0 B11R1.21 CC(C)C1=CC(N)=C(O)C=C1 BB_SC-00452 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 BB_SC-06208 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1N BB_SC-06745 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1O BB_SC-06686 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 BB_SC-04580 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 BB_NC-02256 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 BB_SC-06664 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.13 CC(=O)C1=CC=C(C)C=C1 BB_SC-06635 [1,0,0,0,0,0|1,0,1]=3 8 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 BB_SC-06734 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB_SC-08802 [1,0,0,0,0,0|2,0,1]=4 10 B10R1.13 CC(=O)C1=CC=C(N)C=C1 BB_SC-10671 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.13 CC(=O)C1=CC=C(O)C=C1 BB_SC-06720 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.13 CC(C)C1=CC=C(N)C=C1 BB_SC-12018 [1,0,0,0,0,0|1,0,0]=2 13 B10R1.13 CC(C)C1=CC=C(O)C=C1 BB_SC-12725 [1,0,0,0,0,0|1,0,0]=2 14 B10R1.13 CC(N)C1=CC=C(Br)C=C1 BB_SC-11893 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 BB_SC-06932 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.113 CC(=O)C1=CC(O)=CC=C1 BB_SC-07222 [1,0,0,0,0,0|1,0,1]=3 17 B10R1.113 CC(=O)C1=CC=CC(N)=C1 BB_SC-10669 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.113 CN(C)C1=NC(Cl)=CC=C1 BB_SC-12326 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.113 O=C(O)C1=CC=CC(O)=C1 BB_SC-06483 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.176 NCC1=CC(Cl)=C(O)C=C1 BB_SC-12456 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.176 O=CC1=CC(O)=C(O)C=C1 BB_NC-02317 [1,0,0,0,0,0|2,0,1]=4 22 B12R1.23 CC(C)(C)C1=CC(N)=C(O)C=C1 BB_SC-00395 [0,1,0,0,0,0|2,0,0]=3 23 B12R1.23 CC(C)(C)C1=CC(O)=C(O)C=C1 BB_SC-07178 [0,1,0,0,0,0|1,0,0]=2 24 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 BB_SC-02684 [0,1,0,0,0,0|2,0,1]=4 25 B12R1.48 COC1=CC=C(C(=O)O)C=C1O BB_NC-02259 [0,1,0,0,0,0|2,0,1]=4 26 B12R1.56 COC1=CC(C(C)=O)=CC=C1O BB_NC-02250 [0,1,0,0,0,0|2,0,1]=4 27 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1Cl BB_SC-12733 [0,1,0,0,0,0|1,0,0]=2 28 B12R1.367 CCC(C)C1=CC(N)=C(O)C=C1 BB_SC-00358 [0,1,0,0,0,0|2,0,0]=3 29 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 BB_SC-02713 [0,1,0,0,0,0|2,0,1]=4 30 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 31 B12R1.1021 CC(C)C1=CC=CC(=O)C(O)=C1 BB_NC-03281 [0,0,0,0,0,1|1,0,0]=2 32 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 33 B9R1.1 CC1=CC=C(CCl)C=C1 BB_SC-06960 [2,0,0,0,0,0|1,0,0]=3 34 B9R1.1 CCC1=CC=C(N)C=C1 BB_SC-07009 [2,0,0,0,0,0|1,0,0]=3 35 B9R1.1 CNC1=CC=C(O)C=C1 BB_SC-07044 [2,0,0,0,0,0|2,0,0]=4 36 B9R1.1 COC1=CC=C(S)C=C1 BB_SC-06511 [2,0,0,0,0,0|2,0,0]=4 37 B9R1.1 ClCC1=CC=C(Br)C=C1 BB_SC-04526 [2,0,0,0,0,0|2,0,0]=4 38 B9R1.1 FC1=CC=C(CCl)C=C1 BB_SC-06883 [2,0,0,0,0,0|2,0,0]=4 39 B9R1.1 NCC1=CC=C(Cl)C=C1 BB_SC-04583 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.1 NCC1=CC=C(N)C=C1 BB_SC-08895 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.1 OCC1=CC=C(Cl)C=C1 BB_SC-06996 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.1 OCC1=CC=C(F)C=C1 BB_SC-06738 [2,0,0,0,0,0|2,0,0]=4 43 B9R1.6 CC(N)C1=CC=CC=C1 BB_SC-09414 [2,0,0,0,0,0|1,0,0]=3 44 B9R1.6 CN(C)C1=CC=NC=C1 BB_SC-07248 [2,0,0,0,0,0|2,0,0]=4 45 B9R1.6 C[C@@H](N)C1=CC=CC=C1 BB_NC-02297 [2,0,0,0,0,0|1,0,0]=3 46 B9R1.6 C[C@H](N)C1=CC=CC=C1 BB_SC-10322 [2,0,0,0,0,0|1,0,0]=3 47 B9R1.2 CC1=CC=CC(CCl)=C1 BB_SC-07069 [2,0,0,0,0,0|2,0,0]=4 48 B9R1.2 COC1=CC=CC(N)=C1 BB_SC-07166 [2,0,0,0,0,0|2,0,0]=4 49 B9R1.2 COC1=CC=CC(O)=C1 BB_SC-06850 [2,0,0,0,0,0|1,0,0]=3 50 B9R1.2 CSC1=CC(N)=CC=C1 BB_SC-07267 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.2 ClCC1=CC(Cl)=CC=C1 BB_SC-06965 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.2 ClCC1=CC=CC(Br)=C1 BB_SC-09626 [2,0,0,0,0,0|2,0,0]=4 53 B9R1.2 NCC1=CC(Cl)=CC=C1 BB_SC-04584 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.2 NCC1=CC(F)=CC=C1 BB_SC-04586 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.2 NCC1=CC(N)=CC=C1 BB_SC-08894 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.69 CC1=C(Cl)C=C(N)C=C1 BB_SC-07067 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.69 CC1=C(N)C=C(N)C=C1 BB_SC-07051 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.69 CC1=CC(Br)=C(N)C=C1 BB_SC-06708 [2,0,0,0,0,0|2,0,0]=4 59 B9R1.69 CC1=CC(C)=C(O)C=C1 BB_SC-06950 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.69 CC1=CC=C(N)C(Cl)=C1 BB_SC-07252 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.69 CC1=CC=C(N)C(N)=C1 BB_SC-06834 [2,0,0,0,0,0|2,0,0]=4 62 B11R1.3 CC(C)C1=CC=C(CCl)C=C1 BB_SC-02505 [1,1,0,0,0,0|0,0,0]=2 63 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 BB_SC-07129 [1,1,0,0,0,0|1,0,1]=4 64 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 BB_SC-06693 [1,1,0,0,0,0|1,0,1]=4 65 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 BB_SC-02991 [1,1,0,0,0,0|1,0,1]=4 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 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 BB_SC-06774 [1,1,0,0,0,0|1,0,0]=3 69 B11R1.166 CC1=CC(O)=C(C(C)C)C=C1 BB_NC-02806 [1,1,0,0,0,0|0,0,0]=2 70 B11R1.166 CN(C)C1=C(N)C=C(Cl)C=C1 BB_SC-02758 [1,1,0,0,0,0|2,0,0]=4 71 B11R1.23 NCC(O)C1=CC(O)=CC=C1 BB_NC-02015 [1,1,0,0,0,0|1,0,0]=3 72 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 BB_SC-06878 [1,1,0,0,0,0|1,0,1]=4 73 B11R1.155 OC1=CC(C(F)(F)F)=CC=C1 BB_SC-06615 [1,1,0,0,0,0|2,0,0]=4 74 B11R1.159 CC1=CC=CC(C(C)C)=C1N BB_SC-12019 [1,1,0,0,0,0|1,0,0]=3 75 B11R1.167 CC(=O)C1=CC(O)=CC=C1O BB_SC-06838 [1,1,0,0,0,0|1,0,1]=4 76 B11R1.266 COC1=CC(C(C)=O)=CC=C1 BB_SC-06240 [1,1,0,0,0,0|1,0,1]=4 77 B11R1.192 C=CCC1=CC=C(O)C(O)=C1 BB_NC-00472 [1,1,0,0,0,0|1,0,1]=4 78 B11R1.192 CNCC1=CC(Cl)=C(O)C=C1 BB_SC-12468 [1,1,0,0,0,0|2,0,0]=4 79 B11R1.192 NCCC1=CC(O)=C(O)C=C1 BB_NC-01356 [1,1,0,0,0,0|1,0,0]=3 80 B11R1.279 COC1=C(O)C=C(C=O)C=C1 BB_NC-02245 [1,1,0,0,0,0|1,0,1]=4 81 B11R1.280 COC1=CC(CO)=CC=C1O BB_NC-02797 [1,1,0,0,0,0|2,0,0]=4 82 B13R1.3091 COC1=CC=C(C(C)=O)C=C1OC BB_SC-12397 [0,2,0,0,0,0|1,0,1]=4 83 B13R1.49 CCC(O)C1=CC=C(O)C(OC)=C1 BB_NC-00076 [0,2,0,0,0,0|2,0,0]=4 84 B13R1.466 CNCC(O)C1=CC(O)=C(O)C=C1 BB_NC-00791 [0,2,0,0,0,0|2,0,0]=4 85 B13R1.466 [C@H](O)(CNC)C1=CC(O)=C(O)C=C1 BB_NC-03284 [0,2,0,0,0,0|2,0,0]=4 86 B11R1.20 CC(C)OC1=CC=C(N)C=C1 BB_SC-10569 [1,0,0,0,0,1|1,0,0]=3