0 B17R2.3687 CC1CCCN1C(=O)C2=CC=C(C=C2)C#N MCULE-2944844479 [0,0,0,0,0,0|3,0,1]=4 1 B17R2.3687 COC1=CC=C(C=C1)C(=O)N2C=NN=C2N MCULE-5225159386 [0,0,0,0,0,0|3,0,1]=4 2 B17R2.3687 COC1=CC=C(C=C1)C(=O)N2CCCC2=O MCULE-7933360750 [0,0,0,0,0,0|0,0,0]=0 3 B17R2.3687 COC1=CC=C(C=C1)C(=O)N2CCSC2=S MCULE-5164770353 [0,0,0,0,0,0|1,1,0]=2 4 B16R2.46 CCC1=CC=C(C=C1)C(=O)C2CCCC2 MCULE-6929336776 [1,0,0,0,0,0|2,0,1]=4 5 B16R2.46 CCC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-1214386860 [1,0,0,0,0,0|1,0,1]=3 6 B16R2.46 CCC1=CC=C(C=C1)C(=S)N2CCCC2 MCULE-6896685726 [1,0,0,0,0,0|1,1,1]=4 7 B16R2.46 COC1=CC=C(C=C1)C(=O)C2CCCC2 MCULE-8881132403 [1,0,0,0,0,0|1,0,1]=3 8 B16R2.46 COC1=CC=C(C=C1)C(=O)N2C=CC=N2 MCULE-9971264725 [1,0,0,0,0,0|1,0,2]=4 9 B16R2.46 COC1=CC=C(C=C1)C(=O)N2C=NC=N2 MCULE-7405123938 [1,0,0,0,0,0|2,0,1]=4 10 B16R2.46 COC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-6036145720 [1,0,0,0,0,0|0,0,1]=2 11 B16R2.46 COC1=CC=C(C=C1)C(=S)N2CCCC2 MCULE-6825926811 [1,0,0,0,0,0|0,1,1]=3 12 B16R2.46 COC1=NC=C(C=N1)C(=O)N2CCCC2 MCULE-5556630246 [1,0,0,0,0,0|2,0,1]=4 13 B16R2.46 CSC1=CC=C(C=C1)C(=O)C2CCCC2 MCULE-5642953276 [1,0,0,0,0,0|1,1,1]=4 14 B16R2.46 CSC1=CC=C(C=C1)C(=S)N2CCCC2 MCULE-9575194167 [1,0,0,0,0,0|0,2,1]=4 15 B16R2.46 N#CC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-8698184053 [1,0,0,0,0,0|2,0,1]=4 16 B16R2.46 NCC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-8727852360 [1,0,0,0,0,0|2,0,1]=4 17 B16R2.46 NCC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-9877316290 [1,0,0,0,0,0|2,0,1]=4 18 B16R2.46 O=C(C1=CC=C(C=C1)CCl)N2CCCC2 MCULE-6165261191 [1,0,0,0,0,0|2,0,1]=4 19 B16R2.46 O=CC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-4857984248 [1,0,0,0,0,0|2,0,1]=4 20 B16R2.51 COC1=CC=C(C=C1)C=C2CCOC2=O MCULE-3996502655 [1,0,0,0,0,0|2,0,0]=3 21 B16R2.51 COC1=CC=C(C=C1)CC2CCOC2=O MCULE-2324581247 [1,0,0,0,0,0|2,0,1]=4 22 B16R2.51 COC1=CC=C(C=C1)CN2CCCC2=O MCULE-9427836657 [1,0,0,0,0,0|0,0,1]=2 23 B16R2.51 COC1=CC=C(C=C1)NC2CCNC2=O MCULE-3732009506 [1,0,0,0,0,0|3,0,0]=4 24 B16R2.51 N#CC1=CC=C(C=C1)CN2CCCC2=O MCULE-8775990058 [1,0,0,0,0,0|2,0,1]=4 25 B16R2.51 NCC1=CC=C(C=C1)CN2CCCC2=O MCULE-3139661751 [1,0,0,0,0,0|2,0,1]=4 26 B16R2.1084 CC1=CC=C(C=C1)C(=O)N2CCSC2=S MCULE-9298289540 [1,0,0,0,0,0|1,1,0]=3 27 B16R2.1084 C[C@@H](C1=CC=C(C=C1)Br)N2CCCC2=O MCULE-6737088140 [1,0,0,0,0,0|2,0,1]=4 28 B16R2.1084 C[C@@H]1CCCN1C(=O)C2=CC=C(C=C2)Br MCULE-3684832008 [1,0,0,0,0,0|2,0,1]=4 29 B16R2.1084 C[C@@H]1CCCN1C(=O)C2=CC=C(C=C2)I MCULE-7796892146 [1,0,0,0,0,0|2,0,1]=4 30 B16R2.1084 C[C@H](C1=CC=C(C=C1)Br)N2CCCC2=O MCULE-2660622702 [1,0,0,0,0,0|2,0,1]=4 31 B16R2.1084 C[C@H]1CCCN1C(=O)C2=CC=C(C=C2)Br MCULE-6018410566 [1,0,0,0,0,0|2,0,1]=4 32 B16R2.1084 C[C@H]1CCCN1C(=O)C2=CC=C(C=C2)I MCULE-3936349686 [1,0,0,0,0,0|2,0,1]=4 33 B16R2.1084 NC1=CC=C(C=C1)C(=O)N2CCNC2=O MCULE-3482506731 [1,0,0,0,0,0|2,0,0]=3 34 B16R2.1084 O=C(C1=CC=C(C=C1)Br)N2CCSC2=S MCULE-1979150625 [1,0,0,0,0,0|2,1,0]=4 35 B16R2.1084 O=C(C1=CC=C(C=C1)Cl)N2CCSC2=S MCULE-2261235694 [1,0,0,0,0,0|2,1,0]=4 36 B16R2.1084 O=C(C1=CC=C(C=C1)F)N2CCSC2=S MCULE-8133890667 [1,0,0,0,0,0|2,1,0]=4 37 B16R2.1084 O=C1CCCN1C(=O)C2=CC=C(C=C2)Cl MCULE-7886407598 [1,0,0,0,0,0|1,0,0]=2 38 B16R2.1084 O=C1CCCN1C(=O)C2=CC=C(C=C2)F MCULE-2755791056 [1,0,0,0,0,0|1,0,0]=2 39 B16R2.1084 O=C1NCCC1C(=O)C2=CC=C(C=C2)Br MCULE-6122283060 [1,0,0,0,0,0|3,0,0]=4 40 B16R2.1084 O=C1NCCN1C(=O)C2=CC=C(C=C2)F MCULE-6089327297 [1,0,0,0,0,0|2,0,0]=3 41 B18R2.4364 COC1=CC=C(C=C1)C(=O)N2CCN=C2SC MCULE-1712571003 [0,1,0,0,0,0|1,1,0]=3 42 B18R2.30487 CCOC1=CC=C(C=C1)C(=O)N2CCSC2=S MCULE-6777079628 [0,1,0,0,0,0|1,1,0]=3 43 B18R2.33438 O=C1CCCN1C(=O)C2=CC=C(C=C2)N(=O)=O MCULE-1983679357 [0,1,0,0,0,0|2,0,0]=3 44 B18R2.35907 COC1=CC=C(C=C1)C(=O)N2C(=O)CCC2=O MCULE-7695895248 [0,1,0,0,0,0|0,0,1]=2 45 B16R1.217 COC(=O)C(C)C(=O)C1=CC=C(C=C1)OC MCULE-6710709435 [0,0,1,0,0,0|2,0,0]=3 46 B16R1.4218 CCCC(=O)NC(C)C1=CC=C(C=C1)OC MCULE-5460078245 [0,0,1,0,0,0|1,0,1]=3 47 B16R1.4218 CCCC(C)NC(=O)C1=CC=C(C=C1)CC MCULE-5444725370 [0,0,1,0,0,0|2,0,1]=4 48 B16R1.4218 CCCC(C)NC(=O)C1=CC=C(C=C1)OC MCULE-4722700589 [0,0,1,0,0,0|1,0,1]=3 49 B16R1.4218 CCOC(=O)C=C(C)C1=CC=C(C=C1)OC MCULE-7451355994 [0,0,1,0,0,0|3,0,0]=4 50 B16R1.4218 CCOC(=O)CC(=O)C1=CC=C(C=C1)CC MCULE-6749055528 [0,0,1,0,0,0|3,0,0]=4 51 B16R1.4218 CCOC(=O)CC(=O)C1=CC=C(C=C1)OC MCULE-8455152697 [0,0,1,0,0,0|2,0,0]=3 52 B16R1.4218 CCOC(=O)CC(=O)C1=CC=C(C=C1)SC MCULE-6364875671 [0,0,1,0,0,0|2,1,0]=4 53 B16R1.4218 CCOC(=O)NC(=S)C1=CC=C(C=C1)OC MCULE-2217401732 [0,0,1,0,0,0|1,1,0]=3 54 B16R1.4218 CCOC(=O)NC(C)C1=CC=C(C=C1)OC MCULE-2513138545 [0,0,1,0,0,0|2,0,1]=4 55 B16R1.4218 COCC(C)NC(=O)C1=CC=C(C=C1)OC MCULE-7967997994 [0,0,1,0,0,0|2,0,1]=4 56 B16R1.4603 CCC1=CC=C(C=C1)C(=O)NCCCOC MCULE-1744659146 [0,0,1,0,0,0|3,0,0]=4 57 B16R1.4603 CCCCCCC(=O)C1=CC=C(C=C1)OC MCULE-3307105340 [0,0,1,0,0,0|2,0,1]=4 58 B16R1.4603 CCCCCNC(=O)C1=CC=C(C=C1)OC MCULE-7258386997 [0,0,1,0,0,0|1,0,1]=3 59 B16R1.4603 COC1=CC=C(C=C1)C(=O)CCCCC#N MCULE-3923333471 [0,0,1,0,0,0|2,0,1]=4 60 B16R1.4603 COC1=CC=C(C=C1)C(=O)CCCCCBr MCULE-4459699509 [0,0,1,0,0,0|2,0,1]=4 61 B16R1.4603 COC1=CC=C(C=C1)C(=O)CCCCCCl MCULE-5303253526 [0,0,1,0,0,0|2,0,1]=4 62 B16R1.4603 COCCCNC(=O)C1=CC=C(C=C1)OC MCULE-6410930784 [0,0,1,0,0,0|2,0,0]=3 63 B18R3.79 COC1=CC=C(C=C1)C2=CN=C3N2CCC3 MCULE-1689905591 [0,0,0,1,0,0|2,0,0]=3 64 B18R3.79 COC1=CC=C(C=C1)C2=CN=C3N2CCC3 MCULE-9061372238 [0,0,0,1,0,0|2,0,0]=3 65 B18R3.79 COC1=CC=C(C=C1)C2=CSC3=NCCN23 MCULE-5746104208 [0,0,0,1,0,0|2,1,0]=4 66 B18R3.79 COC1=CC=C(C=C1)C2=CSC3=NCCN23 MCULE-9948104164 [0,0,0,1,0,0|2,1,0]=4 67 B18R3.79 COC1=CC=C(C=C1)C2=CSC3=[NH+]CCN23 MCULE-9234446018 [0,0,0,1,0,0|2,1,0]=4 68 B18R3.79 COC1=CC=C(C=C1)C2=NN=C3N2CCC3 MCULE-9741707063 [0,0,0,1,0,0|2,0,0]=3 69 B18R3.162692 COC1=CC=C2C(=C1)N=C3CCCC3=C2Cl MCULE-6354212555 [0,0,0,1,0,0|3,0,0]=4 70 B18R2.80 COC1=CC=C(C=C1)C(=O)N2CCCC(C2)C MCULE-5414616966 [0,0,0,0,0,1|1,0,1]=3 71 B18R2.80 COC1=CC=C(C=C1)C(=O)N2CCNC(C2)C MCULE-5154902132 [0,0,0,0,0,1|2,0,1]=4 72 B18R2.80 NCC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2 MCULE-3172816562 [0,0,0,0,0,1|3,0,0]=4 73 B18R2.4308 COC1=CC=C(C=C1)CC(=O)N2CCNC2=O MCULE-7962539607 [0,0,0,0,0,1|1,0,0]=2 74 B18R2.4308 COC1=CC=C(C=C1)CC(=O)N2CCSC2=S MCULE-1543302338 [0,0,0,0,0,1|1,1,0]=3 75 B18R2.4308 COC1=CC=C(C=C1)NC(=O)C2CCOC2=O MCULE-5082801602 [0,0,0,0,0,1|2,0,0]=3 76 B18R2.4367 COC1=CC=C(C=C1)C(=O)C2CCCCC2=O MCULE-9276595733 [0,0,0,0,0,1|1,0,0]=2 77 B18R2.4367 COC1=CC=C(C=C1)C(=O)N2CCNCC2C MCULE-5066498519 [0,0,0,0,0,1|1,0,1]=3 78 B18R2.4371 CCC1=CC=C(C=C1)C(=O)CN2CCSC2=N MCULE-5332742118 [0,0,0,0,0,1|3,0,0]=4 79 B18R2.4371 CCC1=CC=C(C=C1)C(=O)CN2CCSC2=N MCULE-9273342182 [0,0,0,0,0,1|3,0,0]=4 80 B18R2.4371 COC1=CC=C(C=C1)C(=O)NC2CCSC2=O MCULE-6590054706 [0,0,0,0,0,1|2,0,0]=3 81 B15R1.3 COC1=CC=C(C=C1)CN(C)C(=O)CCl MCULE-6880895422 [1,0,1,0,0,0|1,0,1]=4 82 B15R1.3 COC1=CC=C(C=C1)CN(C)C(=O)CN MCULE-8096693781 [1,0,1,0,0,0|1,0,1]=4 83 B15R1.211 CCC(=O)NC(C)C1=CC=C(C=C1)OC MCULE-8236420600 [1,0,1,0,0,0|1,0,1]=4 84 B15R1.211 CCC(C)NC(=O)C1=CC=C(C=C1)OC MCULE-3112838417 [1,0,1,0,0,0|1,0,1]=4 85 B15R1.211 COC(=O)CC(=O)C1=CC=C(C=C1)OC MCULE-3980678085 [1,0,1,0,0,0|2,0,0]=4 86 B15R1.211 COC1=CC=C(C=C1)C(=O)NC(=O)CCl MCULE-4884913615 [1,0,1,0,0,0|1,0,0]=3 87 B15R1.3943 CCCC(C)C(=O)C1=CC=C(C=C1)OC MCULE-2719330268 [1,0,1,0,0,0|1,0,1]=4 88 B15R1.3943 CCNC(C)C(=O)C1=CC=C(C=C1)OC MCULE-5355806593 [1,0,1,0,0,0|2,0,0]=4 89 B15R1.3943 CCNC(C)C(=O)C1=CC=C(C=C1)OC MCULE-8312916491 [1,0,1,0,0,0|2,0,0]=4 90 B15R1.3943 CCOC(=O)C(=O)C1=CC=C(C=C1)OC MCULE-2197742178 [1,0,1,0,0,0|2,0,0]=4 91 B15R1.218 CCC(CC)C(=O)C1=CC=C(C=C1)OC MCULE-6130980091 [1,0,1,0,0,0|1,0,1]=4 92 B15R1.218 CCC(NC)C(=O)C1=CC=C(C=C1)OC MCULE-3078615915 [1,0,1,0,0,0|2,0,0]=4 93 B15R1.218 CCC(NC)C(=O)C1=CC=C(C=C1)OC MCULE-3556168916 [1,0,1,0,0,0|2,0,0]=4 94 B15R1.218 CCN(CC)C(=O)C1=CC=C(C=C1)OC MCULE-6786038311 [1,0,1,0,0,0|0,0,1]=3 95 B15R1.23 CCCC(=O)NC(C)C1=CC=C(C=C1)C MCULE-1074253414 [1,0,1,0,0,0|1,0,1]=4 96 B15R1.23 CCCC(C)NC(=O)C1=CC=C(C=C1)C MCULE-3695583670 [1,0,1,0,0,0|1,0,1]=4 97 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C=C1)C MCULE-3286491284 [1,0,1,0,0,0|2,0,0]=4 98 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C=C1)O MCULE-3647095128 [1,0,1,0,0,0|2,0,0]=4 99 B15R1.23 CCOC(=O)NC(=O)C1=CC=C(C=C1)Cl MCULE-2750984627 [1,0,1,0,0,0|2,0,0]=4 100 B15R1.793 CCCC(=O)CCC1=CC=C(C=C1)OC MCULE-2489019985 [1,0,1,0,0,0|1,0,1]=4 101 B15R1.793 CCCC(=O)NCC1=CC=C(C=C1)OC MCULE-7905053026 [1,0,1,0,0,0|0,0,1]=3 102 B15R1.793 CCNC(=O)C=CC1=CC=C(C=C1)OC MCULE-3293571770 [1,0,1,0,0,0|2,0,0]=4 103 B15R1.793 CCOC(=O)/C=C/C1=CC=C(C=C1)OC MCULE-3659493926 [1,0,1,0,0,0|2,0,0]=4 104 B15R1.793 CCOC(=O)C=CC1=CC=C(C=C1)OC MCULE-7539638665 [1,0,1,0,0,0|2,0,0]=4 105 B15R1.793 CCOC(=O)NCC1=CC=C(C=C1)OC MCULE-9001289907 [1,0,1,0,0,0|1,0,1]=4 106 B15R1.793 CNCC(=O)NCC1=CC=C(C=C1)OC MCULE-2404801526 [1,0,1,0,0,0|1,0,1]=4 107 B15R1.793 COC1=CC=C(C=C1)CNC(=O)CCCl MCULE-6308815976 [1,0,1,0,0,0|1,0,1]=4 108 B15R1.793 COCC(=O)NCC1=CC=C(C=C1)OC MCULE-4214388711 [1,0,1,0,0,0|1,0,1]=4 109 B15R1.1389 CCCCCC(=O)C1=CC=C(C=C1)OC MCULE-3626892334 [1,0,1,0,0,0|1,0,1]=4 110 B15R1.1389 CCCCNC(=O)C1=CC=C(C=C1)OC MCULE-3219530771 [1,0,1,0,0,0|0,0,1]=3 111 B15R1.1389 COC1=CC=C(C=C1)C(=O)CCCC#N MCULE-1889548411 [1,0,1,0,0,0|1,0,1]=4 112 B15R1.1389 COC1=CC=C(C=C1)C(=O)CCCCBr MCULE-9984892750 [1,0,1,0,0,0|1,0,1]=4 113 B15R1.1389 COC1=CC=C(C=C1)C(=O)CCCCCl MCULE-2664506891 [1,0,1,0,0,0|1,0,1]=4 114 B15R1.1389 COC1=CC=C(C=C1)C(=O)NCCCCl MCULE-4318188053 [1,0,1,0,0,0|1,0,0]=3 115 B15R1.1389 COC1=CC=C(C=C1)C(=O)NCCCN MCULE-1335293555 [1,0,1,0,0,0|1,0,0]=3 116 B15R1.1389 COCCNC(=O)C1=CC=C(C=C1)OC MCULE-1525903243 [1,0,1,0,0,0|1,0,1]=4 117 B15R1.30 COCCCNC(=O)C1=CC=C(C=C1)C MCULE-3479635590 [1,0,1,0,0,0|2,0,0]=4 118 B15R1.1178 COC1=CC=C(C=C1)OCCCCC=O MCULE-3438128362 [1,0,1,0,0,0|2,0,0]=4 119 B15R2.34 COC1=CC=C(C=C1)CN2CCCC2 MCULE-3889251435 [2,0,0,0,0,0|0,0,2]=4 120 B15R2.91 CC1=CC=C(C=C1)C(=O)C2CCCC2 MCULE-7268998420 [2,0,0,0,0,0|1,0,1]=4 121 B15R2.91 CC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-1505727295 [2,0,0,0,0,0|0,0,1]=3 122 B15R2.91 CC1=CC=C(C=C1)C(=S)N2CCCC2 MCULE-6779078415 [2,0,0,0,0,0|0,1,1]=4 123 B15R2.91 NC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-5666930185 [2,0,0,0,0,0|1,0,1]=4 124 B15R2.91 NC1=CC=C(C=C1)C(=O)N2CCCN2 MCULE-7606876817 [2,0,0,0,0,0|2,0,0]=4 125 B15R2.91 O=C(C1=CC=C(C=C1)Br)N2CCCC2 MCULE-8208241091 [2,0,0,0,0,0|1,0,1]=4 126 B15R2.91 O=C(C1=CC=C(C=C1)Cl)N2CCCC2 MCULE-5697754444 [2,0,0,0,0,0|1,0,1]=4 127 B15R2.91 O=C(C1=CC=C(C=C1)F)N2CCCC2 MCULE-2623775353 [2,0,0,0,0,0|1,0,1]=4 128 B15R2.91 O=C(C1=CC=C(C=C1)I)N2CCCC2 MCULE-4895964079 [2,0,0,0,0,0|1,0,1]=4 129 B15R2.91 O=C(C1=CC=C(C=C1)O)N2CCCC2 MCULE-1995665594 [2,0,0,0,0,0|0,0,1]=3 130 B15R2.91 OC1=CC=C(C=C1)C(=S)N2CCCC2 MCULE-9215969935 [2,0,0,0,0,0|0,1,1]=4 131 B15R2.1510 CC1=CC=C(C=C1)NN2CCOC2=O MCULE-8150680434 [2,0,0,0,0,0|2,0,0]=4 132 B15R2.1510 NC1=CC=C(C=C1)CN2CCCC2=O MCULE-1773415218 [2,0,0,0,0,0|1,0,1]=4 133 B15R2.1510 O=C1CCCN1CC2=CC=C(C=C2)Br MCULE-2825572640 [2,0,0,0,0,0|1,0,1]=4 134 B15R2.1510 O=C1CCCN1CC2=CC=C(C=C2)Cl MCULE-9101142230 [2,0,0,0,0,0|1,0,1]=4 135 B15R2.1510 O=C1CCCN1CC2=CC=C(C=C2)I MCULE-1435239762 [2,0,0,0,0,0|1,0,1]=4 136 B15R2.1510 O=C1OCCC1=CC2=CC=C(C=C2)O MCULE-5784050788 [2,0,0,0,0,0|2,0,0]=4 137 B15R2.395 CC(C1=CC=CC=C1)N2CCCC2=O MCULE-6866066990 [2,0,0,0,0,0|1,0,1]=4 138 B15R2.395 C[C@H](C1=CC=CC=C1)N2CCCC2=O MCULE-9263916605 [2,0,0,0,0,0|1,0,1]=4 139 B15R2.395 O=C(C1=CC=CC=C1)N2CCSC2=S MCULE-1798567589 [2,0,0,0,0,0|1,1,0]=4 140 B15R2.395 O=C1CCCC1C(=O)C2=CC=CC=C2 MCULE-9265341836 [2,0,0,0,0,0|1,0,0]=3 141 B15R2.395 O=C1CCCN1C(=O)C2=CC=CC=C2 MCULE-2031409343 [2,0,0,0,0,0|0,0,0]=2 142 B15R2.395 O=C1CCCN1C(=O)C2=CN=CC=C2 MCULE-2906986656 [2,0,0,0,0,0|1,0,0]=3 143 B15R2.395 O=C1NCCN1C(=O)C2=CC=CC=C2 MCULE-9320810415 [2,0,0,0,0,0|1,0,0]=3 144 B15R2.395 O=C1OCCC1C(=O)C2=CC=CC=C2 MCULE-9034427859 [2,0,0,0,0,0|2,0,0]=4 145 B17R1.17858 CCOC(=O)C(Br)C(=O)C1=CC=C(C=C1)OC MCULE-1704480633 [0,1,1,0,0,0|2,0,0]=4 146 B17R1.10562 COC1=CC=C(C=C1)C(=O)N(C(C)C)C(C)C MCULE-8516816285 [0,1,1,0,0,0|1,0,1]=4 147 B17R1.208 COC1=CC=C(C=C1)C(=O)NC(=S)NC(C)C MCULE-8266704044 [0,1,1,0,0,0|1,1,0]=4 148 B17R1.4583 CCCC(=O)OC(=O)C1=CC=C(C=C1)N(C)C MCULE-2389851095 [0,1,1,0,0,0|2,0,0]=4 149 B17R1.4601 CCCC(C)NC(=O)C1=CC(=C(C=C1)OC)C MCULE-2025609676 [0,1,1,0,0,0|1,0,1]=4 150 B17R1.4601 CCCC(C)NC(=O)C1=CC=C(C(=C1)Cl)OC MCULE-9423468841 [0,1,1,0,0,0|1,0,1]=4 151 B17R1.4601 CCOC(=O)CC(=O)C1=CC(=C(C=C1)OC)C MCULE-4748794483 [0,1,1,0,0,0|2,0,0]=4 152 B17R1.4601 CCOC(=O)CC(=O)C1=CC(=C(C=C1)OC)F MCULE-2177805377 [0,1,1,0,0,0|2,0,0]=4 153 B17R1.4601 CCOC(=O)CC(=O)C1=CC=C(C(=C1)Br)OC MCULE-7802293390 [0,1,1,0,0,0|2,0,0]=4 154 B17R1.4601 CCOC(=O)CC(=O)C1=CC=C(C(=C1)Cl)OC MCULE-9177510446 [0,1,1,0,0,0|2,0,0]=4 155 B17R1.8620 CCCC(C)NC(=O)C1=CC=C(C=C1)OCC MCULE-9701882770 [0,1,1,0,0,0|1,0,1]=4 156 B17R1.8620 CCOC(=O)CC(=O)C1=CC=C(C=C1)OCC MCULE-2173986883 [0,1,1,0,0,0|2,0,0]=4 157 B17R1.37033 CCOC(=O)CC(=O)C1=C(C=C(C=C1)OC)F MCULE-6697078501 [0,1,1,0,0,0|2,0,0]=4 158 B17R1.37033 CCOC(=O)CC(=O)C1=CC=C(C=C1C)OC MCULE-2865662420 [0,1,1,0,0,0|2,0,0]=4 159 B17R1.37033 CCOC(=O)CC(=O)C1=CC=C(C=C1Cl)OC MCULE-8249054437 [0,1,1,0,0,0|2,0,0]=4 160 B17R1.37033 CCOC(=O)CC(=O)C1=CC=C(C=C1O)OC MCULE-1358507971 [0,1,1,0,0,0|2,0,0]=4 161 B17R1.239 CCC1=CC=C(C=C1)C(=O)CCCCC(=O)O MCULE-9733896512 [0,1,1,0,0,0|2,0,0]=4 162 B17R1.239 COC1=CC=C(C=C1)C(=O)CCCCC(=O)O MCULE-8192823409 [0,1,1,0,0,0|1,0,0]=3 163 B17R1.239 COC1=CC=C(C=C1)C(=O)CCNCC(=O)O MCULE-1075293476 [0,1,1,0,0,0|2,0,0]=4 164 B17R1.239 COC1=CC=C(C=C1)C(=O)NCCCC(=O)O MCULE-8616420846 [0,1,1,0,0,0|0,0,0]=2 165 B17R1.239 COC1=NC=C(C=C1)C(=O)CCCCC(=O)O MCULE-9038798767 [0,1,1,0,0,0|2,0,0]=4 166 B17R1.239 CSC1=CC=C(C=C1)C(=O)CCCCC(=O)O MCULE-7875007736 [0,1,1,0,0,0|1,1,0]=4 167 B17R1.5087 CCCCCNC(=O)C1=CC=C(C=C1)OCC MCULE-7691950008 [0,1,1,0,0,0|1,0,1]=4 168 B17R1.5087 CCOC1=CC=C(C=C1)C(=O)NCCCOC MCULE-8673876408 [0,1,1,0,0,0|2,0,0]=4 169 B17R1.5111 COCCCNC(=O)C1=CC=C(C(=C1)Cl)OC MCULE-1336967717 [0,1,1,0,0,0|2,0,0]=4 170 B17R1.9256 CCCCCCNC(=O)C1=CC=C(C=C1)OC MCULE-6571458572 [0,1,1,0,0,0|1,0,1]=4 171 B17R1.9256 CCOCCCNC(=O)C1=CC=C(C=C1)OC MCULE-7046468149 [0,1,1,0,0,0|1,0,1]=4 172 B17R1.9256 COC1=CC=C(C=C1)C(=O)NCCOCCO MCULE-3877570456 [0,1,1,0,0,0|0,0,2]=4 173 B17R1.25740 CCCCN(CC)C(=O)C1=CC=C(C=C1)OC MCULE-3701180587 [0,1,1,0,0,0|1,0,1]=4 174 B17R1.31537 CCCN(CCC)C(=O)C1=CC=C(C=C1)OC MCULE-1536408475 [0,1,1,0,0,0|1,0,1]=4 175 B17R2.58 COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2 MCULE-7368557391 [1,1,0,0,0,0|1,0,1]=4 176 B17R2.1965 COC1=CC(=C(C=C1)C(=O)C2CCCC2)C MCULE-8150629240 [1,1,0,0,0,0|1,0,1]=4 177 B17R2.1965 COC1=CC(=C(C=C1)C(=O)N2CCCC2)I MCULE-4117007180 [1,1,0,0,0,0|0,0,1]=3 178 B17R2.1965 COC1=CC=C(C(=C1)Cl)C(=O)C2CCCC2 MCULE-3287426968 [1,1,0,0,0,0|1,0,1]=4 179 B17R2.2439 COC1=C(C=C(C=C1)C(=O)C2CCCC2)C MCULE-1832280119 [1,1,0,0,0,0|1,0,1]=4 180 B17R2.2439 COC1=C(C=C(C=C1)C(=O)C2CCCC2)F MCULE-8048086663 [1,1,0,0,0,0|1,0,1]=4 181 B17R2.2439 COC1=C(C=C(C=C1)C(=O)C2CCCN2)C MCULE-3460060202 [1,1,0,0,0,0|2,0,0]=4 182 B17R2.2439 COC1=C(C=C(C=C1)C(=O)C2CCCN2)C MCULE-6744323275 [1,1,0,0,0,0|2,0,0]=4 183 B17R2.2439 COC1=C(C=C(C=C1)C(=O)N2CCCC2)Br MCULE-5736764098 [1,1,0,0,0,0|0,0,1]=3 184 B17R2.2439 COC1=C(C=C(C=C1)C(=O)N2CCCC2)C MCULE-9871890417 [1,1,0,0,0,0|0,0,1]=3 185 B17R2.2439 COC1=C(C=C(C=C1)C(=O)N2CCCC2)N MCULE-6119865709 [1,1,0,0,0,0|0,0,1]=3 186 B17R2.2439 COC1=C(C=C(C=C1)C(=S)N2CCCC2)C MCULE-6600880427 [1,1,0,0,0,0|0,1,1]=4 187 B17R2.2439 COC1=CC=C(C=C1Br)C(=S)N2CCCC2 MCULE-7348959841 [1,1,0,0,0,0|0,1,1]=4 188 B17R2.2439 COC1=CC=C(C=C1I)C(=O)N2CCCC2 MCULE-4934500277 [1,1,0,0,0,0|0,0,1]=3 189 B17R2.2439 COC1=CC=C(C=C1O)C(=S)N2CCCC2 MCULE-2280334394 [1,1,0,0,0,0|0,1,1]=4 190 B17R2.2439 COC1=COC(=CC1=O)C(=O)N2CCCC2 MCULE-9493653100 [1,1,0,0,0,0|1,0,1]=4 191 B17R2.3320 CCOC1=CC=C(C=C1)C(=O)C2CCCC2 MCULE-5342953671 [1,1,0,0,0,0|1,0,1]=4 192 B17R2.3320 CCOC1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-5134386175 [1,1,0,0,0,0|0,0,1]=3 193 B17R2.3320 CCOC1=CC=C(C=C1)C(=S)N2CCCC2 MCULE-4373727599 [1,1,0,0,0,0|0,1,1]=4 194 B17R2.5652 CC(C)C1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-3308622575 [1,1,0,0,0,0|1,0,1]=4 195 B17R2.5652 CN(C)C1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-5249032413 [1,1,0,0,0,0|1,0,1]=4 196 B17R2.5652 C[C@H](N)C1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-3203116803 [1,1,0,0,0,0|1,0,1]=4 197 B17R2.5652 C[C@H](N)C1=CC=C(C=C1)C(=O)N2CCCC2 MCULE-9337866363 [1,1,0,0,0,0|1,0,1]=4 198 B17R2.2354 NCCC1=CC=C(C=C1)CN2CCCC2=O MCULE-2924281868 [1,1,0,0,0,0|1,0,1]=4 199 B17R2.2354 NCCC1=CC=C(C=C1)CN2CCCC2=O MCULE-5830856238 [1,1,0,0,0,0|1,0,1]=4 200 B17R2.3628 COC1=CC=C(C=C1)CN2CCCS2(=O)=O MCULE-4976799242 [1,1,0,0,0,0|1,0,1]=4 201 B17R2.3630 COC1=CC=C(C=C1)CN2CC(CC2=O)N MCULE-3308130145 [1,1,0,0,0,0|0,0,1]=3 202 B17R2.3630 COC1=CC=C(C=C1)CN2CC(CC2=O)N MCULE-6848260509 [1,1,0,0,0,0|0,0,1]=3 203 B17R2.3723 COC1=CC=C(C=C1)CN2C(=O)CCC2=O MCULE-3286855398 [1,1,0,0,0,0|0,0,2]=4 204 B17R2.3723 COC1=CC=C(C=C1)CN2C(=O)CCC2O MCULE-8340150443 [1,1,0,0,0,0|0,0,1]=3 205 B17R2.3752 COC1=CC=C(C=C1)CN2CCC(=O)C2=O MCULE-9966275068 [1,1,0,0,0,0|0,0,2]=4 206 B17R2.3752 COC1=CC=C(C=C1)CN2CCC(C2=O)Br MCULE-1450852752 [1,1,0,0,0,0|0,0,1]=3 207 B17R2.3752 COC1=CC=C(C=C1)CN2CCC(C2=O)C MCULE-6462205895 [1,1,0,0,0,0|0,0,1]=3 208 B17R2.3752 COC1=CC=C(C=C1)CN2CCC(C2=O)N MCULE-8287909637 [1,1,0,0,0,0|0,0,1]=3 209 B17R2.9454 COC1=CC=C(C=C1F)CN2CCCC2=O MCULE-9490179985 [1,1,0,0,0,0|0,0,1]=3 210 B17R2.445 CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2=O MCULE-6156541876 [1,1,0,0,0,0|1,0,0]=3 211 B17R2.445 CC1=CC=C(C=C1)S(=O)(=O)N2CCOC2=O MCULE-1635796061 [1,1,0,0,0,0|2,0,0]=4 212 B17R2.445 O=C1CCCN1S(=O)(=O)C2=CC=C(C=C2)Cl MCULE-1839377903 [1,1,0,0,0,0|2,0,0]=4 213 B17R2.445 O=C1CCCN1S(=O)(=O)C2=CC=C(C=C2)F MCULE-8469368167 [1,1,0,0,0,0|2,0,0]=4 214 B17R2.21013 CC1=CC=C(C=C1C)C(=O)N2CCSC2=S MCULE-5762007954 [1,1,0,0,0,0|1,1,0]=4 215 B17R2.56641 O=C1CCC(=O)N1C(=O)C2=CC=C(C=C2)Cl MCULE-7584450182 [1,1,0,0,0,0|1,0,1]=4 216 B17R2.56641 O=C1CCC(=O)N1C(=O)C2=CC=C(C=C2)F MCULE-9589525142 [1,1,0,0,0,0|1,0,1]=4 217 B19R2.2718 COC1=C(C=C(C=C1)C(=O)N2CCCC(C2)O)F MCULE-9619060809 [0,1,0,0,0,1|0,0,2]=4 218 B19R2.4264 CCOC1=CC=C(C=C1)C(=O)N2CCCC(C2)C MCULE-4708618436 [0,1,0,0,0,1|1,0,1]=4 219 B19R2.546497 COC1=CC=C(C=C1)C(=O)N2CC(CC(C2)C)C MCULE-8254113775 [0,1,0,0,0,1|1,0,1]=4 220 B19R2.4941 COC1=CC=C(C=C1)CC(=O)N2CCN=C2SC MCULE-1334575164 [0,1,0,0,0,1|1,1,0]=4 221 B19R2.195812 COC1=CC(=C(C=C1)NC(=O)N2CCCC2C)C MCULE-9589105693 [0,1,0,0,0,1|1,0,1]=4 222 B19R2.5085 CCC1CCCCN1C(=O)C2=CC=C(C=C2)OC MCULE-7450926726 [0,1,0,0,0,1|1,0,1]=4 223 B19R2.5085 COC1=CC=C(C=C1)C(=O)N2CCCCC2CO MCULE-6228842888 [0,1,0,0,0,1|0,0,2]=4 224 B19R2.5085 COC1=CC=C(C=C1)C(=O)N2CCOCC2CO MCULE-7174030301 [0,1,0,0,0,1|0,0,2]=4 225 B19R2.46835 CCOC1=CC=C(C=C1)C(=O)N2CCCCC2C MCULE-3253182654 [0,1,0,0,0,1|1,0,1]=4 226 B19R2.56427 COC1=CC=C(C=C1)C(=O)N2C(CCCC2C)C MCULE-6804991701 [0,1,0,0,0,1|1,0,1]=4 227 B19R2.46839 CCOC1=CC=C(C=C1)C(=O)NC2CCSC2=O MCULE-1373274489 [0,1,0,0,0,1|2,0,0]=4 228 B19R2.56417 CCC1=CC=C(C=C1)C(=O)ON2C(=O)CCC2=O MCULE-1633913456 [0,1,0,0,0,1|1,0,1]=4 229 B19R2.56417 COC1=CC=C(C=C1)C(=O)NN2C(=O)CSC2=S MCULE-6501713608 [0,1,0,0,0,1|1,0,1]=4 230 B19R2.56417 COC1=CC=C(C=C1)C(=O)ON2C(=O)CCC2=O MCULE-7277037192 [0,1,0,0,0,1|0,0,1]=3 231 B19R2.56417 COC1=CN=C(C=C1)C(=O)ON2C(=O)CCC2=O MCULE-4331448915 [0,1,0,0,0,1|1,0,1]=4 232 B19R2.5082 COC1=CC=C(C=C1)C(=O)C2CCCC2C(=O)O MCULE-3441783488 [0,2,0,0,0,0|1,0,1]=4 233 B19R2.5082 COC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)O MCULE-6589861687 [0,2,0,0,0,0|0,0,1]=3 234 B19R2.5082 COC1=CC=C(C=C1)C(=O)N2CCC[C@H]2C(=O)O MCULE-6393796385 [0,2,0,0,0,0|0,0,1]=3 235 B19R2.5082 COC1=CC=C(C=C1)C(=O)N2CCC[C@H]2C(=O)O MCULE-7946035600 [0,2,0,0,0,0|0,0,1]=3 236 B19R2.5082 COC1=CC=C(C=C1)C(=O)[C@@H]2CCC[C@H]2C(=O)O MCULE-4853187369 [0,2,0,0,0,0|1,0,1]=4 237 B19R2.5082 COC1=CC=C(C=C1)C(=O)[C@H]2CCC[C@H]2C(=O)O MCULE-4567270620 [0,2,0,0,0,0|1,0,1]=4 238 B19R2.5082 COC1=CC=C(C=C1)C(=O)[C@H]2CCC[C@H]2C(=O)O MCULE-6842103087 [0,2,0,0,0,0|1,0,1]=4 239 B19R2.46832 CCOC1=CC=C(C=C1)C(=O)N2CCN=C2SC MCULE-8042817397 [0,2,0,0,0,0|1,1,0]=4 240 B19R2.245509 COC1=C(C=C(C=C1)C(=O)N2CC[C@@H](C2=O)O)O MCULE-4953178015 [0,2,0,0,0,0|0,0,0]=2 241 B19R2.311488 COC1=CC=C(C=C1OC)C(=O)N2CCSC2=S MCULE-7676164886 [0,2,0,0,0,0|1,1,0]=4 242 B17R2.413015 COC1=CC=C2C(=O)C(CCC2=C1)C(=O)C MCULE-7280126359 [0,0,1,1,0,0|1,0,0]=3 243 B17R2.56 COC1=CC=C(C=C1)C(=O)NC2=NCCS2 MCULE-6151245693 [0,0,1,1,0,0|1,1,0]=4 244 B17R2.56 COC1=CC=C(C=C1)C(=O)NC2CCCC2 MCULE-3684819635 [0,0,1,1,0,0|1,0,1]=4 245 B17R2.68 COC1=CC=C(C=C1)C(=O)N2CCCCC2 MCULE-4597568214 [0,0,1,1,0,0|1,0,1]=4 246 B17R3.2413 CC1=CC=C(C=C1)C2=CN=C3N2CCC3 MCULE-6747072292 [1,0,0,1,0,0|2,0,0]=4 247 B17R3.2413 CC1=CC=C(C=C1)C2=C[NH+]=C3N2CCC3 MCULE-3432721011 [1,0,0,1,0,0|2,0,0]=4 248 B19R3.127 COC1=CC=C(C=C1)C2=C(N3CCCC3=N2)Br MCULE-6351956541 [0,0,0,1,0,1|2,0,0]=4 249 B19R3.127 COC1=CC=C(C=C1)C2=C(N3CCCC3=N2)Br MCULE-7077428993 [0,0,0,1,0,1|2,0,0]=4 250 B19R3.127 COC1=CC=C(C=C1)C2=C(N3CCCC3=N2)C MCULE-2654256343 [0,0,0,1,0,1|2,0,0]=4 251 B19R3.127 COC1=CC=C(C=C1)C2=C(N3CCCC3=N2)C MCULE-6635873376 [0,0,0,1,0,1|2,0,0]=4 252 B19R3.5 COC1=CC=C(C=C1)C2=CN=C3N2CCCC3 MCULE-5007658032 [0,0,0,1,0,1|2,0,0]=4 253 B19R3.5 COC1=CC=C(C=C1)C2=CN=C3N2CCCC3 MCULE-8284327654 [0,0,0,1,0,1|2,0,0]=4 254 B19R3.5 COC1=CC=C(C=C1)C2=NN=C3N2CCCN3 MCULE-2653231754 [0,0,0,1,0,1|2,0,0]=4 255 B19R3.5 COC1=CC=C(C=C1)C2=NN=C3N2CCNC3 MCULE-9602046055 [0,0,0,1,0,1|2,0,0]=4 256 B19R3.65488 COC1=CC=C(C=C1)C(=O)N2C3CCC2CC3 MCULE-9501500196 [0,1,0,1,0,0|1,0,1]=4 257 B19R3.2268 CCOC1=CC=C(C=C1)C2=CN=C3N2CCC3 MCULE-2972110976 [0,1,0,1,0,0|2,0,0]=4 258 B19R3.2268 CCOC1=CC=C(C=C1)C2=C[NH+]=C3N2CCC3 MCULE-6479615508 [0,1,0,1,0,0|2,0,0]=4 259 B15R2.7890 CCC1=CC=C(C=C1)C(=O)C2CCC2 MCULE-1903916601 [1,0,0,0,1,0|2,0,0]=4 260 B15R2.7890 COC1=CC=C(C=C1)C(=O)C2CCC2 MCULE-1819272006 [1,0,0,0,1,0|1,0,0]=3 261 B15R2.7890 COC1=CC=C(C=C1)C(=O)N2CCC2 MCULE-3526331234 [1,0,0,0,1,0|0,0,0]=2 262 B15R2.7890 COC1=NC=C(C=C1)C(=O)N2CCC2 MCULE-9430377601 [1,0,0,0,1,0|1,0,0]=3 263 B15R2.7890 CSC1=CC=C(C=C1)C(=O)C2CCC2 MCULE-8950860683 [1,0,0,0,1,0|1,1,0]=4 264 B15R2.7890 N#CC1=CC=C(C=C1)C(=O)N2CCC2 MCULE-9415946103 [1,0,0,0,1,0|2,0,0]=4 265 B15R2.7890 NCC1=CC=C(C=C1)C(=O)N2CCC2 MCULE-7999498077 [1,0,0,0,1,0|2,0,0]=4 266 B15R2.36 COC1=CC=C(C=C1)C2CCNC2=O MCULE-4585930441 [1,0,0,0,1,0|2,0,0]=4 267 B15R2.36 COC1=CC=C(C=C1)N2CC=CC2=O MCULE-7622834363 [1,0,0,0,1,0|0,0,2]=4 268 B15R2.36 COC1=CC=C(C=C1)N2CCCC2=O MCULE-1417656764 [1,0,0,0,1,0|0,0,0]=2 269 B15R2.36 COC1=CC=C(C=C1)N2CCNC2=O MCULE-9006031254 [1,0,0,0,1,0|1,0,0]=3 270 B15R2.36 COC1=CC=C(C=C1)N2CCSC2=O MCULE-2533701023 [1,0,0,0,1,0|1,0,0]=3 271 B15R2.36 COC1=CC=C(C=C1)N2CSCC2=O MCULE-7425916836 [1,0,0,0,1,0|1,0,0]=3 272 B15R2.36 COC1=CC=C(C=N1)N2CCNC2=O MCULE-2799164129 [1,0,0,0,1,0|2,0,0]=4 273 B15R2.36 CSC1=CC=C(C=C1)N2CCNC2=O MCULE-8229861707 [1,0,0,0,1,0|1,1,0]=4 274 B15R2.36 N#CC1=CC=C(C=C1)N2CCCC2=O MCULE-7103731894 [1,0,0,0,1,0|2,0,0]=4 275 B15R2.36 NCC1=CC=C(C=C1)N2CCCC2=O MCULE-1023130208 [1,0,0,0,1,0|2,0,0]=4 276 B15R2.36 NCC1=CC=C(C=C1)N2CCCC2=O MCULE-8520985834 [1,0,0,0,1,0|2,0,0]=4 277 B15R2.36 O=C1CCCN1C2=CC=C(C=C2)CCl MCULE-7363586398 [1,0,0,0,1,0|2,0,0]=4 278 B15R2.36 O=C1CCCN1C2=CC=C(C=C2)CO MCULE-5370503082 [1,0,0,0,1,0|2,0,0]=4 279 B15R2.36 O=CC1=CC=C(C=C1)N2CCCC2=O MCULE-7521155910 [1,0,0,0,1,0|2,0,0]=4 280 B17R1.21815 CCC1=CC=C(C=C1)OC(=O)NC(=O)CCBr MCULE-6660597899 [0,0,1,0,0,1|2,0,0]=4 281 B17R1.21815 CCCC(=O)NC(=S)NC1=CC=C(C=C1)CC MCULE-8220456711 [0,0,1,0,0,1|1,1,0]=4 282 B17R1.21815 CCOC(=O)CC(=O)CC1=CC=C(C=C1)OC MCULE-5463669917 [0,0,1,0,0,1|2,0,0]=4 283 B17R1.21815 CCOC(=O)CC(=O)NC1=CC=C(C=C1)OC MCULE-8551242915 [0,0,1,0,0,1|2,0,0]=4 284 B17R1.21815 CCOC(=O)NC(=S)NC1=CC=C(C=C1)OC MCULE-3046849914 [0,0,1,0,0,1|1,1,0]=4 285 B17R1.21815 COC1=CC=C(C=C1)NC(=O)NC(=O)CC#N MCULE-8353369322 [0,0,1,0,0,1|1,0,1]=4 286 B17R1.6501 C=COCCNC(=O)NC1=CC=C(C=C1)OC MCULE-6245413758 [0,0,1,0,0,1|2,0,0]=4 287 B17R1.6501 CCCCCNC(=O)CC1=CC=C(C=C1)OC MCULE-6163304558 [0,0,1,0,0,1|1,0,1]=4 288 B17R1.6501 COCCCNC(=O)NC1=CC=C(C=C1)OC MCULE-8820427544 [0,0,1,0,0,1|2,0,0]=4 289 B17R2.52 CCC1=CC=C(C=C1)NC(=O)N2CCCC2 MCULE-3251330883 [1,0,0,0,0,1|1,0,1]=4 290 B17R2.52 COC1=CC=C(C=C1)CC(=O)N2CCCC2 MCULE-1805506616 [1,0,0,0,0,1|0,0,1]=3 291 B17R2.52 COC1=CC=C(C=C1)NC(=O)C2CCCC2 MCULE-4084226900 [1,0,0,0,0,1|1,0,1]=4 292 B17R2.52 COC1=CC=C(C=C1)NC(=O)C2CCCN2 MCULE-3481174167 [1,0,0,0,0,1|2,0,0]=4 293 B17R2.52 COC1=CC=C(C=C1)NC(=O)C2CCCN2 MCULE-7509453598 [1,0,0,0,0,1|2,0,0]=4 294 B17R2.52 COC1=CC=C(C=C1)NC(=O)C2CCCO2 MCULE-8955597324 [1,0,0,0,0,1|2,0,0]=4 295 B17R2.52 COC1=CC=C(C=C1)NC(=O)N2CCSC2 MCULE-3461723799 [1,0,0,0,0,1|1,0,1]=4 296 B17R2.52 COC1=CC=C(C=C1)NC(=S)N2CCCC2 MCULE-2200914248 [1,0,0,0,0,1|0,1,1]=4 297 B17R2.52 COC1=CC=C(C=C1)OC(=O)C2CCCC2 MCULE-3906359158 [1,0,0,0,0,1|1,0,1]=4 298 B17R2.47 COC1=CC=C(C=C1)CC2CCCC(=O)C2 MCULE-5443583626 [1,0,0,0,0,1|1,0,1]=4 299 B17R2.47 COC1=CC=C(C=C1)NC2=CC(=O)CCC2 MCULE-1307556234 [1,0,0,0,0,1|2,0,0]=4 300 B17R2.54 COC1=CC=C(C=C1)NC=C2CCOC2=O MCULE-6483319642 [1,0,0,0,0,1|2,0,0]=4 301 B17R2.79 COC1=CC=C(C=C1)C=C2CCCCC2=O MCULE-3346341033 [1,0,0,0,0,1|1,0,0]=3 302 B17R2.79 COC1=CC=C(C=C1)C=C2CCCNC2=O MCULE-1948169124 [1,0,0,0,0,1|1,0,0]=3 303 B17R2.79 COC1=CC=C(C=C1)CN2CC=CCC2=O MCULE-4034277401 [1,0,0,0,0,1|0,0,2]=4 304 B17R2.79 COC1=CC=C(C=C1)CN2CCC=CC2=O MCULE-3259305660 [1,0,0,0,0,1|0,0,2]=4 305 B17R2.79 COC1=CC=C(C=C1)CN2CCNCC2=O MCULE-2679540953 [1,0,0,0,0,1|0,0,1]=3 306 B17R2.79 COC1=CC=C(C=C1)CN2CCNCC2=O MCULE-3866939035 [1,0,0,0,0,1|0,0,1]=3 307 B17R2.191 CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C MCULE-7407482061 [1,0,0,0,0,1|1,0,1]=4 308 B17R2.191 CC1=CC=C(C=C1)C(=O)N2CCCC(C2)N MCULE-8466122665 [1,0,0,0,0,1|1,0,1]=4 309 B17R2.191 CC1=CC=C(C=C1)C(=O)N2CCCC(C2)N MCULE-9493818015 [1,0,0,0,0,1|1,0,1]=4 310 B17R2.191 NC1=CC=C(C=C1)C(=O)N2CCNC(=O)C2 MCULE-4087350494 [1,0,0,0,0,1|2,0,0]=4 311 B17R2.381 CC1=CC=C(C=C1)C(=O)N2CCCCC2C MCULE-4766724697 [1,0,0,0,0,1|1,0,1]=4 312 B17R2.381 CC1=CC=C(C=C1)C(=O)N2CCNCC2C MCULE-6611196651 [1,0,0,0,0,1|1,0,1]=4 313 B17R2.381 CC1=CC=C(C=C1)C(=O)N2CCOCC2C MCULE-7459636450 [1,0,0,0,0,1|1,0,1]=4 314 B17R2.384 CC1=CC=C(C=C1)C(=O)NC2CCSC2=O MCULE-3420544171 [1,0,0,0,0,1|2,0,0]=4 315 B17R2.384 O=C(CC1CCCC1=O)C2=CC=C(C=C2)F MCULE-1102667213 [1,0,0,0,0,1|2,0,0]=4 316 B17R2.484 CC1=CC=C(C=C1)NC(=O)N2CCCC2=O MCULE-2211593523 [1,0,0,0,0,1|0,0,0]=2 317 B17R2.71199 COC1=CC(=CC=C1)C(=O)N2CCSC2=S MCULE-8672956896 [0,0,0,0,1,1|1,1,0]=4 318 B19R2.54 COC1=CC=C(C=C1)CC(=O)N2CCCC(C2)C MCULE-2442705482 [0,0,0,0,0,2|1,0,1]=4 319 B19R2.56362 COC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C MCULE-8842402696 [0,0,0,0,0,2|2,0,0]=4 320 B19R2.4944 COC1=CC=C(C=C1)CC(=O)N2CCNCC2C MCULE-2777709569 [0,0,0,0,0,2|1,0,1]=4 321 B19R2.4948 COC1=CC=C(C=C1)NC(=O)CN2CCNC2=S MCULE-2604012481 [0,0,0,0,0,2|1,1,0]=4 322 B19R2.4948 COC1=CC=C(C=C1)NC(=O)CN2CCNC2=S MCULE-5719876323 [0,0,0,0,0,2|1,1,0]=4 323 B19R2.5055 COC1=CC=C(C=C1)CNC(=O)C2CCNC2=O MCULE-3289394854 [0,0,0,0,0,2|2,0,0]=4 324 B19R2.5003 COC1=CC=C(C=C1)C(=O)/C=C/2\NCCOC2=O MCULE-4987336804 [0,0,0,0,0,2|2,0,0]=4 325 B19R2.5003 COC1=CC=C(C=C1)C(=O)C=C2NCCNC2=O MCULE-4167792289 [0,0,0,0,0,2|2,0,0]=4 326 B19R2.5003 COC1=CC=C(C=C1)C(=O)C=C2NCCOC2=O MCULE-2664442724 [0,0,0,0,0,2|2,0,0]=4 327 B19R2.5003 COC1=NC=C(C=C1)C(=O)NC2CCCNC2=O MCULE-4544079180 [0,0,0,0,0,2|2,0,0]=4 328 B19R2.5080 COC1=CC=C(C=C1)C(=O)CCC2CCCC2=O MCULE-5012296861 [0,0,0,0,0,2|1,0,0]=3