0 B15R2.2226 CP(C1=CC=CC=C1)C2=CC=CC=C2 7615AL [0,0,0,0,0,0|2,0,0]=2 1 B15R2.2226 NC(C1=CC=CC=C1)C2=CC=CN=N2 2397AJ [0,0,0,0,0,0|3,0,1]=4 2 B15R2.2226 NC(C1=CN=CC=C1)C2=NC=CC=C2 8590AB [0,0,0,0,0,0|3,0,1]=4 3 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CN=N2 4451AJ [0,0,0,0,0,0|2,0,0]=2 4 B15R2.2226 OC(C1=CC=CC=C1)C2=CC=CN=C2 3791AL [0,0,0,0,0,0|1,0,2]=3 5 B14R2.6 C1=CC=C([Pt]C2=CC=CC=C2)C=C1 4369AA [1,0,0,0,0,0|1,0,0]=2 6 B14R2.6 C1=CN=CC(CC2=CC=CN=C2)=C1 2252AC [1,0,0,0,0,0|2,0,1]=4 7 B16R2.120 N[C@@H](C1=CC=CC=C1)C2=CC=C(Cl)C=C2 1004AL [0,1,0,0,0,0|1,0,1]=3 8 B16R2.120 O=C(C1=CC=C(I)C=C1)C2=NC=CC=C2 2515AF [0,1,0,0,0,0|1,0,0]=2 9 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(Br)C=N2 0580AB [0,1,0,0,0,0|1,0,0]=2 10 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(Cl)N=N2 7246AA [0,1,0,0,0,0|2,0,0]=3 11 B16R2.3896 NC1=C(C(=O)C2=CC=CC=C2)C=CN=C1 4905AB [0,1,0,0,0,0|1,0,0]=2 12 B16R2.3896 O=C(C1=CC=CC=C1)C2=C(O)N=CC=C2 8510AH [0,1,0,0,0,0|1,0,0]=2 13 B16R2.3896 O=C(C1=NC=CC=C1)C2=C(Br)C=CC=C2 9356AE [0,1,0,0,0,0|1,0,0]=2 14 B16R3.20606 O=C1C2=CC=CN=C2C3=C1C=CC=C3 6090AJ [0,0,0,1,0,0|1,0,0]=2 15 B14R2.114 O=C(C1=CC=CC=N1)C2=NC=CS2 2735AF [0,0,0,0,1,0|3,0,0]=4 16 B14R2.114 O=C(C1=CC=CS1)C2=NC=CC=C2 7574AE [0,0,0,0,1,0|2,0,0]=3 17 B14R2.114 O=C(C1=CC=NC=C1)C2=CC=CS2 7233AD [0,0,0,0,1,0|2,0,0]=3 18 B16R2.88 C\C(=N/C1=CC=CC=C1)C2=CC=CC=C2 0239AQ [0,0,0,0,0,1|1,0,0]=2 19 B15R2.29 NC1=CC=C(CC2=CC=CN=C2)C=C1 2926AJ [1,1,0,0,0,0|1,0,1]=4 20 B15R2.29 NC1=CC=C(SC2=CC=CC=C2)N=C1 7848AC [1,1,0,0,0,0|2,0,0]=4 21 B15R2.29 O=C1C=CN(CC2=CC=CC=C2)C=C1 1589AL [1,1,0,0,0,0|1,0,1]=4 22 B15R2.31 NC1=NC(CC2=CC=CC=C2)=CC=C1 Z3604 [1,1,0,0,0,0|1,0,1]=4 23 B15R2.38 CC1=CC=CC=C1OC2=CN=CC=C2 3887AB [1,1,0,0,0,0|2,0,0]=4 24 B15R2.38 IC1=CC=CN=C1OC2=CC=CC=C2 Z0830 [1,1,0,0,0,0|2,0,0]=4 25 B15R2.91 O=C(C1=CC=C(Br)C=C1)C2=CC=CS2 2959AE [0,1,0,0,1,0|1,0,0]=3 26 B15R2.91 O=C(C1=CC=C(Cl)C=C1)C2=NC=CO2 2448AF [0,1,0,0,1,0|2,0,0]=4 27 B15R2.91 O=C(C1=CC=C(F)C=C1)C2=NC=CO2 2446AF [0,1,0,0,1,0|2,0,0]=4 28 B15R2.1108 CC1=CC=CC(C(=O)C2=NC=CO2)=C1 2443AF [0,1,0,0,1,0|2,0,0]=4 29 B15R2.1108 O=C(C1=CC(Br)=CC=C1)C2=NC=CO2 2449AF [0,1,0,0,1,0|2,0,0]=4 30 B15R2.1108 O=C(C1=CC(Cl)=CC=C1)C2=NC=CO2 2447AF [0,1,0,0,1,0|2,0,0]=4 31 B15R2.1108 O=C(C1=CC(F)=CC=C1)C2=NC=CO2 2445AF [0,1,0,0,1,0|2,0,0]=4 32 B17R2.209 CC1=CC=C(OC(=O)C2=CC=CC=C2)C=C1 6186AF [0,1,0,0,0,1|0,0,0]=2 33 B17R2.209 NC1=CC=C(NC(=O)C2=CC=NC=C2)C=C1 3642AD [0,1,0,0,0,1|1,0,0]=3 34 B17R2.209 O=C(NC1=CC=C(Br)C=C1)C2=CC=CC=N2 7188AA [0,1,0,0,0,1|1,0,0]=3 35 B17R2.3417 O=C(CC1=CC=CC=C1)C2=CC=CC=C2Br 1606AE [0,1,0,0,0,1|0,0,0]=2 36 B17R2.3417 OC1=CC=CC=C1C(O)CC2=CC=CC=C2 5455AB [0,1,0,0,0,1|0,0,2]=4 37 B17R2.3426 O=C(NC1=C(Br)C=CC=N1)C2=CC=CC=C2 9323AB [0,1,0,0,0,1|1,0,0]=3 38 B17R2.5273 O=C(CC1=CC=CC=C1)C2=CC(F)=CC=C2 2672AE [0,1,0,0,0,1|0,0,0]=2 39 B17R2.5273 O=C(NC1=CC=CC=C1)C2=NC=CC(Cl)=C2 3846AD [0,1,0,0,0,1|1,0,0]=3 40 B17R2.5293 O=C(NC1=CC(O)=CC=C1)C2=CC=CC=C2 1875AE [0,1,0,0,0,1|0,0,0]=2 41 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@H](N)C2=CC=CC=C2 Z3396 [0,1,0,0,0,1|1,0,1]=4 42 B17R2.20249 C[Si](C)(CC1=CC=CC=C1)C2=CC=CC=C2 AMTSi100 [0,1,0,0,0,1|1,1,0]=4 43 B17R2.68 COC1=CC=C(C(=O)C2=CN=CC=C2)C=C1 8051AD [0,2,0,0,0,0|1,0,0]=3 44 B17R2.68 COC1=NC=C(C(=O)C2=CC=CC=N2)C=C1 2069AE [0,2,0,0,0,0|2,0,0]=4 45 B17R2.68 N#CC1=CC=C(C(=O)C2=NC=CC=C2)C=C1 5979AE [0,2,0,0,0,0|1,0,0]=3 46 B17R2.191 CC1=CC=C(C(=O)C2=CC(Br)=CN=C2)C=C1 SYN5169 [0,2,0,0,0,0|1,0,0]=3 47 B17R2.217 CC1=CC=C(C(N)C2=CC=C(C)C=C2)C=C1 5472AE [0,2,0,0,0,0|1,0,1]=4 48 B17R2.217 CC1=CC=C(S(=O)C2=CC=C(C)C=C2)C=C1 L592 [0,2,0,0,0,0|1,0,0]=3 49 B17R2.291 N#CC(C1=CC=CC=C1)C2=CC=C(F)C=C2 4822AH [0,2,0,0,0,0|1,0,1]=4 50 B17R2.291 NCC(C1=CC=CC=C1)C2=CC=C(Cl)C=C2 4816AH [0,2,0,0,0,0|1,0,1]=4 51 B17R2.291 NCC(C1=CC=CC=C1)C2=CC=C(F)C=C2 4823AH [0,2,0,0,0,0|1,0,1]=4 52 B17R2.381 CC1=CC=C(C(=O)C2=C(N)C=CC=C2)C=C1 1974AL [0,2,0,0,0,0|0,0,0]=2 53 B17R2.381 O=C(C1=CC=C(Cl)C=C1)C2=CC=CC=C2Br 4707AF [0,2,0,0,0,0|0,0,0]=2 54 B17R2.159 CNCC(C1=CC=CC=C1)C2=CC=CC=C2 9957AE [0,2,0,0,0,0|1,0,1]=4 55 B17R2.159 OCCN(C1=CC=CC=C1)C2=CC=CC=C2 W7516 [0,2,0,0,0,0|1,0,1]=4 56 B17R2.159 [NH3+]CCP(C1=CC=CC=C1)C2=CC=CC=C2 4235AA [0,2,0,0,0,0|2,0,0]=4 57 B17R2.288 ClC1=CC=CC(C(CBr)C2=CC=CC=C2)=C1 9399AH [0,2,0,0,0,0|1,0,1]=4 58 B17R2.2274 ClC1=CC=CC=C1C(CBr)C2=CC=CC=C2 9398AH [0,2,0,0,0,0|1,0,1]=4 59 B17R2.1797 COC1=CC=CC(C(=O)C2=NC=CC=C2)=C1 5461AE [0,2,0,0,0,0|1,0,0]=3 60 B17R2.1797 N#CC1=CC(C(=O)C2=CC=CC=N2)=CC=C1 2516AF [0,2,0,0,0,0|1,0,0]=3 61 B17R2.5305 NC1=C(C(=O)C2=CC=CC=C2)C=CN=C1Cl 2349AL [0,2,0,0,0,0|1,0,0]=3 62 B17R2.5305 O=C(C1=CC=CC=C1)C2=CC=CC(Br)=C2F 4624AA [0,2,0,0,0,0|0,0,0]=2 63 B17R2.5356 CC1=C(C(=O)C2=CC=CC=C2)C=C(N)C=C1 8821AH [0,2,0,0,0,0|0,0,0]=2 64 B17R2.5356 NC1=CC=C(Br)C=C1C(=O)C2=CC=CC=C2 W6020 [0,2,0,0,0,0|0,0,0]=2 65 B17R2.5356 NC1=CC=C(Br)C=C1C(=O)C2=CC=CN=C2 1187AA [0,2,0,0,0,0|1,0,0]=3 66 B17R2.5356 NC1=CC=C(Br)C=C1C(=O)C2=CC=NC=C2 8679AA [0,2,0,0,0,0|1,0,0]=3 67 B17R3.8708 C1=CC=C(C2=CC3=C(C=CC=C3)C2)C=C1 6216AB [0,0,0,1,0,1|1,0,0]=3 68 B17R3.8708 C1=CC=C(C2=CC3=C(C=CC=C3)O2)C=C1 2166AL [0,0,0,1,0,1|0,0,1]=3 69 B17R3.8708 C1=CC=C(N2C=C3C=CC=CC3=N2)C=C1 2163AL [0,0,0,1,0,1|2,0,0]=4 70 B17R3.54615 OC1=CC2=C(C=CC=C2)C3=C1C=CC=C3 6618AB [0,0,0,1,0,1|0,0,1]=3 71 B17R3.4408 NC1=CC=CC2=C1C3=CC=CC=C3C2=O 0487AQ [0,1,0,1,0,0|0,0,0]=2 72 B17R3.35227 BrC1=C2C=CC=CC2=NC3=CC=CC=C31 0950AQ [0,1,0,1,0,0|1,0,0]=3 73 B13R2.3 C1=CC=C(C2=CC=CN=N2)C=C1 7602AA [1,0,0,0,1,0|2,0,0]=4 74 B15R2.2195 C(#CC1=CC=CN=C1)C2=CC=CC=C2 5376AH [1,0,0,0,0,1|1,0,1]=4 75 B15R2.2195 C1=CC=C(NCC2=CC=CN=C2)C=C1 8990AE [1,0,0,0,0,1|1,0,1]=4 76 B15R2.64 O=C(CC1=CC=CC=C1)C2=NC=CS2 2158AL [0,0,0,0,1,1|2,0,0]=4 77 B15R2.64 O=C(CC1=NC=CC=C1)C2=CSC=C2 1278AJ [0,0,0,0,1,1|2,0,0]=4 78 B15R2.64 O=C(SC1=NC=CC=C1)C2=CSC=C2 Z3444 [0,0,0,0,1,1|2,0,0]=4 79 B17R2.143 NC(CC1=CC=CC=C1)CC2=CC=CC=C2 2175AC [0,0,0,0,0,2|1,0,1]=4 80 B17R2.2342 O=C(OCC1=CC=CC=C1)N2C=CC=CC2 Y4107 [0,0,0,0,0,2|1,0,1]=4 81 B17R2.2342 O=C(\C=C\C1=CC=CC=C1)C2=NC=CC=C2 Y6283 [0,0,0,0,0,2|1,0,0]=3