0 B10R1.11 CCOC(=O)C1=CNC=N1 BB01-7910 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.11 CCOC(=O)C1=CNN=C1 BB12-1454 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.11 CCOC(=O)C1=CON=C1 BB57-1591 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.11 CCOC(=O)C1=CSC=N1 BB54-3895 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.11 CCOC(=O)C1=NNC=C1 BB55-2980 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.11 CCOC(=O)C1=NNC=N1 BB54-5314 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.11 CCOC(=O)C1=NOC=N1 BB54-4959 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.11 N#C\N=C(\N)C1=CC=CO1 BB53-1704 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.11 CCC(=O)C1=NC=CS1 BB55-8398 [1,0,0,0,0,0|1,1,0]=3 9 B9R1.11 COC(=O)C1=CC=CN1 BB54-1949 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.11 COC(=O)C1=CC=NO1 BB05-4453 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.11 COC(=O)C1=CC=NO1 BB54-4360 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.11 COC(=O)C1=CNC=N1 BB20-4625 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.11 COC(=O)C1=NNC=C1 BB12-1846 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.11 C\C(=N/O)C1=CC=CO1 BB05-0882 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.11 C\C(=N\O)C1=CC=CO1 BB01-6608 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.11 NCC(=O)C1=CSC=C1 BB58-1386 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.11 NNC(=O)C1=CC=CN1 BB01-6450 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.11 NNC(=O)C1=CC=CO1 BB01-6372 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.12 CCNCC1=CC=CO1 BB01-4781 [1,0,0,0,0,0|1,0,1]=3 20 B9R1.12 CNCCC1=CC=CS1 BB55-8320 [1,0,0,0,0,0|1,1,1]=4 21 B9R1.12 NCCCC1=CC=CO1 BB01-5828 [1,0,0,0,0,0|1,0,1]=3 22 B11R1.15 CCNC(=O)C1=CC=C(Br)O1 BB55-2911 [0,1,0,0,0,0|1,0,0]=2 23 B11R1.15 CCOC(=O)C1=CC(C)=NO1 BB55-7613 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.15 CCOC(=O)C1=CC(N)=CS1 BB20-6180 [0,1,0,0,0,0|1,1,0]=3 25 B11R1.15 CCOC(=O)C1=CC(N)=NN1 BB55-4150 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.15 CCOC(=O)C1=CN=C(Br)N1 BB58-1668 [0,1,0,0,0,0|3,0,0]=4 27 B11R1.15 CCOC(=O)C1=CN=C(N)S1 BB55-6567 [0,1,0,0,0,0|2,1,0]=4 28 B11R1.15 CCOC(=O)C1=CNC(N)=N1 BB54-5771 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 BB12-1472 [0,1,0,0,0,0|3,0,0]=4 30 B11R1.15 CCOC(=O)C1=CSC(N)=N1 BB12-1273 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.15 CCOC(=O)C1=CSC(N)=N1 BB56-1326 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.15 CCOC(=O)C1=NN(C)C=C1 BB57-4165 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.15 CCOC(=O)C1=NNC(C)=C1 BB56-2143 [0,1,0,0,0,0|3,0,0]=4 34 B11R1.15 CCOC(=O)C1=NNC(N)=C1 BB05-1931 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.15 CCOC(=O)C1=NOC(C)=C1 BB55-3966 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.29 NCCNC(=O)C1=NNC=C1 BB05-2433 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.29 O=C(NCCO)C1=CC=NN1 BB54-0683 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.77 CC(=O)CC(=O)C1=CC=CS1 BB54-4313 [0,1,0,0,0,0|0,1,1]=3 39 B11R1.199 CCOC(=O)C1=C(C)N=CO1 BB54-1776 [0,1,0,0,0,0|2,0,0]=3 40 B11R1.199 CCOC(=O)C1=C(C)NC=C1 BB57-2152 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.199 CCOC(=O)C1=C(C)NC=N1 BB26-0240 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.199 CCOC(=O)C1=C(C)SC=N1 BB57-3717 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.199 CCOC(=O)C1=C(N)SC=C1 BB55-1541 [0,1,0,0,0,0|3,0,0]=4 44 B11R1.199 CCOC(=O)C1=NC=CN1C BB54-1363 [0,1,0,0,0,0|3,0,0]=4 45 B11R1.199 CCOC(=O)C1=NNC=C1Br BB12-3693 [0,1,0,0,0,0|3,0,0]=4 46 B11R1.199 CCOC(=O)C1=NNC=C1N BB54-1692 [0,1,0,0,0,0|3,0,0]=4 47 B11R2.2 C1=COC(C2CCCN2)=C1 BB05-3960 [0,0,0,1,0,0|1,0,1]=3 48 B11R2.2 C1=COC(C2CCCN2)=C1 BB56-0036 [0,0,0,1,0,0|1,0,1]=3 49 B11R2.2 C1=CSC(C2CCCN2)=C1 BB05-3961 [0,0,0,1,0,0|1,1,1]=4 50 B11R2.2 C1=CSC(C2CCCN2)=C1 BB55-3981 [0,0,0,1,0,0|1,1,1]=4 51 B11R2.2 C1=NOC(C2CCCN2)=C1 BB58-0383 [0,0,0,1,0,0|2,0,1]=4 52 B11R2.106 O=C1CCCC2=C1C=NN2 BB54-4553 [0,0,0,1,0,0|3,0,0]=4 53 B11R2.106 O=C1CCCN2C=CN=C12 BB58-3678 [0,0,0,1,0,0|2,0,0]=3 54 B11R1.16 CCOC(=O)C1=CC=NC=C1 BB12-2749 [0,0,0,0,0,1|2,0,0]=3 55 B11R1.30 CCOC(=O)CC1=CSC=N1 BB54-4145 [0,0,0,0,0,1|3,0,0]=4 56 B11R1.30 CCOC(=O)CN1C=CC=C1 BB56-2158 [0,0,0,0,0,1|3,0,0]=4 57 B11R1.30 CCOC(=O)NC1=CC=CN1 BB01-3354 [0,0,0,0,0,1|2,0,0]=3 58 B8R1.7 CC(=O)C1=NC=CN1 BB58-3749 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.8 CCCC1=CC=CS1 BB05-4767 [2,0,0,0,0,0|0,1,0]=3 60 B8R1.8 NCCC1=CC=CO1 BB01-5388 [2,0,0,0,0,0|1,0,0]=3 61 B10R1.14 CC1=CC=C(C(=O)NN)O1 BB58-0339 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.14 CCC(=O)C1=CC=C(C)S1 BB55-2281 [1,1,0,0,0,0|0,1,0]=3 63 B10R1.14 CCC(=O)C1=NC(C)=CN1 BB57-7203 [1,1,0,0,0,0|2,0,0]=4 64 B10R1.14 COC(=O)C1=CC(N)=CS1 BB58-1694 [1,1,0,0,0,0|1,1,0]=4 65 B10R1.14 COC(=O)C1=CC=C(N)S1 BB54-5468 [1,1,0,0,0,0|1,1,0]=4 66 B10R1.149 CNC(=O)C1=C(N)C=CS1 BB53-1658 [1,1,0,0,0,0|1,1,0]=4 67 B10R1.149 COC(=O)C1=C(Br)C=CS1 BB20-4653 [1,1,0,0,0,0|1,1,0]=4 68 B10R1.21 NCCSCC1=CC=CO1 BB58-0598 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.27 CCC(=O)CC1=CC=CO1 BB54-3617 [1,1,0,0,0,0|0,0,2]=4 70 B10R1.66 CC(=O)\C=C\C1=CC=CO1 BB12-2961 [1,1,0,0,0,0|0,0,2]=4 71 B10R1.66 CC(N)CCC1=CC=CO1 BB05-2102 [1,1,0,0,0,0|0,0,1]=3 72 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 BB54-0091 [0,1,0,0,0,1|1,0,0]=3 73 B12R1.16 CCNC(=O)C1=CC=C(N)C=C1 BB57-1198 [0,1,0,0,0,1|2,0,0]=4 74 B12R1.16 CCOC(=O)C1=CN=C(O)C=N1 BB20-4231 [0,1,0,0,0,1|2,0,0]=4 75 B12R1.16 CCOC(=O)C1=NC=C(O)C=C1 BB58-1367 [0,1,0,0,0,1|2,0,0]=4 76 B12R1.16 CCOC(=O)C1=NNC(=O)C=C1 BB10-0120 [0,1,0,0,0,1|2,0,0]=4 77 B12R1.16 CNCC(=O)C1=CC=C(O)C=C1 BB54-2248 [0,1,0,0,0,1|2,0,0]=4 78 B12R1.17 CCCC(=O)C1=CC=CC(Cl)=C1 BB32-1724 [0,1,0,0,0,1|1,0,0]=3 79 B12R1.17 CCOC(=O)C1=CC(Br)=CN=C1 BB01-2817 [0,1,0,0,0,1|2,0,0]=4 80 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=C1 BB54-4316 [0,1,0,0,0,1|2,0,0]=4 81 B12R1.17 CCOC(=O)C1=CN=CC(N)=C1 BB01-3744 [0,1,0,0,0,1|2,0,0]=4 82 B12R1.17 CCOC(=O)C1=NC(O)=CC=C1 BB54-2947 [0,1,0,0,0,1|2,0,0]=4 83 B12R1.17 CCOC(=O)C1=NC=CC(O)=C1 BB58-1368 [0,1,0,0,0,1|2,0,0]=4 84 B12R1.30 NCCNC(=O)C1=CC=CC=C1 BB32-0721 [0,1,0,0,0,1|2,0,0]=4 85 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [0,1,0,0,0,1|1,0,1]=4 86 B12R1.308 CCNC(=O)C1=CC=CN=C1Cl BB55-2908 [0,1,0,0,0,1|2,0,0]=4 87 B12R1.260 CC(C)OC(=O)CC1=CC=CN1 BB58-0484 [0,1,0,0,0,1|2,0,0]=4 88 B12R1.103 CC(C)NC(=O)C1=CC=C(Br)S1 BB55-2941 [0,2,0,0,0,0|1,1,0]=4 89 B12R1.312 CCOC(=O)C1=CC(CC)=NO1 BB55-3831 [0,2,0,0,0,0|2,0,0]=4 90 B12R1.312 CCOC(=O)C1=CC=C(CN)O1 BB54-0420 [0,2,0,0,0,0|1,0,0]=3 91 B12R1.313 CCOC(=O)C1=C(C)C=C(C)N1 BB54-4358 [0,2,0,0,0,0|2,0,0]=4 92 B12R1.313 CCOC(=O)C1=C(N)C=C(C)N1 BB90-0097 [0,2,0,0,0,0|2,0,0]=4 93 B12R1.313 CCOC(=O)N1OC(N)=CC1=O BB58-1811 [0,2,0,0,0,0|2,0,0]=4 94 B12R1.15 COC(=O)CC(=O)C1=CC=CS1 BB57-3597 [0,2,0,0,0,0|0,1,1]=4 95 B12R1.35 O=C(CCCCCl)C1=CC=CS1 BB54-1792 [0,2,0,0,0,0|0,1,0]=3 96 B12R1.54 CN(C)\C=N\C(=O)C1=CC=CO1 BB57-4245 [0,2,0,0,0,0|1,0,1]=4 97 B12R1.54 O=C(O)CCC(=O)C1=CC=CO1 BB54-4290 [0,2,0,0,0,0|0,0,1]=3 98 B12R1.460 CCCOC(=O)C1=C(N)SC=C1 BB55-6398 [0,2,0,0,0,0|2,0,0]=4 99 B12R1.144 CC(C)CC(=O)C1=NC=CN1C BB54-4658 [0,2,0,0,0,0|2,0,0]=4 100 B12R1.316 CCOC(=O)C1=C(CN)C=CO1 BB54-1168 [0,2,0,0,0,0|1,0,0]=3 101 B10R1.10 CNCC1=CC(O)=CC=C1 BB12-1357 [0,0,1,1,0,0|2,0,0]=4 102 B10R2.16 NC1(C2=CC=CO2)CC1 BB58-3661 [1,0,0,1,0,0|1,0,1]=4 103 B10R2.7 C1=CC2=C(CCCC2)S1 BB58-0529 [1,0,0,1,0,0|0,1,1]=4 104 B12R2.1081 O=C1CCOC2=CC=CC=C12 BB01-2459 [0,0,0,1,0,1|2,0,0]=4 105 B12R2.6 CC1=CC=C(C2CCCN2)O1 BB56-1523 [0,1,0,1,0,0|1,0,1]=4 106 B10R1.15 CCC(=O)C1=NC=CC=C1 BB12-2185 [1,0,0,0,0,1|1,0,0]=3 107 B10R1.15 COC(=O)C1=CC=NC=C1 BB20-4674 [1,0,0,0,0,1|2,0,0]=4 108 B10R1.15 COC(=O)C1=NC=CN=C1 BB01-2777 [1,0,0,0,0,1|2,0,0]=4 109 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [1,0,0,0,0,1|2,0,0]=4 110 B12R1.32 NCCC(=O)NC1=CC=CN=C1 BB53-1856 [0,0,0,0,0,2|2,0,0]=4 111 B12R1.32 NCCC(=O)NC1=CC=NC=C1 BB53-1854 [0,0,0,0,0,2|2,0,0]=4 112 B12R1.32 O=C(CCCl)NC1=NC=CC=C1 BB57-1669 [0,0,0,0,0,2|2,0,0]=4 113 B12R1.51 CCOC(=O)\C=C\C1=CC=CO1 BB54-0050 [0,0,0,0,0,2|1,0,0]=3 114 B12R1.51 O=C(CCCl)NCC1=CC=CS1 BB55-2901 [0,0,0,0,0,2|1,1,0]=4