0 B12R2.18 CC1CC2=CC=CC=C2C1=O BB12-2283 [0,0,0,0,0,0|2,0,1]=3 1 B12R2.18 CN1C2=CC=CC=C2N=C1Cl BB12-1469 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.1 NC1=NNC2=C1C=CC=C2 BB26-0849 [1,0,0,0,0,0|3,0,0]=4 3 B11R2.10 CC1=NC2=CC=CC=C2O1 BB12-1505 [1,0,0,0,0,0|1,0,0]=2 4 B11R2.10 CC1=NC2=CC=CN=C2N1 BB12-2830 [1,0,0,0,0,0|3,0,0]=4 5 B11R2.10 O=C1NC2=CC=CC=C2N1 BB12-1666 [1,0,0,0,0,0|3,0,0]=4 6 B11R2.10 S=C1NC2=NC=CC=C2O1 BB12-2264 [1,0,0,0,0,0|3,0,0]=4 7 B11R2.10 SC1=NC2=NC=CC=C2O1 BB12-1574 [1,0,0,0,0,0|3,0,0]=4 8 B13R2.45 CN1C2=CC=CC=C2N=C1CCl BB12-3126 [0,1,0,0,0,0|2,0,0]=3 9 B13R2.135 CCN1C(C)=NC2=CC=CN=C21 BB20-4578 [0,1,0,0,0,0|3,0,0]=4 10 B13R2.135 CCN1C2=CC=CC=C2N=C1N BB53-1597 [0,1,0,0,0,0|3,0,0]=4 11 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 BB12-1449 [0,1,0,0,0,0|3,0,0]=4 12 B13R2.3085 CN1C(=O)C(N)C2=CC=CC=C21 BB12-1567 [0,1,0,0,0,0|3,0,0]=4 13 B13R2.3085 CN1C(=O)N(C)C2=CC=CC=C21 BB12-2126 [0,1,0,0,0,0|3,0,0]=4 14 B13R2.5190 CC1=NC2=CC(N)=CC=C2N1C BB12-1088 [0,1,0,0,0,0|2,0,0]=3 15 B13R2.5190 CN1C(=O)CC2=CC(Br)=CC=C21 BB12-1851 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 BB17-2230 [0,0,1,0,0,0|3,0,0]=4 17 B11R1.41 CCOC1=CC=CC=C1NN BB56-0057 [0,0,1,0,0,0|2,0,1]=4 18 B11R1.222 COC(=O)C1=C(S)C=CC=C1 BB12-1508 [0,0,1,0,0,0|2,1,0]=4 19 B11R1.222 COC(=O)C1=NC=CC=C1O BB17-0205 [0,0,1,0,0,0|3,0,0]=4 20 B13R2.32 CC1=C(N)C2=CC=CN=C2C=C1 BB12-5008 [0,0,0,0,0,1|3,0,0]=4 21 B13R2.32 OC1=C(Cl)C2=CC=CC=C2C=C1 BB12-5003 [0,0,0,0,0,1|3,0,0]=4 22 B13R2.328 CC1=NC2=CC=CC=C2C(=O)N1 BB10-0253 [0,0,0,0,0,1|2,0,0]=3 23 B13R2.328 CC1=NC2=NC=CC=C2C(=O)N1 BB12-1115 [0,0,0,0,0,1|3,0,0]=4 24 B13R2.328 O=C1NC(=S)SC2=CC=CC=C12 BB12-3901 [0,0,0,0,0,1|2,1,0]=4 25 B13R2.328 OC1=NC2=CC=CC=C2C(O)=N1 BB12-1549 [0,0,0,0,0,1|3,0,0]=4 26 B13R2.369 O=C1NC2=CC=CC=C2OC1=O BB12-1662 [0,0,0,0,0,1|2,0,0]=3 27 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [1,0,1,0,0,0|0,0,2]=4 28 B10R1.15 CNC(C)C1=CC=CC=C1 BB12-1671 [1,0,1,0,0,0|1,0,1]=4 29 B10R1.15 N=C(NO)C1=CC=CC=C1 BB20-3129 [1,0,1,0,0,0|2,0,0]=4 30 B10R1.20 COC1=CC=CC=C1NN BB56-0061 [1,0,1,0,0,0|2,0,0]=4 31 B10R1.20 [C-]#[N+]C1=CC=CC=C1OC BB56-1195 [1,0,1,0,0,0|1,0,1]=4 32 B10R1.16 CC1=CC=C(\C=C\C=O)O1 BB17-2261 [1,0,1,0,0,0|1,0,0]=3 33 B10R1.61 CN(C)C1=C(N)C=CC=C1 BB12-1582 [1,0,1,0,0,0|2,0,0]=4 34 B10R2.7 C1=CC2=C(N=C1)NC=C2 BB12-3415 [2,0,0,0,0,0|2,0,0]=4 35 B10R2.7 C1=CC2=NC=CN2C=C1 BB56-1794 [2,0,0,0,0,0|2,0,0]=4 36 B12R1.20 CC(=O)N(C)C1=CC=C(Br)C=C1 BB12-4088 [0,1,1,0,0,0|1,0,1]=4 37 B12R1.34 CN(C(=O)CBr)C1=CC=CC=C1 BB17-0243 [0,1,1,0,0,0|1,0,1]=4 38 B12R1.75 COC1=C(NC(C)=O)C=CC=C1 BB12-5051 [0,1,1,0,0,0|2,0,0]=4 39 B12R2.1 O\N=C1/COC2=CC=CC=C21 BB12-2095 [1,1,0,0,0,0|1,0,1]=4 40 B12R2.196 CN1C=CC2=C(N)C=CC=C21 BB26-0150 [1,1,0,0,0,0|2,0,0]=4 41 B12R2.203 NC1=NOC2=CC=CC(F)=C21 BB01-1948 [1,1,0,0,0,0|2,0,0]=4 42 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB26-0144 [1,1,0,0,0,0|1,0,1]=4 43 B12R2.32 NCC1=CN2C=CC=CC2=N1 BB12-2946 [1,1,0,0,0,0|2,0,0]=4 44 B12R2.32 NCC1=NC2=CC=CC=C2N1 BB12-2371 [1,1,0,0,0,0|2,0,0]=4 45 B12R2.95 CC1(C)CC2=CC=CC=C2O1 BB12-2136 [1,1,0,0,0,0|0,0,2]=4 46 B12R2.202 CC1=C2N=C(S)OC2=CC=C1 BB12-1589 [1,1,0,0,0,0|2,0,0]=4 47 B12R2.202 CC1=C2OC(N)=NC2=CC=C1 BB17-0771 [1,1,0,0,0,0|2,0,0]=4 48 B12R2.202 CC1=CC2=CC=CC(N)=C2O1 BB12-1928 [1,1,0,0,0,0|0,0,0]=2 49 B12R2.202 SC1=NC2=C(O1)C(Cl)=CC=C2 BB12-1564 [1,1,0,0,0,0|2,0,0]=4 50 B12R2.606 CC1=CC2=C(C=C1)N=C(N)O2 BB12-2735 [1,1,0,0,0,0|2,0,0]=4 51 B12R2.606 CC1=CC2=CC(N)=CC=C2O1 BB12-1929 [1,1,0,0,0,0|0,0,0]=2 52 B12R2.606 CC1=CC2=NC(C)=CN2C=C1 BB56-1792 [1,1,0,0,0,0|2,0,0]=4 53 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 BB12-1457 [1,1,0,0,0,0|2,0,0]=4 54 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 BB12-1458 [1,1,0,0,0,0|2,0,0]=4 55 B12R2.606 CC1=NC2=CC(N)=CC=C2N1 BB12-2007 [1,1,0,0,0,0|2,0,0]=4 56 B12R2.606 NC1=NC2=CC=C(Cl)C=C2O1 BB12-3087 [1,1,0,0,0,0|2,0,0]=4 57 B12R2.606 NC1=NC2=CC=C(F)C=C2O1 BB12-2723 [1,1,0,0,0,0|2,0,0]=4 58 B12R2.606 O=C1NC2=CC=C(F)C=C2O1 BB12-1459 [1,1,0,0,0,0|2,0,0]=4 59 B14R2.8188 CC1=C(Br)C(=O)NC2=CC=CC=C21 BB12-1910 [0,1,0,0,0,1|2,0,0]=4 60 B14R2.1019 CCC1=NC2=CC=CC=C2C(=O)N1 BB12-2175 [0,1,0,0,0,1|2,0,0]=4 61 B14R2.8235 CC1=CC(=O)NC2=CC=C(Cl)C=C12 BB12-2182 [0,1,0,0,0,1|2,0,0]=4 62 B14R2.8235 CC1=CC(Cl)=NC2=CC=C(Cl)C=C12 BB12-2183 [0,1,0,0,0,1|2,0,0]=4 63 B14R2.29365 CC1=CC2=C(C=C1)C(C)=NC(O)=N2 BB12-4098 [0,1,0,0,0,1|2,0,0]=4 64 B14R2.8239 CC1OC2=CC=C(Cl)C=C2NC1=O BB20-2561 [0,1,0,0,0,1|1,0,1]=4 65 B14R2.450 CC(=O)C1=C(N)C2=CC=CN=C2O1 BB20-3090 [0,2,0,0,0,0|2,0,0]=4 66 B14R2.1060 CCC1=C(C)C2=CC(N)=CC=C2O1 BB12-1943 [0,2,0,0,0,0|0,0,0]=2 67 B14R2.2151 CCC1=C(C)C2=CC=CC(N)=C2O1 BB12-1974 [0,2,0,0,0,0|0,0,0]=2 68 B14R2.517 CC1=C(CCN)C2=CC=CC=C2N1 BB56-0181 [0,2,0,0,0,0|1,0,0]=3 69 B14R2.642 CC(=O)C1=C(C)NC2=CC=CC=C21 BB17-2235 [0,2,0,0,0,0|1,0,0]=3 70 B12R2.41 C1=CC2=C(C=C1)OCCCO2 BB53-1823 [0,0,1,1,0,0|1,0,1]=4 71 B14R3.49 C1=CC=C2C(=C1)N=C3NCCN23 BB12-4332 [0,1,0,1,0,0|2,0,0]=4 72 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [0,0,1,0,0,1|1,0,1]=4 73 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 BB12-1278 [0,0,1,0,0,1|2,0,0]=4