0 B16R2.40078 COC1=C2OCOC2=CC(=C1)CC(C)Br MCULE-9282514225 [0,0,0,0,0,0|1,0,0]=1 1 B16R2.40078 COC1=CC(=CC2=C1OCO2)C=C(Br)Br MCULE-7812380568 [0,0,0,0,0,0|2,0,2]=4 2 B16R2.40078 COC1=CC(=CC2=C1OCO2)CC(C)N MCULE-2558406408 [0,0,0,0,0,0|0,0,0]=0 3 B16R2.40078 COC1=CC(=CC2=C1OCO2)CC(C)N MCULE-5396021301 [0,0,0,0,0,0|0,0,0]=0 4 B15R2.4367 C=CCC1=CC2=C(OCO2)C(=C1)OC MCULE-6209105333 [1,0,0,0,0,0|0,0,2]=3 5 B15R2.4367 CC=CC1=CC2=C(OCO2)C(=C1)OC MCULE-6712038376 [1,0,0,0,0,0|0,0,2]=3 6 B15R2.4367 COC1=CC(=CC2=C1OCO2)/C=N/O MCULE-5533273643 [1,0,0,0,0,0|2,0,1]=4 7 B15R2.4367 COC1=CC(=CC2=C1OCO2)C#CBr MCULE-9933035786 [1,0,0,0,0,0|1,0,2]=4 8 B15R2.4367 COC1=CC(=CC2=C1OCO2)C=NO MCULE-5296636031 [1,0,0,0,0,0|2,0,1]=4 9 B15R2.4367 COC1=CC(=CC2=C1OCO2)CC#N MCULE-7782446662 [1,0,0,0,0,0|0,0,2]=3 10 B15R2.4367 COC1=CC(=CC2=C1OCO2)CCN MCULE-6742727939 [1,0,0,0,0,0|0,0,0]=1 11 B15R2.4367 COC1=CC(=CC2=C1OCO2)CCN MCULE-8942586750 [1,0,0,0,0,0|0,0,0]=1 12 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@@H](N)C(F)F MCULE-3752990087 [0,1,0,0,0,0|2,0,0]=3 13 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@@H](N)C(F)F MCULE-9492684483 [0,1,0,0,0,0|2,0,0]=3 14 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@@H](N)[C@H](C)O MCULE-1275782329 [0,1,0,0,0,0|1,0,0]=2 15 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@@H](N)[C@H](C)O MCULE-3572658162 [0,1,0,0,0,0|1,0,0]=2 16 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@H](N)C(F)F MCULE-1054974288 [0,1,0,0,0,0|2,0,0]=3 17 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@H](N)C(F)F MCULE-4850294610 [0,1,0,0,0,0|2,0,0]=3 18 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@H](N)[C@@H](C)O MCULE-6235289828 [0,1,0,0,0,0|1,0,0]=2 19 B17R2.68833 COC1=CC(=CC2=C1OCO2)[C@H](N)[C@@H](C)O MCULE-8974798208 [0,1,0,0,0,0|1,0,0]=2 20 B17R2.68884 CNC(C)CC1=CC(=C2OCOC2=C1)OC MCULE-1164361449 [0,1,0,0,0,0|0,0,0]=1 21 B17R2.68884 CNC(C)CC1=CC(=C2OCOC2=C1)OC MCULE-9976284855 [0,1,0,0,0,0|0,0,0]=1 22 B17R2.68884 COC1=C2OCOC2=CC(=C1)CC(O)CO MCULE-8680280992 [0,1,0,0,0,0|1,0,0]=2 23 B15R1.390 COC1=CC(=CC(=C1O)OC)CC(=O)C MCULE-6447550253 [0,0,1,0,0,0|1,0,1]=3 24 B15R1.390 COC1=CC(=CC(=C1O)OC)CC(=O)Cl MCULE-3762032326 [0,0,1,0,0,0|2,0,1]=4 25 B15R1.390 COC1=CC(=CC(=C1O)OC)CC(=O)N MCULE-8871813480 [0,0,1,0,0,0|1,0,1]=3 26 B15R1.390 COC1=CC(=CC(=C1O)OC)CC(=O)O MCULE-7468196609 [0,0,1,0,0,0|2,0,1]=4 27 B15R1.9548 CCOC1=CC=C(C=C1OC)CC(=O)C MCULE-5825201967 [0,0,1,0,0,0|2,0,1]=4 28 B15R2.22662 COC1=C2OCOC2=CC(=C1)C(=O)O MCULE-6505497764 [0,0,0,0,1,0|2,0,1]=4 29 B15R2.22662 COC1=CC(=CC2=C1OCO2)C(=O)N MCULE-6875938118 [0,0,0,0,1,0|1,0,1]=3 30 B15R2.22662 COC1=CC(=CC2=C1OCO2)N(=O)=O MCULE-5562421420 [0,0,0,0,1,0|3,0,0]=4 31 B15R2.22662 COC1=CC(=CC2=C1OCO2)[C@@H](C)N MCULE-2853499273 [0,0,0,0,1,0|0,0,0]=1 32 B15R2.22662 COC1=CC(=CC2=C1OCO2)[C@@H](C)N MCULE-5166400713 [0,0,0,0,1,0|0,0,0]=1 33 B15R2.22662 COC1=CC(=CC2=C1OCO2)[C@H](C)N MCULE-3040318877 [0,0,0,0,1,0|0,0,0]=1 34 B15R2.22662 COC1=CC(=CC2=C1OCO2)[C@H](C)N MCULE-6231171337 [0,0,0,0,1,0|0,0,0]=1 35 B17R2.68834 COC1=C2OCOC2=CC(=C1)CCC(=O)O MCULE-9339815081 [0,0,0,0,0,1|2,0,1]=4 36 B14R1.3237 CNCC1=CC(=C(C(=C1)Br)OC)OC MCULE-8815430444 [1,0,1,0,0,0|2,0,0]=4 37 B14R1.3237 CNCC1=CC(=C(C(=C1)Br)OC)OC MCULE-8862590248 [1,0,1,0,0,0|2,0,0]=4 38 B14R1.3237 CNCC1=CC(=C(C(=C1)Cl)OC)OC MCULE-7222893543 [1,0,1,0,0,0|2,0,0]=4 39 B14R1.3237 CNCC1=CC(=C(C(=C1)Cl)OC)OC MCULE-7368704750 [1,0,1,0,0,0|2,0,0]=4 40 B14R1.3237 COC1=C(C(=CC(=C1)CCN)Br)OC MCULE-3113880125 [1,0,1,0,0,0|1,0,0]=3 41 B14R1.3237 COC1=C(C(=CC(=C1)CCN)Br)OC MCULE-6754458617 [1,0,1,0,0,0|1,0,0]=3 42 B14R1.3651 C=C(C)CC1=CC(=C(C=C1)OC)OC MCULE-4254257045 [1,0,1,0,0,0|1,0,1]=4 43 B14R1.3651 COC1=C(C=C(C=C1)CC(=O)N)OC MCULE-2374637580 [1,0,1,0,0,0|1,0,1]=4 44 B14R1.3651 COC1=C(C=C(C=C1)CC(=S)N)OC MCULE-2611162186 [1,0,1,0,0,0|1,0,1]=4 45 B14R1.3651 COC1=C(C=C(C=C1)CC(C)N)OC MCULE-7873825278 [1,0,1,0,0,0|0,0,0]=2 46 B14R1.3651 COC1=C(C=C(C=C1)CC(C)N)OC MCULE-8136102161 [1,0,1,0,0,0|0,0,0]=2 47 B14R1.3651 COC1=C(C=C(C=C1)CC(C)O)OC MCULE-3015974488 [1,0,1,0,0,0|1,0,0]=3 48 B14R1.3651 COC1=CC=C(C=C1OC)CC(=N)N MCULE-3798981516 [1,0,1,0,0,0|1,0,1]=4 49 B14R1.3651 COC1=CC=C(C=C1OC)CC(=N)N MCULE-5175813147 [1,0,1,0,0,0|1,0,1]=4 50 B14R1.3651 COC1=CC=C(C=C1OC)CC(=N)N MCULE-8636723686 [1,0,1,0,0,0|1,0,1]=4 51 B14R1.3651 COC1=CC=C(C=C1OC)CC(=O)C MCULE-1687299329 [1,0,1,0,0,0|1,0,1]=4 52 B14R1.3651 COC1=CC=C(C=C1OC)C[C@@H](C)N MCULE-7802962307 [1,0,1,0,0,0|0,0,0]=2 53 B14R1.3651 COC1=CC=C(C=C1OC)C[C@H](C)N MCULE-6463237365 [1,0,1,0,0,0|0,0,0]=2 54 B14R1.3651 COC1=CC=C(C=C1OC)C[C@H](C)O MCULE-1608444421 [1,0,1,0,0,0|1,0,0]=3 55 B14R1.3651 COC1=CC=C(C=C1OC)C[C@H](C)O MCULE-4959674138 [1,0,1,0,0,0|1,0,0]=3 56 B14R1.3651 COC1=CC=C(C=C1OC)OC(C)C MCULE-3147257093 [1,0,1,0,0,0|2,0,0]=4 57 B14R1.3651 COC1=CC=C(C=C1OC)SC(C)C MCULE-3487892047 [1,0,1,0,0,0|2,0,0]=4 58 B14R1.3651 [C@H](C)(O)CC1=CC(=C(C=C1)OC)OC MCULE-7553279638 [1,0,1,0,0,0|1,0,0]=3 59 B14R1.12535 COC1=C(C=C(C=C1C)CC(C)O)C MCULE-4142304840 [1,0,1,0,0,0|2,0,0]=4 60 B14R1.379 C=C(C)CC1=CC(=CC(=C1)OC)OC MCULE-2246711757 [1,0,1,0,0,0|1,0,1]=4 61 B14R1.379 COC1=CC(=CC(=C1)OC)CC(=N)N MCULE-4720439759 [1,0,1,0,0,0|1,0,1]=4 62 B14R1.379 COC1=CC(=CC(=C1)OC)CC(=N)N MCULE-7287917613 [1,0,1,0,0,0|1,0,1]=4 63 B14R1.379 COC1=CC(=CC(=C1)OC)CC(=O)C MCULE-9611748304 [1,0,1,0,0,0|1,0,1]=4 64 B14R1.379 COC1=CC(=CC(=C1)OC)CC(=O)N MCULE-2444812222 [1,0,1,0,0,0|1,0,1]=4 65 B14R1.379 COC1=CC(=CC(=C1)OC)CC(C)N MCULE-1755424466 [1,0,1,0,0,0|0,0,0]=2 66 B14R1.379 COC1=CC(=CC(=C1)OC)CC(C)N MCULE-7113516177 [1,0,1,0,0,0|0,0,0]=2 67 B14R1.379 COC1=CC(=CC(=C1)SC(C)C)OC MCULE-4545656613 [1,0,1,0,0,0|2,0,0]=4 68 B14R1.3236 C=CCC1=CC(=C(C(=C1)OC)O)OC MCULE-3042673985 [1,0,1,0,0,0|0,0,2]=4 69 B14R1.3236 CC=CC1=CC(=C(C(=C1)OC)O)OC MCULE-9888937169 [1,0,1,0,0,0|0,0,2]=4 70 B14R1.3236 CCCC1=CC(=C(C(=C1)OC)O)OC MCULE-3154995567 [1,0,1,0,0,0|0,0,0]=2 71 B14R1.3236 COC1=CC(=CC(=C1C)OC)CCN MCULE-2192569796 [1,0,1,0,0,0|1,0,0]=3 72 B14R1.3236 COC1=CC(=CC(=C1O)OC)CC#N MCULE-1634070303 [1,0,1,0,0,0|0,0,2]=4 73 B14R1.3236 COC1=CC(=CC(=C1O)OC)CCN MCULE-9467298646 [1,0,1,0,0,0|0,0,0]=2 74 B14R1.3236 COC1=CC(=CC(=C1O)OC)CCN MCULE-9945611522 [1,0,1,0,0,0|0,0,0]=2 75 B14R1.6788 CCOC1=C(C=C(C=C1)CNC)OC MCULE-2518158867 [1,0,1,0,0,0|2,0,0]=4 76 B14R1.6788 CCOC1=C(C=C(C=C1)CNC)OC MCULE-9920432450 [1,0,1,0,0,0|2,0,0]=4 77 B14R1.6788 CCOC1=CC=C(C=C1OC)CCN MCULE-6429149889 [1,0,1,0,0,0|1,0,0]=3 78 B14R2.1101 C#CC1=CC2=C(OCO2)C(=C1)OC MCULE-3695633623 [2,0,0,0,0,0|0,0,2]=4 79 B14R2.1101 COC1=C2OCOC2=CC(=C1)C#N MCULE-8778019334 [2,0,0,0,0,0|0,0,2]=4 80 B14R2.1101 COC1=C2OCOC2=CC(=C1)CN MCULE-8634770711 [2,0,0,0,0,0|0,0,0]=2 81 B14R2.1101 COC1=C2OCOC2=CC(=C1)CO MCULE-9684334946 [2,0,0,0,0,0|1,0,0]=3 82 B14R2.1101 COC1=CC(=CC2=C1OCO2)C=O MCULE-8723569120 [2,0,0,0,0,0|1,0,1]=4 83 B14R2.1101 COC1=CC(=CC2=C1OCO2)CN MCULE-9654018454 [2,0,0,0,0,0|0,0,0]=2 84 B14R2.1008 C=C(C)CC1=CC=C2OCOC2=C1 MCULE-2962263201 [2,0,0,0,0,0|1,0,1]=4 85 B14R2.1008 CC(=O)CC1=CC=C2OCOC2=C1 MCULE-5560751145 [2,0,0,0,0,0|1,0,1]=4 86 B14R2.1008 CC(C)SC1=CC=C2OCOC2=C1 MCULE-3063103466 [2,0,0,0,0,0|2,0,0]=4 87 B14R2.1008 CC(N)CC1=CC2=C(C=C1)CCC2 MCULE-2209009510 [2,0,0,0,0,0|2,0,0]=4 88 B14R2.1008 CC(N)CC1=CC2=C(C=C1)CCO2 MCULE-5677784350 [2,0,0,0,0,0|1,0,0]=3 89 B14R2.1008 CC(N)CC1=CC2=C(C=C1)CCO2 MCULE-7407797823 [2,0,0,0,0,0|1,0,0]=3 90 B14R2.1008 CC(N)CC1=CC2=C(C=C1)OC=C2 MCULE-4841159295 [2,0,0,0,0,0|1,0,1]=4 91 B14R2.1008 CC(N)CC1=CC2=C(C=C1)OC=C2 MCULE-8830433863 [2,0,0,0,0,0|1,0,1]=4 92 B14R2.1008 CC(N)CC1=CC2=C(C=C1)OCO2 MCULE-1294662651 [2,0,0,0,0,0|0,0,0]=2 93 B14R2.1008 CC(N)CC1=CC2=C(C=C1)OCO2 MCULE-6462457769 [2,0,0,0,0,0|0,0,0]=2 94 B14R2.1008 CC(N)CC1=CC=C2CCCC2=C1 MCULE-3366484294 [2,0,0,0,0,0|2,0,0]=4 95 B14R2.1008 CC(O)CC1=CC=C2OCOC2=C1 MCULE-1377715219 [2,0,0,0,0,0|1,0,0]=3 96 B14R2.1008 CN(C)CC1=CC=C2OCOC2=C1 MCULE-7113933598 [2,0,0,0,0,0|2,0,0]=4 97 B14R2.1008 C[C@@H](O)CC1=CC2=C(C=C1)OCO2 MCULE-6695171739 [2,0,0,0,0,0|1,0,0]=3 98 B14R2.1008 C[C@H](O)CC1=CC2=C(C=C1)OCO2 MCULE-2906842800 [2,0,0,0,0,0|1,0,0]=3 99 B14R2.1008 N=C(N)CC1=CC2=C(C=C1)OCO2 MCULE-3574957496 [2,0,0,0,0,0|1,0,1]=4 100 B14R2.1008 N=C(N)CC1=CC2=C(C=C1)OCO2 MCULE-5533727980 [2,0,0,0,0,0|1,0,1]=4 101 B14R2.1008 NC(=O)CC1=CC2=C(C=C1)OCO2 MCULE-2574088454 [2,0,0,0,0,0|1,0,1]=4 102 B16R1.412 C=C(C)CC1=CC(=C(C(=C1)OC)OC)OC MCULE-4797313196 [0,1,1,0,0,0|1,0,1]=4 103 B16R1.412 COC1=CC(=CC(=C1OC)OC)CC(=O)C MCULE-5197904035 [0,1,1,0,0,0|1,0,1]=4 104 B16R1.412 COC1=CC(=CC(=C1OC)OC)CC(=O)N MCULE-4067300830 [0,1,1,0,0,0|1,0,1]=4 105 B16R1.412 COC1=CC(=CC(=C1OC)OC)CC(C)N MCULE-1110204508 [0,1,1,0,0,0|0,0,0]=2 106 B16R1.412 COC1=CC(=CC(=C1OC)OC)CC(C)N MCULE-7438553731 [0,1,1,0,0,0|0,0,0]=2 107 B16R1.422 COC1=CC(=CC(=C1Br)OC)[C@@H](N)[C@H](C)O MCULE-3044318788 [0,1,1,0,0,0|2,0,0]=4 108 B16R1.422 COC1=CC(=CC(=C1Br)OC)[C@@H](N)[C@H](C)O MCULE-7516519173 [0,1,1,0,0,0|2,0,0]=4 109 B16R1.422 COC1=CC(=CC(=C1Br)OC)[C@H](N)[C@@H](C)O MCULE-6135095191 [0,1,1,0,0,0|2,0,0]=4 110 B16R1.422 COC1=CC(=CC(=C1Br)OC)[C@H](N)[C@@H](C)O MCULE-7449128350 [0,1,1,0,0,0|2,0,0]=4 111 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@@H](N)C(F)F MCULE-2377813150 [0,1,1,0,0,0|2,0,0]=4 112 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@@H](N)C(F)F MCULE-5005879982 [0,1,1,0,0,0|2,0,0]=4 113 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@@H](N)[C@H](C)O MCULE-1542259004 [0,1,1,0,0,0|1,0,0]=3 114 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@@H](N)[C@H](C)O MCULE-2136509052 [0,1,1,0,0,0|1,0,0]=3 115 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@@H](O)[C@@H](C)O MCULE-1198291978 [0,1,1,0,0,0|1,0,0]=3 116 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@H](N)C(F)F MCULE-3681032547 [0,1,1,0,0,0|2,0,0]=4 117 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@H](N)C(F)F MCULE-5135862048 [0,1,1,0,0,0|2,0,0]=4 118 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@H](N)[C@@H](C)O MCULE-1238678103 [0,1,1,0,0,0|1,0,0]=3 119 B16R1.422 COC1=CC(=CC(=C1O)OC)[C@H](N)[C@@H](C)O MCULE-5567030762 [0,1,1,0,0,0|1,0,0]=3 120 B16R1.11588 COC(=O)CC1=CC(=C(C(=C1)OC)O)OC MCULE-5552945222 [0,1,1,0,0,0|1,0,1]=4 121 B16R1.11588 COC1=CC(=CC(=C1O)OC)CC(=O)NN MCULE-2101539355 [0,1,1,0,0,0|1,0,1]=4 122 B16R1.11588 COC1=CC(=CC(=C1O)OC)CC(O)CO MCULE-4759387525 [0,1,1,0,0,0|1,0,0]=3 123 B16R1.9380 CCOC1=C(C=C(C=C1)[C@@H](N)[C@H](C)O)OC MCULE-3548149501 [0,1,1,0,0,0|2,0,0]=4 124 B16R1.9380 CCOC1=C(C=C(C=C1)[C@@H](N)[C@H](C)O)OC MCULE-7299457614 [0,1,1,0,0,0|2,0,0]=4 125 B16R1.9380 CCOC1=C(C=C(C=C1)[C@H](N)[C@@H](C)O)OC MCULE-3738207667 [0,1,1,0,0,0|2,0,0]=4 126 B16R1.9380 CCOC1=C(C=C(C=C1)[C@H](N)[C@@H](C)O)OC MCULE-6312463097 [0,1,1,0,0,0|2,0,0]=4 127 B16R2.12177 COC1=C2OC=CC2=CC(=C1)CCCO MCULE-4071568494 [1,1,0,0,0,0|1,0,1]=4 128 B16R2.12177 COC1=C2OCOC2=CC(=C1)C=CCO MCULE-8682340959 [1,1,0,0,0,0|0,0,2]=4 129 B16R2.12177 COC1=CC(=CC2=C1OCO2)/C=C/CO MCULE-8414031647 [1,1,0,0,0,0|0,0,2]=4 130 B16R2.12177 COC1=CC(=CC2=C1OCO2)CCCI MCULE-2257506239 [1,1,0,0,0,0|0,0,0]=2 131 B16R2.12177 COC1=CC(=CC2=C1OCO2)CCCO MCULE-6467303102 [1,1,0,0,0,0|0,0,0]=2 132 B16R2.40075 C=C[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-9540131445 [1,1,0,0,0,0|0,0,2]=4 133 B16R2.40075 C=C[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-9872550610 [1,1,0,0,0,0|0,0,2]=4 134 B16R2.40075 C=C[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-3816151714 [1,1,0,0,0,0|0,0,2]=4 135 B16R2.40075 C=C[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-9019989645 [1,1,0,0,0,0|0,0,2]=4 136 B16R2.40075 CCC(=O)C1=CC2=C(OCO2)C(=C1)OC MCULE-6877638028 [1,1,0,0,0,0|0,0,1]=3 137 B16R2.40075 CC[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-7636584543 [1,1,0,0,0,0|0,0,0]=2 138 B16R2.40075 CC[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-8596005869 [1,1,0,0,0,0|0,0,0]=2 139 B16R2.40075 CC[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-6227076204 [1,1,0,0,0,0|0,0,0]=2 140 B16R2.40075 CC[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-7003591582 [1,1,0,0,0,0|0,0,0]=2 141 B16R2.40075 COC(=O)C1=CC2=C(OCO2)C(=C1)OC MCULE-3784085177 [1,1,0,0,0,0|1,0,1]=4 142 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@@H](N)CF MCULE-3071445948 [1,1,0,0,0,0|1,0,0]=3 143 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@@H](N)CF MCULE-4955208605 [1,1,0,0,0,0|1,0,0]=3 144 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@@H](N)CN MCULE-4039257370 [1,1,0,0,0,0|0,0,0]=2 145 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@@H](N)CN MCULE-8162486071 [1,1,0,0,0,0|0,0,0]=2 146 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@@H](N)CO MCULE-5535847137 [1,1,0,0,0,0|1,0,0]=3 147 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@@H](N)CO MCULE-6176671416 [1,1,0,0,0,0|1,0,0]=3 148 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@H](N)CF MCULE-1614933877 [1,1,0,0,0,0|1,0,0]=3 149 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@H](N)CF MCULE-4269784571 [1,1,0,0,0,0|1,0,0]=3 150 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@H](N)CN MCULE-6464244670 [1,1,0,0,0,0|0,0,0]=2 151 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@H](N)CN MCULE-9764903859 [1,1,0,0,0,0|0,0,0]=2 152 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@H](N)CO MCULE-3258962601 [1,1,0,0,0,0|1,0,0]=3 153 B16R2.40075 COC1=CC(=CC2=C1OCO2)[C@H](N)CO MCULE-8126287599 [1,1,0,0,0,0|1,0,0]=3 154 B16R2.33586 CNC(C)CC1=CC2=C(OCO2)C(=C1)O MCULE-5622237383 [1,1,0,0,0,0|0,0,0]=2 155 B16R2.33586 CNC(C)CC1=CC2=C(OCO2)C(=C1)O MCULE-9580952429 [1,1,0,0,0,0|0,0,0]=2 156 B16R2.33586 CN[C@@H](C)CC1=CC2=C(OCO2)C(=C1)O MCULE-3195415327 [1,1,0,0,0,0|0,0,0]=2 157 B16R2.33586 CN[C@@H](C)CC1=CC2=C(OCO2)C(=C1)O MCULE-8221236929 [1,1,0,0,0,0|0,0,0]=2 158 B16R2.33586 CN[C@H](C)CC1=CC2=C(OCO2)C(=C1)O MCULE-1216210899 [1,1,0,0,0,0|0,0,0]=2 159 B16R2.33586 CN[C@H](C)CC1=CC2=C(OCO2)C(=C1)O MCULE-7565867371 [1,1,0,0,0,0|0,0,0]=2 160 B18R2.113905 C=C(C)C[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-2461368089 [0,1,0,0,0,1|1,0,1]=4 161 B18R2.113905 C=C(C)C[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-5176529504 [0,1,0,0,0,1|1,0,1]=4 162 B18R2.113905 C=C(C)C[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-4472430499 [0,1,0,0,0,1|1,0,1]=4 163 B18R2.113905 C=C(C)C[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-9025998092 [0,1,0,0,0,1|1,0,1]=4 164 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@@H](N)CC(C)C MCULE-3735331059 [0,1,0,0,0,1|1,0,0]=3 165 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@@H](N)CC(C)C MCULE-3939056923 [0,1,0,0,0,1|1,0,0]=3 166 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@@H](N)CC(F)F MCULE-4075060360 [0,1,0,0,0,1|2,0,0]=4 167 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@@H](N)CC(F)F MCULE-6458508840 [0,1,0,0,0,1|2,0,0]=4 168 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@H](N)CC(C)C MCULE-1893979646 [0,1,0,0,0,1|1,0,0]=3 169 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@H](N)CC(C)C MCULE-5914403790 [0,1,0,0,0,1|1,0,0]=3 170 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@H](N)CC(F)F MCULE-1812191352 [0,1,0,0,0,1|2,0,0]=4 171 B18R2.113905 COC1=CC(=CC2=C1OCO2)[C@H](N)CC(F)F MCULE-5972774868 [0,1,0,0,0,1|2,0,0]=4 172 B18R2.253521 COC1=C(C=C2OCOC2=C1OC)CC(C)N MCULE-2458166494 [0,2,0,0,0,0|0,0,0]=2 173 B18R2.253521 COC1=C(C=C2OCOC2=C1OC)CC(C)N MCULE-8818893012 [0,2,0,0,0,0|0,0,0]=2 174 B18R2.253521 COC1=C(C=C2OCOC2=C1OC)CC(C)N MCULE-8821461942 [0,2,0,0,0,0|0,0,0]=2 175 B18R2.107599 COC1=CC(=C(C2=C1OCO2)OC)CC(C)Cl MCULE-8472791187 [0,2,0,0,0,0|1,0,0]=3 176 B18R2.113910 CCC(C)[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-4141585867 [0,2,0,0,0,0|1,0,0]=3 177 B18R2.113910 CCC(C)[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-7956299807 [0,2,0,0,0,0|1,0,0]=3 178 B18R2.113910 CCC(C)[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-3507386862 [0,2,0,0,0,0|1,0,0]=3 179 B18R2.113910 CCC(C)[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-6808240010 [0,2,0,0,0,0|1,0,0]=3 180 B18R2.113910 CC[C@@H](O)[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-5797707334 [0,2,0,0,0,0|1,0,0]=3 181 B18R2.113910 CC[C@@H](O)[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-9176742341 [0,2,0,0,0,0|1,0,0]=3 182 B18R2.113910 CC[C@H](O)[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-2071473053 [0,2,0,0,0,0|1,0,0]=3 183 B18R2.113910 CC[C@H](O)[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-2389281973 [0,2,0,0,0,0|1,0,0]=3 184 B18R2.113910 CNC(C)C(=O)C1=CC(=C2OCOC2=C1)OC MCULE-6797775429 [0,2,0,0,0,0|0,0,1]=3 185 B18R2.113910 CNC(C)C(=O)C1=CC(=C2OCOC2=C1)OC MCULE-8588562867 [0,2,0,0,0,0|0,0,1]=3 186 B18R2.113910 COC(=O)[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-8309882925 [0,2,0,0,0,0|1,0,1]=4 187 B18R2.113910 COC(=O)[C@@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-9729661111 [0,2,0,0,0,0|1,0,1]=4 188 B18R2.113910 COC(=O)[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-2100768381 [0,2,0,0,0,0|1,0,1]=4 189 B18R2.113910 COC(=O)[C@H](N)C1=CC2=C(OCO2)C(=C1)OC MCULE-3602136726 [0,2,0,0,0,0|1,0,1]=4 190 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@@H](N)C(C)(C)C MCULE-3077367148 [0,2,0,0,0,0|1,0,0]=3 191 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@@H](N)C(C)(C)C MCULE-8369453262 [0,2,0,0,0,0|1,0,0]=3 192 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@@H](N)C(F)(F)F MCULE-6667835190 [0,2,0,0,0,0|2,0,0]=4 193 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@@H](N)C(F)(F)F MCULE-8055775766 [0,2,0,0,0,0|2,0,0]=4 194 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@H](N)C(C)(C)C MCULE-4212580583 [0,2,0,0,0,0|1,0,0]=3 195 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@H](N)C(C)(C)C MCULE-9264512002 [0,2,0,0,0,0|1,0,0]=3 196 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@H](N)C(F)(F)F MCULE-2480708492 [0,2,0,0,0,0|2,0,0]=4 197 B18R2.832353 COC1=CC(=CC2=C1OCO2)[C@H](N)C(F)(F)F MCULE-9271135780 [0,2,0,0,0,0|2,0,0]=4 198 B18R3.365246 COC1=C2CN(CCC2=CC3=C1OCO3)C MCULE-2444936690 [0,0,0,1,0,1|2,0,0]=4 199 B18R3.365246 COC1=C2CN(CCC2=CC3=C1OCO3)C MCULE-3217601605 [0,0,0,1,0,1|2,0,0]=4 200 B18R3.365246 COC1=C2OCOC2=CC3=C1C=[N+](CC3)C MCULE-2084306837 [0,0,0,1,0,1|2,0,0]=4 201 B18R3.365246 COC1=C2OCOC2=CC3=C1C=[N+](CC3)C MCULE-3248666309 [0,0,0,1,0,1|2,0,0]=4 202 B18R3.365246 COC1=C2OCOC2=CC3=C1C=[N+](CC3)C MCULE-4030718101 [0,0,0,1,0,1|2,0,0]=4 203 B18R3.365246 COC1=C2OCOC2=CC3=C1CN(CC3)C MCULE-5345347233 [0,0,0,1,0,1|2,0,0]=4 204 B18R3.1346953 COC1=CC(=CC2=C1OCO2)[C@@H](N)C3CC3 MCULE-1716172963 [0,1,0,1,0,0|1,0,0]=3 205 B18R3.1346953 COC1=CC(=CC2=C1OCO2)[C@@H](N)C3CC3 MCULE-8712394233 [0,1,0,1,0,0|1,0,0]=3 206 B18R3.1346953 COC1=CC(=CC2=C1OCO2)[C@H](N)C3CC3 MCULE-2877471610 [0,1,0,1,0,0|1,0,0]=3 207 B18R3.1346953 COC1=CC(=CC2=C1OCO2)[C@H](N)C3CC3 MCULE-4930780441 [0,1,0,1,0,0|1,0,0]=3 208 B14R1.362 COC1=CC(=CC(=C1Br)OC)[C@@H](C)N MCULE-3513294499 [0,0,1,0,1,0|1,0,0]=3 209 B14R1.362 COC1=CC(=CC(=C1Br)OC)[C@@H](C)N MCULE-7388625130 [0,0,1,0,1,0|1,0,0]=3 210 B14R1.362 COC1=CC(=CC(=C1Br)OC)[C@H](C)N MCULE-4583716296 [0,0,1,0,1,0|1,0,0]=3 211 B14R1.362 COC1=CC(=CC(=C1Br)OC)[C@H](C)N MCULE-4896952051 [0,0,1,0,1,0|1,0,0]=3 212 B14R1.362 COC1=CC(=CC(=C1O)OC)C(=O)C MCULE-7881518363 [0,0,1,0,1,0|1,0,1]=4 213 B14R1.362 COC1=CC(=CC(=C1O)OC)C(=O)N MCULE-3149562338 [0,0,1,0,1,0|1,0,1]=4 214 B14R1.362 COC1=CC(=CC(=C1O)OC)[C@@H](C)N MCULE-1095488178 [0,0,1,0,1,0|0,0,0]=2 215 B14R1.362 COC1=CC(=CC(=C1O)OC)[C@@H](C)N MCULE-4574676263 [0,0,1,0,1,0|0,0,0]=2 216 B14R1.362 COC1=CC(=CC(=C1O)OC)[C@H](C)N MCULE-3982008653 [0,0,1,0,1,0|0,0,0]=2 217 B14R1.362 COC1=CC(=CC(=C1O)OC)[C@H](C)N MCULE-5150127873 [0,0,1,0,1,0|0,0,0]=2 218 B14R1.6723 CCOC1=C(C=C(C=C1)C(C)N)OC MCULE-3045657117 [0,0,1,0,1,0|1,0,0]=3 219 B14R1.6723 CCOC1=C(C=C(C=C1)C(C)N)OC MCULE-7204253547 [0,0,1,0,1,0|1,0,0]=3 220 B14R1.6723 CCOC1=C(C=C(C=C1)[C@@H](C)N)OC MCULE-4249764378 [0,0,1,0,1,0|1,0,0]=3 221 B14R1.6723 CCOC1=C(C=C(C=C1)[C@@H](C)N)OC MCULE-6598476491 [0,0,1,0,1,0|1,0,0]=3 222 B14R1.6723 CCOC1=C(C=C(C=C1)[C@H](C)N)OC MCULE-1345626710 [0,0,1,0,1,0|1,0,0]=3 223 B14R1.6723 CCOC1=C(C=C(C=C1)[C@H](C)N)OC MCULE-6657897185 [0,0,1,0,1,0|1,0,0]=3 224 B14R1.6723 CCOC1=CC=C(C=C1OC)C(C)O MCULE-5590625916 [0,0,1,0,1,0|2,0,0]=4 225 B16R1.414 COC1=C(C(=CC(=C1)CNC(C)C)Br)OC MCULE-1269218197 [0,0,1,0,0,1|2,0,0]=4 226 B16R1.414 COC1=C(C(=CC(=C1)CNC(C)C)Br)OC MCULE-4059525281 [0,0,1,0,0,1|2,0,0]=4 227 B16R1.414 COC1=C(C(=CC(=C1)CNC(C)C)Cl)OC MCULE-1490899422 [0,0,1,0,0,1|2,0,0]=4 228 B16R1.414 COC1=C(C(=CC(=C1)CNC(C)C)Cl)OC MCULE-6403777866 [0,0,1,0,0,1|2,0,0]=4 229 B16R1.423 COC1=CC(=CC(=C1O)OC)CNC(C)C MCULE-6940612532 [0,0,1,0,0,1|1,0,0]=3 230 B16R1.423 COC1=CC(=CC(=C1O)OC)CNC(C)C MCULE-7334450888 [0,0,1,0,0,1|1,0,0]=3 231 B16R1.9381 CCOC1=C(C=C(C=C1)CNC(C)C)OC MCULE-4681314100 [0,0,1,0,0,1|2,0,0]=4 232 B16R1.9381 CCOC1=C(C=C(C=C1)CNC(C)C)OC MCULE-9864545771 [0,0,1,0,0,1|2,0,0]=4 233 B16R2.3814 CNCC1=CC2=C(OCCO2)C(=C1)OC MCULE-4485912163 [1,0,0,0,0,1|1,0,0]=3 234 B16R2.3814 CNCC1=CC2=C(OCCO2)C(=C1)OC MCULE-8348750887 [1,0,0,0,0,1|1,0,0]=3 235 B16R2.1579 COC1=CC2=C(C=C1CC(C)N)OCO2 MCULE-1458870644 [0,0,0,0,1,1|0,0,0]=2 236 B16R2.1579 COC1=CC2=C(C=C1CC(C)N)OCO2 MCULE-4480592267 [0,0,0,0,1,1|0,0,0]=2