0 B10R1.66 CC(=O)\C=C\C1=CC=CO1 BB12-2961 [0,0,0,0,0,0|1,0,1]=2 1 B10R1.66 CC(N)CCC1=CC=CO1 BB05-2102 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.66 NC(=O)CCN1C=CC=N1 BB55-3573 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.66 NC(=O)NCC1=CC=CO1 BB01-7602 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.66 O=C(O)CCC1=CC=NO1 BB54-1995 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.66 O=[N+]([O-])CCC1=CC=CO1 BB01-2590 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.12 CCNCC1=CC=CO1 BB01-4781 [1,0,0,0,0,0|1,0,1]=3 7 B9R1.12 CNCCC1=CC=CS1 BB55-8320 [1,0,0,0,0,0|2,1,0]=4 8 B9R1.12 NCCCC1=CC=CO1 BB01-5828 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.12 O=C=NCC1=CC=CS1 BB12-1538 [1,0,0,0,0,0|1,1,1]=4 10 B11R1.25 NCC(=O)NCC1=CC=CO1 BB53-1842 [0,1,0,0,0,0|1,0,0]=2 11 B11R1.35 NC(CC1=CC=CS1)C(=O)O BB57-4844 [0,1,0,0,0,0|2,1,0]=4 12 B11R1.75 CC(=O)OCC1=NC(C)=NO1 BB12-3527 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.75 CC1=CC=C(CNC(C)C)O1 BB55-8288 [0,1,0,0,0,0|2,0,1]=4 14 B11R1.75 NC(=O)CCC1=CC(Br)=NO1 BB55-8880 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.75 NC(=O)CCC1=CC(Cl)=NO1 BB57-2000 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.75 O=C(O)CCC1=CC(=O)NO1 BB54-3563 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.75 O=C(O)CCC1=CC(Cl)=NO1 BB05-2083 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.77 CC(=O)CC(=O)C1=CC=CS1 BB54-4313 [0,1,0,0,0,0|1,1,1]=4 19 B11R1.77 NC(CC(=O)O)C1=CC=CS1 BB01-4064 [0,1,0,0,0,0|2,1,0]=4 20 B11R1.510 CS(=O)(=O)NCC1=CC=CO1 BB17-1504 [0,1,0,0,0,0|2,0,0]=3 21 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [0,0,0,0,1,0|0,1,0]=2 22 B9R1.13 CC(=O)CN1C=CC=N1 BB54-2703 [0,0,0,0,1,0|2,0,0]=3 23 B9R1.13 CC(=O)CN1C=NC=N1 BB54-3954 [0,0,0,0,1,0|3,0,0]=4 24 B9R1.13 CC(N)CC1=CC=CO1 BB01-4437 [0,0,0,0,1,0|1,0,1]=3 25 B9R1.13 CC(N)CC1=CC=CO1 BB05-3274 [0,0,0,0,1,0|1,0,1]=3 26 B9R1.13 CN(C)CC1=CC=CN1 BB12-1785 [0,0,0,0,1,0|3,0,0]=4 27 B9R1.13 N=C(N)CC1=CC=CS1 BB12-3709 [0,0,0,0,1,0|2,1,0]=4 28 B9R1.13 NC(=O)CC1=CSC=N1 BB57-2399 [0,0,0,0,1,0|3,0,0]=4 29 B9R1.13 NC(=S)CC1=CC=CS1 BB57-5509 [0,0,0,0,1,0|1,2,0]=4 30 B9R1.13 O=C(O)CC1=CC=CN1 BB58-0483 [0,0,0,0,1,0|2,0,0]=3 31 B9R1.13 O=C(O)CC1=CSC=N1 BB54-4129 [0,0,0,0,1,0|3,0,0]=4 32 B9R1.13 O=C(O)CN1C=CC=C1 BB55-6532 [0,0,0,0,1,0|3,0,0]=4 33 B11R1.91 N=C(N)OCC1=CC=CC=C1 BB57-6018 [0,0,0,0,0,1|3,0,0]=4 34 B11R1.91 NC(=O)NCC1=CC=CC=C1 BB01-6935 [0,0,0,0,0,1|3,0,0]=4 35 B11R1.91 O=C(O)CCC1=NC=CN=C1 BB58-4745 [0,0,0,0,0,1|3,0,0]=4 36 B11R1.172 O=C(O)CSCC1=CC=CS1 BB01-3297 [0,0,0,0,0,1|1,2,0]=4 37 B8R1.8 CCCC1=CC=CS1 BB05-4767 [2,0,0,0,0,0|0,1,1]=4 38 B8R1.8 COCC1=NC=CN1 BB58-3125 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.8 NCCC1=CC=CO1 BB01-5388 [2,0,0,0,0,0|1,0,1]=4 40 B10R1.16 CC1=CC=C(\C=C\C=O)O1 BB17-2261 [1,1,0,0,0,0|1,0,1]=4 41 B10R1.21 NCCSCC1=CC=CO1 BB58-0598 [1,1,0,0,0,0|0,1,1]=4 42 B10R1.27 CCC(=O)CC1=CC=CO1 BB54-3617 [1,1,0,0,0,0|1,0,1]=4 43 B10R1.27 C\C(C=O)=C/C1=CC=CO1 BB17-1881 [1,1,0,0,0,0|1,0,1]=4 44 B10R1.23 NC(C(=O)O)C1=CC=CS1 BB56-0352 [0,1,0,0,1,0|1,1,0]=4 45 B10R1.54 CC(=O)CN1C=CC(C)=N1 BB55-2972 [0,1,0,0,1,0|2,0,0]=4 46 B10R1.54 CC1=CC=C(CC(=O)O)S1 BB56-0024 [0,1,0,0,1,0|1,1,0]=4 47 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 BB56-1329 [0,1,0,0,1,0|1,1,0]=4 48 B12R1.21 CC(=O)NCC1=CC=C(Cl)N=C1 BB53-1661 [0,1,0,0,0,1|2,0,0]=4 49 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 BB54-3217 [0,1,0,0,0,1|2,0,0]=4 50 B12R1.54 O=C(O)CCC(=O)C1=CC=CO1 BB54-4290 [0,1,0,0,0,1|2,0,0]=4 51 B12R1.477 O=C(CCl)NCCC1=CC=CS1 BB53-1508 [0,1,0,0,0,1|1,1,0]=4 52 B12R1.15 COC(=O)CC(N)C1=CC=CS1 BB32-1198 [0,2,0,0,0,0|1,1,0]=4 53 B12R1.26 COC(=O)CCC1=CC(Br)=NO1 BB55-8879 [0,2,0,0,0,0|2,0,0]=4 54 B12R1.51 CCOC(=O)\C=C\C1=CC=CO1 BB54-0050 [0,2,0,0,0,0|1,0,1]=4 55 B12R1.51 O=C(CCCl)NCC1=CC=CS1 BB55-2901 [0,2,0,0,0,0|1,1,0]=4 56 B12R1.196 CCS(=O)(=O)NCC1=CC=CO1 BB17-1505 [0,2,0,0,0,0|2,0,0]=4 57 B12R1.103 CC1=CC=C(C(N)CC(=O)O)O1 BB01-4074 [0,2,0,0,0,0|2,0,0]=4 58 B8R1.7 CC(=O)C1=NC=CN1 BB58-3749 [0,0,0,0,2,0|2,0,0]=4 59 B12R1.252 CC(=O)CCCC1=CC=CC=N1 BB54-3908 [0,0,0,0,0,2|2,0,0]=4 60 B12R1.252 CC(=O)NCCC1=CC=CC=C1 BB01-7779 [0,0,0,0,0,2|2,0,0]=4 61 B12R1.252 O=C(O)COCC1=CC=CC=C1 BB01-5008 [0,0,0,0,0,2|2,0,0]=4