0 B12R2.18 CN1C2=CC=CC=C2N=C1Cl BB12-1469 [0,0,0,0,0,0|2,0,1]=3 1 B11R2.1 NC1=NNC2=C1C=CC=C2 BB26-0849 [1,0,0,0,0,0|3,0,0]=4 2 B11R2.10 CC1=NC2=CC=CC=C2O1 BB12-1505 [1,0,0,0,0,0|2,0,1]=4 3 B11R2.10 CC1=NC2=CC=CN=C2N1 BB12-2830 [1,0,0,0,0,0|2,0,1]=4 4 B11R2.10 O=C1NC2=CC=CC=C2N1 BB12-1666 [1,0,0,0,0,0|0,0,0]=1 5 B11R2.10 S=C1NC2=NC=CC=C2O1 BB12-2264 [1,0,0,0,0,0|2,1,0]=4 6 B13R2.45 CN1C2=CC=CC=C2N=C1CCl BB12-3126 [0,1,0,0,0,0|2,0,1]=4 7 B13R2.135 CCN1C2=CC=CC=C2N=C1N BB53-1597 [0,1,0,0,0,0|2,0,1]=4 8 B13R2.3028 NC1C(=O)NC2=CC=C(Cl)C=C21 BB12-1579 [0,1,0,0,0,0|2,0,0]=3 9 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 BB12-1449 [0,1,0,0,0,0|1,0,1]=3 10 B13R2.3085 CN1C(=O)C(N)C2=CC=CC=C21 BB12-1567 [0,1,0,0,0,0|2,0,0]=3 11 B13R2.3085 CN1C(=O)N(C)C2=CC=CC=C21 BB12-2126 [0,1,0,0,0,0|1,0,0]=2 12 B13R2.4825 NC1C(=O)NC2=C(Cl)C=CC=C21 BB12-1523 [0,1,0,0,0,0|2,0,0]=3 13 B13R2.5190 CC1=NC2=CC(N)=CC=C2N1C BB12-1088 [0,1,0,0,0,0|2,0,1]=4 14 B13R2.5190 CN1C(=O)CC2=CC(Br)=CC=C21 BB12-1851 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 BB20-4534 [0,0,1,0,0,0|2,0,0]=3 16 B11R1.40 NNC(=O)CC1=NC=CC=C1 BB12-2162 [0,0,1,0,0,0|3,0,0]=4 17 B11R1.40 NNC(=S)NC1=CC=CC=C1 BB12-2786 [0,0,1,0,0,0|1,1,0]=3 18 B11R1.40 O=C(CS)NC1=CC=CC=C1 BB12-3947 [0,0,1,0,0,0|1,1,0]=3 19 B13R2.328 O=C1N=[N+]([O-])C2=CC=CC=C2N1 BB12-1595 [0,0,0,0,0,1|0,0,2]=3 20 B13R2.328 OC1=NC2=CC=CC=C2C(O)=N1 BB12-1549 [0,0,0,0,0,1|1,0,2]=4 21 B13R2.369 O=C1NC2=CC=CC=C2OC1=O BB12-1662 [0,0,0,0,0,1|1,0,1]=3 22 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [1,0,1,0,0,0|2,0,0]=4 23 B10R1.18 CC(=O)NC1=CC=CN=C1 BB12-1692 [1,0,1,0,0,0|2,0,0]=4 24 B10R1.4 CCNC1=CC=CC=C1N BB12-3022 [1,0,1,0,0,0|1,0,1]=4 25 B10R1.61 CN(C)C1=C(N)C=CC=C1 BB12-1582 [1,0,1,0,0,0|1,0,1]=4 26 B10R1.61 NC1=C(C(=O)O)C=CN=C1 BB12-1728 [1,0,1,0,0,0|2,0,0]=4 27 B10R2.7 C1=CC2=C(C=C1)NN=N2 BB01-6327 [2,0,0,0,0,0|1,0,1]=4 28 B10R2.7 C1=CC2=C(N=C1)NC=C2 BB12-3415 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.20 CC(=O)N(C)C1=CC=C(Br)C=C1 BB12-4088 [0,1,1,0,0,0|2,0,0]=4 30 B12R1.34 CN(C(=O)CBr)C1=CC=CC=C1 BB17-0243 [0,1,1,0,0,0|2,0,0]=4 31 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 BB12-3950 [0,1,1,0,0,0|1,1,0]=4 32 B12R1.49 CCC(=O)NC1=CC=C(N)C=C1 BB17-0336 [0,1,1,0,0,0|2,0,0]=4 33 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 BB12-3948 [0,1,1,0,0,0|1,1,0]=4 34 B12R1.50 O=C(CCl)NC1=CC(I)=CC=C1 BB17-1406 [0,1,1,0,0,0|2,0,0]=4 35 B12R1.371 O=C(CS)NC1=C(Cl)C=CC=C1 BB12-3951 [0,1,1,0,0,0|1,1,0]=4 36 B12R1.371 O=C(CS)NC1=C(F)C=CC=C1 BB12-3952 [0,1,1,0,0,0|1,1,0]=4 37 B12R1.75 COC1=C(NC(C)=O)C=CC=C1 BB12-5051 [0,1,1,0,0,0|2,0,0]=4 38 B12R2.196 CN1C=CC2=C(N)C=CC=C21 BB26-0150 [1,1,0,0,0,0|2,0,0]=4 39 B12R2.196 ON1N=NC2=C1C=CC=C2Cl BB12-2042 [1,1,0,0,0,0|1,0,1]=4 40 B12R2.32 C=CC1=NC2=CC=CC=C2N1 BB12-1680 [1,1,0,0,0,0|1,0,1]=4 41 B12R2.32 NCC1=NC2=CC=CC=C2N1 BB12-2371 [1,1,0,0,0,0|1,0,1]=4 42 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 BB56-2371 [1,1,0,0,0,0|1,0,0]=3 43 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 BB12-2964 [1,1,0,0,0,0|0,0,0]=2 44 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 BB12-1457 [1,1,0,0,0,0|1,0,0]=3 45 B12R2.606 CC1=CC=C2NC(Cl)=NC2=C1 BB12-3012 [1,1,0,0,0,0|1,0,1]=4 46 B12R2.606 CC1=CC=C2NC(N)=NC2=C1 BB12-2729 [1,1,0,0,0,0|1,0,1]=4 47 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 BB12-1458 [1,1,0,0,0,0|1,0,0]=3 48 B12R2.606 CC1=NC2=CC(N)=CC=C2N1 BB12-2007 [1,1,0,0,0,0|1,0,1]=4 49 B12R2.606 NC1=CC=C2NC(O)=NC2=C1 BB26-0788 [1,1,0,0,0,0|0,0,2]=4 50 B12R2.606 O=C1NC2=CC=C(F)C=C2O1 BB12-1459 [1,1,0,0,0,0|1,0,0]=3 51 B12R2.606 OC1=NC2=CC=C(F)C=C2N1 BB17-0211 [1,1,0,0,0,0|0,0,2]=4 52 B14R2.8235 CC1=CC(=O)NC2=CC=C(Cl)C=C12 BB12-2182 [0,1,0,0,0,1|2,0,0]=4 53 B14R2.8235 O=C1N=[N+]([O-])C2=CC(Br)=CC=C2N1 BB12-1596 [0,1,0,0,0,1|0,0,2]=4 54 B14R2.8235 O=C1NC2=CC=C(I)C=C2C(=O)O1 BB12-1892 [0,1,0,0,0,1|1,0,1]=4 55 B14R2.8239 CC1OC2=CC=C(Cl)C=C2NC1=O BB20-2561 [0,1,0,0,0,1|2,0,0]=4 56 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2N1 BB12-2295 [0,2,0,0,0,0|2,0,0]=4 57 B14R2.4220 O=C1NC2=C(Cl)C=CC=C2\C1=N\O BB12-1528 [0,2,0,0,0,0|1,0,0]=3 58 B14R2.19008 O=C1NC2=CC=C(Cl)C=C2\C1=N\O BB12-1530 [0,2,0,0,0,0|1,0,0]=3 59 B14R2.19306 CCN1C(=O)C(N)C2=CC=CC=C21 BB12-1524 [0,2,0,0,0,0|2,0,0]=4 60 B14R2.19306 O=C1C(=O)N(CO)C2=C1C=CC=C2 BB12-3787 [0,2,0,0,0,0|1,0,0]=3 61 B14R2.57380 CN1C(=O)C(Cl)(Cl)C2=CC=CC=C21 BB52-7708 [0,2,0,0,0,0|2,0,0]=4 62 B14R2.3274 CCC1=CC=C2NC(=O)C(N)C2=C1 BB12-1592 [0,2,0,0,0,0|2,0,0]=4 63 B14R2.8716 CN1C(=O)C(=O)C2=CC(Cl)=CC=C21 BB17-2357 [0,2,0,0,0,0|1,0,1]=4 64 B14R2.28485 CC1=C2C(=CC=C1)C(=O)C(=O)N2C BB12-1594 [0,2,0,0,0,0|1,0,1]=4 65 B14R2.28485 CC1=C2C(=CC=C1)C(N)C(=O)N2C BB12-1614 [0,2,0,0,0,0|2,0,0]=4 66 B14R2.28485 CN1C(=O)C(=O)C2=CC=CC(Br)=C21 BB17-2251 [0,2,0,0,0,0|1,0,1]=4 67 B14R2.11645 CCC1=C2NC(=O)C(N)C2=CC=C1 BB12-1632 [0,2,0,0,0,0|2,0,0]=4 68 B14R2.27750 CC1=CC(C)=C2C(=O)C(=O)NC2=C1 BB17-2355 [0,2,0,0,0,0|1,0,1]=4 69 B12R2.24 O=C1COC2=CC=CN=C2N1 BB12-2193 [0,0,1,1,0,0|2,0,0]=4 70 B12R2.24 O=C1CSC2=CC=CC=C2N1 BB20-4697 [0,0,1,1,0,0|1,1,0]=4 71 B12R2.24 S=C1COC2=CC=CC=C2N1 BB10-0259 [0,0,1,1,0,0|1,1,0]=4 72 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 BB12-1278 [0,0,1,0,0,1|2,0,0]=4 73 B12R1.27 NNC(=O)CNC1=CC=CC=C1 BB17-0801 [0,0,1,0,0,1|1,0,0]=3 74 B12R1.27 NNC(=O)COC1=CC=CC=C1 BB12-2509 [0,0,1,0,0,1|2,0,0]=4