0 B17R2.2342 C[C@@H](NCC1=CC=CC=C1)C2=CC=CC=C2 3631-1-R0 [0,0,0,0,0,0|2,0,1]=3 1 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2 4648-1-Y6 [0,0,0,0,0,0|1,0,0]=1 2 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CC=CN=C2 4H58-1-174 [0,0,0,0,0,0|1,0,0]=1 3 B17R2.2342 O=C(OCC1=CC=CC=C1)N2CC=CCC2 4H56-1-8N [0,0,0,0,0,0|1,0,3]=4 4 B17R2.2342 O=C(\C=C\C1=CC=CC=C1)C2=CC=CC=C2 2917-1-0K [0,0,0,0,0,0|1,0,1]=2 5 B16R2.2256 C1=CC=C(CCCC2=CC=NC=C2)C=C1 3H32-1-MU [1,0,0,0,0,0|2,0,1]=4 6 B16R2.2256 C1=CC=C(CNCC2=CC=CC=C2)C=C1 3731-1-05 [1,0,0,0,0,0|1,0,1]=3 7 B16R2.2256 C1=CC=C(SCSC2=CC=CC=C2)C=C1 6166-1-X1 [1,0,0,0,0,0|3,0,0]=4 8 B16R2.2256 C1=CC=C(\N=N\NC2=CC=CC=C2)C=C1 3639-1-04 [1,0,0,0,0,0|3,0,0]=4 9 B18R2.253 O=C(NCC1=CC=CC=C1)C2=CC=C(Br)C=C2 4748-9-X1 [0,1,0,0,0,0|1,0,0]=2 10 B18R2.253 O=C(OCC1=CC=CC=C1)C2=CC=C(O)C=C2 2729-1-06 [0,1,0,0,0,0|0,0,0]=1 11 B18R2.253 O=C(\C=C\C1=CC=CC=C1)C2=CC=C(Br)C=C2 2917-9-X1 [0,1,0,0,0,0|1,0,1]=3 12 B18R2.253 O=C(\C=C\C1=CC=CC=C1)C2=CC=C(Cl)C=C2 2917-5-X2 [0,1,0,0,0,0|1,0,1]=3 13 B18R2.253 O=C(\C=C\C1=CC=CC=C1)C2=CC=C(F)C=C2 2917-3-04 [0,1,0,0,0,0|1,0,1]=3 14 B18R2.257 O=C(CNC1=CC=C(Br)C=C1)C2=CC=CC=C2 4656-9-12 [0,1,0,0,0,0|2,0,0]=3 15 B18R2.257 O=C(CNC1=CC=C(Cl)C=C1)C2=CC=CC=C2 4656-5-42 [0,1,0,0,0,0|2,0,0]=3 16 B18R2.257 O=C(\C=C\C1=CC=C(Cl)C=C1)C2=CC=CC=C2 2917-5-01 [0,1,0,0,0,0|1,0,1]=3 17 B18R2.257 O=C(\C=C\C1=CC=C(F)C=C1)C2=CC=CC=C2 2917-3-01 [0,1,0,0,0,0|1,0,1]=3 18 B18R2.257 O=C(\C=C\C1=CC=C(O)C=C1)C2=CC=CC=C2 2920-1-X6 [0,1,0,0,0,0|1,0,1]=3 19 B18R2.3634 O=C(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 2618-1-X4 [0,1,0,0,0,0|1,0,1]=3 20 B18R2.3990 O=C(\C=C\C1=CC=CC=C1O)C2=CC=CC=C2 2920-1-05 [0,1,0,0,0,0|1,0,1]=3 21 B18R2.4001 NC1=CC=CC=C1C(=O)OCC2=CC=CC=C2 4758-1-06 [0,1,0,0,0,0|0,0,0]=1 22 B18R2.4001 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2Br 4748-9-06 [0,1,0,0,0,0|1,0,0]=2 23 B18R2.6463 O=C(NCC1=CC=CC=C1)C2=CC(Br)=CC=C2 4648-9-34 [0,1,0,0,0,0|1,0,0]=2 24 B18R2.6467 CC1=CC=C[N+](\C=C\C(=O)C2=CC=CC=C2)=C1 4H32-5-X7 [0,1,0,0,0,0|2,0,1]=4 25 B18R2.32237 O=S(=O)(\C=C\C1=CC=CC=C1)C2=CC=CC=C2 6963-1-X1 [0,1,0,0,0,0|2,0,1]=4 26 B16R2.88 O=C(CC1=CC=NC=N1)C2=CC=CC=C2 4H17-1-Y5 [0,0,0,0,1,0|2,0,0]=3 27 B16R2.88 O=C(NC1=CC=CC=C1)C2=CC=CC=C2 4648-1-22 [0,0,0,0,1,0|1,0,0]=2 28 B16R2.88 O=C(NC1=CC=CC=C1)C2=CN=CC=C2 4H48-1-01U [0,0,0,0,1,0|2,0,0]=3 29 B16R2.88 O=C(NC1=CC=NC=C1)C2=CC=CC=C2 4H48-1-F1 [0,0,0,0,1,0|2,0,0]=3 30 B16R2.88 [O-]\[N+](=N/C1=CC=CC=C1)C2=CC=CC=C2 4H52-1-01 [0,0,0,0,1,0|2,0,1]=4 31 B16R2.2238 O=C(OCC1=CC=CC=C1)N2CC=CC2 4H56-1-6Z [0,0,0,0,1,0|1,0,2]=4 32 B16R2.2238 O=C(\C=C\C1=CC=CC=C1)C2=CC=CS2 6H17-1-X2 [0,0,0,0,1,0|2,0,1]=4 33 B18R2.2429 S=C(NCC1=CC=CC=C1)NC2=CC=CC=C2 7767-1-05 [0,0,0,0,0,1|1,1,0]=3 34 B17R2.143 O=C(CC1=CC=CC=C1)CC2=CC=CC=C2 2617-1-51 [1,1,0,0,0,0|1,0,1]=4 35 B17R2.143 O=S(CC1=CC=CC=C1)CC2=CC=CC=C2 6765-1-01 [1,1,0,0,0,0|0,1,1]=4 36 B17R2.192 O=C(CC1=CC=CC=C1)C2=CC=C(Cl)C=C2 2717-5-06 [0,1,0,0,1,0|0,0,0]=2 37 B17R2.192 O=C(NC1=CC=CC=C1)C2=CC=C(Br)C=C2 4648-9-19 [0,1,0,0,1,0|1,0,0]=3 38 B17R2.3417 NC1=CC=CC=C1C(=O)NC2=CC=CC=C2 4648-1-30 [0,1,0,0,1,0|1,0,0]=3 39 B17R2.3417 NC1=CC=CC=C1C(=O)NC2=CC=CN=C2 4H48-1-LP [0,1,0,0,1,0|2,0,0]=4 40 B17R2.3417 NC1=CC=CC=C1C(=O)OC2=CC=CC=C2 4658-1-11 [0,1,0,0,1,0|0,0,0]=2 41 B17R2.3417 O=C(OC1=CC=CC=C1)C2=CC=CC=C2O 2629-1-Y1 [0,1,0,0,1,0|0,0,0]=2 42 B17R2.5273 O=C(NC1=CC=CC=C1)C2=CC(O)=CC=C2 4648-1-12 [0,1,0,0,1,0|1,0,0]=3 43 B17R2.5293 NC1=CC=CC(NC(=O)C2=CC=CC=C2)=C1 4648-1-08 [0,1,0,0,1,0|1,0,0]=3 44 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@@H](N)C2=CC=CC=C2 3630-1-X0 [0,1,0,0,1,0|1,0,1]=4 45 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 4656-1-H0 [0,1,0,0,1,0|0,0,2]=4 46 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@H](N)C2=CC=CC=C2 3730-1-W3 [0,1,0,0,1,0|1,0,1]=4 47 B17R2.10205 O=C(C1=CC=CC=C1)N(O)C2=CC=CC=C2 4648-1-75 [0,1,0,0,1,0|1,0,0]=3 48 B17R2.3283 O=C(NCC1=CC=CO1)C2=CC=C(Br)C=C2 4H48-9-65 [0,1,0,0,1,0|2,0,0]=4 49 B19R2.11870 CC1=CC=C(C(=O)\C=C\C2=CC=C(Cl)C=C2)C=C1 2917-5-X0 [0,2,0,0,0,0|1,0,1]=4 50 B19R2.11870 O=C(\C=C\C1=CC=C(F)C=C1)C2=CC=C(F)C=C2 2917-3-X2 [0,2,0,0,0,0|1,0,1]=4 51 B19R2.12067 O=C(\C=C\C1=CC=CC=C1Cl)C2=CC=C(O)C=C2 2920-5-01 [0,2,0,0,0,0|1,0,1]=4 52 B19R2.12067 O=C(\C=C\C1=CC=CC=C1O)C2=CC=C(F)C=C2 2920-3-01 [0,2,0,0,0,0|1,0,1]=4 53 B19R2.48071 NC1=CC=CC(S(=O)(=O)NCC2=CC=CC=C2)=C1 8769-1-27 [0,2,0,0,0,0|2,0,0]=4 54 B19R2.48071 O=S(=O)(NCC1=CC=CC=C1)C2=CC(Br)=CC=C2 8769-9-05 [0,2,0,0,0,0|2,0,0]=4 55 B17R2.262 O=CC1=CC=CC=C1OCC2=CC=CC=C2 2615-1-X3 [0,0,1,1,0,0|2,0,0]=4 56 B17R2.1819 O=CC1=CC=CC(OCC2=CC=CC=C2)=C1 2615-1-62 [0,0,1,1,0,0|2,0,0]=4 57 B17R3.54615 BrC1=CC2=C(C=CC=C2)C3=C1C=CC=C3 1600-9-X5 [0,0,0,1,1,0|1,0,1]=4 58 B17R3.54615 ClC1=NC2=C(C=CC=C2)C3=C1C=CC=C3 3H32-5-0S [0,0,0,1,1,0|2,0,0]=4 59 B17R3.54615 O=[PH]1OC2=CC=CC=C2C3=CC=CC=C31 6677-1-01 [0,0,0,1,1,0|1,0,0]=3 60 B19R3.9171 O=C1CC(C2=CC=CC=C2)OC3=CC=CC=C13 2H17-1-16 [0,1,0,1,0,0|1,0,0]=3 61 B15R2.2195 C1=CC=C(CCC2=CC=CC=C2)C=C1 1700-1-X4 [1,0,0,0,1,0|0,0,1]=3 62 B15R2.2195 C1=CC=C(SSC2=CC=CC=C2)C=C1 9634-1-X2 [1,0,0,0,1,0|1,1,0]=4 63 B15R2.2195 C1=CC=C(\N=N\C2=CC=CC=C2)C=C1 3640-1-00 [1,0,0,0,1,0|2,0,0]=4 64 B15R2.2226 ClP(C1=CC=CC=C1)C2=CC=CC=C2 5672-5-01 [0,0,0,0,2,0|2,0,0]=4 65 B15R2.2226 N=C(C1=CC=CC=C1)C2=CC=CC=C2 3635-1-01 [0,0,0,0,2,0|1,0,0]=3 66 B15R2.2226 NC(C1=CC=CC=C1)C2=CC=CC=C2 3730-1-X8 [0,0,0,0,2,0|1,0,1]=4 67 B15R2.2226 NN(C1=CC=CC=C1)C2=CC=CC=C2 3639-5-0C [0,0,0,0,2,0|2,0,0]=4 68 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CC=C2 2617-1-01 [0,0,0,0,2,0|0,0,0]=2 69 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CC=N2 4H17-1-X2 [0,0,0,0,2,0|1,0,0]=3 70 B15R2.2226 O=S(C1=CC=CC=C1)C2=CC=CC=C2 6665-1-01 [0,0,0,0,2,0|1,0,0]=3 71 B15R2.2226 O=[PH](C1=CC=CC=C1)C2=CC=CC=C2 6674-1-21 [0,0,0,0,2,0|1,0,0]=3 72 B15R2.2226 OC(C1=CC=CC=C1)C2=CC=CC=C2 2602-1-01 [0,0,0,0,2,0|0,0,2]=4 73 B17R2.2382 C1=CC=C(CCNCC2=CC=CC=C2)C=C1 3631-1-0G [1,0,0,0,0,1|1,0,1]=4 74 B17R2.2382 C1=CC=C(\C=C\C=C\C2=CC=CC=C2)C=C1 1900-1-X1 [1,0,0,0,0,1|1,0,1]=4 75 B17R2.2382 C1=CC=C(\C=N\N=C\C2=CC=CC=C2)C=C1 3639-1-02 [1,0,0,0,0,1|1,0,1]=4 76 B19R2.8900 S=C(NCCC1=CC=CC=C1)NC2=CC=CC=C2 7767-1-29 [0,0,0,0,0,2|1,1,0]=4 77 B19R2.16162 O=C(\N=N\C1=CC=CC=C1)NNC2=CC=CC=C2 4642-1-05 [0,0,0,0,0,2|2,0,0]=4