0 B12R1.51 CCOC(=O)CCN1C=CC=N1 BB05-3519 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.51 CCOC(=O)\C=C\C1=CC=CO1 BB54-0050 [0,0,0,0,0,0|0,0,2]=2 2 B12R1.51 O=C(CCCl)NCC1=CC=CS1 BB55-2901 [0,0,0,0,0,0|3,1,0]=4 3 B11R1.25 COC(=O)CCN1C=CN=C1 BB58-0776 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.25 NCC(=O)NCC1=CC=CO1 BB53-1842 [1,0,0,0,0,0|2,0,0]=3 5 B13R2.6970 O=C(\C=C\C1=CC=CO1)C2CC2 BB54-0052 [0,0,0,1,0,0|1,0,2]=4 6 B11R1.30 CCOC(=O)CC1=CSC=N1 BB54-4145 [0,0,0,0,1,0|2,0,0]=3 7 B11R1.30 CCOC(=O)CC1=NC=NN1 BB54-1622 [0,0,0,0,1,0|3,0,0]=4 8 B11R1.30 CCOC(=O)CN1C=CC=C1 BB56-2158 [0,0,0,0,1,0|2,0,0]=3 9 B11R1.30 CCOC(=O)NC1=CC=CN1 BB01-3354 [0,0,0,0,1,0|2,0,0]=3 10 B13R1.404 CCOC(=O)CCCN1C=CC=N1 BB05-3606 [0,0,0,0,0,1|2,0,0]=3 11 B10R1.66 CC(=O)\C=C\C1=CC=CO1 BB12-2961 [2,0,0,0,0,0|0,0,2]=4 12 B10R1.66 CC(N)CCC1=CC=CO1 BB05-2102 [2,0,0,0,0,0|1,0,1]=4 13 B10R1.66 NC(=O)NCC1=CC=CO1 BB01-7602 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.66 O=C(O)CCC1=CC=NO1 BB54-1995 [2,0,0,0,0,0|1,0,0]=3 15 B10R1.66 O=[N+]([O-])CCC1=CC=CO1 BB01-2590 [2,0,0,0,0,0|1,0,1]=4 16 B12R1.15 COC(=O)CC(=O)C1=CC=CS1 BB57-3597 [1,1,0,0,0,0|0,1,1]=4 17 B12R1.15 COC(=O)CC(N)C1=CC=CS1 BB32-1198 [1,1,0,0,0,0|0,1,0]=3 18 B12R1.26 COC(=O)CCC1=CC(Br)=NO1 BB55-8879 [1,1,0,0,0,0|1,0,0]=3 19 B12R1.26 COC(=O)CCC1=CSC(N)=N1 BB58-1165 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.26 COC(=O)CCN1C=C(Br)C=N1 BB55-6297 [1,1,0,0,0,0|2,0,0]=4 21 B12R1.26 COC(=O)CCN1C=C(C)C=N1 BB05-5034 [1,1,0,0,0,0|2,0,0]=4 22 B12R1.26 COC(=O)CCN1C=C(Cl)C=N1 BB05-1604 [1,1,0,0,0,0|2,0,0]=4 23 B12R1.26 COC(=O)CCN1C=C(I)C=N1 BB57-3850 [1,1,0,0,0,0|2,0,0]=4 24 B12R1.26 COC(=O)CCN1C=CC(C)=N1 BB05-1597 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.108 COC(=O)C(C)CN1C=CC=N1 BB05-3563 [1,1,0,0,0,0|2,0,0]=4 26 B12R1.196 CCS(=O)(=O)NCC1=CC=CO1 BB17-1505 [1,1,0,0,0,0|2,0,0]=4 27 B12R1.264 CC(Br)C(=O)NCC1=CC=CO1 BB01-8239 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.31 CCOC(=O)CC1=CN=C(N)S1 BB54-1701 [0,1,0,0,1,0|1,1,0]=4 29 B12R1.31 CCOC(=O)CC1=COC(C)=N1 BB54-4151 [0,1,0,0,1,0|2,0,0]=4 30 B12R1.31 CCOC(=O)CC1=CSC(C)=N1 BB54-4146 [0,1,0,0,1,0|2,0,0]=4 31 B12R1.31 CCOC(=O)CC1=NC(O)=CS1 BB54-0817 [0,1,0,0,1,0|1,1,0]=4 32 B12R1.31 CCOC(=O)CN1C=C(Br)C=N1 BB05-1828 [0,1,0,0,1,0|2,0,0]=4 33 B12R1.31 CCOC(=O)CN1C=C(Br)C=N1 BB55-6804 [0,1,0,0,1,0|2,0,0]=4 34 B12R1.31 CCOC(=O)CN1C=C(C)C=N1 BB05-5039 [0,1,0,0,1,0|2,0,0]=4 35 B12R1.31 CCOC(=O)CN1C=C(I)C=N1 BB57-1262 [0,1,0,0,1,0|2,0,0]=4 36 B12R1.31 CCOC(=O)CN1C=CC(C)=N1 BB05-1596 [0,1,0,0,1,0|2,0,0]=4 37 B12R1.31 CCOC(=O)CN1C=CC(C)=N1 BB55-6557 [0,1,0,0,1,0|2,0,0]=4 38 B12R1.31 CCOC(=O)CN1C=CC(N)=N1 BB05-4061 [0,1,0,0,1,0|2,0,0]=4 39 B12R1.31 CCOC(=O)CN1C=CC(N)=N1 BB54-1092 [0,1,0,0,1,0|2,0,0]=4 40 B12R1.55 CCOC(=O)[C@H](C)N1C=CC=C1 BB56-2157 [0,1,0,0,1,0|2,0,0]=4 41 B12R1.260 CC(C)OC(=O)CC1=CC=CN1 BB58-0484 [0,1,0,0,1,0|1,0,0]=3 42 B12R1.318 CCOC(=O)CN1N=CC=C1C BB05-1589 [0,1,0,0,1,0|2,0,0]=4 43 B12R1.318 CCOC(=O)CN1N=CC=C1C BB55-7756 [0,1,0,0,1,0|2,0,0]=4 44 B14R1.29 CCOC(=O)CC(=O)C1=NC=CC=C1 BB01-4761 [0,1,0,0,0,1|1,0,1]=4 45 B14R1.32 CCOC(=O)CNC1=CC(C)=CC=C1 BB12-2557 [0,1,0,0,0,1|2,0,0]=4 46 B14R1.502 CCOC(=O)CNC1=CC=C(C)C=C1 BB12-2898 [0,1,0,0,0,1|2,0,0]=4 47 B14R1.502 CCOC(=O)CNC1=CC=C(Cl)C=C1 BB12-2773 [0,1,0,0,0,1|2,0,0]=4 48 B14R1.502 CCOC(=O)CNC1=CC=C(F)C=C1 BB58-0804 [0,1,0,0,0,1|2,0,0]=4 49 B14R1.502 CCOC(=O)COC1=CC=C(I)C=C1 BB05-4908 [0,1,0,0,0,1|2,0,0]=4 50 B14R1.502 CCOC(=O)CSC1=CC=C(Cl)N=N1 BB10-0314 [0,1,0,0,0,1|2,0,0]=4 51 B14R1.598 CCOC(=O)CNC1=C(C)C=CC=C1 BB12-2889 [0,1,0,0,0,1|2,0,0]=4 52 B14R1.598 CCOC(=O)COC1=CC=CN=C1Br BB12-1853 [0,1,0,0,0,1|2,0,0]=4 53 B14R1.519 CCOC(=O)CCCN1C=CC(C)=N1 BB05-3576 [0,1,0,0,0,1|2,0,0]=4 54 B14R1.3309 CCOC(=O)CCN1N=C(C)C=C1C BB20-2299 [0,2,0,0,0,0|2,0,0]=4 55 B12R1.17 CCOC(=O)C1=NC(O)=CC=C1 BB54-2947 [0,0,1,1,0,0|1,0,1]=4 56 B14R2.322 C1=COC(CNCC2CCCO2)=C1 BB01-4037 [0,0,0,1,0,1|1,0,1]=4 57 B14R2.249 NC1=CC(=O)CC(C2=CC=CO2)C1 BB52-7072 [0,1,0,1,0,0|1,0,1]=4 58 B10R1.27 CCC(=O)CC1=CC=CO1 BB54-3617 [1,0,0,0,1,0|0,0,0]=2 59 B10R1.11 CCOC(=O)C1=CNC=N1 BB01-7910 [0,0,0,0,2,0|2,0,0]=4 60 B10R1.11 CCOC(=O)C1=CSC=N1 BB54-3895 [0,0,0,0,2,0|2,0,0]=4 61 B10R1.11 CCOC(=O)C1=NNC=C1 BB55-2980 [0,0,0,0,2,0|2,0,0]=4