,0,1,0|2,0,0]=4 145 B13R2.15 NC1=CC=NN1C2=CC=CC=C2 30330 [1,0,0,0,1,0|2,0,0]=4 146 B13R2.15 O=C1C=CNN1C2=CC=CC=C2 D83685 [1,0,0,0,1,0|2,0,0]=4 147 B15R2.31 BrC1=CC(OC2=CC=CC=C2)=CC=C1 CL8604 [1,0,0,0,0,1|2,0,0]=4 148 B15R2.31 CC1=CC=CC(NC2=CC=CC=C2)=C1 I10224 [1,0,0,0,0,1|1,0,0]=3 149 B15R2.31 CC1=CC=CC(OC2=CC=CC=C2)=C1 34074 [1,0,0,0,0,1|1,0,0]=3 150 B15R2.31 NC1=CC=CC(NC2=CC=CC=C2)=C1 O12015 [1,0,0,0,0,1|2,0,0]=4 151 B15R2.31 NC1=CC=CC(OC2=CC=CC=C2)=C1 CL8437 [1,0,0,0,0,1|2,0,0]=4 152 B15R2.31 OC1=CC(CC2=CC=CC=C2)=CC=C1 25978 [1,0,0,0,0,1|2,0,0]=4 153 B15R2.31 OC1=CC(NC2=CC=CC=C2)=CC=C1 I10244 [1,0,0,0,0,1|2,0,0]=4 154 B17R2.5365 CC1=C\C(=N/NC2=CC=CC=C2)C(=O)C=C1 D91912 [0,0,0,0,0,2|1,0,0]=3