0 B17R2.143 O=C(CC1=CC=CC=C1)NC2=CC=CC=C2 C10418 [0,0,0,0,0,0|1,0,0]=1 1 B17R2.143 O=C(NC1=CN=CC=C1)OC2=CC=CC=C2 W12138 [0,0,0,0,0,0|3,0,0]=3 2 B16R2.2256 C1=CC=C(CNCC2=CC=NC=C2)C=C1 71440 [1,0,0,0,0,0|2,0,0]=3 3 B16R2.2256 C1=CC=C(CNCC2=NC=CC=C2)C=C1 71439 [1,0,0,0,0,0|2,0,0]=3 4 B18R2.199 O=NN(CC1=CC=CC=C1)CC2=CC=CC=C2 D93482 [0,1,0,0,0,0|1,0,0]=2 5 B18R2.266 O=C(NC1=CC=C(Br)C=C1)OC2=CC=CC=C2 W12844 [0,1,0,0,0,0|2,0,0]=3 6 B18R2.6478 S=C(NC1=CC=CC=C1)NC2=CC=CC(Cl)=C2 W18448 [0,1,0,0,0,0|2,1,0]=4 7 B18R2.7204 CC(OC1=CC=CC=C1)C(O)C2=CC=CC=C2 C74512 [0,1,0,0,0,0|2,0,1]=4 8 B18R2.32233 C[N+](C)(CC1=CC=CC=C1)CC2=CC=CC=C2 D92817 [0,1,0,0,0,0|2,0,0]=3 9 B18R2.32233 O=P(O)(OC1=CC=CC=C1)OC2=CC=CC=C2 AC9048 [0,1,0,0,0,0|3,0,0]=4 10 B18R3.182 O=C1NC2=C(C=CC=C2)N1C3=CC=CC=C3 36555 [0,0,0,1,0,0|2,0,0]=3 11 B18R3.182 O=C1NC2=C(C=CC=C2)[C@@H]1C3=CC=CC=C3 Y13508 [0,0,0,1,0,0|1,0,0]=2 12 B16R2.88 CN(CC1=CC=CC=C1)C2=CC=CC=C2 C75880 [0,0,0,0,1,0|2,0,0]=3 13 B16R2.88 O=C(CC1=CC=CC=C1)C2=NC=CC=C2 28067 [0,0,0,0,1,0|1,0,0]=2 14 B16R2.88 O=C(NC1=NC=CC=C1)C2=CC=CC=C2 D86229 [0,0,0,0,1,0|2,0,0]=3 15 B16R2.88 [O-]\[N+](=C/C1=CC=CC=C1)C2=CC=CC=C2 A11906 [0,0,0,0,1,0|1,0,2]=4 16 B17R2.216 FC1=CC=C(CNCC2=CC=CC=C2)C=C1 W18469 [1,1,0,0,0,0|1,0,0]=3 17 B17R2.2342 CC(C=CC1=CC=CC=C1)C2=CC=CC=C2 D93566 [1,1,0,0,0,0|0,0,1]=3 18 B17R2.192 CC1=CC=C(C(=O)CC2=CC=NC=C2)C=C1 25890 [0,1,0,0,1,0|1,0,0]=3 19 B17R2.192 O=C(CC1=CC=NC=C1)C2=CC=C(Br)C=C2 C71028 [0,1,0,0,1,0|1,0,0]=3 20 B17R2.192 O=C(NC1=NC=CC=C1)C2=CC=C(Br)C=C2 W13177 [0,1,0,0,1,0|2,0,0]=4 21 B17R2.192 O=C(OC1=CC=CC=C1)C2=CC=C(O)C=C2 D90820 [0,1,0,0,1,0|1,0,0]=3 22 B17R2.209 O=C(CC1=CC=C(Cl)C=C1)C2=CC=CC=C2 W18442 [0,1,0,0,1,0|0,0,0]=2 23 B17R2.209 O=C(NC1=CC=C(Cl)C=C1)C2=NC=CC=C2 F17384 [0,1,0,0,1,0|2,0,0]=4 24 B17R2.3417 O=C(CC1=CC=CC=C1)C2=C(O)C=CC=C2 T70645 [0,1,0,0,1,0|0,0,0]=2 25 B17R2.3417 O=C(CC1=CC=NC=C1)C2=C(Cl)C=CC=C2 C74059 [0,1,0,0,1,0|1,0,0]=3 26 B17R2.3426 O=C(NC1=CC=CN=C1Cl)C2=CC=CC=C2 A51231 [0,1,0,0,1,0|2,0,0]=4 27 B17R2.5273 O=C(NC1=CC=CC=C1)C2=NC=CC(Cl)=C2 AR3401 [0,1,0,0,1,0|2,0,0]=4 28 B17R2.5293 O=C(CC1=CC(Br)=NC=C1)C2=NC=CC=C2 Y11286 [0,1,0,0,1,0|2,0,0]=4 29 B17R2.5293 O=C(CC1=CC=CC(Br)=C1)C2=CC=CC=C2 W18445 [0,1,0,0,1,0|0,0,0]=2 30 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 20150 [0,1,0,0,1,0|0,0,2]=4 31 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 20152 [0,1,0,0,1,0|0,0,2]=4 32 B19R2.4385 NC1=CC=CC(NC(=O)OCC2=CC=CC=C2)=C1 71581 [0,1,0,0,0,1|1,0,0]=3 33 B19R2.4385 O=C(\C=C\C1=CC=CC=C1)NC2=CC(O)=CC=C2 C74212 [0,1,0,0,0,1|1,0,1]=4 34 B19R2.4485 O=C(NC1=C(O)N=CC=C1)OCC2=CC=CC=C2 78155 [0,1,0,0,0,1|2,0,0]=4 35 B19R2.4485 O=C(\C=C\C1=CC=CC=C1)NC2=C(F)C=CC=C2 C74343 [0,1,0,0,0,1|1,0,1]=4 36 B19R2.8924 O=C(OC1=CC=CC=C1)C(=O)OC2=CC=CC=C2 D91801 [0,1,0,0,0,1|1,0,1]=4 37 B19R2.8929 CN(CC1=CC=CC=C1)C[C@H](O)C2=CC=CC=C2 C74496 [0,1,0,0,0,1|2,0,0]=4 38 B19R2.388 ClCCN(CC1=CC=CC=C1)CC2=CC=CC=C2 D78410 [0,2,0,0,0,0|2,0,0]=4 39 B19R2.388 NCCN(CC1=CC=CC=C1)CC2=CC=CC=C2 C14733 [0,2,0,0,0,0|2,0,0]=4 40 B19R2.4600 NC(=S)N(CC1=CC=CC=C1)CC2=CC=CC=C2 37204 [0,2,0,0,0,0|1,1,0]=4 41 B19R2.291 NC1=CC=C(NC(=O)NC2=CC=C(N)C=C2)C=C1 77846 [0,2,0,0,0,0|2,0,0]=4 42 B19R2.291 O=C(NC1=CC=C(Cl)C=C1)NC2=CC=C(Cl)C=C2 T70154 [0,2,0,0,0,0|2,0,0]=4 43 B19R2.50170 O=C(NC1=C(Br)C=CC=C1)NC2=C(Br)C=CC=C2 20596 [0,2,0,0,0,0|2,0,0]=4 44 B19R2.21040 O=C(C(=O)C1=CC=CC=C1)C(=O)C2=CC=CC=C2 T71171 [0,2,0,0,0,0|0,0,2]=4 45 B17R3.8 C1=CC=C(C2=CNC3=C2C=CC=C3)C=C1 Y13578 [1,0,0,1,0,0|1,0,1]=4 46 B17R3.8 C1=CC=C(N2C=CC3=C2C=CC=C3)C=C1 35182 [1,0,0,1,0,0|1,0,1]=4 47 B17R3.8 C1=CC=C(N2C=NC3=C2C=CC=C3)C=C1 65288 [1,0,0,1,0,0|2,0,0]=4 48 B17R3.8708 C1=CC=C(C2=NC3=C(C=CC=C3)O2)C=C1 65348 [0,0,0,1,1,0|1,0,1]=4 49 B17R3.54615 BrC1=NC2=CC=CC=C2C3=CC=CC=C31 C73355 [0,0,0,1,1,0|2,0,0]=4 50 B17R3.54615 NC1=CC2=CC=CC=C2C3=CC=CC=C13 H10540 [0,0,0,1,1,0|1,0,1]=4 51 B17R3.54615 O=C1OC2=C(C=CC=C2)C3=C1C=CC=C3 A10856 [0,0,0,1,1,0|1,0,0]=3 52 B19R3.288 ClC1=NC2=C(C=CC=C2)N1CC3=CC=CC=C3 W18755 [0,0,0,1,0,1|2,0,0]=4 53 B19R3.288 O=C1CC2=C(N=CC=C2)N1CC3=CC=CC=C3 F18462 [0,0,0,1,0,1|1,0,0]=3 54 B19R3.294 O=C1CC2=C(C=CC=C2)[C@H](C3=CC=CC=C3)N1 I10861 [0,0,0,1,0,1|0,0,0]=2 55 B19R3.294 O=C1N[C@@H](C2=CC=CC=C2)C3=C(C=CC=C3)O1 C71428 [0,0,0,1,0,1|1,0,0]=3 56 B19R3.19255 C1=CC=C(CSC2=NC3=C(C=CC=C3)O2)C=C1 D85413 [0,0,0,1,0,1|1,0,1]=4 57 B19R3.88146 BrC1=CC2=C(C=C1)CN(CC3=CC=CC=C3)C2 20862 [0,1,0,1,0,0|2,0,0]=4 58 B19R3.88146 FC1=CC2=C(C=C1)CN(CC3=CC=CC=C3)C2 21088 [0,1,0,1,0,0|2,0,0]=4 59 B19R3.88146 NC1=CC2=C(C=C1)CN(CC3=CC=CC=C3)C2 SC1821 [0,1,0,1,0,0|2,0,0]=4 60 B19R3.289 CN1C(=O)CC2=C(C=CC=C2)C3=C1C=CC=C3 F31308 [0,1,0,1,0,0|1,0,0]=3 61 B19R3.8766 O=C1NC2=C(C=CC=C2)[C@@]1(O)C3=CC=CC=C3 Y13471 [0,1,0,1,0,0|1,0,0]=3 62 B15R2.2195 C1=CC=C(CNC2=CC=CC=C2)C=C1 E70421 [1,0,0,0,1,0|1,0,0]=3 63 B15R2.2195 C1=CC=C(COC2=CN=CC=C2)C=C1 W19145 [1,0,0,0,1,0|2,0,0]=4 64 B15R2.2195 C1=CC=C(SSC2=CC=CC=C2)C=C1 D72521 [1,0,0,0,1,0|2,0,0]=4 65 B15R2.2195 C1=CC=C([Te][Te]C2=CC=CC=C2)C=C1 T70770 [1,0,0,0,1,0|2,0,0]=4 66 B15R2.2195 C1=CC=C(\C=C\C2=CC=NC=C2)C=C1 F17039 [1,0,0,0,1,0|1,0,1]=4 67 B15R2.2226 CP(C1=CC=CC=C1)C2=CC=CC=C2 D94667 [0,0,0,0,2,0|2,0,0]=4 68 B15R2.2226 O=C(C1=CN=CC=C1)C2=CN=CC=C2 C74841 [0,0,0,0,2,0|2,0,0]=4 69 B17R2.2382 C1=CC=C(CSSCC2=CC=CC=C2)C=C1 D77707 [1,0,0,0,0,1|1,0,0]=3 70 B19R2.16162 CN(CCC1=CC=CC=C1)CCC2=CC=CC=C2 C72583 [0,0,0,0,0,2|2,0,0]=4 71 B19R2.16162 O=C(NCC1=CC=CC=C1)NCC2=CC=CC=C2 W13186 [0,0,0,0,0,2|0,0,0]=2