0 B17R2.2740 NC[C@H]1CCCC[C@]1(O)C2=CC=CC(=C2)O MCULE-4977757434 [0,0,0,0,0,0|0,0,0]=0 1 B16R2.2464 [C@@H]1(CCCC[C@]1(O)C2=CC=CC=C2)CO MCULE-3039405509 [1,0,0,0,0,0|1,0,0]=2 2 B16R2.80687 C1(CNCCC1(C)C2=CC=CC(=C2)O)C MCULE-9572720021 [1,0,0,0,0,0|2,0,0]=3 3 B16R2.80687 C[C@@H]1CNCC[C@]1(C)C2=CC(=CC=C2)O MCULE-8597690237 [1,0,0,0,0,0|2,0,0]=3 4 B16R2.80687 C[C@H]1CNCC[C@@]1(C)C2=CC=CC(=C2)O MCULE-2936081767 [1,0,0,0,0,0|2,0,0]=3 5 B16R2.80687 C[C@H]1CNCC[C@@]1(C)C2=CC=CC(=C2)O MCULE-5373005229 [1,0,0,0,0,0|2,0,0]=3 6 B16R2.80687 C[C@H]1CNCC[C@]1(C)C2=CC(=CC=C2)O MCULE-6888330882 [1,0,0,0,0,0|2,0,0]=3 7 B18R2.7552 CNCC1CCCCC1(O)C2=CC(=CC=C2)O MCULE-5926951928 [0,1,0,0,0,0|0,0,0]=1 8 B18R2.7552 CNC[C@@H]1CCCC[C@@]1(O)C2=CC(=CC=C2)O MCULE-8251498413 [0,1,0,0,0,0|0,0,0]=1 9 B18R2.172433 COC1=CC=CC(=C1)C2(CCCCC2CN)O MCULE-4396262057 [0,1,0,0,0,0|0,0,0]=1 10 B15R1.106 CCCCCCCCC1=CC(=CC=C1)N MCULE-5121349078 [1,0,1,0,0,0|2,0,0]=4 11 B15R1.106 CCCCCCCCC1=CC=CC(=C1)Br MCULE-8099704163 [1,0,1,0,0,0|2,0,0]=4 12 B15R1.106 NCCCCCCOC1=CC(=CC=C1)F MCULE-5209950959 [1,0,1,0,0,0|2,0,0]=4 13 B15R1.138 CCCCCCCC(O)C1=CC=CC=C1 MCULE-1512555180 [1,0,1,0,0,0|1,0,0]=3 14 B15R2.21 CCC1CNCCC1C2=CC=CC=C2 MCULE-7590491190 [2,0,0,0,0,0|2,0,0]=4 15 B15R2.21 CNC1CCCCC1C2=CC=CC=C2 MCULE-5027186563 [2,0,0,0,0,0|2,0,0]=4 16 B15R2.21 NCC1CCCCC1C2=CC=CC=C2 MCULE-7259520721 [2,0,0,0,0,0|0,0,0]=2 17 B15R2.21 NCC1CCCOC1C2=CC=CC=C2 MCULE-3450705292 [2,0,0,0,0,0|1,0,0]=3 18 B15R2.21 OCC1CCCCN1C2=CC=CC=C2 MCULE-8389121221 [2,0,0,0,0,0|2,0,0]=4 19 B15R2.21 OCC1CCNCC1C2=CC=CC=C2 MCULE-4515562847 [2,0,0,0,0,0|2,0,0]=4 20 B15R2.21 OCC1CCNCC1C2=CC=CC=C2 MCULE-4567247267 [2,0,0,0,0,0|2,0,0]=4 21 B15R2.21 OCC1CNCCC1C2=CC=CC=C2 MCULE-4014765332 [2,0,0,0,0,0|2,0,0]=4 22 B15R2.21 OC[C@@H]1CNCC[C@@H]1C2=CC=CC=C2 MCULE-3322104845 [2,0,0,0,0,0|2,0,0]=4 23 B15R2.21 OC[C@H]1CNCC[C@@H]1C2=CC=CC=C2 MCULE-7862424570 [2,0,0,0,0,0|2,0,0]=4 24 B15R2.332 CC1=CC(=CC=C1)C2CCCCC2O MCULE-2918510192 [2,0,0,0,0,0|2,0,0]=4 25 B15R2.332 CC1=CC(=CC=C1)[C@@H]2CCCC[C@H]2O MCULE-1755534375 [2,0,0,0,0,0|2,0,0]=4 26 B15R2.332 CC1=CC=CC(=C1)C2CCCCC2C MCULE-5321399880 [2,0,0,0,0,0|1,0,0]=3 27 B15R2.332 OC1CCCCC1C2=CC=CC(=C2)F MCULE-5928050812 [2,0,0,0,0,0|2,0,0]=4 28 B15R2.332 O[C@@H]1CCCC[C@H]1C2=CC=CC(=C2)F MCULE-4099788853 [2,0,0,0,0,0|2,0,0]=4 29 B15R2.367 OC1CCCCC1(O)C2=CC=CC=C2 MCULE-1388055281 [2,0,0,0,0,0|1,0,0]=3 30 B15R2.367 O[C@@H]1CNCC[C@@]1(O)C2=CC=CC=C2 MCULE-2684407027 [2,0,0,0,0,0|2,0,0]=4 31 B15R2.367 O[C@@H]1CNCC[C@@]1(O)C2=CC=CC=C2 MCULE-8763366528 [2,0,0,0,0,0|2,0,0]=4 32 B15R2.41951 CC1=CC(=CC=C1)C2(CCOCC2)O MCULE-3969995044 [2,0,0,0,0,0|2,0,0]=4 33 B15R2.41951 CC1=CC(=CC=C1)C2(CCSCC2)O MCULE-3494683037 [2,0,0,0,0,0|2,0,0]=4 34 B15R2.41951 CC1=CC=CC(=C1)C2(CCCCC2)C MCULE-5789209272 [2,0,0,0,0,0|2,0,0]=4 35 B15R2.41951 CC1=CC=CC(=C1)C2(CCCNC2)O MCULE-4359859946 [2,0,0,0,0,0|2,0,0]=4 36 B15R2.41951 CC1=CC=CC(=C1)C2(CCCNC2)O MCULE-5873123998 [2,0,0,0,0,0|2,0,0]=4 37 B15R2.41951 CC1=CC=CC(=C1)C2(CCNCC2)O MCULE-4539543225 [2,0,0,0,0,0|2,0,0]=4 38 B15R2.41951 NC1(CCCCC1)C2=CC(=CC=C2)Br MCULE-1044549965 [2,0,0,0,0,0|2,0,0]=4 39 B15R2.41951 NC1(CCCCC1)C2=CC(=CC=C2)Br MCULE-3856184069 [2,0,0,0,0,0|2,0,0]=4 40 B15R2.41951 NC1(CCCCC1)C2=CC(=CC=C2)F MCULE-3518994097 [2,0,0,0,0,0|2,0,0]=4 41 B15R2.41951 NC1(CCCCC1)C2=CC=CC(=C2)F MCULE-6590518088 [2,0,0,0,0,0|2,0,0]=4 42 B15R2.41951 OC1(CCCCC1)C2=CC(=CC=C2)F MCULE-6337873292 [2,0,0,0,0,0|1,0,0]=3 43 B15R2.41951 OC1(CCNCC1)C2=CC(=CC=C2)Cl MCULE-4185961604 [2,0,0,0,0,0|2,0,0]=4 44 B15R2.41951 OC1(CCNCC1)C2=CC(=CC=C2)F MCULE-5351810331 [2,0,0,0,0,0|2,0,0]=4 45 B15R2.41951 OC1(CCOCC1)C2=CC(=CC=C2)Br MCULE-4350644563 [2,0,0,0,0,0|2,0,0]=4 46 B15R2.41951 OC1(CCOCC1)C2=CC(=CC=C2)Cl MCULE-4173680295 [2,0,0,0,0,0|2,0,0]=4 47 B15R2.41951 OC1(CCOCC1)C2=CC(=CC=C2)F MCULE-4756222199 [2,0,0,0,0,0|2,0,0]=4 48 B15R2.41951 OC1(CCSCC1)C2=CC(=CC=C2)F MCULE-9151990138 [2,0,0,0,0,0|2,0,0]=4 49 B15R2.41951 OC1(CCSCC1)C2=CC=CC(=C2)Cl MCULE-1732224771 [2,0,0,0,0,0|2,0,0]=4 50 B17R2.63793 CN1CCCC(C1C2=CC(=CC=C2)Cl)CN MCULE-8523990643 [1,1,0,0,0,0|2,0,0]=4 51 B17R2.5684 O=C(O)C1CCCCC1(O)C2=CC=CC=C2 MCULE-1825992981 [1,1,0,0,0,0|1,0,1]=4 52 B17R2.5684 O=C(O)C1CCCC[C@@]1(O)C2=CC=CC=C2 MCULE-9219711377 [1,1,0,0,0,0|1,0,1]=4 53 B17R2.5684 O=C(O)[C@@H]1CCCC[C@@]1(O)C2=CC=CC=C2 MCULE-1765631862 [1,1,0,0,0,0|1,0,1]=4 54 B17R2.5684 O=C(O)[C@@H]1CCCC[C@@]1(O)C2=CC=CC=C2 MCULE-7373733581 [1,1,0,0,0,0|1,0,1]=4 55 B17R2.5684 O=C(O)[C@@H]1CCCC[C@@]1(O)C2=CC=CC=C2 MCULE-9086235800 [1,1,0,0,0,0|1,0,1]=4 56 B17R2.5684 O=C(O)[C@H]1CCCC[C@]1(O)C2=CC=CC=C2 MCULE-9600226232 [1,1,0,0,0,0|1,0,1]=4 57 B17R2.5684 [C@@H]1(CCCC[C@]1(O)C2=CC=CC=C2)C(=O)O MCULE-3277741368 [1,1,0,0,0,0|1,0,1]=4 58 B17R2.72145 CCC1CN(CCC1(O)C2=CC=CC=C2)C MCULE-4399090758 [1,1,0,0,0,0|2,0,0]=4 59 B17R2.150257 C[C@H]1CN(CC[C@@]1(C)C2=CC=CC(=C2)O)C MCULE-2226190876 [1,1,0,0,0,0|2,0,0]=4 60 B17R2.150257 C[C@H]1CN(CC[C@@]1(C)C2=CC=CC(=C2)O)C MCULE-6123794061 [1,1,0,0,0,0|2,0,0]=4 61 B19R2.119947 CNCC1CCCCC1(O)C2=CC(=CC=C2)OC MCULE-3468156764 [0,2,0,0,0,0|0,0,0]=2 62 B19R2.119947 CNCC1CCCCC1(O)C2=CC=CC(=C2)OC MCULE-6747641231 [0,2,0,0,0,0|0,0,0]=2 63 B19R2.483078 CN(C)CC1CSCCC1(O)C2=CC(=CC=C2)Cl MCULE-3690735901 [0,2,0,0,0,0|2,0,0]=4 64 B19R2.483078 CN(C)CC1CSCCC1(O)C2=CC(=CC=C2)Cl MCULE-7609947092 [0,2,0,0,0,0|2,0,0]=4 65 B19R2.483078 CN(C)CC1CSCCC1(O)C2=CC(=CC=C2)O MCULE-2121004857 [0,2,0,0,0,0|1,0,0]=3 66 B19R2.483078 CN(C)CC1CSCCC1(O)C2=CC(=CC=C2)O MCULE-2809991103 [0,2,0,0,0,0|1,0,0]=3 67 B19R2.483078 CN(C)C[C@@H]1CCCC[C@@]1(O)C2=CC(=CC=C2)O MCULE-8575146649 [0,2,0,0,0,0|0,0,0]=2 68 B19R2.483078 CN(C)C[C@H]1CCCC[C@]1(O)C2=CC(=CC=C2)O MCULE-1326854271 [0,2,0,0,0,0|0,0,0]=2 69 B19R2.483078 CN(C)C[C@H]1CCCC[C@]1(O)C2=CC(=CC=C2)O MCULE-8621757096 [0,2,0,0,0,0|0,0,0]=2 70 B19R2.483078 CN(C)C[C@H]1CCCC[C@]1(O)C2=CC(=CC=C2)O MCULE-9115879520 [0,2,0,0,0,0|0,0,0]=2 71 B17R2.273415 CC1=CC=CC(=C1)C(O)C2CCCCCC2 MCULE-8583142012 [0,0,1,1,0,0|2,0,0]=4 72 B17R2.273415 OC(C1=CC(=CC=C1)Br)C2CCCCCC2 MCULE-4333618819 [0,0,1,1,0,0|2,0,0]=4 73 B17R2.273415 OC(C1=CC(=CC=C1)Cl)C2CCCCCC2 MCULE-3917348749 [0,0,1,1,0,0|2,0,0]=4 74 B17R2.273415 OC(C1=CC(=CC=C1)F)C2CCCCCC2 MCULE-9797639142 [0,0,1,1,0,0|2,0,0]=4 75 B17R3.28709 OC1(CN2CCC1CC2)C3=CC=CC=C3 MCULE-5291301235 [1,0,0,1,0,0|2,0,0]=4 76 B17R3.28709 OC1(CN2CCC1CC2)C3=CC=CC=C3 MCULE-7638877935 [1,0,0,1,0,0|2,0,0]=4 77 B17R2.261 NCC1CCCCN1CC2=CC(=CC=C2)Cl MCULE-6273060714 [1,0,0,0,0,1|2,0,0]=4