0 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=NC=CC=C2 180896 [0,0,0,0,0,0|2,0,0]=2 1 B17R2.2342 O=C(NCC1=CC=NC=C1)C2=CC=NC=C2 180911 [0,0,0,0,0,0|3,0,0]=3 2 B17R2.2342 O=C(\C=C\C1=CC=CC=C1)C2=CC=NC=C2 180836 [0,0,0,0,0,0|2,0,1]=3 3 B17R2.2342 O=S(OCC1=CC=CC=C1)C2=CC=CC=C2 181254 [0,0,0,0,0,0|1,0,0]=1 4 B17R2.2342 OC(CCC1=CC=CC=C1)C2=CC=NC=C2 032604 [0,0,0,0,0,0|2,0,2]=4 5 B17R2.2342 OC(CCC1=CC=NC=C1)C2=CC=CC=C2 180916 [0,0,0,0,0,0|2,0,2]=4 6 B18R2.253 CC(NCC1=CC=CC=C1)C2=CC=C(F)C=C2 015177 [0,1,0,0,0,0|2,0,1]=4 7 B18R2.253 CC1=CC=C(C(=O)\C=C\C2=CC=CC=C2)C=C1 068176 [0,1,0,0,0,0|1,0,1]=3 8 B18R2.257 CC1=CC=C(\C=C\C(=O)C2=CC=CC=C2)C=C1 015698 [0,1,0,0,0,0|1,0,1]=3 9 B18R2.3634 CN(NC(=O)C1=CC=CC=C1)C2=CC=CC=C2 187088 [0,1,0,0,0,0|2,0,0]=3 10 B18R2.4001 CC1=CC=CC=C1C(=O)NCC2=CC=CC=C2 181131 [0,1,0,0,0,0|1,0,0]=2 11 B18R2.7204 CN(C(=O)CC1=CC=CC=C1)C2=CC=CC=C2 181133 [0,1,0,0,0,0|3,0,0]=4 12 B16R2.88 C\C(=N\[N+]1=CC=CC=C1)C2=CC=CC=C2 186318 [0,0,0,0,1,0|3,0,0]=4 13 B16R2.88 O=C(C[N+]1=CC=CC=C1)C2=CC=CC=C2 182473 [0,0,0,0,1,0|1,0,0]=2 14 B16R2.88 O=C(NC1=CC=CC=N1)C2=CC=NC=C2 032584 [0,0,0,0,1,0|3,0,0]=4 15 B16R2.88 O=C(N[N+]1=CC=CC=C1)C2=CC=CC=C2 182881 [0,0,0,0,1,0|2,0,0]=3 16 B16R2.88 O=C(OC1=CC=CN=C1)C2=CC=CC=C2 180699 [0,0,0,0,1,0|1,0,0]=2 17 B18R2.7189 O=C(NCSC1=CC=CC=C1)C2=CC=CC=C2 188283 [0,0,0,0,0,1|1,0,0]=2 18 B17R2.216 FC1=CC=C(CNCC2=CC=CC=C2)C=C1 015109 [1,1,0,0,0,0|1,0,1]=4 19 B17R2.162 N=NN(CC1=CC=CC=C1)C2=CC=CC=C2 180877 [0,1,0,0,1,0|2,0,0]=4 20 B17R2.192 O=S(NC1=CC=CC=C1)C2=CC=C(Cl)C=C2 181625 [0,1,0,0,1,0|2,0,0]=4 21 B17R2.209 CC1=CC=[N+](CC(=O)C2=CC=CC=C2)C=C1 182359 [0,1,0,0,1,0|1,0,0]=3 22 B17R2.3417 NC1=C(C(=O)NC2=CC=CC=C2)C=CC=C1 018169 [0,1,0,0,1,0|1,0,0]=3 23 B17R2.5293 CC1=CC(NC(=O)C2=CC=CC=C2)=CC=C1 180876 [0,1,0,0,1,0|1,0,0]=3 24 B17R2.5293 CC1=CC(NC(=O)C2=CC=CC=C2)=NC=C1 180895 [0,1,0,0,1,0|2,0,0]=4 25 B17R2.5293 NC1=CC=C[N+](CC(=O)C2=CC=CC=C2)=C1 182380 [0,1,0,0,1,0|1,0,0]=3 26 B17R2.5293 O=C(C[N+]1=CC(O)=CC=C1)C2=CC=CC=C2 182395 [0,1,0,0,1,0|1,0,0]=3 27 B17R2.20249 O=S(=O)(C[N+]1=CC=CC=C1)C2=CC=CC=C2 181288 [0,1,0,0,1,0|2,0,0]=4 28 B19R2.11857 O=C(NC1=CC=C(Cl)C=C1)OCC2=CC=NC=C2 181833 [0,1,0,0,0,1|1,0,0]=3 29 B19R2.16158 CN(C(=O)CCC1=CC=CC=C1)C2=CC=CC=C2 181394 [0,1,0,0,0,1|1,0,0]=3 30 B19R2.8898 O=C(CSC(=O)C1=CC=CC=C1)C2=CC=CC=C2 181721 [0,1,0,0,0,1|0,1,0]=3 31 B19R2.11833 NC1=C(N)C=C(C(=O)NCC2=CC=CC=C2)C=C1 189044 [0,2,0,0,0,0|1,0,0]=3 32 B19R2.11870 O=C(\C=C/C1=CC=C(Cl)C=C1)C2=CC=C(Br)C=C2 015356 [0,2,0,0,0,0|1,0,1]=4 33 B19R3.9171 O=C1NC(C2=CC=NC=C2)NC3=C1C=CC=C3 055413 [0,1,0,1,0,0|2,0,0]=4 34 B19R3.182 O=C1C2=C(C=CC=C2)C\C1=C/C3=CC=CC=C3 187046 [0,1,0,1,0,0|1,0,1]=4 35 B15R2.2195 C1=CC=C(CCC2=CC=NC=C2)C=C1 180496 [1,0,0,0,1,0|1,0,1]=4 36 B15R2.2195 C1=CC=C(CC[N+]2=CC=CC=C2)C=C1 188364 [1,0,0,0,1,0|1,0,1]=4 37 B15R2.2195 C1=CC=C(SC[N+]2=CC=CC=C2)C=C1 182542 [1,0,0,0,1,0|1,1,0]=4 38 B15R2.1259 O=C(CN1C=CC=N1)C2=CC=CC=C2 180518 [0,0,0,0,2,0|2,0,0]=4 39 B15R2.2226 O=[IH2+](C1=CC=CC=C1)C2=CC=CC=C2 186560 [0,0,0,0,2,0|1,0,0]=3 40 B19R2.16162 O=C(NNC1=CC=CC=C1)OCC2=CC=CC=C2 181439 [0,0,0,0,0,2|0,0,0]=2 41 B19R2.8899 O=C(OCCCC1=CC=NC=C1)C2=CC=CC=C2 181423 [0,0,0,0,0,2|1,0,0]=3