0 B11R1.40 NNC(=S)NC1=CC=CC=C1 BB12-2786 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.40 O=C(CS)NC1=CC=CC=C1 BB12-3947 [0,0,0,0,0,0|2,1,1]=4 2 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 BB17-2230 [0,0,0,0,0,0|1,0,0]=1 3 B10R1.17 NC\C=C\C1=CC=CC=C1 BB12-1612 [1,0,0,0,0,0|1,0,1]=3 4 B10R1.18 CC(=O)NC1=CC=CN=C1 BB12-1692 [1,0,0,0,0,0|2,0,0]=3 5 B12R2.18 CC1CC2=CC=CC=C2C1=O BB12-2283 [0,0,0,1,0,0|0,0,2]=3 6 B12R2.24 FC1=CC2=CC=CC=C2C=C1 BB53-1916 [0,0,0,1,0,0|2,0,0]=3 7 B12R2.24 NC1=CC=C2N=CC=CC2=C1 BB12-2220 [0,0,0,1,0,0|3,0,0]=4 8 B12R2.32 C=CC1=NC2=CC=CC=C2N1 BB12-1680 [0,0,0,1,0,0|3,0,0]=4 9 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [0,0,0,0,1,0|0,0,1]=2 10 B10R1.15 CNC(C)C1=CC=CC=C1 BB12-1671 [0,0,0,0,1,0|2,0,1]=4 11 B10R1.15 N=C(NO)C1=CC=CC=C1 BB20-3129 [0,0,0,0,1,0|2,0,1]=4 12 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [0,0,0,0,1,0|2,0,1]=4 13 B10R1.15 NNC(=O)C1=CC=CC=C1 BB20-4243 [0,0,0,0,1,0|3,0,0]=4 14 B10R1.15 N\N=C(/N)C1=CC=CC=C1 BB10-1016 [0,0,0,0,1,0|3,0,0]=4 15 B10R1.27 C\C(C=O)=C/C1=CC=CO1 BB17-1881 [0,0,0,0,1,0|1,0,0]=2 16 B11R1.1 C(=O)NCC1=CC=C(C)C=C1 BB20-3386 [1,1,0,0,0,0|1,0,1]=4 17 B11R1.16 N#C\C=C(\N)C1=CC=CC=C1 BB20-4559 [1,1,0,0,0,0|1,0,1]=4 18 B11R1.28 O\N=C\C=C\C1=CC=CC=C1 BB12-1495 [1,1,0,0,0,0|0,0,1]=3 19 B11R1.91 CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [1,1,0,0,0,0|1,0,1]=4 20 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB12-2585 [1,1,0,0,0,0|1,0,1]=4 21 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [1,1,0,0,0,0|1,0,0]=3 22 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [1,1,0,0,0,0|1,0,0]=3 23 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [1,1,0,0,0,0|1,0,1]=4 24 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 BB20-4534 [1,1,0,0,0,0|1,0,1]=4 25 B11R1.86 CC(=O)NC1=CC=CC=C1S BB12-2835 [1,1,0,0,0,0|1,0,0]=3 26 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 BB12-2255 [1,1,0,0,0,0|1,0,0]=3 27 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 BB53-1859 [1,1,0,0,0,0|2,0,0]=4 28 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 BB12-2929 [0,1,0,0,0,1|1,0,1]=4 29 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 BB12-1362 [0,2,0,0,0,0|2,0,0]=4 30 B13R1.133 CC(OC1=CC=C(O)C=C1)C(=O)O BB12-1748 [0,2,0,0,0,0|1,0,1]=4 31 B13R1.133 C\C(=C\C1=CC=C(Br)C=C1)[N+](=O)[O-] BB20-3101 [0,2,0,0,0,0|1,0,0]=3 32 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1O BB12-3041 [0,2,0,0,0,0|2,0,0]=4 33 B13R1.2872 C\C(C=O)=C/C1=C(O)C=CC(Br)=C1 BB17-1487 [0,2,0,0,0,0|0,0,0]=2 34 B13R1.2872 C\C(C=O)=C\C1=C(O)C=CC(Cl)=C1 BB17-1588 [0,2,0,0,0,0|0,0,0]=2 35 B11R2.10 CC1=NC2=CC=CC=C2O1 BB12-1505 [1,0,0,1,0,0|1,0,1]=4 36 B11R2.10 O=C1NC2=CC=CC=C2N1 BB12-1666 [1,0,0,1,0,0|2,0,0]=4 37 B13R2.10 CC1=CC(C2=CC=CC=C2)=NN1 BB20-3383 [0,0,0,1,0,1|2,0,0]=4 38 B13R2.32 CC1=C(N)C2=CC=CN=C2C=C1 BB12-5008 [0,0,0,1,0,1|2,0,0]=4 39 B13R2.32 NC1=CN=C2C=CC=CN2C1=O BB12-1096 [0,0,0,1,0,1|2,0,0]=4 40 B13R2.32 OC1=C(Cl)C2=CC=CC=C2C=C1 BB12-5003 [0,0,0,1,0,1|2,0,0]=4 41 B13R2.328 CC1=NC2=CC=CC=C2C(=O)N1 BB10-0253 [0,1,0,1,0,0|1,0,0]=3 42 B13R2.328 CC1=NC2=NC=CC=C2C(=O)N1 BB12-1115 [0,1,0,1,0,0|2,0,0]=4 43 B13R2.328 O=C1NC(=S)SC2=CC=CC=C12 BB12-3901 [0,1,0,1,0,0|2,0,0]=4 44 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 BB12-1449 [0,1,0,1,0,0|2,0,0]=4 45 B13R2.369 O=C1NC2=CC=CC=C2OC1=O BB12-1662 [0,1,0,1,0,0|2,0,0]=4 46 B13R2.435 CC(=O)C1=CC2=CC=CC=C2N1 BB12-3811 [0,1,0,1,0,0|1,0,0]=3 47 B13R2.435 CC(=O)C1=CN2C=CC=CC2=C1 BB12-3461 [0,1,0,1,0,0|1,0,1]=4 48 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 BB12-2951 [0,1,0,1,0,0|2,0,0]=4 49 B13R2.435 O=C(O)C1=NC2=CC=CC=C2O1 BB12-1678 [0,1,0,1,0,0|2,0,0]=4 50 B13R2.3683 CC1=NC2=CC=C(N)C=C2C=C1 BB12-4988 [0,1,0,1,0,0|2,0,0]=4 51 B13R2.5179 CC1=CC=C2C(N)=CC=CC2=N1 BB17-0572 [0,1,0,1,0,0|2,0,0]=4 52 B13R2.162 CC1=NC2=C(Br)C=CC=C2C=C1 BB56-0660 [0,1,0,1,0,0|2,0,0]=4 53 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [1,0,0,0,1,0|1,0,1]=4