0 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 BB_SC-06991 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CC(=O)C1=CC=C(N)C=C1O BB_SC-08749 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.166 CC(=O)C1=CC=C(O)C=C1O BB_SC-06691 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 BB_SC-06774 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.166 CC1=CC(O)=C(C(C)C)C=C1 BB_NC-02806 [0,0,0,0,0,0|0,0,0]=0 5 B11R1.166 CN(C)C1=C(N)C=C(Cl)C=C1 BB_SC-02758 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.166 O=C(O)C1=CC=C(O)C=C1O BB_NC-02190 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.166 O=[N+]([O-])C1=CC=C(F)C=C1O BB_SC-08901 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 BB_SC-06664 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.13 CC(=O)C1=CC=C(C)C=C1 BB_SC-06635 [1,0,0,0,0,0|1,0,1]=3 10 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 BB_SC-06734 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB_SC-08802 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.13 CC(=O)C1=CC=C(N)C=C1 BB_SC-10671 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.13 CC(=O)C1=CC=C(O)C=C1 BB_SC-06720 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.13 CC(C)C1=CC=C(N)C=C1 BB_SC-12018 [1,0,0,0,0,0|1,0,0]=2 15 B10R1.13 CC(C)C1=CC=C(O)C=C1 BB_SC-12725 [1,0,0,0,0,0|1,0,0]=2 16 B10R1.13 CC(N)C1=CC=C(Br)C=C1 BB_SC-11893 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 BB_SC-06932 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.25 COC1=CC=C(N)C=C1Cl BB_SC-11214 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.25 ClCC1=CC=C(Cl)C=C1Cl BB_SC-07005 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.25 O=CC1=C(O)C=C(O)C=C1 BB_NC-02242 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.61 CC(=O)C1=C(C)C=CC=C1 BB_SC-06871 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.61 CC(=O)C1=C(O)C=CC=C1 BB_SC-06782 [1,0,0,0,0,0|1,0,1]=3 23 B10R1.61 CC(=O)C1=CC=CC=C1N BB_SC-09205 [1,0,0,0,0,0|2,0,1]=4 24 B10R1.61 NC(=O)C1=C(O)C=CC=C1 BB_SC-00234 [1,0,0,0,0,0|2,0,1]=4 25 B12R1.57 COC1=CC(F)=CC=C1C(C)=O BB_SC-04593 [0,1,0,0,0,0|2,0,1]=4 26 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1Cl BB_SC-12733 [0,1,0,0,0,0|0,0,0]=1 27 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 BB_SC-04592 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.452 COC1=CC(O)=C(C(C)=O)C=C1 BB_SC-02796 [0,1,0,0,0,0|1,0,1]=3 29 B12R1.893 CC(=O)C1=C(O)C(O)=C(O)C=C1 BB_SC-07200 [0,1,0,0,0,0|2,0,1]=4 30 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 BB_SC-12620 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O BB_SC-05956 [0,1,0,0,0,0|2,0,1]=4 32 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB_NC-02097 [0,0,0,1,0,0|2,0,1]=4 33 B9R0.1 C\C=C(C)\C=C\C=C(C)C BB_NC-01504 [1,0,1,0,0,0|0,0,2]=4 34 B9R1.1 CC1=CC=C(CCl)C=C1 BB_SC-06960 [2,0,0,0,0,0|1,0,0]=3 35 B9R1.1 CCC1=CC=C(N)C=C1 BB_SC-07009 [2,0,0,0,0,0|1,0,0]=3 36 B9R1.1 CNC1=CC=C(O)C=C1 BB_SC-07044 [2,0,0,0,0,0|2,0,0]=4 37 B9R1.1 COC1=CC=C(S)C=C1 BB_SC-06511 [2,0,0,0,0,0|2,0,0]=4 38 B9R1.1 ClCC1=CC=C(Br)C=C1 BB_SC-04526 [2,0,0,0,0,0|2,0,0]=4 39 B9R1.1 FC1=CC=C(CCl)C=C1 BB_SC-06883 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.1 NCC1=CC=C(Cl)C=C1 BB_SC-04583 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.1 NCC1=CC=C(N)C=C1 BB_SC-08895 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.1 OCC1=CC=C(Cl)C=C1 BB_SC-06996 [2,0,0,0,0,0|2,0,0]=4 43 B9R1.1 OCC1=CC=C(F)C=C1 BB_SC-06738 [2,0,0,0,0,0|2,0,0]=4 44 B9R1.6 CC(N)C1=CC=CC=C1 BB_SC-09414 [2,0,0,0,0,0|1,0,0]=3 45 B9R1.6 CN(C)C1=CC=NC=C1 BB_SC-07248 [2,0,0,0,0,0|2,0,0]=4 46 B9R1.6 C[C@@H](N)C1=CC=CC=C1 BB_NC-02297 [2,0,0,0,0,0|1,0,0]=3 47 B9R1.6 C[C@H](N)C1=CC=CC=C1 BB_SC-10322 [2,0,0,0,0,0|1,0,0]=3 48 B9R1.15 CC1=CC=CC=C1CCl BB_SC-07008 [2,0,0,0,0,0|2,0,0]=4 49 B9R1.15 ClCC1=C(Cl)C=CC=C1 BB_SC-06882 [2,0,0,0,0,0|2,0,0]=4 50 B9R1.15 N#CC1=C(O)C=CC=C1 BB_SC-04062 [2,0,0,0,0,0|1,0,1]=4 51 B9R1.15 NC1=C(CO)C=CC=C1 BB_SC-05568 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.15 NCC1=C(Cl)C=CC=C1 BB_SC-06959 [2,0,0,0,0,0|2,0,0]=4 53 B9R1.15 NCC1=C(F)C=CC=C1 BB_SC-04585 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.15 O=CC1=C(O)C=CC=C1 BB_SC-09449 [2,0,0,0,0,0|1,0,1]=4 55 B9R1.69 CC1=C(Cl)C=C(N)C=C1 BB_SC-07067 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.69 CC1=C(N)C=C(N)C=C1 BB_SC-07051 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.69 CC1=CC(Br)=C(N)C=C1 BB_SC-06708 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.69 CC1=CC(C)=C(O)C=C1 BB_SC-06950 [2,0,0,0,0,0|2,0,0]=4 59 B9R1.69 CC1=CC=C(N)C(Cl)=C1 BB_SC-07252 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.69 CC1=CC=C(N)C(N)=C1 BB_SC-06834 [2,0,0,0,0,0|2,0,0]=4 61 B11R1.3 CC(C)C1=CC=C(CCl)C=C1 BB_SC-02505 [1,1,0,0,0,0|0,0,0]=2 62 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 BB_SC-07129 [1,1,0,0,0,0|1,0,1]=4 63 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 BB_SC-06693 [1,1,0,0,0,0|1,0,1]=4 64 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 BB_SC-02991 [1,1,0,0,0,0|1,0,1]=4 65 B11R1.21 CC(C)C1=CC(N)=C(O)C=C1 BB_SC-00452 [1,1,0,0,0,0|1,0,0]=3 66 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 BB_SC-06931 [1,1,0,0,0,0|1,0,1]=4 67 B11R1.22 NCC(O)C1=CC=C(O)C=C1 BB_NC-01337 [1,1,0,0,0,0|2,0,0]=4 68 B11R1.279 COC1=C(O)C=C(C=O)C=C1 BB_NC-02245 [1,1,0,0,0,0|1,0,1]=4 69 B11R1.53 COC1=CC=CC=C1C(C)=O BB_SC-06447 [1,1,0,0,0,0|1,0,1]=4 70 B11R1.159 CC1=CC=CC(C(C)C)=C1N BB_SC-12019 [1,1,0,0,0,0|1,0,0]=3 71 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 BB_SC-06880 [1,1,0,0,0,0|1,0,1]=4 72 B11R1.167 CC(=O)C1=CC(N)=CC=C1O BB_NC-02592 [1,1,0,0,0,0|1,0,1]=4 73 B11R1.167 CC(=O)C1=CC(O)=CC=C1O BB_SC-06838 [1,1,0,0,0,0|1,0,1]=4 74 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 BB_SC-06886 [1,1,0,0,0,0|1,0,1]=4 75 B11R1.222 CNC(=O)C1=CC=CC=C1O BB_SC-00487 [1,1,0,0,0,0|1,0,1]=4 76 B11R1.222 COC(=O)C1=CC=CC=C1O BB_SC-07170 [1,1,0,0,0,0|1,0,1]=4 77 B13R1.99 COC1=CC=C(C(C)=O)C(OC)=C1 BB_SC-09384 [0,2,0,0,0,0|1,0,1]=4 78 B13R1.165 CN(C)C1=CC=C(N)C=C1C(=O)O BB_SC-10225 [0,2,0,0,0,0|2,0,0]=4 79 B11R2.36 NC1=CC2=C(C=C1)OCO2 BB_SC-12006 [1,0,0,1,0,0|2,0,0]=4 80 B11R2.36 OC1=CC2=C(C=C1)OCO2 BB_NC-01237 [1,0,0,1,0,0|2,0,0]=4 81 B11R2.36 OC1=CC2=C(C=C1)OCO2 BB_NC-02931 [1,0,0,1,0,0|2,0,0]=4 82 B11R1.20 CC(C)OC1=CC=C(N)C=C1 BB_SC-10569 [1,0,0,0,0,1|1,0,0]=3