0 B15R2.2226 NC(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00020926 [0,0,0,0,0,0|1,0,1]=2 1 B15R2.2226 NN(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00032808 [0,0,0,0,0,0|2,0,0]=2 2 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00004333 [0,0,0,0,0,0|0,0,0]=0 3 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=NC=C2 BBS-00028234 [0,0,0,0,0,0|1,0,0]=1 4 B15R2.2226 OC(C1=CC=CC=C1)C2=CC=CC=N2 BBS-00001128 [0,0,0,0,0,0|1,0,2]=3 5 B16R2.187 NNC(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00032540 [0,1,0,0,0,0|1,0,1]=3 6 B16R2.3896 NC1=CC=CC=C1C(=O)C2=CC=CC=C2 BBS-00004375 [0,1,0,0,0,0|0,0,0]=1 7 B16R3.20606 O=C1C2=CC=CN=C2C3=C1C=CC=N3 BBS-00000188 [0,0,0,1,0,0|2,0,0]=3 8 B14R2.114 NC(C1=CC=CC=C1)C2=CC=CS2 BBS-00017955 [0,0,0,0,1,0|2,0,1]=4 9 B14R2.114 NC(C1=CC=CC=C1)C2=CC=CS2 BBS-00029829 [0,0,0,0,1,0|2,0,1]=4 10 B14R2.114 O=C(C1=CC=CC=C1)C2=NC=CN2 BBS-00002807 [0,0,0,0,1,0|2,0,0]=3 11 B16R2.88 CC(NC1=CC=CC=C1)C2=CN=CC=C2 BBS-00038429 [0,0,0,0,0,1|2,0,1]=4 12 B16R2.88 O=C(CC1=CC=CC=C1)C2=CC=CC=C2 BBS-00028516 [0,0,0,0,0,1|0,0,0]=1 13 B16R2.88 O=C(NC1=CC=CC=C1)C2=CC=NC=C2 BBS-00029275 [0,0,0,0,0,1|1,0,0]=2 14 B15R2.29 BrC1=CC=C(OC2=CC=CC=C2)N=C1 BBS-00023831 [1,1,0,0,0,0|2,0,0]=4 15 B15R2.29 IC1=CC=C(NC2=CC=CC=C2)C=C1 BBS-00026410 [1,1,0,0,0,0|1,0,0]=3 16 B15R2.29 NC1=CC=C(CC2=CC=NC=C2)C=C1 BBS-00038327 [1,1,0,0,0,0|1,0,1]=4 17 B15R2.29 NC1=CC=C(OC2=CC=CC=C2)C=C1 BBS-00003565 [1,1,0,0,0,0|1,0,0]=3 18 B15R2.29 NC1=CC=C(OC2=CC=CC=N2)C=C1 BBS-00018772 [1,1,0,0,0,0|2,0,0]=4 19 B15R2.38 NC1=C(OC2=CC=CC=C2)C=CC=C1 BBS-00018785 [1,1,0,0,0,0|1,0,0]=3 20 B15R2.38 NC1=CC=CN=C1SC2=CC=CC=C2 BBS-00032916 [1,1,0,0,0,0|2,0,0]=4 21 B15R2.91 CC1=CC=C(C(=O)C2=CC=CS2)C=C1 BBS-00005963 [0,1,0,0,1,0|1,0,0]=3 22 B15R2.91 NC1=CC=C(C(=O)C2=CC=CS2)C=C1 BBS-00014329 [0,1,0,0,1,0|1,0,0]=3 23 B15R2.353 O=S(=O)(C1=CC=CC=C1)N2C=CC=C2 BBS-00027492 [0,1,0,0,1,0|2,0,0]=4 24 B15R2.395 CN1C=CN=C1C(=O)C2=CC=CC=C2 BBS-00002809 [0,1,0,0,1,0|2,0,0]=4 25 B15R2.1108 NC1=CC(C(=O)C2=CC=CS2)=CC=C1 BBS-00011991 [0,1,0,0,1,0|1,0,0]=3 26 B17R2.192 O=C(NC1=CC=CC=C1)C2=CC=C(O)C=C2 BBS-00009389 [0,1,0,0,0,1|0,0,0]=2 27 B17R2.192 O=C(NC1=CC=CN=C1)C2=CC=C(O)C=C2 BBS-00021020 [0,1,0,0,0,1|1,0,0]=3 28 B17R2.192 O=C1C=CC(C(=O)NC2=CC=CC=C2)=NN1 BBS-00019966 [0,1,0,0,0,1|2,0,0]=4 29 B17R2.209 CC1=CC=C(NC(=O)C2=CC=CC=C2)C=C1 BBS-00028596 [0,1,0,0,0,1|0,0,0]=2 30 B17R2.209 CC1=CC=C(NC(=O)C2=CC=CN=C2)C=C1 BBS-00038806 [0,1,0,0,0,1|1,0,0]=3 31 B17R2.209 O=C(NC1=CC=C(O)C=C1)C2=CC=CC=C2 BBS-00000750 [0,1,0,0,0,1|0,0,0]=2 32 B17R2.3417 NC1=NC=CN=C1C(=O)NC2=CC=CC=C2 BBS-00021057 [0,1,0,0,0,1|2,0,0]=4 33 B17R2.3426 O=C(NC1=C(Cl)C=CC=C1)C2=CC=CC=C2 BBS-00029945 [0,1,0,0,0,1|0,0,0]=2 34 B17R2.5293 O=C(NC1=CC=CC(O)=C1)C2=CN=CC=C2 BBS-00008027 [0,1,0,0,0,1|1,0,0]=3 35 B17R2.10205 NC(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 BBS-00027631 [0,1,0,0,0,1|0,0,0]=2 36 B17R2.10205 O=C(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 BBS-00029286 [0,1,0,0,0,1|0,0,0]=2 37 B17R2.10205 O=C(C1=CC=CC=C1)C(Br)C2=CC=CC=C2 BBS-00000845 [0,1,0,0,0,1|0,0,0]=2 38 B17R2.10205 O=C(C1=CC=CC=C1)C(Cl)C2=CC=CC=C2 BBS-00004804 [0,1,0,0,0,1|0,0,0]=2 39 B17R2.68 O=C(C1=CC=CC=C1)C2=CC=C(CBr)C=C2 BBS-00014400 [0,2,0,0,0,0|0,0,0]=2 40 B17R2.68 O=C(C1=CC=CC=C1)C2=CC=C(CCl)C=C2 BBS-00035750 [0,2,0,0,0,0|0,0,0]=2 41 B17R2.191 NC1=CC(C(=O)C2=CC=C(F)C=C2)=CC=C1 BBS-00011992 [0,2,0,0,0,0|0,0,0]=2 42 B17R2.203 CC(C)(C1=CC=CC=C1)C2=CC=C(O)C=C2 BBS-00008036 [0,2,0,0,0,0|1,0,1]=4 43 B17R2.217 CC1=CC=C(C(=N)C2=CC=C(C)C=C2)C=C1 BBS-00032181 [0,2,0,0,0,0|1,0,0]=3 44 B17R2.217 N=C(C1=CC=C(F)C=C1)C2=CC=C(F)C=C2 BBS-00014336 [0,2,0,0,0,0|1,0,0]=3 45 B17R2.217 NC1=CC=C(C(=O)C2=CC=C(F)C=C2)C=C1 BBS-00014331 [0,2,0,0,0,0|0,0,0]=2 46 B17R2.219 CC1=CC(C(=O)C2=CC=CC=C2)=CC=C1O BBS-00008118 [0,2,0,0,0,0|0,0,0]=2 47 B17R2.219 NC1=CC=C(C(=O)C2=CC=CC=C2)C=C1N BBS-00039570 [0,2,0,0,0,0|0,0,0]=2 48 B17R2.381 CC1=CC=C(C(=O)C2=CC=CC=C2N)C=C1 BBS-00021876 [0,2,0,0,0,0|0,0,0]=2 49 B17R2.381 NC1=CC=CC=C1C(=O)C2=CC=C(Cl)C=C2 BBS-00033165 [0,2,0,0,0,0|0,0,0]=2 50 B17R2.381 NC1=CC=CC=C1C(O)C2=CC=C(Cl)C=C2 BBS-00024628 [0,2,0,0,0,0|0,0,2]=4 51 B17R2.5362 CC1=CC=C(C(=O)C2=CC=CC=C2)C(N)=C1 BBS-00024620 [0,2,0,0,0,0|0,0,0]=2 52 B17R2.5362 CC1=CC=C(C(=O)C2=CC=CC=C2)C(N)=C1 BBS-00027138 [0,2,0,0,0,0|0,0,0]=2 53 B17R2.5362 NC1=CC(Cl)=CC=C1C(=O)C2=CC=CC=C2 BBS-00027136 [0,2,0,0,0,0|0,0,0]=2 54 B17R2.5362 NC1=CC(Cl)=CC=C1C(=O)C2=CC=CC=C2 BBS-00027137 [0,2,0,0,0,0|0,0,0]=2 55 B17R2.5362 NC1=CC(Cl)=CC=C1C(O)C2=CC=CC=C2 BBS-00027094 [0,2,0,0,0,0|0,0,2]=4 56 B17R2.159 N#CCN(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00000379 [0,2,0,0,0,0|2,0,0]=4 57 B17R2.2712 NC(CO)(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00024947 [0,2,0,0,0,0|0,0,2]=4 58 B17R2.2712 NNP(=S)(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00032621 [0,2,0,0,0,0|1,1,0]=4 59 B17R2.2712 O=P(CO)(C1=CC=CC=C1)C2=CC=CC=C2 BBS-00024644 [0,2,0,0,0,0|1,0,0]=3 60 B17R2.5356 CC1=CC(C(=O)C2=CC=CC=C2)=C(N)C=C1 BBS-00021832 [0,2,0,0,0,0|0,0,0]=2 61 B17R2.5356 NC1=C(C(O)C2=CC=CC=C2)C=C(F)C=C1 BBS-00032419 [0,2,0,0,0,0|0,0,2]=4 62 B17R2.5356 NC1=CC=C(Br)C=C1C(=O)C2=CC=CC=C2 BBS-00021865 [0,2,0,0,0,0|0,0,0]=2 63 B17R2.5356 NC1=CC=C(Br)C=C1C(O)C2=CC=CC=C2 BBS-00013419 [0,2,0,0,0,0|0,0,2]=4 64 B17R2.5356 NC1=CC=C(Cl)C=C1C(=O)C2=CC=CC=C2 BBS-00032216 [0,2,0,0,0,0|0,0,0]=2 65 B17R2.5356 NC1=CC=C(N)C(C(=O)C2=CC=CC=C2)=C1 BBS-00026409 [0,2,0,0,0,0|0,0,0]=2 66 B15R2.17 O=CC1=CC=CC(C2=CC=CC=C2)=C1 BBS-00001382 [0,0,1,1,0,0|2,0,0]=4 67 B15R3.3 C1=CC2=C(C=C1)C3=C(C=CC=C3)N2 BBS-00004359 [1,0,0,1,0,0|1,0,0]=3 68 B15R3.3 C1=CC=C2C(=C1)NC3=C2C=CC=N3 BBS-00028642 [1,0,0,1,0,0|2,0,0]=4 69 B17R3.8708 C1=CC=C(C2=CN3C=CC=CC3=C2)C=C1 BBS-00028554 [0,0,0,1,0,1|2,0,0]=4 70 B17R3.8708 C1=CC=C(C2=CN3C=CC=CC3=N2)C=C1 BBS-00023709 [0,0,0,1,0,1|2,0,0]=4 71 B17R3.8708 C1=CC=C2NC(C3=CC=NC=C3)=NC2=C1 BBS-00011062 [0,0,0,1,0,1|2,0,0]=4 72 B17R3.8708 C1=CC=C2NC(C3=CN=CC=C3)=NC2=C1 BBS-00011061 [0,0,0,1,0,1|2,0,0]=4 73 B17R3.8708 C1=CC=C2NC(C3=NC=CC=C3)=NC2=C1 BBS-00011060 [0,0,0,1,0,1|2,0,0]=4 74 B17R3.54615 O=C1NC2=CC=CC=C2C3=CC=CC=C13 BBS-00026225 [0,0,0,1,0,1|0,0,0]=2 75 B17R3.54615 SC1=NC2=CC=CC=C2C3=CC=CC=C31 BBS-00023591 [0,0,0,1,0,1|0,1,0]=3 76 B17R3.8 C1=CC=C(C2=NN=C3C=CC=CN32)C=C1 BBS-00022899 [0,1,0,1,0,0|2,0,0]=4 77 B17R3.182920 O=NN1C2=CC=CC=C2C3=C1C=CC=C3 BBS-00037069 [0,1,0,1,0,0|1,0,0]=3 78 B17R3.35227 BrC1=C2C=CC=CC2=CC3=CC=CC=C31 BBS-00025612 [0,1,0,1,0,0|1,0,0]=3 79 B17R3.35227 CC1=C2C=CC=CC2=NC3=CC=CC=C31 BBS-00025578 [0,1,0,1,0,0|1,0,0]=3 80 B17R3.35227 C[N+]1=C2C=CC=CC2=NC3=CC=CC=C31 BBS-00021317 [0,1,0,1,0,0|2,0,0]=4 81 B17R3.35227 O=S1C2=CC=CC=C2NC3=C1C=CC=C3 BBS-00015235 [0,1,0,1,0,0|1,0,0]=3 82 B17R3.35227 [O-][N+]1=C2C=CC=CC2=NC3=CC=CC=C31 BBS-00021320 [0,1,0,1,0,0|1,0,1]=4 83 B13R2.3 C1=CC=C(C2=NC=CC=C2)N=C1 BBS-00039039 [1,0,0,0,1,0|2,0,0]=4 84 B15R2.2195 C1=CC=C(CNC2=CC=CC=C2)C=C1 BBS-00028664 [1,0,0,0,0,1|0,0,1]=3 85 B15R2.2195 C1=CC=C(CNC2=NC=CC=C2)C=C1 BBS-00001749 [1,0,0,0,0,1|1,0,1]=4 86 B15R2.2195 C1=CC=C(COC2=CC=NC=C2)C=C1 BBS-00030195 [1,0,0,0,0,1|1,0,1]=4 87 B15R2.2195 C1=CC=C(\C=C\C2=CC=NC=C2)C=C1 BBS-00028057 [1,0,0,0,0,1|1,0,0]=3 88 B15R2.2195 C1=CN=C(\C=C/C2=NC=CC=C2)C=C1 BBS-00026603 [1,0,0,0,0,1|2,0,0]=4 89 B17R2.143 NC(CC1=CC=CC=C1)CC2=CC=CC=C2 BBS-00008389 [0,0,0,0,0,2|1,0,1]=4 90 B17R2.143 NC(CC1=CC=CC=C1)CC2=CC=CC=C2 BBS-00032160 [0,0,0,0,0,2|1,0,1]=4 91 B17R2.143 N\C(=N\C1=CC=CC=C1)NC2=CC=CC=C2 BBS-00027970 [0,0,0,0,0,2|1,0,0]=3 92 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CN=C2 BBS-00022513 [0,0,0,0,0,2|1,0,0]=3 93 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=NC=C2 BBS-00022511 [0,0,0,0,0,2|1,0,0]=3 94 B17R2.2342 O=C(NNC1=CC=CC=C1)C2=CC=NC=C2 BBS-00022896 [0,0,0,0,0,2|1,0,0]=3 95 B17R2.2342 O=C(\C=C\C1=CC=NC=C1)C2=CC=CC=C2 BBS-00025440 [0,0,0,0,0,2|1,0,0]=3