0 B6R1.1 C1=CC=[NH+]C=C1 BB_SC-07082 [0,0,0,0,0,0|1,0,0]=1 1 B6R1.1 C1=CC=[NH+]C=C1 BB_SC-11518 [0,0,0,0,0,0|1,0,0]=1 2 B6R1.1 C1=CN=NC=C1 BB_SC-07118 [0,0,0,0,0,0|2,0,0]=2 3 B6R1.1 C1=COCCC1 BB_SC-07074 [0,0,0,0,0,0|1,0,3]=4 4 B7R1.3 BrC1=CC=CC=N1 BB_SC-04785 [0,1,0,0,0,0|1,0,0]=2 5 B7R1.3 BrC1=CC=NC=C1 BB_SC-02988 [0,1,0,0,0,0|1,0,0]=2 6 B7R1.3 BrC1=CN=CC=C1 BB_SC-04786 [0,1,0,0,0,0|1,0,0]=2 7 B7R1.3 CC1=CC=NC=C1 BB_SC-07024 [0,1,0,0,0,0|1,0,0]=2 8 B7R1.3 ClC1=CC=CC=N1 BB_SC-06726 [0,1,0,0,0,0|1,0,0]=2 9 B7R1.3 ClC1=NC=CC=N1 BB_SC-02990 [0,1,0,0,0,0|2,0,0]=3 10 B7R1.3 ClC1=NC=CN=C1 BB_SC-07206 [0,1,0,0,0,0|2,0,0]=3 11 B7R1.3 FC1=CC=CC=N1 BB_SC-03368 [0,1,0,0,0,0|1,0,0]=2 12 B7R1.3 IC1=CC=NC=C1 BB_SC-02996 [0,1,0,0,0,0|1,0,0]=2 13 B7R1.3 NC1=CC=CN=C1 BB_SC-06592 [0,1,0,0,0,0|1,0,0]=2 14 B7R1.3 NC1=CC=NC=C1 BB_SC-06974 [0,1,0,0,0,0|1,0,0]=2 15 B7R1.3 NC1=NC=CC=C1 BB_SC-06704 [0,1,0,0,0,0|1,0,0]=2 16 B7R1.3 NC1=NC=CC=N1 BB_SC-06567 [0,1,0,0,0,0|2,0,0]=3 17 B7R1.3 O=C1C=CCCC1 BB_SC-07147 [0,1,0,0,0,0|0,0,3]=4 18 B7R1.3 OC1=CN=CC=C1 BB_SC-00238 [0,1,0,0,0,0|1,0,0]=2 19 B7R1.3 OC1=NC=CC=C1 BB_SC-07237 [0,1,0,0,0,0|1,0,0]=2 20 B7R1.3 SC1=NC=CC=N1 BB_SC-06856 [0,1,0,0,0,0|2,0,0]=3 21 B5R1.1 C1=CNC=C1 BB_SC-07205 [0,0,0,0,1,0|1,0,0]=2 22 B5R1.1 C1=CNC=N1 BB_SC-06938 [0,0,0,0,1,0|2,0,0]=3 23 B5R1.1 C1=CNN=C1 BB_SC-04986 [0,0,0,0,1,0|2,0,0]=3 24 B5R1.1 C1=COCC1 BB_SC-06597 [0,0,0,0,1,0|1,0,2]=4 25 B5R1.1 C1=CON=C1 BB_SC-08801 [0,0,0,0,1,0|2,0,0]=3 26 B5R1.1 C1=CSC=N1 BB_SC-08800 [0,0,0,0,1,0|2,0,0]=3 27 B7R1.24 C1=CC=CCC=C1 BB_SC-06674 [0,0,0,0,0,1|0,0,0]=1 28 B4R0.2 C\C=C\C=O BB_SC-06898 [1,0,1,0,0,0|1,0,1]=4 29 B6R1.2 BrC1=CN=CN1 BB_SC-06082 [0,1,0,0,1,0|2,0,0]=4 30 B6R1.2 BrC1=CNN=C1 BB_SC-05016 [0,1,0,0,1,0|2,0,0]=4 31 B6R1.2 BrC1=NC=CS1 BB_SC-04599 [0,1,0,0,1,0|2,0,0]=4 32 B6R1.2 CC1=CC=NN1 BB_SC-03908 [0,1,0,0,1,0|2,0,0]=4 33 B6R1.2 CC1=NC=CN1 BB_SC-06891 [0,1,0,0,1,0|2,0,0]=4 34 B6R1.2 CN1C=CC=N1 BB_SC-04178 [0,1,0,0,1,0|2,0,0]=4 35 B6R1.2 CN1C=CN=C1 BB_SC-06980 [0,1,0,0,1,0|2,0,0]=4 36 B6R1.2 ClC1=CC=CS1 BB_SC-08899 [0,1,0,0,1,0|1,0,0]=3 37 B6R1.2 ClC1=CNN=C1 BB_SC-08868 [0,1,0,0,1,0|2,0,0]=4 38 B6R1.2 IC1=CNN=C1 BB_SC-04601 [0,1,0,0,1,0|2,0,0]=4 39 B6R1.2 NC1=CC=NN1 BB_SC-08263 [0,1,0,0,1,0|2,0,0]=4 40 B6R1.2 NC1=CNN=C1 BB_SC-05260 [0,1,0,0,1,0|2,0,0]=4 41 B6R1.2 NC1=CNN=C1 BB_SC-10964 [0,1,0,0,1,0|2,0,0]=4 42 B6R1.2 NC1=NC=CN1 BB_SC-09635 [0,1,0,0,1,0|2,0,0]=4 43 B6R1.2 NC1=NC=CS1 BB_SC-10668 [0,1,0,0,1,0|2,0,0]=4 44 B6R1.2 NC1=NOC=C1 BB_SC-12691 [0,1,0,0,1,0|2,0,0]=4 45 B6R1.2 O=C1OC=CO1 BB_SC-06550 [0,1,0,0,1,0|2,0,0]=4 46 B8R1.2 C=CC1=CC=CC=N1 BB_SC-05428 [0,2,0,0,0,0|1,0,0]=3 47 B8R1.2 C=CC1=CC=NC=C1 BB_SC-05441 [0,2,0,0,0,0|1,0,0]=3 48 B8R1.2 COC1=NC=CC=C1 BB_SC-07094 [0,2,0,0,0,0|1,0,0]=3 49 B8R1.2 ClCC1=CC=CC=N1 BB_SC-02985 [0,2,0,0,0,0|1,0,0]=3 50 B8R1.2 ClCC1=CC=CN=C1 BB_SC-03000 [0,2,0,0,0,0|1,0,0]=3 51 B8R1.2 ClCC1=CC=NC=C1 BB_SC-02999 [0,2,0,0,0,0|1,0,0]=3 52 B8R1.2 N#CC1=CC=CN=C1 BB_SC-12614 [0,2,0,0,0,0|1,0,0]=3 53 B8R1.2 N#CC1=CC=NC=C1 BB_SC-07019 [0,2,0,0,0,0|1,0,0]=3 54 B8R1.2 N#CC1=NC=CC=C1 BB_SC-08696 [0,2,0,0,0,0|1,0,0]=3 55 B8R1.2 N#CC1=NC=CN=C1 BB_SC-08694 [0,2,0,0,0,0|2,0,0]=4 56 B8R1.2 NCC1=CC=CC=N1 BB_SC-05841 [0,2,0,0,0,0|1,0,0]=3 57 B8R1.2 NCC1=CN=CC=C1 BB_SC-12559 [0,2,0,0,0,0|1,0,0]=3 58 B8R1.2 NNC1=CC=CC=C1 BB_SC-06741 [0,2,0,0,0,0|0,0,0]=2 59 B8R1.2 NNC1=NC=CC=C1 BB_SC-07490 [0,2,0,0,0,0|1,0,0]=3 60 B8R1.2 O=CC1=CC=CC=N1 BB_SC-07272 [0,2,0,0,0,0|1,0,0]=3 61 B8R1.2 O=CC1=CC=NC=C1 BB_SC-06717 [0,2,0,0,0,0|1,0,0]=3 62 B8R1.2 O=CC1=CN=CC=C1 BB_SC-11212 [0,2,0,0,0,0|1,0,0]=3 63 B8R1.2 OCC1=CC=CC=C1 BB_SC-07027 [0,2,0,0,0,0|0,0,0]=2 64 B8R1.3 CC1=CC=[N+]([O-])C=C1 BB_SC-06930 [0,2,0,0,0,0|1,0,0]=3 65 B8R1.3 CC1=CN=C(N)C=C1 BB_SC-07181 [0,2,0,0,0,0|1,0,0]=3 66 B8R1.3 ClC1=CC=C(Cl)N=N1 BB_SC-06573 [0,2,0,0,0,0|2,0,0]=4 67 B8R1.3 ClC1=NC=C(Br)C=C1 BB_SC-09720 [0,2,0,0,0,0|1,0,0]=3 68 B8R1.3 FC1=CN=C(Cl)C=C1 BB_SC-11222 [0,2,0,0,0,0|1,0,0]=3 69 B8R1.3 NC1=CC=C(Br)C=N1 BB_SC-06010 [0,2,0,0,0,0|1,0,0]=3 70 B8R1.3 NC1=CC=C(Cl)C=N1 BB_SC-03655 [0,2,0,0,0,0|1,0,0]=3 71 B8R1.3 NC1=CC=C(N)C=C1 BB_SC-07053 [0,2,0,0,0,0|0,0,0]=2 72 B8R1.3 NC1=CC=C(O)C=C1 BB_SC-06973 [0,2,0,0,0,0|0,0,0]=2 73 B8R1.3 NC1=CN=C(Cl)C=C1 BB_SC-04736 [0,2,0,0,0,0|1,0,0]=3 74 B8R1.3 O=C1C=CC(=O)C=C1 BB_NC-02313 [0,2,0,0,0,0|0,0,0]=2 75 B8R1.3 O=C1C=CC(Cl)=NN1 BB_SC-09945 [0,2,0,0,0,0|2,0,0]=4 76 B8R1.3 OC1=CC=C(O)C=C1 BB_NC-02226 [0,2,0,0,0,0|0,0,0]=2 77 B8R1.3 OC1=NC=C(Cl)C=C1 BB_SC-07238 [0,2,0,0,0,0|1,0,0]=3 78 B8R1.4 CC1=CC=CC(C)=N1 BB_SC-06945 [0,2,0,0,0,0|1,0,0]=3 79 B8R1.4 CC1=CC=CC(N)=N1 BB_SC-06591 [0,2,0,0,0,0|1,0,0]=3 80 B8R1.4 CC1=CC=NC(C)=C1 BB_SC-06947 [0,2,0,0,0,0|1,0,0]=3 81 B8R1.4 CC1=CC=NC(N)=N1 BB_SC-06605 [0,2,0,0,0,0|2,0,0]=4 82 B8R1.4 ClC1=CC=CC(Cl)=N1 BB_SC-05381 [0,2,0,0,0,0|1,0,0]=3 83 B8R1.4 ClC1=NC(Cl)=NC=C1 BB_SC-06244 [0,2,0,0,0,0|2,0,0]=4 84 B8R1.4 NC1=CC(S)=CC=C1 BB_SC-04635 [0,2,0,0,0,0|0,0,0]=2 85 B8R1.4 NC1=CC=CC(N)=N1 BB_SC-08890 [0,2,0,0,0,0|1,0,0]=3 86 B8R1.4 NC1=CC=NC(Cl)=C1 BB_SC-02987 [0,2,0,0,0,0|1,0,0]=3 87 B8R1.4 NC1=NC(Cl)=CN=C1 BB_SC-09567 [0,2,0,0,0,0|2,0,0]=4 88 B8R1.4 NC1=NC=CC(Cl)=C1 BB_SC-06262 [0,2,0,0,0,0|1,0,0]=3 89 B8R1.4 O=C1C=CNC(=O)N1 BB_NC-02210 [0,2,0,0,0,0|2,0,0]=4 90 B8R1.4 OC1=CC=NC(S)=N1 BB_SC-06628 [0,2,0,0,0,0|2,0,0]=4 91 B8R1.4 [O-][N+]1=CC=CC(O)=C1 BB_SC-05501 [0,2,0,0,0,0|1,0,0]=3 92 B8R1.5 CC1=C(Br)C=NC=C1 BB_SC-09560 [0,2,0,0,0,0|1,0,0]=3 93 B8R1.5 CC1=C(N)C=CC=C1 BB_SC-07050 [0,2,0,0,0,0|0,0,0]=2 94 B8R1.5 CC1=C(N)N=CC=C1 BB_SC-06560 [0,2,0,0,0,0|1,0,0]=3 95 B8R1.5 CC1=CC=NC=C1C BB_SC-06614 [0,2,0,0,0,0|1,0,0]=3 96 B8R1.5 C[N+]1=CC=CC=C1Cl BB_SC-06462 [0,2,0,0,0,0|1,0,0]=3 97 B8R1.5 NC1=C(Br)C=CC=C1 BB_SC-12017 [0,2,0,0,0,0|0,0,0]=2 98 B8R1.5 NC1=C(F)C=CC=C1 BB_SC-05842 [0,2,0,0,0,0|0,0,0]=2 99 B8R1.5 NC1=C(I)C=CC=C1 BB_SC-06756 [0,2,0,0,0,0|0,0,0]=2 100 B8R1.5 NC1=C(O)C=CN=C1 BB_SC-04743 [0,2,0,0,0,0|1,0,0]=3 101 B8R1.5 NC1=CC=CN=C1Cl BB_SC-01725 [0,2,0,0,0,0|1,0,0]=3 102 B8R1.5 NC1=CC=CN=C1N BB_SC-04738 [0,2,0,0,0,0|1,0,0]=3 103 B8R1.5 NC1=CC=NC=C1N BB_SC-03135 [0,2,0,0,0,0|1,0,0]=3 104 B8R1.5 NC1=NC=CC=C1O BB_SC-01724 [0,2,0,0,0,0|1,0,0]=3 105 B8R1.5 OC1=C(Br)N=CC=C1 BB_SC-04833 [0,2,0,0,0,0|1,0,0]=3 106 B8R1.5 OC1=C(Cl)N=CC=C1 BB_SC-12711 [0,2,0,0,0,0|1,0,0]=3 107 B8R1.5 OC1=C(O)C=CC=C1 BB_NC-02239 [0,2,0,0,0,0|0,0,0]=2 108 B8R1.5 OC1=C(O)N=CC=C1 BB_SC-05516 [0,2,0,0,0,0|1,0,0]=3 109 B8R1.49 C1=CC=CC=CC=C1 BB_SC-05388 [0,0,0,0,0,2|0,0,0]=2