0 B14R2.20 CC1=CC=C(C2=NOC(N)=C2)C=C1 SC-59608 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.20 CC1=CC=C(C2CCC(=O)O2)C=C1 SC-36106 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.20 CC1=NN(C2=CC=C(Br)C=C2)C=C1 SC-30633 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.20 NC1=CC(C2=CC=C(Br)C=C2)=NN1 SC-13398 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.20 NC1=CC(C2=CC=C(Br)C=C2)=NO1 SC-59642 [0,0,0,0,0,0|2,0,1]=3 5 B14R2.20 NC1=CC(C2=CC=C(Cl)C=C2)=NO1 SC-45832 [0,0,0,0,0,0|2,1,1]=4 6 B14R2.20 NC1=CC(C2=CC=C(F)C=C2)=NO1 SC-26280 [0,0,0,0,0,0|2,1,1]=4 7 B14R2.20 NC1=CC(C2=CC=C(O)C=C2)=NO1 SC-12459 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.20 NC1=CSC(C2=CC=C(Br)C=C2)=N1 SC-72073 [0,0,0,0,0,0|2,0,1]=3 9 B14R2.20 NC1=NC(C2=CC=C(Br)C=C2)=CS1 SC-75529 [0,0,0,0,0,0|0,1,2]=3 10 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=CS1 SC-49317 [0,0,0,0,0,0|0,2,2]=4 11 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=NO1 SC-29528 [0,0,0,0,0,0|1,1,1]=3 12 B14R2.20 NC1=NC(C2=CC=C(F)C=C2)=NO1 SC-34829 [0,0,0,0,0,0|1,1,1]=3 13 B14R2.20 NC1=NC=C(C2=CC=C(Br)C=C2)O1 SC-31034 [0,0,0,0,0,0|2,0,2]=4 14 B14R2.20 NC1=NC=C(C2=CC=C(Br)C=C2)S1 SC-30736 [0,0,0,0,0,0|2,0,2]=4 15 B14R2.20 NC1=NN=C(C2=CC=C(Br)C=C2)O1 SC-30614 [0,0,0,0,0,0|3,0,1]=4 16 B14R2.20 NC1=NOC(C2=CC=C(Cl)C=C2)=N1 SC-29974 [0,0,0,0,0,0|2,1,1]=4 17 B14R2.20 O=C1CCC(C2=CC=C(Br)C=C2)O1 SC-36132 [0,0,0,0,0,0|3,0,0]=3 18 B14R2.20 O=C1CCC(C2=CC=C(Cl)C=C2)O1 SC-36131 [0,0,0,0,0,0|3,1,0]=4 19 B14R2.20 O=C1CCC(C2=CC=C(F)C=C2)N1 SC-37835 [0,0,0,0,0,0|2,1,1]=4 20 B13R2.10 BrC1=NC(C2=CC=CC=C2)=NO1 SC-53031 [1,0,0,0,0,0|2,0,1]=4 21 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 SC-70308 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.10 NC1=CSC(C2=CC=CC=C2)=N1 SC-72044 [1,0,0,0,0,0|2,0,1]=4 23 B13R2.10 NC1=NSC(C2=CC=CC=C2)=N1 SC-13955 [1,0,0,0,0,0|2,0,1]=4 24 B13R2.10 O=C1NCC(C2=CC=CC=C2)N1 SC-89145 [1,0,0,0,0,0|2,0,1]=4 25 B13R2.10 O=C1NCC(C2=CC=CC=C2)O1 SC-49190 [1,0,0,0,0,0|3,0,0]=4 26 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 SC-17369 [1,0,0,0,0,0|1,0,1]=3 27 B13R2.10 [C@@H]1(C2=CC=CC=C2)COC(=S)N1 SC-25816 [1,0,0,0,0,0|1,0,1]=3 28 B13R2.10 [C@H]1(C2=CC=CC=C2)CSC(=S)N1 SC-17058 [1,0,0,0,0,0|1,1,1]=4 29 B13R2.12 BrC1=CC=C(C2=NC=CN2)C=C1 SC-51915 [1,0,0,0,0,0|2,0,1]=4 30 B13R2.12 BrC1=CC=C(C2=NNC=N2)C=C1 SC-51989 [1,0,0,0,0,0|2,0,1]=4 31 B13R2.12 BrC1=CC=C(C2CCNC2)C=C1 SC-13138 [1,0,0,0,0,0|2,0,1]=4 32 B15R2.275 NCC1=CSC(C2=CC=C(Br)C=C2)=N1 SC-72074 [0,1,0,0,0,0|2,0,1]=4 33 B15R2.307 CN1C=C(C2=CC=C(Br)C=C2)N=C1N SC-31292 [0,1,0,0,0,0|1,0,2]=4 34 B13R1.14 COC(=O)CCC1=CC=C(F)C=C1 SC-53419 [0,0,1,0,0,0|2,1,0]=4 35 B13R1.132 NC(CC(=O)O)C1=CC=C(Br)C=C1 SC-49308 [0,0,1,0,0,0|3,0,0]=4 36 B13R1.513 N=C(N)CCOC1=CC=C(F)C=C1 SC-41174 [0,0,1,0,0,0|2,1,0]=4 37 B13R1.513 N=C(N)NCCC1=CC=C(Cl)C=C1 SC-60374 [0,0,1,0,0,0|1,1,0]=3 38 B13R1.513 N=C(N)NCCC1=CC=C(F)C=C1 SC-60375 [0,0,1,0,0,0|1,1,0]=3 39 B13R2.147 CC1=CC=C(C2CC(=O)C2)C=C1 SC-36009 [0,0,0,0,1,0|3,0,0]=4 40 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 SC-35818 [0,0,0,0,1,0|2,0,0]=3 41 B13R2.147 O=C1CC(C2=CC=C(F)C=C2)C1 SC-36161 [0,0,0,0,1,0|2,1,0]=4 42 B15R2.28 O=C1CCCC(C2=CC=C(Br)C=C2)C1 SC-65710 [0,0,0,0,0,1|3,0,0]=4 43 B15R2.98 NC1=NC(CC2=CC=C(Br)C=C2)=NO1 SC-34147 [0,0,0,0,0,1|1,0,1]=3 44 B15R2.98 NC1=NC(CC2=CC=C(Cl)C=C2)=NO1 SC-33810 [0,0,0,0,0,1|1,1,1]=4 45 B15R2.98 NC1=NC(CC2=CC=C(F)C=C2)=NO1 SC-52100 [0,0,0,0,0,1|1,1,1]=4 46 B12R1.12 CCC(NN)C1=CC=C(Br)C=C1 SC-38541 [1,0,1,0,0,0|1,0,1]=4 47 B12R1.16 C=CC[C@@H](O)C1=CC=C(Br)C=C1 SC-31130 [1,0,1,0,0,0|2,0,0]=4 48 B12R1.16 C=CC[C@H](O)C1=CC=C(Br)C=C1 SC-30462 [1,0,1,0,0,0|2,0,0]=4 49 B12R1.1 CCOCCC1=CC=C(Br)C=C1 SC-91638 [1,0,1,0,0,0|1,0,1]=4 50 B12R1.21 CC(=O)CCC1=CC=C(Br)C=C1 SC-34731 [1,0,1,0,0,0|2,0,0]=4 51 B12R1.21 N=C(N)CCC1=CC=C(Br)C=C1 SC-38868 [1,0,1,0,0,0|2,0,0]=4 52 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 SC-60359 [1,0,1,0,0,0|1,0,1]=4 53 B12R1.252 N=C(N)CCCC1=CC=CC=C1 SC-39290 [1,0,1,0,0,0|1,0,0]=3 54 B12R1.252 N=C(N)CCCC1=CC=CC=N1 SC-12263 [1,0,1,0,0,0|2,0,0]=4 55 B12R1.252 N=C(N)CCCC1=CC=NC=C1 SC-12261 [1,0,1,0,0,0|2,0,0]=4 56 B12R1.252 N=C(N)CCCC1=CN=CC=C1 SC-12262 [1,0,1,0,0,0|2,0,0]=4 57 B12R1.252 N=C(N)CCOC1=CC=CC=C1 SC-41366 [1,0,1,0,0,0|2,0,0]=4 58 B12R1.252 N=C(N)COCC1=CC=CC=C1 SC-52537 [1,0,1,0,0,0|2,0,0]=4 59 B12R1.252 N=C(N)NCCC1=CC=CC=C1 SC-60341 [1,0,1,0,0,0|1,0,0]=3 60 B14R1.502 CCOC(=N)CCC1=CC=C(Br)C=C1 SC-38579 [0,1,1,0,0,0|1,0,1]=4 61 B14R1.4 COC1=CC=C(CCNC(=N)N)C=C1 SC-60376 [0,1,1,0,0,0|2,0,0]=4 62 B14R2.1 BrCC1=CC=C(C2=NOC=N2)C=C1 SC-34169 [1,1,0,0,0,0|1,0,1]=4 63 B14R2.29365 CC1=NC(N)=CC2=C1C=CC(Br)=C2 SC-33294 [0,0,1,1,0,0|1,0,1]=4 64 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 SC-74945 [0,0,1,0,1,0|2,0,0]=4 65 B12R1.49 COC(=O)CC1=CC=C(I)C=C1 SC-69574 [0,0,1,0,1,0|1,1,0]=4 66 B12R1.49 N\C(CC1=CC=C(Br)C=C1)=N/O SC-33935 [0,0,1,0,1,0|2,0,0]=4 67 B12R1.49 N\C(CC1=CC=C(Br)C=C1)=N/O SC-62762 [0,0,1,0,1,0|2,0,0]=4 68 B12R1.20 CC(C(=O)O)C1=CC=C(N)C=C1 SC-35973 [0,0,1,0,1,0|2,0,0]=4 69 B12R1.20 CC1=CC=C(C(C)C(=O)O)C=C1 SC-46704 [0,0,1,0,1,0|2,0,0]=4 70 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 SC-75645 [0,0,1,0,1,0|2,0,0]=4 71 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 SC-87898 [1,0,0,0,1,0|1,0,1]=4 72 B14R2.19 NC1=NC(CC2=CC=CC=C2)=NO1 SC-34286 [1,0,0,0,0,1|1,0,1]=4 73 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 SC-19534 [1,0,0,0,0,1|1,0,1]=4 74 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 SC-65525 [1,0,0,0,0,1|1,0,1]=4 75 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CO1 SC-14154 [1,0,0,0,0,1|1,0,1]=4