0 B13R2.3683 CC1=NC2=CC=C(N)C=C2C=C1 BB_SC-09573 [0,0,0,0,0,0|3,0,0]=3 1 B13R2.3683 NC1=CC2=C(C=C1)OC(=O)C=C2 BB_NC-01466 [0,0,0,0,0,0|1,0,0]=1 2 B13R2.3683 NC1=CC=C2NC(=O)COC2=C1 BB_SC-06293 [0,0,0,0,0,0|3,0,1]=4 3 B12R2.24 ClC1=CC2=C(C=C1)N=CC=C2 BB_SC-05493 [1,0,0,0,0,0|2,0,0]=3 4 B12R2.24 NC1=CC2=CC=CC=C2C=C1 BB_SC-06644 [1,0,0,0,0,0|2,0,0]=3 5 B12R2.24 NC1=CC2=NC=CN=C2C=C1 BB_SC-00603 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.24 NC1=CN=C2C=CC=CC2=C1 BB_SC-02703 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.24 O=C1C=CC2=CC=CC=C2O1 BB_NC-00720 [1,0,0,0,0,0|0,0,0]=1 8 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 BB_NC-00768 [1,0,0,0,0,0|0,0,2]=3 9 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 BB_SC-11998 [1,0,0,0,0,0|2,0,1]=4 10 B12R2.24 OC1=CC2=NC=CC=C2C=C1 BB_SC-03058 [1,0,0,0,0,0|2,0,1]=4 11 B12R2.24 SC1=CC=C2C=CC=CC2=C1 BB_SC-06653 [1,0,0,0,0,0|1,1,0]=3 12 B12R2.24 SC1=CC=C2C=CC=CC2=N1 BB_SC-05471 [1,0,0,0,0,0|1,1,0]=3 13 B14R2.2332 COC1=CC2=CC=C(C)N=C2C=C1 BB_SC-00315 [0,1,0,0,0,0|2,0,0]=3 14 B14R2.8235 CC1=CC(=O)OC2=C1C=C(O)C=C2 BB_NC-03353 [0,1,0,0,0,0|1,0,0]=2 15 B14R2.8235 CC1=NC2=C(C=C(N)C=C2)C(O)=C1 BB_SC-01551 [0,1,0,0,0,0|3,0,0]=4 16 B14R2.8235 CC1=NC2=CC=C(Br)C=C2C(S)=C1 BB_SC-00462 [0,1,0,0,0,0|3,0,0]=4 17 B14R2.8235 CC1=NC2=CC=C(Cl)C=C2C(N)=C1 BB_SC-07508 [0,1,0,0,0,0|3,0,0]=4 18 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(Cl)=C1 BB_SC-02511 [0,1,0,0,0,0|3,0,0]=4 19 B14R2.8235 CC1=NC2=CC=C(F)C=C2C(N)=C1 BB_SC-05911 [0,1,0,0,0,0|3,0,0]=4 20 B14R2.8235 O=C1NC2=CC=C(Br)C=C2C(=O)O1 BB_SC-08238 [0,1,0,0,0,0|3,0,0]=4 21 B14R2.8235 O=C1NC2=CC=C(Cl)C=C2C(=O)O1 BB_SC-08237 [0,1,0,0,0,0|3,0,0]=4 22 B14R2.8239 NC1=CC=C2NC(=O)C(=O)NC2=C1 BB_SC-11429 [0,1,0,0,0,0|3,0,0]=4 23 B14R2.8239 O=C1C=CC2=CC(O)=C(O)C=C2O1 BB_NC-03268 [0,1,0,0,0,0|1,0,0]=2 24 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 BB_SC-03069 [0,0,1,0,0,0|1,0,1]=3 25 B12R1.226 NC1=CC=CC(OCC(=O)O)=C1 BB_SC-07541 [0,0,1,0,0,0|2,0,1]=4 26 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 BB_NC-02248 [0,0,1,0,0,0|1,0,0]=2 27 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 BB_SC-11241 [0,0,0,0,1,0|3,0,0]=4 28 B12R2.606 O=C1CC2=CC(Cl)=CC=C2N1 BB_SC-04983 [0,0,0,0,1,0|2,0,1]=4 29 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 BB_SC-05274 [0,0,0,0,1,0|2,0,1]=4 30 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 BB_SC-01605 [0,0,0,0,1,0|3,0,0]=4 31 B12R2.606 O=C1OC2=C(C=CC(O)=C2)S1 BB_SC-09910 [0,0,0,0,1,0|2,1,0]=4 32 B12R2.606 O=C1OC2=CC=C(O)C=C2S1 BB_SC-05336 [0,0,0,0,1,0|2,0,0]=3 33 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 BB_SC-10754 [0,0,0,0,1,0|2,0,1]=4 34 B12R2.612 O=C1COC2=CC(O)=CC=C12 BB_NC-02097 [0,0,0,0,1,0|2,0,1]=4 35 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 BB_NC-02262 [1,0,1,0,0,0|2,0,0]=4 36 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 BB_SC-12727 [1,0,1,0,0,0|1,0,0]=3 37 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 BB_SC-06780 [1,0,1,0,0,0|1,0,0]=3 38 B11R1.91 O=C(O)C#CC1=CC=CC=C1 BB_SC-06586 [1,0,1,0,0,0|0,0,2]=4 39 B11R1.91 O=C(O)CCC1=CC=CC=C1 BB_NC-02055 [1,0,1,0,0,0|0,0,2]=4 40 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB_NC-02642 [1,0,1,0,0,0|1,0,1]=4 41 B11R1.91 O=C(O)COC1=CC=CC=C1 BB_SC-06261 [1,0,1,0,0,0|1,0,1]=4 42 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 BB_SC-12379 [1,0,1,0,0,0|0,0,0]=2 43 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 BB_SC-03070 [1,0,1,0,0,0|1,0,0]=3 44 B11R2.20 C1=CC2=C(C=C1)N=CC=C2 BB_SC-06766 [2,0,0,0,0,0|1,0,0]=3 45 B11R2.20 C1=CC2=CC=NC=C2C=C1 BB_SC-06613 [2,0,0,0,0,0|2,0,0]=4 46 B11R2.20 C1=CC=C2N=CC=NC2=C1 BB_SC-07021 [2,0,0,0,0,0|2,0,0]=4 47 B13R1.511 O=C(O)\C=C\C1=CC=C(O)C(O)=C1 BB_NC-02102 [0,1,1,0,0,0|1,0,0]=3 48 B13R1.643 COC1=CC=CC(\C=C\C(=O)O)=C1 BB_NC-02329 [0,1,1,0,0,0|0,0,0]=2 49 B13R2.32 NC1=C2C=CC=CC2=CC=C1O BB_SC-01424 [1,1,0,0,0,0|1,0,1]=4 50 B13R2.32 NC1=CC=C2N=CC=CC2=C1N BB_SC-00340 [1,1,0,0,0,0|2,0,0]=4 51 B13R2.32 O=C1C=CC2=C(C=CC=C2)C1=O BB_SC-00615 [1,1,0,0,0,0|1,0,0]=3 52 B13R2.57 COC1=CC2=CC=CN=C2C=C1 BB_NC-02279 [1,1,0,0,0,0|1,0,0]=3 53 B13R2.57 O=CC1=CC=C2N=CC=CC2=C1 BB_NC-00823 [1,1,0,0,0,0|1,0,1]=4 54 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 BB_NC-01232 [1,1,0,0,0,0|1,0,0]=3 55 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 BB_SC-00694 [1,1,0,0,0,0|2,0,0]=4 56 B13R2.155 O=C1C=CC2=C(C=C(O)C=C2)O1 BB_NC-02704 [1,1,0,0,0,0|0,0,0]=2 57 B13R2.162 CC1=CC=C2C=CC=C(N)C2=N1 BB_SC-05377 [1,1,0,0,0,0|2,0,0]=4 58 B13R2.162 CC1=CC=C2C=CC=C(O)C2=N1 BB_SC-06645 [1,1,0,0,0,0|2,0,0]=4 59 B13R2.162 ClC1=CC=C2N=CC=C(Cl)C2=C1 BB_SC-05907 [1,1,0,0,0,0|2,0,0]=4 60 B13R2.162 FC1=CC=C2N=CC=C(Cl)C2=C1 BB_SC-05910 [1,1,0,0,0,0|2,0,0]=4 61 B13R2.162 NC1=CC=C2OC=CC(=O)C2=C1 BB_NC-02485 [1,1,0,0,0,0|1,0,0]=3 62 B13R2.162 NC1=CC=NC2=CC=C(Cl)C=C12 BB_SC-05815 [1,1,0,0,0,0|2,0,0]=4 63 B13R2.162 NC1=CC=NC2=CC=C(F)C=C12 BB_SC-09835 [1,1,0,0,0,0|2,0,0]=4 64 B13R2.162 OC1=CC2=C(C=CC=C2O)C=C1 BB_SC-06769 [1,1,0,0,0,0|1,0,1]=4 65 B13R2.328 CC1=CC(Cl)=NC2=CC=CC=C12 BB_SC-01400 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.328 CC1=CC(O)=C2C=CC=CC2=N1 BB_SC-06490 [1,1,0,0,0,0|2,0,0]=4 67 B13R2.328 CC1=CC(O)=NC2=CC=CC=C12 BB_SC-00502 [1,1,0,0,0,0|1,0,1]=4 68 B13R2.328 CC1=CC(S)=NC2=CC=CC=C12 BB_SC-03283 [1,1,0,0,0,0|1,1,0]=4 69 B13R2.328 CC1=NC2=C(C=CC=C2)C(S)=C1 BB_SC-00265 [1,1,0,0,0,0|2,0,0]=4 70 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)O1 BB_NC-00709 [1,1,0,0,0,0|0,0,0]=2 71 B13R2.328 O=C1NC2=C(C=CC=C2)C(=O)O1 BB_NC-00461 [1,1,0,0,0,0|2,0,0]=4 72 B13R2.328 OC1=CC(O)=C2C=CC=CC2=N1 BB_SC-12664 [1,1,0,0,0,0|1,0,1]=4 73 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O BB_SC-01163 [1,1,0,0,0,0|2,0,0]=4 74 B13R2.43 O=CC1=CC2=CC(Br)=CC=C2N1 BB_NC-02405 [0,1,0,0,1,0|2,0,0]=4 75 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 BB_SC-01355 [0,1,0,0,1,0|1,0,0]=3 76 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O BB_SC-04830 [0,1,0,0,1,0|2,0,0]=4 77 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O BB_SC-04829 [0,1,0,0,1,0|2,0,0]=4 78 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O BB_SC-01565 [0,1,0,0,1,0|2,0,0]=4 79 B13R2.13083 CC1=C(N)C=C2NC(=O)NC2=C1 BB_SC-12073 [0,1,0,0,1,0|2,0,0]=4 80 B13R2.662 O=CC1=CNC2=C1C=CC(Cl)=C2 BB_SC-05140 [0,1,0,0,1,0|2,0,0]=4 81 B13R2.662 O=CC1=CNC2=CC(Br)=CC=C12 BB_NC-02468 [0,1,0,0,1,0|2,0,0]=4 82 B13R2.662 O=CC1=CNC2=CC(F)=CC=C12 BB_SC-08351 [0,1,0,0,1,0|2,0,0]=4 83 B13R2.2130 CN1C=CC2=CC(CO)=CC=C21 BB_SC-12345 [0,1,0,0,1,0|2,0,0]=4 84 B13R2.5187 NC1=CC=C2C(=O)NC(=O)C2=C1 BB_SC-00031 [0,1,0,0,1,0|2,0,0]=4 85 B13R2.5187 O=C1OC(=O)C2=C1C=CC(Cl)=C2 BB_SC-06607 [0,1,0,0,1,0|2,0,0]=4 86 B15R2.1754 CC1=CC=C2C=C(C=O)C(Cl)=NC2=C1 BB_SC-00148 [0,2,0,0,0,0|2,0,0]=4 87 B15R2.4780 COC1=CC=C2N=C(C=O)C=CC2=C1 BB_NC-01276 [0,2,0,0,0,0|1,0,0]=3 88 B15R2.21329 COC1=CC2=C(C=C1)N=C(C)C=C2S BB_SC-00262 [0,2,0,0,0,0|2,0,0]=4 89 B15R2.21329 COC1=CC=C2N=C(S)C=C(C)C2=C1 BB_SC-01118 [0,2,0,0,0,0|1,1,0]=4 90 B15R2.21336 COC1=CC2=CC(C)=C(Cl)N=C2C=C1 BB_SC-02501 [0,2,0,0,0,0|2,0,0]=4 91 B15R2.59732 CC1=CC(C)=C2N=C(C)C=C(N)C2=C1 BB_SC-07506 [0,2,0,0,0,0|2,0,0]=4 92 B15R2.59733 CC1=CC(=O)OC2=C1C=C(O)C(O)=C2 BB_NC-00493 [0,2,0,0,0,0|1,0,0]=3 93 B15R2.59733 CC1=CC(=O)OC2=CC(O)=C(Cl)C=C12 BB_SC-04373 [0,2,0,0,0,0|1,0,0]=3 94 B15R2.89950 CC1=CC=C2OC(=O)C=C(CCl)C2=C1 BB_NC-00988 [0,2,0,0,0,0|0,0,0]=2 95 B15R2.89950 O=C1C=C(CCl)C2=CC(O)=CC=C2O1 BB_NC-02095 [0,2,0,0,0,0|1,0,0]=3 96 B15R2.1824 CC1=CC=C2N=C(Cl)C(C=O)=CC2=C1 BB_SC-00150 [0,2,0,0,0,0|2,0,0]=4 97 B15R2.1824 CC1=CC=C2N=C(O)C(C=O)=CC2=C1 BB_NC-00336 [0,2,0,0,0,0|1,0,1]=4 98 B13R2.371 CC1=C2N=CC=CC2=C(N)C=C1 BB_SC-03451 [0,0,1,1,0,0|2,0,0]=4 99 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 BB_SC-06931 [0,0,1,0,1,0|0,0,2]=4 100 B11R2.1 O=C1OCC2=C1C=CC=C2 BB_SC-05507 [1,0,0,0,1,0|1,0,1]=4 101 B11R2.10 O=C1CC2=C(C=CC=C2)N1 BB_SC-04787 [1,0,0,0,1,0|1,0,1]=4 102 B11R2.10 O=C1NC2=C(C=CC=C2)O1 BB_NC-02706 [1,0,0,0,1,0|1,0,0]=3 103 B11R2.10 SC1=NC2=C(C=CC=C2)O1 BB_SC-00261 [1,0,0,0,1,0|1,1,0]=4 104 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 BB_SC-01562 [1,0,0,0,1,0|2,0,0]=4 105 B11R2.36 BrC1=CC=C2C=CNC2=C1 BB_SC-01865 [1,0,0,0,1,0|2,0,0]=4 106 B11R2.36 CC1=CC2=C(C=C1)NC=C2 BB_SC-01558 [1,0,0,0,1,0|1,0,0]=3 107 B11R2.36 ClC1=CC=C2C=CNC2=C1 BB_SC-05138 [1,0,0,0,1,0|2,0,0]=4 108 B11R2.36 ClC1=CC=C2NC=CC2=C1 BB_SC-01608 [1,0,0,0,1,0|2,0,0]=4 109 B11R2.36 FC1=CC=C2C=CNC2=C1 BB_SC-01877 [1,0,0,0,1,0|2,0,0]=4 110 B11R2.36 NC1=CC=C2C=CNC2=C1 BB_SC-04605 [1,0,0,0,1,0|2,0,0]=4 111 B11R2.36 OC1=CC2=C(C=C1)NC=C2 BB_SC-01866 [1,0,0,0,1,0|2,0,0]=4