0 B14R1.158 CC(CC1=CC=CC=C1)NCCCCl MCULE-5606187384 [0,0,0,0,0,0|0,0,0]=0 1 B14R1.158 CC(CC1=CC=CC=C1)NCCCCl MCULE-5675500300 [0,0,0,0,0,0|0,0,0]=0 2 B14R1.158 CCCCNC(=O)CC1=CC=CC=C1 MCULE-4971254938 [0,0,0,0,0,0|2,0,1]=3 3 B14R1.158 CCCCNC(=O)NC1=CC=CC=C1 MCULE-3334192192 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.158 CCCCNC(=S)NC1=CC=CC=C1 MCULE-1451418538 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.158 CCCCNC(C)CC1=CC=CC=C1 MCULE-2384394281 [0,0,0,0,0,0|1,0,0]=1 6 B14R1.158 CCCCNC(C)CC1=CC=CC=C1 MCULE-8644209849 [0,0,0,0,0,0|1,0,0]=1 7 B14R1.158 CCCCOC(=O)CC1=CC=CC=C1 MCULE-5426662821 [0,0,0,0,0,0|3,0,1]=4 8 B14R1.158 CN(CCCCN)CC1=CC=CC=C1 MCULE-1010496311 [0,0,0,0,0,0|3,0,0]=3 9 B14R1.158 CNCCCN(C)CC1=CC=CC=C1 MCULE-5756936355 [0,0,0,0,0,0|4,0,0]=4 10 B14R1.158 COCCCC(N)CC1=CC=CC=C1 MCULE-3571120058 [0,0,0,0,0,0|4,0,0]=4 11 B14R1.158 COCCNC(=O)CC1=CC=CC=C1 MCULE-2071026786 [0,0,0,0,0,0|3,0,1]=4 12 B14R1.158 NCCCNC(=O)CC1=CC=CC=C1 MCULE-4605051290 [0,0,0,0,0,0|2,0,1]=3 13 B14R1.158 NCCCNC(=O)NC1=CC=CC=C1 MCULE-1381981252 [0,0,0,0,0,0|3,0,1]=4 14 B14R1.158 NCCCNC(=O)NC1=CC=CC=C1 MCULE-7387812048 [0,0,0,0,0,0|3,0,1]=4 15 B14R1.158 O=C(CC1=CC=CC=C1)NCCCO MCULE-3385046487 [0,0,0,0,0,0|2,0,1]=3 16 B14R1.158 O=C(CCCCCl)NC1=CC=CC=C1 MCULE-5470039565 [0,0,0,0,0,0|3,0,1]=4 17 B14R1.158 O=C(NCCCO)NC1=CC=CC=C1 MCULE-2828444867 [0,0,0,0,0,0|3,0,1]=4 18 B14R1.158 OCCCNC(=S)NC1=CC=CC=C1 MCULE-5828135303 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.28 BrCCCCCCC1=CC=CC=C1 MCULE-1041458078 [1,0,0,0,0,0|1,1,0]=3 20 B13R1.28 BrCCCCCOC1=CC=CC=C1 MCULE-1326167281 [1,0,0,0,0,0|2,1,0]=4 21 B13R1.28 BrCCCCOCC1=CC=CC=C1 MCULE-2844010209 [1,0,0,0,0,0|2,1,0]=4 22 B13R1.28 C=CCCCCCC1=CC=CC=C1 MCULE-7746447332 [1,0,0,0,0,0|2,0,1]=4 23 B13R1.28 C=CCCNCCC1=CC=CC=C1 MCULE-9178516652 [1,0,0,0,0,0|1,0,1]=3 24 B13R1.28 C=CCCNOCC1=CC=CC=C1 MCULE-2030849934 [1,0,0,0,0,0|2,0,1]=4 25 B13R1.28 C=CCCNOCC1=CC=CC=C1 MCULE-2880457601 [1,0,0,0,0,0|2,0,1]=4 26 B13R1.28 CCCCCCCC1=CC=CC=C1 MCULE-1420418528 [1,0,0,0,0,0|2,0,0]=3 27 B13R1.28 CCCCCCCC1=CC=CN=C1 MCULE-6989963780 [1,0,0,0,0,0|3,0,0]=4 28 B13R1.28 CCCCCCCC1=CC=NC=C1 MCULE-3984051017 [1,0,0,0,0,0|3,0,0]=4 29 B13R1.28 CCCCCCCC1=NC=CC=C1 MCULE-9053046501 [1,0,0,0,0,0|3,0,0]=4 30 B13R1.28 CCCCCCNC1=CC=CC=C1 MCULE-2577191795 [1,0,0,0,0,0|3,0,0]=4 31 B13R1.28 CCCCCNCC1=CC=CC=C1 MCULE-9851883766 [1,0,0,0,0,0|3,0,0]=4 32 B13R1.28 CCCCCSCC1=CC=CC=C1 MCULE-3245663306 [1,0,0,0,0,0|3,0,0]=4 33 B13R1.28 CCCCNCCC1=CC=CC=C1 MCULE-6672387413 [1,0,0,0,0,0|1,0,0]=2 34 B13R1.28 CCCCNCCC1=CC=CC=C1 MCULE-8439409843 [1,0,0,0,0,0|1,0,0]=2 35 B13R1.28 CCCCNOCC1=CC=CC=C1 MCULE-8661808634 [1,0,0,0,0,0|2,0,0]=3 36 B13R1.28 CCCNCCCC1=CC=CC=C1 MCULE-3563172023 [1,0,0,0,0,0|3,0,0]=4 37 B13R1.28 CCCNCCCC1=CC=CC=C1 MCULE-7093598896 [1,0,0,0,0,0|3,0,0]=4 38 B13R1.28 COCCNCCC1=CC=CC=C1 MCULE-2429573891 [1,0,0,0,0,0|2,0,0]=3 39 B13R1.28 COCCNCCC1=CC=CC=C1 MCULE-7938501319 [1,0,0,0,0,0|2,0,0]=3 40 B13R1.28 COCCNCCC1=CC=NC=C1 MCULE-2672838344 [1,0,0,0,0,0|3,0,0]=4 41 B13R1.28 COCCNCCC1=NC=CC=C1 MCULE-2708550069 [1,0,0,0,0,0|3,0,0]=4 42 B13R1.28 ClCCCCCCC1=CC=CC=C1 MCULE-4425387429 [1,0,0,0,0,0|1,0,0]=2 43 B13R1.28 ClCCCOCCC1=CC=CC=C1 MCULE-3189448085 [1,0,0,0,0,0|1,0,0]=2 44 B13R1.28 ICCCCOCC1=CC=CC=C1 MCULE-6984529666 [1,0,0,0,0,0|2,1,0]=4 45 B13R1.28 N#CCCNCCC1=CC=CC=C1 MCULE-2513014321 [1,0,0,0,0,0|1,0,1]=3 46 B13R1.28 N#CCCNCCC1=CC=CC=C1 MCULE-4919966393 [1,0,0,0,0,0|1,0,1]=3 47 B13R1.28 NCCCCCCC1=CC=CC=C1 MCULE-7765181229 [1,0,0,0,0,0|2,0,0]=3 48 B13R1.28 NCCCCCOC1=CC=CC=C1 MCULE-7985048525 [1,0,0,0,0,0|3,0,0]=4 49 B13R1.28 NCCCCNCC1=CC=CC=C1 MCULE-3625526352 [1,0,0,0,0,0|3,0,0]=4 50 B13R1.28 NCCCCOCC1=CC=CC=C1 MCULE-1760628040 [1,0,0,0,0,0|3,0,0]=4 51 B13R1.28 NCCCOCCC1=CC=CC=C1 MCULE-8485133532 [1,0,0,0,0,0|2,0,0]=3 52 B13R1.28 O=CCCCCCC1=CC=CC=C1 MCULE-8255719806 [1,0,0,0,0,0|2,0,1]=4 53 B13R1.28 OCCCCCCC1=CC=CC=C1 MCULE-6285536612 [1,0,0,0,0,0|2,0,0]=3 54 B13R1.28 OCCCCCCC1=CN=CC=C1 MCULE-9472101148 [1,0,0,0,0,0|3,0,0]=4 55 B13R1.28 OCCCCNCC1=CC=CC=C1 MCULE-2999285613 [1,0,0,0,0,0|3,0,0]=4 56 B13R1.28 OCCCCOCC1=CC=CC=C1 MCULE-2756359294 [1,0,0,0,0,0|3,0,0]=4 57 B13R1.28 OCCCOCCC1=CC=CC=C1 MCULE-6329398726 [1,0,0,0,0,0|2,0,0]=3 58 B13R1.28 OCCSCCCC1=CC=CC=C1 MCULE-7040544754 [1,0,0,0,0,0|3,0,0]=4 59 B13R1.28 SCCCCCOC1=CC=CC=C1 MCULE-2488026816 [1,0,0,0,0,0|3,0,0]=4 60 B13R1.44 C#CCCN(C)CC1=CC=CC=C1 MCULE-5512783296 [1,0,0,0,0,0|2,0,1]=4 61 B13R1.44 C#CCNC(C)CC1=CC=CC=C1 MCULE-1120354174 [1,0,0,0,0,0|0,0,2]=3 62 B13R1.44 C#CCN[C@H](C)CC1=CC=CC=C1 MCULE-2848627886 [1,0,0,0,0,0|0,0,2]=3 63 B13R1.44 C#CCN[C@H](C)CC1=CC=CC=C1 MCULE-7891233976 [1,0,0,0,0,0|0,0,2]=3 64 B13R1.44 CCCCC(=O)CC1=CC=CC=C1 MCULE-3101369672 [1,0,0,0,0,0|2,0,1]=4 65 B13R1.44 CCCCC(O)CC1=CC=CC=C1 MCULE-1622619125 [1,0,0,0,0,0|2,0,0]=3 66 B13R1.44 CCCCC(O)CC1=NC=CC=C1 MCULE-2520833133 [1,0,0,0,0,0|3,0,0]=4 67 B13R1.44 CCCCN(C)CC1=CC=CC=C1 MCULE-3049716506 [1,0,0,0,0,0|2,0,0]=3 68 B13R1.44 CCCCN(C)CC1=CC=CC=C1 MCULE-6245586199 [1,0,0,0,0,0|2,0,0]=3 69 B13R1.44 CCCCS(=O)CC1=CC=CC=C1 MCULE-3049977079 [1,0,0,0,0,0|3,0,0]=4 70 B13R1.44 CCCNC(=O)NC1=CC=CC=C1 MCULE-9539768822 [1,0,0,0,0,0|2,0,1]=4 71 B13R1.44 CCCNC(=S)NC1=CC=CC=C1 MCULE-1195138137 [1,0,0,0,0,0|2,0,1]=4 72 B13R1.44 CCCNC(C)CC1=CC=CC=C1 MCULE-8664334660 [1,0,0,0,0,0|0,0,0]=1 73 B13R1.44 CCCNC(C)CC1=CC=CC=C1 MCULE-8817958524 [1,0,0,0,0,0|0,0,0]=1 74 B13R1.44 CCCOC(=O)CC1=CC=CC=C1 MCULE-6980766796 [1,0,0,0,0,0|2,0,1]=4 75 B13R1.44 CN(CCC#N)CC1=CC=CC=C1 MCULE-5807751349 [1,0,0,0,0,0|2,0,1]=4 76 B13R1.44 CN(CCC#N)CC1=CC=CC=C1 MCULE-8251854768 [1,0,0,0,0,0|2,0,1]=4 77 B13R1.44 CN(CCCCl)CC1=CC=CC=C1 MCULE-5925068697 [1,0,0,0,0,0|1,0,0]=2 78 B13R1.44 CN(CCCCl)CC1=CC=CC=C1 MCULE-9303600891 [1,0,0,0,0,0|1,0,0]=2 79 B13R1.44 CN(CCCN)CC1=CC=CC=C1 MCULE-1379736579 [1,0,0,0,0,0|2,0,0]=3 80 B13R1.44 CN(CCCN)CC1=CC=CC=C1 MCULE-4814188828 [1,0,0,0,0,0|2,0,0]=3 81 B13R1.44 CN(CCCO)CC1=CC=CC=C1 MCULE-7191802245 [1,0,0,0,0,0|2,0,0]=3 82 B13R1.44 CNCCN(C)CC1=CC=CC=C1 MCULE-3214282163 [1,0,0,0,0,0|3,0,0]=4 83 B13R1.44 NC(CCCO)CC1=CC=CC=C1 MCULE-4024748371 [1,0,0,0,0,0|2,0,0]=3 84 B13R1.44 NCCNC(=O)CC1=CC=CC=C1 MCULE-4086211834 [1,0,0,0,0,0|2,0,1]=4 85 B13R1.44 O=C(CC1=CC=CC=C1)NCCCl MCULE-6652712797 [1,0,0,0,0,0|1,0,1]=3 86 B13R1.44 O=C(CC1=CC=CC=C1)NCCO MCULE-5675818960 [1,0,0,0,0,0|2,0,1]=4 87 B13R1.44 O=C(CCCCl)NC1=CC=CC=C1 MCULE-2632144417 [1,0,0,0,0,0|2,0,1]=4 88 B13R1.44 O=C(NCCCl)NC1=CC=CC=C1 MCULE-9992215000 [1,0,0,0,0,0|2,0,1]=4 89 B15R1.83 CCCCCCC(C)CC1=CC=NC=C1 MCULE-4685486490 [0,1,0,0,0,0|3,0,0]=4 90 B15R1.83 CCCCNCC(=CC1=CC=CC=C1)C MCULE-1525444300 [0,1,0,0,0,0|1,0,2]=4 91 B15R1.83 CCCCNCC(=CC1=CC=CC=C1)C MCULE-4866974906 [0,1,0,0,0,0|1,0,2]=4 92 B15R1.83 CCNCCCN(C)CC1=CC=CC=C1 MCULE-3970832563 [0,1,0,0,0,0|3,0,0]=4 93 B15R1.83 CN(CCOCCO)CC1=CC=CC=C1 MCULE-4019236133 [0,1,0,0,0,0|3,0,0]=4 94 B15R1.128 CCCCCC(C)CC1=CC=C(C=C1)N MCULE-6121130082 [0,1,0,0,0,0|2,0,0]=3 95 B15R1.128 CCCCNC(=O)CC1=CC=C(C=C1)Br MCULE-6563904458 [0,1,0,0,0,0|2,0,1]=4 96 B15R1.128 CCCCNC(=O)CC1=CC=C(C=C1)C MCULE-1884110547 [0,1,0,0,0,0|2,0,1]=4 97 B15R1.128 CCCCNC(=O)CC1=CC=C(C=C1)Cl MCULE-8050897072 [0,1,0,0,0,0|2,0,1]=4 98 B15R1.128 CCCCNC(=O)CC1=CC=C(C=C1)F MCULE-9200344467 [0,1,0,0,0,0|2,0,1]=4 99 B15R1.128 COCCNC(C)CC1=CC=C(C=C1)F MCULE-6434913767 [0,1,0,0,0,0|2,0,0]=3 100 B15R1.128 O=C(CC1=CC=C(C=C1)Br)NCCCCl MCULE-2448471138 [0,1,0,0,0,0|1,0,1]=3 101 B15R1.128 O=C(CC1=CC=C(C=C1)Cl)NCCCO MCULE-6942104839 [0,1,0,0,0,0|2,0,1]=4 102 B15R1.129 CN(CCCCN)CC1=CC=CC(=C1)F MCULE-3925584004 [0,1,0,0,0,0|3,0,0]=4 103 B15R1.809 CC(CC1=CC=CC=C1)NC(=O)CCCl MCULE-6069204507 [0,1,0,0,0,0|0,0,1]=2 104 B15R1.809 CCCC(C)NC(=O)CC1=CC=CC=C1 MCULE-5270918475 [0,1,0,0,0,0|2,0,1]=4 105 B15R1.809 CCOC(=O)NC(C)CC1=CC=CC=C1 MCULE-9768835832 [0,1,0,0,0,0|2,0,1]=4 106 B15R1.1081 CC(C)CCNC(=O)CC1=CC=CC=C1 MCULE-3108233512 [0,1,0,0,0,0|2,0,1]=4 107 B15R1.1409 CC1=C(C=CC=C1)CC(=O)NCCCO MCULE-3583120496 [0,1,0,0,0,0|2,0,1]=4 108 B15R1.1409 O=C(CC1=C(C=CC=C1)Cl)NCCCO MCULE-7724054626 [0,1,0,0,0,0|2,0,1]=4 109 B15R1.2074 CCCCNS(=O)(=O)CC1=CC=CC=C1 MCULE-5581073319 [0,1,0,0,0,0|3,0,0]=4 110 B15R1.2074 O=S(=O)(CC1=CC=CC=C1)NCCCCl MCULE-9906759917 [0,1,0,0,0,0|2,0,0]=3 111 B15R2.15 BrCC1CCN(C1)CC2=CC=CC=C2 MCULE-1994493874 [0,0,0,1,0,0|2,1,0]=4 112 B15R2.15 ClCC1CCN(C1)CC2=CC=CC=C2 MCULE-2535824632 [0,0,0,1,0,0|2,0,0]=3 113 B15R2.15 ClCC1CCN(C1)CC2=CC=CC=C2 MCULE-9022533605 [0,0,0,1,0,0|2,0,0]=3 114 B15R2.15 ICC1CCN(C1)CC2=CC=CC=C2 MCULE-1535372914 [0,0,0,1,0,0|2,1,0]=4 115 B15R2.15 NCC1CCN(C1)CC2=CC=CC=C2 MCULE-1872702316 [0,0,0,1,0,0|3,0,0]=4 116 B15R2.15 NCC1CCN(C1)CC2=CC=CC=C2 MCULE-6236359108 [0,0,0,1,0,0|3,0,0]=4 117 B15R2.15 NC[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-1643912888 [0,0,0,1,0,0|3,0,0]=4 118 B15R2.15 NC[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-8095578103 [0,0,0,1,0,0|3,0,0]=4 119 B15R2.15 NC[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-8712274466 [0,0,0,1,0,0|3,0,0]=4 120 B15R2.15 NC[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-5790323887 [0,0,0,1,0,0|3,0,0]=4 121 B15R2.15 OCC1CCN(C1)CC2=CC=CC=C2 MCULE-8386869532 [0,0,0,1,0,0|3,0,0]=4 122 B15R2.15 OC[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-1388248799 [0,0,0,1,0,0|3,0,0]=4 123 B15R2.15 OC[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-7218258067 [0,0,0,1,0,0|3,0,0]=4 124 B15R2.15 OC[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-6621099388 [0,0,0,1,0,0|3,0,0]=4 125 B15R2.15 OC[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-8442857239 [0,0,0,1,0,0|3,0,0]=4 126 B15R2.31 BrC1CCCN(C1)CC2=CC=CC=C2 MCULE-6783693477 [0,0,0,1,0,0|2,1,0]=4 127 B15R2.31 Br[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-1173777341 [0,0,0,1,0,0|2,1,0]=4 128 B15R2.31 Br[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-8239870536 [0,0,0,1,0,0|2,1,0]=4 129 B15R2.31 Br[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-4478934744 [0,0,0,1,0,0|2,1,0]=4 130 B15R2.31 Br[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-8292086061 [0,0,0,1,0,0|2,1,0]=4 131 B15R2.31 CC1CCCN(C1)CC2=CC=CC=C2 MCULE-3064651626 [0,0,0,1,0,0|3,0,0]=4 132 B15R2.31 CN1CCNC(C1)CC2=CC=CC=C2 MCULE-7096007232 [0,0,0,1,0,0|2,0,0]=3 133 B15R2.31 CN1CCNC(C1)CC2=CC=CC=C2 MCULE-9473206212 [0,0,0,1,0,0|2,0,0]=3 134 B15R2.31 CN1CCN[C@@H](C1)CC2=CC=CC=C2 MCULE-7996784882 [0,0,0,1,0,0|2,0,0]=3 135 B15R2.31 CN1CCN[C@@H](C1)CC2=CC=CC=C2 MCULE-8523388301 [0,0,0,1,0,0|2,0,0]=3 136 B15R2.31 CN1CCN[C@@H](C1)CC2=CC=CC=C2 MCULE-9013556329 [0,0,0,1,0,0|2,0,0]=3 137 B15R2.31 CN1CCN[C@H](C1)CC2=CC=CC=C2 MCULE-1994606386 [0,0,0,1,0,0|2,0,0]=3 138 B15R2.31 CN1CCN[C@H](C1)CC2=CC=CC=C2 MCULE-2222737729 [0,0,0,1,0,0|2,0,0]=3 139 B15R2.31 CN1CCN[C@H](C1)CC2=CC=CC=C2 MCULE-2272703179 [0,0,0,1,0,0|2,0,0]=3 140 B15R2.31 CN1CCN[C@H](C1)CC2=CC=CC=C2 MCULE-6469865199 [0,0,0,1,0,0|2,0,0]=3 141 B15R2.31 C[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-4876107295 [0,0,0,1,0,0|3,0,0]=4 142 B15R2.31 ClC1CCCN(C1)CC2=CC=CC=C2 MCULE-9303698205 [0,0,0,1,0,0|2,0,0]=3 143 B15R2.31 Cl[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-8339106278 [0,0,0,1,0,0|2,0,0]=3 144 B15R2.31 Cl[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-1197502749 [0,0,0,1,0,0|2,0,0]=3 145 B15R2.31 IC1CCCN(C1)CC2=CC=CC=C2 MCULE-6268641513 [0,0,0,1,0,0|2,1,0]=4 146 B15R2.31 I[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-7161703417 [0,0,0,1,0,0|2,1,0]=4 147 B15R2.31 NC1CCCN(C1)CC2=CC=CC=C2 MCULE-2741895203 [0,0,0,1,0,0|3,0,0]=4 148 B15R2.31 NC1CCCN(C1)CC2=CC=CC=C2 MCULE-5256972840 [0,0,0,1,0,0|3,0,0]=4 149 B15R2.31 NC1CCCN(C1)CC2=CC=CC=C2 MCULE-8771869811 [0,0,0,1,0,0|3,0,0]=4 150 B15R2.31 NC1CCCN(C1)CC2=CC=CC=C2 MCULE-9083506024 [0,0,0,1,0,0|3,0,0]=4 151 B15R2.31 N[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-2011033334 [0,0,0,1,0,0|3,0,0]=4 152 B15R2.31 N[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-9770396643 [0,0,0,1,0,0|3,0,0]=4 153 B15R2.31 N[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-5238709080 [0,0,0,1,0,0|3,0,0]=4 154 B15R2.31 N[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-5993953655 [0,0,0,1,0,0|3,0,0]=4 155 B15R2.31 N[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-6268174478 [0,0,0,1,0,0|3,0,0]=4 156 B15R2.31 N[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-9508460557 [0,0,0,1,0,0|3,0,0]=4 157 B15R2.31 O=C1CCCC(C1)CC2=CC=CC=C2 MCULE-3727571662 [0,0,0,1,0,0|2,0,1]=4 158 B15R2.31 O=C1CCNC(C1)CC2=CC=CC=C2 MCULE-6725854916 [0,0,0,1,0,0|1,0,1]=3 159 B15R2.31 O=C1CCNC(C1)CC2=CC=CC=C2 MCULE-8752288618 [0,0,0,1,0,0|1,0,1]=3 160 B15R2.31 OC1CCCN(C1)CC2=CC=CC=C2 MCULE-3230578624 [0,0,0,1,0,0|3,0,0]=4 161 B15R2.31 OC1CCCN(C1)CC2=CC=CC=C2 MCULE-5830362496 [0,0,0,1,0,0|3,0,0]=4 162 B15R2.31 O[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-7143976137 [0,0,0,1,0,0|3,0,0]=4 163 B15R2.31 O[C@@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-9306499576 [0,0,0,1,0,0|3,0,0]=4 164 B15R2.31 O[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-5870619508 [0,0,0,1,0,0|3,0,0]=4 165 B15R2.31 O[C@H]1CCCN(C1)CC2=CC=CC=C2 MCULE-6811856629 [0,0,0,1,0,0|3,0,0]=4 166 B15R2.31 SC1CCCN(C1)CC2=CC=CC=C2 MCULE-1018519255 [0,0,0,1,0,0|3,0,0]=4 167 B15R2.31 SC1CCCN(C1)CC2=CC=CC=C2 MCULE-3816191480 [0,0,0,1,0,0|3,0,0]=4 168 B15R2.54 NC1CCCCCC1C2=CC=CC=C2 MCULE-4680064165 [0,0,0,1,0,0|3,0,0]=4 169 B15R2.54 O=C1NCCCNC1C2=CC=CC=C2 MCULE-3858068306 [0,0,0,1,0,0|2,0,1]=4 170 B15R2.64 NC(CC1=CC=CC=C1)C2CCCC2 MCULE-3578323951 [0,0,0,1,0,0|3,0,0]=4 171 B15R2.64 NC(CC1=CC=CC=C1)C2CCCC2 MCULE-9877509279 [0,0,0,1,0,0|3,0,0]=4 172 B15R2.1435 CC1=CC2=C(N1CCCN)C=CC=C2 MCULE-1216510633 [0,0,0,1,0,0|1,0,2]=4 173 B15R2.1435 CC1=CC2=C(N1CCCO)C=CC=C2 MCULE-2511829188 [0,0,0,1,0,0|1,0,2]=4 174 B15R2.1435 CC1=NC2=C(N1CCCN)C=CC=C2 MCULE-1369907459 [0,0,0,1,0,0|2,0,1]=4 175 B15R2.1435 CC1=NC2=C(N1CCCO)C=CC=C2 MCULE-5524451583 [0,0,0,1,0,0|2,0,1]=4 176 B15R2.1435 CC1CC2=C(N1CCCN)C=CC=C2 MCULE-3815376838 [0,0,0,1,0,0|1,0,0]=2 177 B15R2.1435 CCCCN1C(=CC2=C1C=CC=C2)C MCULE-1333885912 [0,0,0,1,0,0|1,0,2]=4 178 B15R2.1435 CCCCN1C(=NC2=C1C=CC=C2)C MCULE-6276702756 [0,0,0,1,0,0|2,0,1]=4 179 B15R2.1435 CCCCN1C2=CC=CC=C2N=C1C MCULE-7034687601 [0,0,0,1,0,0|2,0,1]=4 180 B15R2.1435 O=C1CC2=CC=CC=C2N1CCCBr MCULE-7255424736 [0,0,0,1,0,0|1,1,1]=4 181 B15R2.1435 O=C1NC2=C(N1CCCCl)C=CC=C2 MCULE-2663680758 [0,0,0,1,0,0|2,0,1]=4 182 B15R2.1435 O=C1OC2=C(N1CCCCl)C=CC=C2 MCULE-9946444588 [0,0,0,1,0,0|2,0,1]=4 183 B15R2.2167 C1=CC=C(C=C1)CN2CCCCCC2 MCULE-2109357958 [0,0,0,1,0,0|3,0,0]=4 184 B15R2.2167 C1=CC=C(N=C1)CC2CCCCCN2 MCULE-8091801609 [0,0,0,1,0,0|2,0,0]=3 185 B15R2.2203 COCCNC1CC2=C(C1)C=CC=C2 MCULE-7849649795 [0,0,0,1,0,0|2,0,0]=3 186 B15R2.2203 ClCCCNC1=NC2=C(N1)C=CC=C2 MCULE-1361664614 [0,0,0,1,0,0|2,0,1]=4 187 B15R2.2203 ClCCCNC1=NC2=CC=CC=C2N1 MCULE-4041128624 [0,0,0,1,0,0|2,0,1]=4 188 B15R2.2280 CN1CCC(C1C2=CC=CC=C2)CN MCULE-6216862882 [0,0,0,1,0,0|3,0,0]=4 189 B15R2.2280 CN1CCC(C1C2=CC=CC=C2)CN MCULE-7168039797 [0,0,0,1,0,0|3,0,0]=4 190 B15R2.7956 C[N+]1(CCCCC1)CC2=CC=CC=C2 MCULE-1342847749 [0,0,0,1,0,0|3,0,0]=4 191 B15R2.7956 C[N+]1(CCCCC1)CC2=CC=CC=C2 MCULE-9716480280 [0,0,0,1,0,0|3,0,0]=4 192 B15R2.7956 NC1(CCCCC1)CC2=CC=CC=C2 MCULE-3898366555 [0,0,0,1,0,0|3,0,0]=4 193 B15R2.7956 NC1(CCCCC1)CC2=CC=CC=C2 MCULE-6477915992 [0,0,0,1,0,0|3,0,0]=4 194 B15R2.7956 OC1(CCCCC1)CC2=CC=CC=C2 MCULE-7871950599 [0,0,0,1,0,0|3,0,0]=4 195 B13R1.24 C=CCCNC(C)C1=CC=CC=C1 MCULE-6934280126 [0,0,0,0,1,0|1,0,1]=3 196 B13R1.24 C=CCCN[C@@H](C)C1=CC=CC=C1 MCULE-3202048874 [0,0,0,0,1,0|1,0,1]=3 197 B13R1.24 C=CCCN[C@H](C)C1=CC=CC=C1 MCULE-2340054517 [0,0,0,0,1,0|1,0,1]=3 198 B13R1.24 C=CCCN[C@H](C)C1=CC=CC=C1 MCULE-2343681928 [0,0,0,0,1,0|1,0,1]=3 199 B13R1.24 CC(CNCCO)C1=CC=CC=C1 MCULE-6961782888 [0,0,0,0,1,0|3,0,0]=4 200 B13R1.24 CC(CNCCO)C1=CC=CC=C1 MCULE-9969589055 [0,0,0,0,1,0|3,0,0]=4 201 B13R1.24 CC(NCCC#N)C1=CC=CC=C1 MCULE-5022639190 [0,0,0,0,1,0|1,0,1]=3 202 B13R1.24 CC(NCCCN)C1=CC=CC=C1 MCULE-4263276376 [0,0,0,0,1,0|1,0,0]=2 203 B13R1.24 CC(NCCCO)C1=CC=CC=C1 MCULE-1723943049 [0,0,0,0,1,0|1,0,0]=2 204 B13R1.24 CC(NCCCO)C1=CC=CN=C1 MCULE-5572409655 [0,0,0,0,1,0|2,0,0]=3 205 B13R1.24 CC(NCCCO)C1=CC=CN=C1 MCULE-6210527206 [0,0,0,0,1,0|2,0,0]=3 206 B13R1.24 CC(NCCCO)C1=CC=NC=C1 MCULE-6847550092 [0,0,0,0,1,0|2,0,0]=3 207 B13R1.24 CC(NCCCO)C1=NC=CC=C1 MCULE-1378019595 [0,0,0,0,1,0|2,0,0]=3 208 B13R1.24 CC(NCCCO)C1=NC=CC=C1 MCULE-4737757805 [0,0,0,0,1,0|2,0,0]=3 209 B13R1.24 CC(OCCCN)C1=CC=CC=C1 MCULE-4762195303 [0,0,0,0,1,0|2,0,0]=3 210 B13R1.24 CC([NH2+]CCCO)C1=CC=CN=C1 MCULE-9783317948 [0,0,0,0,1,0|2,0,1]=4 211 B13R1.24 CCCCCC(N)C1=CC=CC=C1 MCULE-9743644044 [0,0,0,0,1,0|3,0,0]=4 212 B13R1.24 CCCCCC(O)C1=CC=CC=C1 MCULE-4426936102 [0,0,0,0,1,0|3,0,0]=4 213 B13R1.24 CCCCC[C@@H](N)C1=CC=CC=C1 MCULE-2032681584 [0,0,0,0,1,0|3,0,0]=4 214 B13R1.24 CCCCC[C@@H](N)C1=CC=CC=C1 MCULE-6522041604 [0,0,0,0,1,0|3,0,0]=4 215 B13R1.24 CCCCC[C@H](N)C1=CC=CC=C1 MCULE-1166195890 [0,0,0,0,1,0|3,0,0]=4 216 B13R1.24 CCCCC[C@H](N)C1=CC=CC=C1 MCULE-5300569827 [0,0,0,0,1,0|3,0,0]=4 217 B13R1.24 CCCCNC(=O)C1=CC=CC=C1 MCULE-8546561963 [0,0,0,0,1,0|2,0,1]=4 218 B13R1.24 CCCCNC(C)C1=CC=CC=C1 MCULE-1129178205 [0,0,0,0,1,0|1,0,0]=2 219 B13R1.24 CCCCNC(C)C1=CC=CC=C1 MCULE-1434309674 [0,0,0,0,1,0|1,0,0]=2 220 B13R1.24 CCCNCC(C)C1=CC=CC=C1 MCULE-1054038442 [0,0,0,0,1,0|3,0,0]=4 221 B13R1.24 CCCNCC(C)C1=CC=CC=C1 MCULE-5245418759 [0,0,0,0,1,0|3,0,0]=4 222 B13R1.24 CN(CCCCN)C1=CC=CC=C1 MCULE-3356090715 [0,0,0,0,1,0|3,0,0]=4 223 B13R1.24 CN(CCCCO)C1=CC=CC=C1 MCULE-2374281685 [0,0,0,0,1,0|3,0,0]=4 224 B13R1.24 COCCNC(C)C1=CC=CC=C1 MCULE-6674569644 [0,0,0,0,1,0|2,0,0]=3 225 B13R1.24 NCCCC[C@@H](N)C1=CC=CC=C1 MCULE-3845307939 [0,0,0,0,1,0|3,0,0]=4 226 B13R1.24 NCCCC[C@@H](N)C1=CC=CC=C1 MCULE-4822482936 [0,0,0,0,1,0|3,0,0]=4 227 B13R1.24 NCCCC[C@H](N)C1=CC=CC=C1 MCULE-6121179611 [0,0,0,0,1,0|3,0,0]=4 228 B13R1.24 NCCCC[C@H](N)C1=CC=CC=C1 MCULE-8060059069 [0,0,0,0,1,0|3,0,0]=4 229 B13R1.24 NCCCNC(=O)C1=CC=CC=C1 MCULE-2656026718 [0,0,0,0,1,0|2,0,1]=4 230 B13R1.24 NCCCNC(=O)C1=CC=CC=C1 MCULE-4255381995 [0,0,0,0,1,0|2,0,1]=4 231 B13R1.24 O=C(CCCCCl)C1=CC=CC=C1 MCULE-6658697485 [0,0,0,0,1,0|2,0,1]=4 232 B13R1.24 O=C(OCCCCl)C1=CC=CC=C1 MCULE-1095436278 [0,0,0,0,1,0|2,0,1]=4 233 B15R1.78 CC(CCC1=CC=CC=C1)NCCC#N MCULE-2566626330 [0,0,0,0,0,1|1,0,1]=3 234 B15R1.78 CC(CCC1=CC=CC=C1)NCCC#N MCULE-5898306117 [0,0,0,0,0,1|1,0,1]=3 235 B15R1.78 CC(COC1=CC=CC=C1)OCCCO MCULE-6838781385 [0,0,0,0,0,1|2,0,0]=3 236 B15R1.78 CCCCNC(=O)CCC1=CC=CC=C1 MCULE-1998676091 [0,0,0,0,0,1|2,0,1]=4 237 B15R1.78 CCCCNC(=O)OCC1=CC=CC=C1 MCULE-1046690627 [0,0,0,0,0,1|2,0,1]=4 238 B15R1.78 CCCCNC(=S)NCC1=CC=CC=C1 MCULE-6871595547 [0,0,0,0,0,1|2,0,1]=4 239 B15R1.78 CCCCNC(O)COC1=CC=CC=C1 MCULE-7435540511 [0,0,0,0,0,1|2,0,0]=3 240 B15R1.78 NCCCNC(=O)NCC1=CC=CC=C1 MCULE-2564858815 [0,0,0,0,0,1|2,0,1]=4 241 B15R1.78 NCCCNC(=O)NCC1=CC=CC=C1 MCULE-6468818648 [0,0,0,0,0,1|2,0,1]=4 242 B15R1.78 NCCCNC(=O)OCC1=CC=CC=C1 MCULE-3759132887 [0,0,0,0,0,1|2,0,1]=4 243 B15R1.78 NCCCNC(=O)OCC1=CC=CC=C1 MCULE-9668763917 [0,0,0,0,0,1|2,0,1]=4 244 B15R1.78 O=C(CCC1=CC=CC=C1)NCCCO MCULE-4860254357 [0,0,0,0,0,1|2,0,1]=4 245 B15R1.78 O=C(CSC1=CC=CC=C1)NCCCCl MCULE-7478587578 [0,0,0,0,0,1|1,0,1]=3 246 B15R1.78 O=C(NCCCBr)OCC1=CC=CC=C1 MCULE-2809494389 [0,0,0,0,0,1|1,1,1]=4 247 B15R1.78 O=C(NCCCCl)OCC1=CC=CC=C1 MCULE-4624740637 [0,0,0,0,0,1|1,0,1]=3 248 B15R1.78 O=C(NCCCO)OCC1=CC=CC=C1 MCULE-1907531173 [0,0,0,0,0,1|2,0,1]=4 249 B12R1.8 BrCCCCCC1=CC=CC=C1 MCULE-2935273353 [2,0,0,0,0,0|0,1,0]=3 250 B12R1.8 BrCCCCOC1=CC=CC=C1 MCULE-5875035811 [2,0,0,0,0,0|1,1,0]=4 251 B12R1.8 BrCCCNCC1=CC=CC=C1 MCULE-8593877267 [2,0,0,0,0,0|0,1,0]=3 252 B12R1.8 BrCCCOCC1=CC=CC=C1 MCULE-2857170337 [2,0,0,0,0,0|1,1,0]=4 253 B12R1.8 BrCCCSCC1=CC=CC=C1 MCULE-2608942714 [2,0,0,0,0,0|1,1,0]=4 254 B12R1.8 BrCCNCCC1=CC=NC=C1 MCULE-1196476708 [2,0,0,0,0,0|1,1,0]=4 255 B12R1.8 BrCCNCCC1=CC=NC=C1 MCULE-5909688000 [2,0,0,0,0,0|1,1,0]=4 256 B12R1.8 C#CCCCCC1=CC=CC=C1 MCULE-8434689989 [2,0,0,0,0,0|1,0,1]=4 257 B12R1.8 C#CCNCCC1=CC=CC=C1 MCULE-3304911272 [2,0,0,0,0,0|0,0,2]=4 258 B12R1.8 C#CCNCCC1=CC=CC=C1 MCULE-5510429225 [2,0,0,0,0,0|0,0,2]=4 259 B12R1.8 C=CCCCCC1=CC=CC=C1 MCULE-5742507683 [2,0,0,0,0,0|1,0,1]=4 260 B12R1.8 C=CCCNCC1=CC=CC=C1 MCULE-6303257398 [2,0,0,0,0,0|1,0,1]=4 261 B12R1.8 C=CCNCCC1=CC=CC=C1 MCULE-2958799596 [2,0,0,0,0,0|0,0,2]=4 262 B12R1.8 C=CCNCCC1=CC=CC=C1 MCULE-5942102421 [2,0,0,0,0,0|0,0,2]=4 263 B12R1.8 CCCCCCC1=CC=CC=C1 MCULE-4666294977 [2,0,0,0,0,0|1,0,0]=3 264 B12R1.8 CCCCCCC1=CC=CC=N1 MCULE-3873309255 [2,0,0,0,0,0|2,0,0]=4 265 B12R1.8 CCCCCCC1=CC=NC=C1 MCULE-2658741032 [2,0,0,0,0,0|2,0,0]=4 266 B12R1.8 CCCCCCC1=CN=CC=C1 MCULE-3716892918 [2,0,0,0,0,0|2,0,0]=4 267 B12R1.8 CCCCCC[N+]1=CC=CC=C1 MCULE-2542365118 [2,0,0,0,0,0|2,0,0]=4 268 B12R1.8 CCCCCC[N+]1=CC=CC=C1 MCULE-3902467298 [2,0,0,0,0,0|2,0,0]=4 269 B12R1.8 CCCCCC[N+]1=CC=CC=C1 MCULE-6904965621 [2,0,0,0,0,0|2,0,0]=4 270 B12R1.8 CCCCCC[N+]1=CC=CC=C1 MCULE-7578847193 [2,0,0,0,0,0|2,0,0]=4 271 B12R1.8 CCCCCC[N+]1=CC=CC=C1 MCULE-7604168371 [2,0,0,0,0,0|2,0,0]=4 272 B12R1.8 CCCCCC[N+]1=CC=CC=C1 MCULE-8977020346 [2,0,0,0,0,0|2,0,0]=4 273 B12R1.8 CCCCCNC1=CC=CC=C1 MCULE-8785948151 [2,0,0,0,0,0|2,0,0]=4 274 B12R1.8 CCCCCOC1=CC=CC=C1 MCULE-6384720129 [2,0,0,0,0,0|2,0,0]=4 275 B12R1.8 CCCCCSC1=CC=CC=C1 MCULE-5536739436 [2,0,0,0,0,0|2,0,0]=4 276 B12R1.8 CCCCNCC1=CC=CC=C1 MCULE-7692097420 [2,0,0,0,0,0|1,0,0]=3 277 B12R1.8 CCCCNCC1=CC=CN=C1 MCULE-7343092856 [2,0,0,0,0,0|2,0,0]=4 278 B12R1.8 CCCCNCC1=CC=CN=C1 MCULE-8120976254 [2,0,0,0,0,0|2,0,0]=4 279 B12R1.8 CCCCNCC1=CC=CN=C1 MCULE-8209065860 [2,0,0,0,0,0|2,0,0]=4 280 B12R1.8 CCCCNCC1=CC=NC=C1 MCULE-2300979170 [2,0,0,0,0,0|2,0,0]=4 281 B12R1.8 CCCCNCC1=CC=NC=C1 MCULE-4427306390 [2,0,0,0,0,0|2,0,0]=4 282 B12R1.8 CCCCNCC1=CC=NC=C1 MCULE-4468981841 [2,0,0,0,0,0|2,0,0]=4 283 B12R1.8 CCCCNCC1=NC=CC=C1 MCULE-2434608878 [2,0,0,0,0,0|2,0,0]=4 284 B12R1.8 CCCCNCC1=NC=CC=C1 MCULE-3687810364 [2,0,0,0,0,0|2,0,0]=4 285 B12R1.8 CCCCNCC1=NC=CC=C1 MCULE-7594119012 [2,0,0,0,0,0|2,0,0]=4 286 B12R1.8 CCCCOCC1=CC=CC=C1 MCULE-5876690213 [2,0,0,0,0,0|2,0,0]=4 287 B12R1.8 CCCNCCC1=CC=CC=C1 MCULE-3633023803 [2,0,0,0,0,0|0,0,0]=2 288 B12R1.8 CCCNCCC1=CC=CC=C1 MCULE-7870883456 [2,0,0,0,0,0|0,0,0]=2 289 B12R1.8 CCCNCCC1=NC=CC=C1 MCULE-3678488808 [2,0,0,0,0,0|1,0,0]=3 290 B12R1.8 CCCNOCC1=CC=CC=C1 MCULE-1464878260 [2,0,0,0,0,0|1,0,0]=3 291 B12R1.8 CCCOCCC1=NC=CC=C1 MCULE-6125495816 [2,0,0,0,0,0|2,0,0]=4 292 B12R1.8 CCCSCCC1=CC=NC=C1 MCULE-5171349122 [2,0,0,0,0,0|2,0,0]=4 293 B12R1.8 CCCSCCC1=CC=NC=C1 MCULE-8991152756 [2,0,0,0,0,0|2,0,0]=4 294 B12R1.8 CCNCCCC1=CC=CC=C1 MCULE-1109255870 [2,0,0,0,0,0|2,0,0]=4 295 B12R1.8 CCNCCCC1=CC=CC=C1 MCULE-8743949752 [2,0,0,0,0,0|2,0,0]=4 296 B12R1.8 CCSCCCC1=CC=CC=C1 MCULE-5171251431 [2,0,0,0,0,0|2,0,0]=4 297 B12R1.8 CNCCCCC1=CC=CC=C1 MCULE-1885836061 [2,0,0,0,0,0|2,0,0]=4 298 B12R1.8 CNCCCCC1=CC=CC=C1 MCULE-8773540616 [2,0,0,0,0,0|2,0,0]=4 299 B12R1.8 CNCCNCC1=CC=CC=C1 MCULE-2485806250 [2,0,0,0,0,0|2,0,0]=4 300 B12R1.8 COCCNCC1=CC=CC=C1 MCULE-1852623533 [2,0,0,0,0,0|2,0,0]=4 301 B12R1.8 COCCNCC1=CC=CC=C1 MCULE-4595041757 [2,0,0,0,0,0|2,0,0]=4 302 B12R1.8 ClCCCC#CC1=CC=CC=C1 MCULE-8643108851 [2,0,0,0,0,0|0,0,2]=4 303 B12R1.8 ClCCCCCC1=CC=CC=C1 MCULE-4049620045 [2,0,0,0,0,0|0,0,0]=2 304 B12R1.8 ClCCCCOC1=CC=CC=C1 MCULE-9444819844 [2,0,0,0,0,0|1,0,0]=3 305 B12R1.8 ClCCCNCC1=CC=CC=C1 MCULE-8040955409 [2,0,0,0,0,0|0,0,0]=2 306 B12R1.8 ClCCCNCC1=CC=CC=C1 MCULE-9569468273 [2,0,0,0,0,0|0,0,0]=2 307 B12R1.8 ClCCCNCC1=CC=NC=C1 MCULE-1150494769 [2,0,0,0,0,0|1,0,0]=3 308 B12R1.8 ClCCCNCC1=CC=NC=C1 MCULE-6666094689 [2,0,0,0,0,0|1,0,0]=3 309 B12R1.8 ClCCCOCC1=CC=CC=C1 MCULE-6444040724 [2,0,0,0,0,0|1,0,0]=3 310 B12R1.8 ICCCCCC1=CC=CC=C1 MCULE-4126724292 [2,0,0,0,0,0|0,1,0]=3 311 B12R1.8 N#CCCNCC1=CC=CC=C1 MCULE-4395583351 [2,0,0,0,0,0|1,0,1]=4 312 B12R1.8 N#CCCNCC1=CC=CC=C1 MCULE-7104754395 [2,0,0,0,0,0|1,0,1]=4 313 B12R1.8 NCCCCCC1=CC=CC=C1 MCULE-8207103794 [2,0,0,0,0,0|1,0,0]=3 314 B12R1.8 NCCCCCC1=CC=CN=C1 MCULE-5475650280 [2,0,0,0,0,0|2,0,0]=4 315 B12R1.8 NCCCCCC1=CC=CN=C1 MCULE-5671307934 [2,0,0,0,0,0|2,0,0]=4 316 B12R1.8 NCCCCNC1=CC=CC=C1 MCULE-3437713573 [2,0,0,0,0,0|2,0,0]=4 317 B12R1.8 NCCCCOC1=CC=CC=C1 MCULE-1541250791 [2,0,0,0,0,0|2,0,0]=4 318 B12R1.8 NCCCCOC1=CC=CC=C1 MCULE-8628062026 [2,0,0,0,0,0|2,0,0]=4 319 B12R1.8 NCCCNCC1=CC=CC=C1 MCULE-1902775325 [2,0,0,0,0,0|1,0,0]=3 320 B12R1.8 NCCCNCC1=CC=CC=C1 MCULE-2474672632 [2,0,0,0,0,0|1,0,0]=3 321 B12R1.8 NCCCNCC1=CN=CC=C1 MCULE-6157877361 [2,0,0,0,0,0|2,0,0]=4 322 B12R1.8 NCCCOCC1=CC=CC=C1 MCULE-8002466257 [2,0,0,0,0,0|2,0,0]=4 323 B12R1.8 NCCCOCC1=CC=CC=C1 MCULE-9397068798 [2,0,0,0,0,0|2,0,0]=4 324 B12R1.8 NCCCSCC1=CC=CC=C1 MCULE-1673713041 [2,0,0,0,0,0|2,0,0]=4 325 B12R1.8 NCCNCCC1=CC=CC=C1 MCULE-3632090498 [2,0,0,0,0,0|1,0,0]=3 326 B12R1.8 NCCNCCC1=CC=CC=C1 MCULE-4054650445 [2,0,0,0,0,0|1,0,0]=3 327 B12R1.8 NCCNCCC1=CC=NC=C1 MCULE-4823477315 [2,0,0,0,0,0|2,0,0]=4 328 B12R1.8 NCCNOCC1=CC=CC=C1 MCULE-7464972463 [2,0,0,0,0,0|2,0,0]=4 329 B12R1.8 NCCNOCC1=CC=CC=C1 MCULE-7729343544 [2,0,0,0,0,0|2,0,0]=4 330 B12R1.8 NCCOCCC1=CC=CC=C1 MCULE-1515023680 [2,0,0,0,0,0|2,0,0]=4 331 B12R1.8 NCCOCCC1=CC=CC=C1 MCULE-2912577841 [2,0,0,0,0,0|2,0,0]=4 332 B12R1.8 NOCCCCC1=CC=CC=C1 MCULE-1592558959 [2,0,0,0,0,0|2,0,0]=4 333 B12R1.8 O=CCCCCC1=CC=CC=C1 MCULE-3746966374 [2,0,0,0,0,0|1,0,1]=4 334 B12R1.8 OCCCCCC1=CC=CC=C1 MCULE-9291934637 [2,0,0,0,0,0|1,0,0]=3 335 B12R1.8 OCCCCOC1=CC=CC=C1 MCULE-3223154409 [2,0,0,0,0,0|2,0,0]=4 336 B12R1.8 OCCCNCC1=CC=CC=C1 MCULE-2323633803 [2,0,0,0,0,0|1,0,0]=3 337 B12R1.8 OCCCNCC1=CC=CC=C1 MCULE-3934503574 [2,0,0,0,0,0|1,0,0]=3 338 B12R1.8 OCCCNCC1=CC=CC=N1 MCULE-6112490729 [2,0,0,0,0,0|2,0,0]=4 339 B12R1.8 OCCCNCC1=CC=CN=C1 MCULE-6448487023 [2,0,0,0,0,0|2,0,0]=4 340 B12R1.8 OCCCNCC1=CC=CN=C1 MCULE-7358653634 [2,0,0,0,0,0|2,0,0]=4 341 B12R1.8 OCCCNCC1=CC=NC=C1 MCULE-4745403544 [2,0,0,0,0,0|2,0,0]=4 342 B12R1.8 OCCCNCC1=CC=NC=C1 MCULE-7093311385 [2,0,0,0,0,0|2,0,0]=4 343 B12R1.8 OCCCOCC1=CC=CC=C1 MCULE-8079526520 [2,0,0,0,0,0|2,0,0]=4 344 B12R1.8 OCCCSCC1=CC=CC=C1 MCULE-8592748723 [2,0,0,0,0,0|2,0,0]=4 345 B12R1.8 OCCNCCC1=CC=CC=C1 MCULE-5313727578 [2,0,0,0,0,0|1,0,0]=3 346 B12R1.8 OCCNCCC1=CC=NC=C1 MCULE-1153926410 [2,0,0,0,0,0|2,0,0]=4 347 B12R1.8 OCCNCCC1=CC=NC=C1 MCULE-1603175104 [2,0,0,0,0,0|2,0,0]=4 348 B12R1.8 OCCNCCC1=CC=NC=C1 MCULE-2364284269 [2,0,0,0,0,0|2,0,0]=4 349 B12R1.8 OCCOCCC1=CC=CC=C1 MCULE-9734786153 [2,0,0,0,0,0|2,0,0]=4 350 B12R1.8 ONCCCCC1=CC=CC=C1 MCULE-2550804844 [2,0,0,0,0,0|2,0,0]=4 351 B12R1.8 ONCCCCC1=CC=CC=C1 MCULE-4390440585 [2,0,0,0,0,0|2,0,0]=4 352 B12R1.8 SCCCCOC1=CC=CC=C1 MCULE-3913768032 [2,0,0,0,0,0|2,0,0]=4 353 B12R1.8 SCCCCSC1=CC=CC=C1 MCULE-4053575064 [2,0,0,0,0,0|2,0,0]=4 354 B12R1.32 C=CCC(C)CC1=CC=CC=C1 MCULE-2405722964 [2,0,0,0,0,0|0,0,2]=4 355 B12R1.32 CC(CC1=CC=CC=C1)NC=O MCULE-4588183843 [2,0,0,0,0,0|1,0,1]=4 356 B12R1.32 CCCC(=O)CC1=CC=CC=C1 MCULE-4001455569 [2,0,0,0,0,0|1,0,1]=4 357 B12R1.32 CCCC(C)NC1=CC=CC=C1 MCULE-4080915511 [2,0,0,0,0,0|1,0,0]=3 358 B12R1.32 CCCC(N)CC1=CC=CC=C1 MCULE-6420973885 [2,0,0,0,0,0|1,0,0]=3 359 B12R1.32 CCCC(O)CC1=CC=CC=C1 MCULE-4275806844 [2,0,0,0,0,0|1,0,0]=3 360 B12R1.32 CCNC(C)CC1=CC=CC=C1 MCULE-2397384428 [2,0,0,0,0,0|0,0,0]=2 361 B12R1.32 CCNC(C)CC1=CC=CC=C1 MCULE-9107745935 [2,0,0,0,0,0|0,0,0]=2 362 B12R1.32 CN(CCBr)CC1=CC=CC=C1 MCULE-9573295275 [2,0,0,0,0,0|1,1,0]=4 363 B12R1.32 CN(CCBr)CC1=CC=CC=C1 MCULE-9695599768 [2,0,0,0,0,0|1,1,0]=4 364 B12R1.32 CN(CCCl)CC1=CC=CC=C1 MCULE-3929755592 [2,0,0,0,0,0|1,0,0]=3 365 B12R1.32 CN(CCCl)CC1=CC=CC=C1 MCULE-4281074175 [2,0,0,0,0,0|1,0,0]=3 366 B12R1.32 CN(CCN)CC1=CC=CC=C1 MCULE-5883834716 [2,0,0,0,0,0|2,0,0]=4 367 B12R1.32 CN(CCO)CC1=CC=CC=C1 MCULE-9573030800 [2,0,0,0,0,0|2,0,0]=4 368 B12R1.32 CN(CCS)CC1=CC=CC=C1 MCULE-2620441480 [2,0,0,0,0,0|2,0,0]=4 369 B12R1.32 CNCC(C)CC1=CC=CC=C1 MCULE-2092491375 [2,0,0,0,0,0|1,0,0]=3 370 B12R1.32 CNCC(N)CC1=CC=CC=C1 MCULE-4291247711 [2,0,0,0,0,0|2,0,0]=4 371 B12R1.32 CNCC(O)CC1=CC=CC=C1 MCULE-4746668748 [2,0,0,0,0,0|2,0,0]=4 372 B12R1.32 COCC(N)CC1=CC=CC=C1 MCULE-1095061334 [2,0,0,0,0,0|2,0,0]=4 373 B12R1.32 COCC(N)CC1=CC=CC=C1 MCULE-6932547879 [2,0,0,0,0,0|2,0,0]=4 374 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 MCULE-1120791156 [2,0,0,0,0,0|2,0,0]=4 375 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 MCULE-1489938428 [2,0,0,0,0,0|2,0,0]=4 376 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 MCULE-2456955055 [2,0,0,0,0,0|2,0,0]=4 377 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 MCULE-8785058878 [2,0,0,0,0,0|2,0,0]=4 378 B12R1.32 COC[C@H](N)CC1=CC=CC=C1 MCULE-6439803226 [2,0,0,0,0,0|2,0,0]=4 379 B12R1.32 COC[C@H](N)CC1=CC=CC=C1 MCULE-7609850410 [2,0,0,0,0,0|2,0,0]=4 380 B12R1.32 CONC(C)CC1=CC=CC=C1 MCULE-9834036598 [2,0,0,0,0,0|1,0,0]=3 381 B12R1.32 NC(CCO)CC1=CC=CC=C1 MCULE-2804195065 [2,0,0,0,0,0|2,0,0]=4 382 B12R1.32 NC(CCO)CC1=CC=CC=C1 MCULE-5844933369 [2,0,0,0,0,0|2,0,0]=4 383 B14R1.14 CC1=CC=C(C=C1)CCCCCCN MCULE-1640664521 [1,1,0,0,0,0|2,0,0]=4 384 B14R1.14 CCCCCCCC1=CC=C(C=C1)Br MCULE-8287188959 [1,1,0,0,0,0|2,0,0]=4 385 B14R1.14 CCCCCCCC1=CC=C(C=C1)I MCULE-3311482425 [1,1,0,0,0,0|2,0,0]=4 386 B14R1.14 CCCCCCCC1=CC=C(C=C1)N MCULE-2094790879 [1,1,0,0,0,0|2,0,0]=4 387 B14R1.14 CCCCCCCC1=CC=C(C=C1)O MCULE-1814167078 [1,1,0,0,0,0|2,0,0]=4 388 B14R1.26 CCCCCCCC1=CC(=CC=C1)N MCULE-1018085261 [1,1,0,0,0,0|2,0,0]=4 389 B14R1.38 CCCCCCC(C)C1=CC=CC=C1 MCULE-2718273059 [1,1,0,0,0,0|2,0,0]=4 390 B14R1.38 CCCCNCC(C)C1=CC=CC=C1 MCULE-2911966163 [1,1,0,0,0,0|1,0,0]=3 391 B14R1.38 CCCCNCC(C)C1=CC=CC=C1 MCULE-4628355510 [1,1,0,0,0,0|1,0,0]=3 392 B14R1.38 O=C(CCCCCCl)C1=CC=CC=C1 MCULE-6908472978 [1,1,0,0,0,0|1,0,1]=4 393 B14R1.38 O=C(ONCCCCl)C1=CC=CC=C1 MCULE-8118275142 [1,1,0,0,0,0|1,0,1]=4 394 B14R1.123 BrCCCCCCCC1=CC=CC=C1 MCULE-2727632409 [1,1,0,0,0,0|1,1,0]=4 395 B14R1.123 BrCCCCCCOC1=CC=CC=C1 MCULE-3061169257 [1,1,0,0,0,0|1,1,0]=4 396 B14R1.123 BrCCCCCOCC1=CC=CC=C1 MCULE-2403806889 [1,1,0,0,0,0|1,1,0]=4 397 B14R1.123 C=CCCCCCCC1=CC=CC=C1 MCULE-1323897377 [1,1,0,0,0,0|2,0,0]=4 398 B14R1.123 CCCCCCCCC1=CC=CC=C1 MCULE-1667774347 [1,1,0,0,0,0|2,0,0]=4 399 B14R1.123 CCCCCCCNC1=CC=CC=C1 MCULE-9927619098 [1,1,0,0,0,0|2,0,0]=4 400 B14R1.123 CCCCCCNCC1=CC=CC=C1 MCULE-2945919542 [1,1,0,0,0,0|2,0,0]=4 401 B14R1.123 CCCCCNCCC1=CC=CC=C1 MCULE-9079377193 [1,1,0,0,0,0|1,0,0]=3 402 B14R1.123 CCCCCNOCC1=CC=CC=C1 MCULE-3982815565 [1,1,0,0,0,0|2,0,0]=4 403 B14R1.123 CCCCNC/C=C/C1=CC=CC=C1 MCULE-1473313057 [1,1,0,0,0,0|1,0,1]=4 404 B14R1.123 CCCCNC/C=C/C1=CC=CC=C1 MCULE-6970883370 [1,1,0,0,0,0|1,0,1]=4 405 B14R1.123 CCCCNCC#CC1=CC=CC=C1 MCULE-4378072289 [1,1,0,0,0,0|1,0,1]=4 406 B14R1.123 CCCCNCC#CC1=CC=CC=C1 MCULE-7670248246 [1,1,0,0,0,0|1,0,1]=4 407 B14R1.123 CCCCNCC=CC1=CC=CC=C1 MCULE-7722130839 [1,1,0,0,0,0|1,0,1]=4 408 B14R1.123 CCCCNCC=CC1=CC=CC=C1 MCULE-9292914221 [1,1,0,0,0,0|1,0,1]=4 409 B14R1.123 CCCCNCCCC1=CC=CC=C1 MCULE-1280653142 [1,1,0,0,0,0|1,0,0]=3 410 B14R1.123 CCCCNCCCC1=CC=CC=C1 MCULE-8669130835 [1,1,0,0,0,0|1,0,0]=3 411 B14R1.123 CNCCCNCCC1=CC=CC=C1 MCULE-2479440619 [1,1,0,0,0,0|1,0,0]=3 412 B14R1.123 CNCCCNCCC1=CC=CC=C1 MCULE-8004261395 [1,1,0,0,0,0|1,0,0]=3 413 B14R1.123 COCCNCCCC1=CC=CC=C1 MCULE-7615079529 [1,1,0,0,0,0|2,0,0]=4 414 B14R1.123 COCCNCCOC1=CC=CC=C1 MCULE-8725392907 [1,1,0,0,0,0|2,0,0]=4 415 B14R1.123 COCCNCCOC1=CC=CC=C1 MCULE-9838727888 [1,1,0,0,0,0|2,0,0]=4 416 B14R1.123 ClCCCCCCCC1=CC=CC=C1 MCULE-5789505045 [1,1,0,0,0,0|1,0,0]=3 417 B14R1.123 ClCCNCCOCC1=CC=CC=C1 MCULE-4100653635 [1,1,0,0,0,0|2,0,0]=4 418 B14R1.123 ClCCNCCOCC1=CC=CC=C1 MCULE-7519705588 [1,1,0,0,0,0|2,0,0]=4 419 B14R1.123 ClCCOCCOCC1=CC=CC=C1 MCULE-8036463695 [1,1,0,0,0,0|2,0,0]=4 420 B14R1.123 N#CCCCOCCC1=CC=CC=C1 MCULE-6338022369 [1,1,0,0,0,0|2,0,0]=4 421 B14R1.123 NCCCCNOCC1=CC=CC=C1 MCULE-7128295336 [1,1,0,0,0,0|2,0,0]=4 422 B14R1.123 NCCCCNOCC1=CC=CC=C1 MCULE-8488645077 [1,1,0,0,0,0|2,0,0]=4 423 B14R1.123 NCCCCOCCC1=CC=CC=C1 MCULE-5352510422 [1,1,0,0,0,0|2,0,0]=4 424 B14R1.123 NCCCNCCCC1=CC=CC=C1 MCULE-7925425450 [1,1,0,0,0,0|1,0,0]=3 425 B14R1.123 O=CCCCCCCC1=CC=CC=C1 MCULE-3003665955 [1,1,0,0,0,0|2,0,0]=4 426 B14R1.123 OCCCCCCCC1=CC=CC=C1 MCULE-2519007852 [1,1,0,0,0,0|2,0,0]=4 427 B14R1.123 OCCCCCCOC1=CC=CC=C1 MCULE-2243941286 [1,1,0,0,0,0|2,0,0]=4 428 B14R1.123 OCCCCCCSC1=CC=CC=C1 MCULE-1254744426 [1,1,0,0,0,0|2,0,0]=4 429 B14R1.123 OCCCCCNCC1=CC=CC=C1 MCULE-6210842849 [1,1,0,0,0,0|2,0,0]=4 430 B14R1.123 OCCCCCNCC1=CC=CC=C1 MCULE-7872706280 [1,1,0,0,0,0|2,0,0]=4 431 B14R1.123 OCCCCCOCC1=CC=CC=C1 MCULE-3899335451 [1,1,0,0,0,0|2,0,0]=4 432 B14R1.123 OCCCNCC=CC1=CC=CC=C1 MCULE-1673600696 [1,1,0,0,0,0|1,0,1]=4 433 B14R1.123 OCCCNCC=CC1=CC=CC=C1 MCULE-9299231674 [1,1,0,0,0,0|1,0,1]=4 434 B14R1.123 SCCCCCCOC1=CC=CC=C1 MCULE-9521857089 [1,1,0,0,0,0|2,0,0]=4 435 B14R1.123 SCCCCCCSC1=CC=CC=C1 MCULE-4876028846 [1,1,0,0,0,0|2,0,0]=4 436 B14R1.156 CN(CCCN)CCC1=CC=CC=C1 MCULE-2660371009 [1,1,0,0,0,0|1,0,0]=3 437 B14R1.422 CN(C)CCNCCC1=CC=CC=C1 MCULE-7425135449 [1,1,0,0,0,0|2,0,0]=4 438 B14R1.422 NC(=O)CCNCCC1=CC=CC=C1 MCULE-2533301387 [1,1,0,0,0,0|1,0,1]=4 439 B14R1.422 NC(=O)CCNCCC1=CC=CC=C1 MCULE-4734456085 [1,1,0,0,0,0|1,0,1]=4 440 B14R1.422 O=C(O)CCNCCC1=CC=CC=C1 MCULE-2936162502 [1,1,0,0,0,0|1,0,1]=4 441 B14R1.422 O=C(O)CCNCCC1=CC=CC=C1 MCULE-3955262564 [1,1,0,0,0,0|1,0,1]=4 442 B14R1.520 CCCC(=O)NCCC1=CC=CC=C1 MCULE-6073306955 [1,1,0,0,0,0|1,0,1]=4 443 B14R1.520 NCCC(=O)NCCC1=CC=CC=C1 MCULE-3276173763 [1,1,0,0,0,0|1,0,1]=4 444 B14R1.520 NCCC(=O)NCCC1=CC=CC=C1 MCULE-3970661715 [1,1,0,0,0,0|1,0,1]=4 445 B14R1.520 O=C(CCCl)NCCC1=CC=CC=C1 MCULE-3040733430 [1,1,0,0,0,0|0,0,1]=3 446 B14R1.716 NCC(O)CNCCC1=CC=CC=C1 MCULE-3049674034 [1,1,0,0,0,0|1,0,0]=3 447 B14R1.716 NCC(O)CNCCC1=CC=CC=C1 MCULE-6939571742 [1,1,0,0,0,0|1,0,0]=3 448 B14R1.716 NCC(O)CNCCC1=CC=CC=C1 MCULE-8059478840 [1,1,0,0,0,0|1,0,0]=3 449 B14R1.882 CCCCCCCC1=CC=CC=C1N MCULE-3482905292 [1,1,0,0,0,0|2,0,0]=4 450 B14R1.33 CCCCC(C)CC1=CC=C(C=C1)N MCULE-6833734011 [1,1,0,0,0,0|1,0,0]=3 451 B14R1.33 CCCCN(C)CC1=CC=C(C=C1)Br MCULE-1264154275 [1,1,0,0,0,0|2,0,0]=4 452 B14R1.33 CCCCN(C)CC1=CC=C(C=C1)C MCULE-4354533403 [1,1,0,0,0,0|2,0,0]=4 453 B14R1.33 CCCCN(C)CC1=CC=C(C=C1)C MCULE-7593769751 [1,1,0,0,0,0|2,0,0]=4 454 B14R1.33 CCCCN(C)CC1=CC=C(C=C1)Cl MCULE-2438630443 [1,1,0,0,0,0|2,0,0]=4 455 B14R1.33 CCCCN(C)CC1=CC=C(C=C1)Cl MCULE-9055333392 [1,1,0,0,0,0|2,0,0]=4 456 B14R1.33 CCCCN(C)CC1=CC=C(C=C1)O MCULE-8070643342 [1,1,0,0,0,0|2,0,0]=4 457 B14R1.33 CCCCN(C)CC1=CC=C(C=C1)S MCULE-6237293751 [1,1,0,0,0,0|2,0,0]=4 458 B14R1.33 CCCNC(=O)CC1=CC=C(C=C1)Br MCULE-9530103042 [1,1,0,0,0,0|1,0,1]=4 459 B14R1.33 CCCNC(=O)CC1=CC=C(C=C1)C MCULE-3783716447 [1,1,0,0,0,0|1,0,1]=4 460 B14R1.33 CCCNC(=O)CC1=CC=C(C=C1)F MCULE-9330542747 [1,1,0,0,0,0|1,0,1]=4 461 B14R1.34 C#CCNC(C)CC1=CC(=CC=C1)F MCULE-1856586070 [1,1,0,0,0,0|0,0,2]=4 462 B14R1.34 CCCCN(C)CC1=CC(=CC=C1)Br MCULE-8268809825 [1,1,0,0,0,0|2,0,0]=4 463 B14R1.34 CCCCN(C)CC1=CC(=CC=C1)S MCULE-2485147857 [1,1,0,0,0,0|2,0,0]=4 464 B14R1.34 CCCCN(C)CC1=CC=CC(=C1)O MCULE-5185562686 [1,1,0,0,0,0|2,0,0]=4 465 B14R1.60 C#CCN(C)C(C)CC1=CC=CC=C1 MCULE-2022038565 [1,1,0,0,0,0|0,0,2]=4 466 B14R1.60 C#CCN(C)C(C)CC1=CC=CC=C1 MCULE-3188554308 [1,1,0,0,0,0|0,0,2]=4 467 B14R1.60 C#CCN(C)[C@@H](C)CC1=CC=CC=C1 MCULE-2742943549 [1,1,0,0,0,0|0,0,2]=4 468 B14R1.60 C#CCN(C)[C@@H](C)CC1=CC=CC=C1 MCULE-8170592065 [1,1,0,0,0,0|0,0,2]=4 469 B14R1.60 C#CCN(C)[C@H](C)CC1=CC=CC=C1 MCULE-1963825720 [1,1,0,0,0,0|0,0,2]=4 470 B14R1.60 C#CCN(C)[C@H](C)CC1=CC=CC=C1 MCULE-6377643584 [1,1,0,0,0,0|0,0,2]=4 471 B14R1.60 C#CCN(C)[C@H](C)CC1=CC=CC=C1 MCULE-6683314612 [1,1,0,0,0,0|0,0,2]=4 472 B14R1.60 C#CCN(C)[C@H](C)CC1=CC=CC=C1 MCULE-8639879864 [1,1,0,0,0,0|0,0,2]=4 473 B14R1.60 CC(CCN)N(C)CC1=CC=CC=C1 MCULE-3203087570 [1,1,0,0,0,0|2,0,0]=4 474 B14R1.60 CN(CC1=CC=CC=C1)C(=O)CCCl MCULE-5887919060 [1,1,0,0,0,0|1,0,1]=4 475 B14R1.166 C#CCNC(C)C(O)C1=CC=CC=C1 MCULE-6346645941 [1,1,0,0,0,0|0,0,2]=4 476 B14R1.166 C#CCNC(C)C(O)C1=CC=CC=C1 MCULE-9644782174 [1,1,0,0,0,0|0,0,2]=4 477 B14R1.166 CC(NCCO)C(O)C1=CC=CC=C1 MCULE-2868820721 [1,1,0,0,0,0|1,0,0]=3 478 B14R1.166 CC(NCCO)C(O)C1=CC=CC=C1 MCULE-7391381947 [1,1,0,0,0,0|1,0,0]=3 479 B14R1.166 CCCNC(C)C(=O)C1=CC=CC=C1 MCULE-3210764898 [1,1,0,0,0,0|0,0,1]=3 480 B14R1.166 CCCNC(C)C(=O)C1=CC=CC=C1 MCULE-7218233190 [1,1,0,0,0,0|0,0,1]=3 481 B14R1.423 CC(C)CNC(=O)CC1=CC=CC=C1 MCULE-7095510227 [1,1,0,0,0,0|1,0,1]=4 482 B14R1.423 CC(CC1=CC=CC=C1)NCC(=O)O MCULE-1968549151 [1,1,0,0,0,0|1,0,1]=4 483 B14R1.423 CC(CC1=CC=CC=C1)NCC(=O)O MCULE-5996302278 [1,1,0,0,0,0|1,0,1]=4 484 B14R1.423 CC(CCC(=O)O)CC1=CC=CC=C1 MCULE-7245556530 [1,1,0,0,0,0|1,0,1]=4 485 B14R1.423 CC(N)CCN(C)CC1=CC=CC=C1 MCULE-4764679762 [1,1,0,0,0,0|2,0,0]=4 486 B14R1.423 CC(O)CCN(C)CC1=CC=CC=C1 MCULE-7954645008 [1,1,0,0,0,0|2,0,0]=4 487 B14R1.467 CCN(CCCN)CC1=CC=CC=C1 MCULE-6413816991 [1,1,0,0,0,0|2,0,0]=4 488 B14R1.743 CC(CC1=CC=CC=C1)NC(=O)CN MCULE-1237657955 [1,1,0,0,0,0|1,0,1]=4 489 B14R1.743 CC(CC1=CC=CC=C1)NC(=O)CN MCULE-8262846569 [1,1,0,0,0,0|1,0,1]=4 490 B14R1.743 CCC(N)CN(C)CC1=CC=CC=C1 MCULE-5005342479 [1,1,0,0,0,0|2,0,0]=4 491 B14R1.743 CN(CC1=CC=CC=C1)CC(O)CO MCULE-5879812830 [1,1,0,0,0,0|2,0,0]=4 492 B14R1.743 COC(=O)NC(C)CC1=CC=CC=C1 MCULE-6880054651 [1,1,0,0,0,0|1,0,1]=4 493 B14R1.946 CCCCN(C)CC1=C(C=CC=C1)Br MCULE-1173229342 [1,1,0,0,0,0|2,0,0]=4 494 B14R1.946 CCCCN(C)CC1=C(C=CC=C1)Cl MCULE-6285466759 [1,1,0,0,0,0|2,0,0]=4 495 B14R1.946 CCCCN(C)CC1=C(C=CC=C1)Cl MCULE-8556254673 [1,1,0,0,0,0|2,0,0]=4 496 B14R1.946 CCCCN(C)CC1=C(C=CC=C1)F MCULE-1450354953 [1,1,0,0,0,0|2,0,0]=4 497 B14R1.946 CCCCN(C)CC1=C(C=CC=C1)F MCULE-3089946860 [1,1,0,0,0,0|2,0,0]=4 498 B14R1.946 CCCCN(C)CC1=C(C=CC=C1)S MCULE-7171896989 [1,1,0,0,0,0|2,0,0]=4 499 B14R1.946 O=C(CC1=CC=CC=C1Br)NCCCl MCULE-9165088720 [1,1,0,0,0,0|1,0,1]=4 500 B14R1.19 O=C(NCCCCl)C1=CC=C(C=C1)Cl MCULE-9947114759 [0,1,0,0,1,0|1,0,1]=4 501 B14R1.19 O=C(NCCCCl)C1=CC=C(C=C1)F MCULE-9629909022 [0,1,0,0,1,0|1,0,1]=4 502 B14R1.20 O=C(NCCCCl)C1=CC(=CC=C1)Cl MCULE-6042311333 [0,1,0,0,1,0|1,0,1]=4 503 B14R1.29 CC(NC(=O)CCCl)C1=CC=CC=C1 MCULE-3806690903 [0,1,0,0,1,0|0,0,1]=3 504 B14R1.121 C=CCCNC(CO)C1=CC=CC=C1 MCULE-7793371996 [0,1,0,0,1,0|1,0,1]=4 505 B14R1.121 C=CCCN[C@@H](CO)C1=CC=CC=C1 MCULE-4967788511 [0,1,0,0,1,0|1,0,1]=4 506 B14R1.121 CCCCNC(CC)C1=CC=CC=C1 MCULE-6064124378 [0,1,0,0,1,0|1,0,0]=3 507 B14R1.163 CC(OCC(O)CN)C1=CC=CC=C1 MCULE-5292660164 [0,1,0,0,1,0|2,0,0]=4 508 B14R1.420 C/C(=C\CNC(C)C1=CC=CC=C1)/Cl MCULE-1241137407 [0,1,0,0,1,0|0,0,2]=4 509 B14R1.420 C/C(=C\CNC(C)C1=CC=CC=C1)/Cl MCULE-9378012328 [0,1,0,0,1,0|0,0,2]=4 510 B14R1.420 CC(=CCNC(C)C1=CC=CC=C1)Cl MCULE-3269527048 [0,1,0,0,1,0|0,0,2]=4 511 B14R1.420 CC(=CCNC(C)C1=CC=CC=C1)Cl MCULE-8198749387 [0,1,0,0,1,0|0,0,2]=4 512 B14R1.420 CC(NCCC(=O)N)C1=CC=CC=C1 MCULE-7418877508 [0,1,0,0,1,0|1,0,1]=4 513 B14R1.420 CC(NCCC(=O)O)C1=CC=CC=C1 MCULE-7791545562 [0,1,0,0,1,0|1,0,1]=4 514 B14R1.1035 CC1=CC=CC=C1C(=O)NCCCCl MCULE-5675069111 [0,1,0,0,1,0|1,0,1]=4 515 B14R1.1035 O=C(NCCCCl)C1=CC=CC=C1Br MCULE-1335933178 [0,1,0,0,1,0|1,0,1]=4 516 B16R1.51 COCCNC(C)CCC1=CC=C(C=C1)O MCULE-4629657015 [0,1,0,0,0,1|2,0,0]=4 517 B16R1.608 CC(CCC1=CC=CC=C1)NCCN(C)C MCULE-6579404786 [0,1,0,0,0,1|2,0,0]=4 518 B16R1.688 CCCCNCC(O)COC1=CC=CC=C1 MCULE-3034333927 [0,1,0,0,0,1|2,0,0]=4 519 B16R1.688 COCCCNC(C)CCC1=CC=CC=C1 MCULE-6946839262 [0,1,0,0,0,1|1,0,0]=3 520 B16R1.688 COCCCNC(C)CCC1=CC=CC=C1 MCULE-8023516321 [0,1,0,0,0,1|1,0,0]=3 521 B16R1.688 OCCCNCC(O)COC1=CC=CC=C1 MCULE-3029868374 [0,1,0,0,0,1|2,0,0]=4 522 B16R1.54 CCCCCCC(C)CC1=CC=C(C=C1)N MCULE-4877711043 [0,2,0,0,0,0|2,0,0]=4 523 B16R1.54 COCCCNC(C)CC1=CC=C(C=C1)F MCULE-6424352747 [0,2,0,0,0,0|1,0,0]=3 524 B16R1.1329 COC(=O)CCNC(C)CC1=CC=CC=C1 MCULE-6819083834 [0,2,0,0,0,0|1,0,1]=4 525 B16R1.1329 COC(=O)CCNC(C)CC1=CC=CC=C1 MCULE-8571271875 [0,2,0,0,0,0|1,0,1]=4 526 B16R1.61 CCCCNC(C)C(=O)C1=CC=C(C=C1)Cl MCULE-3277789782 [0,2,0,0,0,0|1,0,1]=4 527 B16R1.61 CCCCNC(C)C(=O)C1=CC=C(C=C1)Cl MCULE-3875861530 [0,2,0,0,0,0|1,0,1]=4 528 B16R1.613 CC(NCCC(=O)O)C(O)C1=CC=CC=C1 MCULE-6995684730 [0,2,0,0,0,0|1,0,1]=4 529 B16R1.1244 CCCCN(C)[C@H](C)[C@H](O)C1=CC=CC=C1 MCULE-3511890040 [0,2,0,0,0,0|1,0,0]=3 530 B16R1.1067 CC(C)CCCC(C)CC1=CC=C(C=C1)O MCULE-6291125122 [0,2,0,0,0,0|2,0,0]=4 531 B16R1.936 CCCC(=O)NC(CC)CC1=CC=CC=C1 MCULE-9344420724 [0,2,0,0,0,0|1,0,1]=4 532 B16R1.4235 COCC(C)NC(C)CC1=CC=CC=C1F MCULE-4711905140 [0,2,0,0,0,0|2,0,0]=4 533 B16R1.59031 CC(CC1=CC=CC=C1)NCCS(=O)(=O)[O-] MCULE-4426884765 [0,2,0,0,0,0|2,0,0]=4 534 B16R1.59031 CC(CC1=CC=CC=C1)NCCS(=O)(=O)[O-] MCULE-6129745930 [0,2,0,0,0,0|2,0,0]=4 535 B14R2.3 BrCCCN1CCC2=CC=CC=C12 MCULE-1651583801 [1,0,0,1,0,0|0,1,0]=3 536 B14R2.3 NCCCN1CCC2=C1C=CC=C2 MCULE-3991076565 [1,0,0,1,0,0|1,0,0]=3 537 B14R2.3 OCCCN1CCC2=CC=CC=C12 MCULE-5787866612 [1,0,0,1,0,0|1,0,0]=3 538 B14R2.6 C1=CC(=CC=N1)CC2CCCCN2 MCULE-1431757393 [1,0,0,1,0,0|2,0,0]=4 539 B14R2.6 C1=CC=C(C=C1)CC2CCCCN2 MCULE-1625498779 [1,0,0,1,0,0|1,0,0]=3 540 B14R2.6 C1=CC=C(C=C1)CC2CCCCN2 MCULE-5585146889 [1,0,0,1,0,0|1,0,0]=3 541 B14R2.6 C1=CC=C(C=C1)CC2CNCCN2 MCULE-5052229247 [1,0,0,1,0,0|2,0,0]=4 542 B14R2.6 C1=CC=C(C=C1)CC2CNCCN2 MCULE-9323888933 [1,0,0,1,0,0|2,0,0]=4 543 B14R2.6 C1=CC=C(C=C1)CC2COCCN2 MCULE-8984498487 [1,0,0,1,0,0|2,0,0]=4 544 B14R2.6 C1=CC=C(C=C1)CC2COCCN2 MCULE-9963567571 [1,0,0,1,0,0|2,0,0]=4 545 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CCCCN2 MCULE-3065211798 [1,0,0,1,0,0|1,0,0]=3 546 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CCCCN2 MCULE-5431926276 [1,0,0,1,0,0|1,0,0]=3 547 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CCCCN2 MCULE-6858008776 [1,0,0,1,0,0|1,0,0]=3 548 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CNCCN2 MCULE-1554817266 [1,0,0,1,0,0|2,0,0]=4 549 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CNCCN2 MCULE-2675482150 [1,0,0,1,0,0|2,0,0]=4 550 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CNCCN2 MCULE-8484457018 [1,0,0,1,0,0|2,0,0]=4 551 B14R2.6 C1=CC=C(C=C1)C[C@@H]2CNCCN2 MCULE-8941118132 [1,0,0,1,0,0|2,0,0]=4 552 B14R2.6 C1=CC=C(C=C1)C[C@@H]2COCCN2 MCULE-1037180970 [1,0,0,1,0,0|2,0,0]=4 553 B14R2.6 C1=CC=C(C=C1)C[C@@H]2COCCN2 MCULE-1323912072 [1,0,0,1,0,0|2,0,0]=4 554 B14R2.6 C1=CC=C(C=C1)C[C@H]2CCCCN2 MCULE-1446561355 [1,0,0,1,0,0|1,0,0]=3 555 B14R2.6 C1=CC=C(C=C1)C[C@H]2CCCCN2 MCULE-6132636905 [1,0,0,1,0,0|1,0,0]=3 556 B14R2.6 C1=CC=C(C=C1)C[C@H]2CCCCN2 MCULE-9494223340 [1,0,0,1,0,0|1,0,0]=3 557 B14R2.6 C1=CC=C(C=C1)C[C@H]2CNCCN2 MCULE-3319047948 [1,0,0,1,0,0|2,0,0]=4 558 B14R2.6 C1=CC=C(C=C1)C[C@H]2CNCCN2 MCULE-4807766464 [1,0,0,1,0,0|2,0,0]=4 559 B14R2.6 C1=CC=C(C=C1)C[C@H]2CNCCN2 MCULE-5257402979 [1,0,0,1,0,0|2,0,0]=4 560 B14R2.6 C1=CC=C(C=C1)C[C@H]2CNCCN2 MCULE-5997120765 [1,0,0,1,0,0|2,0,0]=4 561 B14R2.6 C1=CC=C(C=C1)C[C@H]2CNCCN2 MCULE-8405386714 [1,0,0,1,0,0|2,0,0]=4 562 B14R2.6 C1=CC=C(C=C1)C[C@H]2COCCN2 MCULE-5612470397 [1,0,0,1,0,0|2,0,0]=4 563 B14R2.6 C1=CC=C(C=C1)C[C@H]2COCCN2 MCULE-8584925399 [1,0,0,1,0,0|2,0,0]=4 564 B14R2.6 C1=CC=C(N=C1)CC2CCCCN2 MCULE-7949524145 [1,0,0,1,0,0|2,0,0]=4 565 B14R2.6 C1=CN=C(C=C1)CC2CCCCN2 MCULE-5139597033 [1,0,0,1,0,0|2,0,0]=4 566 B14R2.14 CO[C@@H]1CNC[C@H]1C2=CC=CC=C2 MCULE-7548942229 [1,0,0,1,0,0|2,0,0]=4 567 B14R2.14 NCC1CCCC1C2=CC=CC=C2 MCULE-4337332214 [1,0,0,1,0,0|2,0,0]=4 568 B14R2.14 NCC1CCCC1C2=CC=CC=C2 MCULE-5272839815 [1,0,0,1,0,0|2,0,0]=4 569 B14R2.14 OC[C@@H]1CNC[C@H]1C2=CC=CC=N2 MCULE-2398390624 [1,0,0,1,0,0|2,0,0]=4 570 B14R2.14 OC[C@H]1CNC[C@@H]1C2=CC=CC=C2 MCULE-8440088811 [1,0,0,1,0,0|1,0,0]=3 571 B14R2.24 CC1CCNCC1C2=CC=CC=C2 MCULE-6494947862 [1,0,0,1,0,0|1,0,0]=3 572 B14R2.24 CC1CCNCC1C2=CC=CC=C2 MCULE-7673488701 [1,0,0,1,0,0|1,0,0]=3 573 B14R2.24 CN1CCNCC1C2=CC=CC=C2 MCULE-6690890859 [1,0,0,1,0,0|2,0,0]=4 574 B14R2.24 CN1CCNCC1C2=CC=CC=C2 MCULE-9658567665 [1,0,0,1,0,0|2,0,0]=4 575 B14R2.24 ClC1CCCCC1[N+]2=CC=CC=C2 MCULE-1075717317 [1,0,0,1,0,0|2,0,0]=4 576 B14R2.24 ClC1CCCCC1[N+]2=CC=CC=C2 MCULE-9184483547 [1,0,0,1,0,0|2,0,0]=4 577 B14R2.24 NC1CCCCC1C2=CC=CC=C2 MCULE-7985714463 [1,0,0,1,0,0|2,0,0]=4 578 B14R2.24 N[C@@H]1CCCC[C@H]1C2=CC=CC=C2 MCULE-6329655772 [1,0,0,1,0,0|2,0,0]=4 579 B14R2.24 O=C1CCNCC1C2=CC=CC=C2 MCULE-5175026393 [1,0,0,1,0,0|1,0,1]=4 580 B14R2.24 O=C1CCNCC1C2=CC=CC=C2 MCULE-9463400822 [1,0,0,1,0,0|1,0,1]=4 581 B14R2.24 OC1CCCCC1C2=CC=CC=C2 MCULE-2755072886 [1,0,0,1,0,0|2,0,0]=4 582 B14R2.24 OC1CCNCC1C2=CC=CC=C2 MCULE-2175644105 [1,0,0,1,0,0|1,0,0]=3 583 B14R2.24 O[C@@H]1CCCC[C@H]1C2=CC=CC=C2 MCULE-6242115476 [1,0,0,1,0,0|2,0,0]=4 584 B14R2.24 O[C@@H]1CCCC[C@H]1C2=CC=CC=C2 MCULE-6927180796 [1,0,0,1,0,0|2,0,0]=4 585 B14R2.24 O[C@H]1CCCC[C@@H]1C2=CC=CC=C2 MCULE-3959292571 [1,0,0,1,0,0|2,0,0]=4 586 B14R2.24 O[C@H]1CCCC[C@@H]1C2=CC=CC=C2 MCULE-5450402774 [1,0,0,1,0,0|2,0,0]=4 587 B14R2.30 NC1CCCC1CC2=CC=CC=C2 MCULE-4278175885 [1,0,0,1,0,0|2,0,0]=4 588 B14R2.30 OC1CCCC1CC2=CC=CC=C2 MCULE-8326002477 [1,0,0,1,0,0|2,0,0]=4 589 B14R2.30 OC1CCNC1CC2=CC=CC=C2 MCULE-7941317783 [1,0,0,1,0,0|1,0,0]=3 590 B14R2.30 OC1CCNC1CC2=CC=CC=C2 MCULE-9036235011 [1,0,0,1,0,0|1,0,0]=3 591 B14R2.101 C1=CC(=CC=N1)CCN2CCCC2 MCULE-2911571696 [1,0,0,1,0,0|2,0,0]=4 592 B14R2.101 C1=CC=C(C=C1)CCC2CCCN2 MCULE-1628514057 [1,0,0,1,0,0|2,0,0]=4 593 B14R2.101 C1=CC=C(C=C1)CCC2CCCN2 MCULE-1792176547 [1,0,0,1,0,0|2,0,0]=4 594 B14R2.101 C1=CC=C(C=C1)CCN2CCCC2 MCULE-1238637041 [1,0,0,1,0,0|1,0,0]=3 595 B14R2.1253 C1=CC=C(C=C1)C2CCCCCC2 MCULE-9875657807 [1,0,0,1,0,0|2,0,0]=4 596 B14R2.1253 C1=CC=C(C=C1)C2CCCCCN2 MCULE-1512736652 [1,0,0,1,0,0|2,0,0]=4 597 B14R2.1253 C1=CC=C(C=C1)C2CCCCNC2 MCULE-4053730056 [1,0,0,1,0,0|1,0,0]=3 598 B14R2.1253 C1=CC=C(C=C1)C2CNCCCN2 MCULE-9922141005 [1,0,0,1,0,0|1,0,0]=3 599 B14R2.1253 C1=CC=C(C=C1)C2CNCCCO2 MCULE-9750060592 [1,0,0,1,0,0|1,0,0]=3 600 B14R2.1253 C1=CC=C(C=C1)C2CSCCCN2 MCULE-5680859561 [1,0,0,1,0,0|2,0,0]=4 601 B14R2.3018 C1=CC=C(C=C1)CCNCC2CC2 MCULE-9295685871 [1,0,0,1,0,0|1,0,0]=3 602 B14R2.3019 C1=CN=C(C=C1)CCNC2CCC2 MCULE-8228288269 [1,0,0,1,0,0|2,0,0]=4 603 B14R2.7150 CCCC1NCCC2=C1C=CC=C2 MCULE-2257561688 [1,0,0,1,0,0|1,0,0]=3 604 B14R2.7150 N#CCC1NCCC2=C1C=CC=C2 MCULE-1049671261 [1,0,0,1,0,0|1,0,1]=4 605 B14R2.7150 N#CCC1NCCC2=C1C=CC=C2 MCULE-8248485434 [1,0,0,1,0,0|1,0,1]=4 606 B14R2.7150 N#CCC1NCCC2=C1C=CC=C2 MCULE-9620474038 [1,0,0,1,0,0|1,0,1]=4 607 B14R2.7150 NCCC1CCCC2=CC=CC=C12 MCULE-9494270818 [1,0,0,1,0,0|2,0,0]=4 608 B14R2.7150 NCCC1OCCC2=C1C=CC=C2 MCULE-1834094260 [1,0,0,1,0,0|2,0,0]=4 609 B14R2.7150 OCCC1CCCC2=C1C=CC=C2 MCULE-4497926404 [1,0,0,1,0,0|2,0,0]=4 610 B14R2.19 BrC1CCN(C1)CC2=CC=CC=C2 MCULE-5141710482 [1,0,0,1,0,0|1,1,0]=4 611 B14R2.19 Br[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-8909448674 [1,0,0,1,0,0|1,1,0]=4 612 B14R2.19 Br[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-6099112868 [1,0,0,1,0,0|1,1,0]=4 613 B14R2.19 C1(CCN(C1)CC2=CC=CC=C2)O MCULE-6927133515 [1,0,0,1,0,0|2,0,0]=4 614 B14R2.19 ClC1CCN(C1)CC2=CC=CC=C2 MCULE-6289636159 [1,0,0,1,0,0|1,0,0]=3 615 B14R2.19 Cl[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-6684967913 [1,0,0,1,0,0|1,0,0]=3 616 B14R2.19 Cl[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-7870124694 [1,0,0,1,0,0|1,0,0]=3 617 B14R2.19 IC1CCN(C1)CC2=CC=CC=C2 MCULE-3849142821 [1,0,0,1,0,0|1,1,0]=4 618 B14R2.19 I[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-6160413038 [1,0,0,1,0,0|1,1,0]=4 619 B14R2.19 I[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-7857670100 [1,0,0,1,0,0|1,1,0]=4 620 B14R2.19 NC1CCC(C1)CC2=CC=CC=C2 MCULE-1004594203 [1,0,0,1,0,0|1,0,0]=3 621 B14R2.19 NC1CCN(C1)CC2=CC=CC=C2 MCULE-2493276000 [1,0,0,1,0,0|2,0,0]=4 622 B14R2.19 NC1CCN(C1)CC2=CC=CC=C2 MCULE-3515848614 [1,0,0,1,0,0|2,0,0]=4 623 B14R2.19 NC1CCN(C1)CC2=CC=CC=C2 MCULE-4793392621 [1,0,0,1,0,0|2,0,0]=4 624 B14R2.19 NC1CCN(C1)CC2=CC=CC=C2 MCULE-9130898787 [1,0,0,1,0,0|2,0,0]=4 625 B14R2.19 N[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-1688104001 [1,0,0,1,0,0|2,0,0]=4 626 B14R2.19 N[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-3757475167 [1,0,0,1,0,0|2,0,0]=4 627 B14R2.19 N[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-4745848660 [1,0,0,1,0,0|2,0,0]=4 628 B14R2.19 N[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-6482498943 [1,0,0,1,0,0|2,0,0]=4 629 B14R2.19 N[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-7285788312 [1,0,0,1,0,0|2,0,0]=4 630 B14R2.19 N[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-1005513825 [1,0,0,1,0,0|2,0,0]=4 631 B14R2.19 N[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-3301374117 [1,0,0,1,0,0|2,0,0]=4 632 B14R2.19 N[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-4648792626 [1,0,0,1,0,0|2,0,0]=4 633 B14R2.19 N[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-5370503361 [1,0,0,1,0,0|2,0,0]=4 634 B14R2.19 O=C1CCC(C1)CC2=CC=CC=C2 MCULE-1167277321 [1,0,0,1,0,0|1,0,1]=4 635 B14R2.19 OC1CCN(C1)CC2=CC=CC=C2 MCULE-5360308823 [1,0,0,1,0,0|2,0,0]=4 636 B14R2.19 O[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-2301310976 [1,0,0,1,0,0|2,0,0]=4 637 B14R2.19 O[C@@H]1CCN(C1)CC2=CC=CC=C2 MCULE-9230890259 [1,0,0,1,0,0|2,0,0]=4 638 B14R2.19 O[C@H]1CCC(C1)NC2=CC=CC=C2 MCULE-5433566935 [1,0,0,1,0,0|2,0,0]=4 639 B14R2.19 O[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-4653313918 [1,0,0,1,0,0|2,0,0]=4 640 B14R2.19 O[C@H]1CCN(C1)CC2=CC=CC=C2 MCULE-6715203299 [1,0,0,1,0,0|2,0,0]=4 641 B14R2.67 CCCNC1CC2=CC=CC=C2C1 MCULE-3716233043 [1,0,0,1,0,0|0,0,0]=2 642 B14R2.67 CCCNC1CC2=CC=CC=C2C1 MCULE-7835794295 [1,0,0,1,0,0|0,0,0]=2 643 B14R2.67 NCCCN1CC2=C(C1)C=CC=C2 MCULE-5072214929 [1,0,0,1,0,0|2,0,0]=4 644 B14R2.67 NCCCN1CC2=CC=CC=C2C1 MCULE-1914431024 [1,0,0,1,0,0|2,0,0]=4 645 B14R2.90 NCC1CN(C1)CC2=CC=CC=C2 MCULE-6024922923 [1,0,0,1,0,0|2,0,0]=4 646 B14R2.90 NCC1CN(C1)CC2=CC=CC=C2 MCULE-6640222790 [1,0,0,1,0,0|2,0,0]=4 647 B14R2.90 OCC1CC(C1)OC2=CC=CC=C2 MCULE-4185040640 [1,0,0,1,0,0|2,0,0]=4 648 B14R2.90 OCC1CN(C1)CC2=CC=CC=C2 MCULE-8230831128 [1,0,0,1,0,0|2,0,0]=4 649 B14R2.277 CC1CCC(N1C2=CC=CC=C2)C MCULE-6591097798 [1,0,0,1,0,0|2,0,0]=4 650 B14R2.277 CN1CCC(C1C2=CC=CC=C2)N MCULE-7010516483 [1,0,0,1,0,0|2,0,0]=4 651 B14R2.277 CN1CCC(C1C2=CC=CC=C2)N MCULE-8537901755 [1,0,0,1,0,0|2,0,0]=4 652 B14R2.411 CC1(CCCN1)CC2=CC=CC=C2 MCULE-5537286486 [1,0,0,1,0,0|0,0,0]=2 653 B14R2.411 CC1(CCCN1)CC2=CC=CC=C2 MCULE-8253201059 [1,0,0,1,0,0|0,0,0]=2 654 B14R2.411 CC1(CCNC1)CC2=CC=CC=C2 MCULE-2416577075 [1,0,0,1,0,0|2,0,0]=4 655 B14R2.411 C[N+]1(CCCC1)CC2=CC=CC=C2 MCULE-4678710605 [1,0,0,1,0,0|2,0,0]=4 656 B14R2.411 C[N+]1(CCCC1)CC2=CC=CC=C2 MCULE-6476464441 [1,0,0,1,0,0|2,0,0]=4 657 B14R2.411 NC1(CCCC1)CC2=CC=CC=C2 MCULE-3567369794 [1,0,0,1,0,0|2,0,0]=4 658 B14R2.411 NC1(CCCC1)CC2=CC=CC=C2 MCULE-8119570967 [1,0,0,1,0,0|2,0,0]=4 659 B14R2.517 CC1CC2=C(N1CCN)C=CC=C2 MCULE-7117091447 [1,0,0,1,0,0|1,0,0]=3 660 B14R2.517 CC1CC2=C(N1CCO)C=CC=C2 MCULE-9635156798 [1,0,0,1,0,0|1,0,0]=3 661 B14R2.9593 CN(CC1=CC=CC=C1)CC2CO2 MCULE-5970228569 [1,0,0,1,0,0|2,0,0]=4 662 B14R2.9593 O=C(CC1=CC=CC=C1)NC2CC2 MCULE-7458541762 [1,0,0,1,0,0|1,0,1]=4 663 B14R2.8 BrC[C@@H]1CC[C@H](C1)C2=CC=CC=C2 MCULE-7773656988 [0,0,0,1,1,0|1,1,0]=4 664 B14R2.8 ClCC1CNC(O1)C2=CC=CC=C2 MCULE-1867185610 [0,0,0,1,1,0|1,0,0]=3 665 B14R2.8 ClCC1COC(O1)C2=CC=CC=C2 MCULE-1312564552 [0,0,0,1,1,0|2,0,0]=4 666 B14R2.8 OCC1CNC(C1)C2=CC=CC=C2 MCULE-2137640406 [0,0,0,1,1,0|1,0,0]=3 667 B14R2.8 OC[C@@H]1CC[C@H](C1)C2=CC=CC=C2 MCULE-2929021710 [0,0,0,1,1,0|2,0,0]=4 668 B14R2.21 CC1CCCC(C1)C2=CC=CC=C2 MCULE-9263328984 [0,0,0,1,1,0|2,0,0]=4 669 B14R2.21 CN1CCNC(C1)C2=CC=CC=C2 MCULE-2167407320 [0,0,0,1,1,0|2,0,0]=4 670 B14R2.21 CN1CCN[C@H](C1)C2=CC=CC=C2 MCULE-6541988493 [0,0,0,1,1,0|2,0,0]=4 671 B14R2.21 NC1CCCC(C1)C2=CC=CC=C2 MCULE-3948327302 [0,0,0,1,1,0|2,0,0]=4 672 B14R2.21 NC1CCOC(C1)C2=CC=CC=C2 MCULE-2200412661 [0,0,0,1,1,0|2,0,0]=4 673 B14R2.21 NC1CCOC(C1)C2=CC=CC=C2 MCULE-7291981485 [0,0,0,1,1,0|2,0,0]=4 674 B14R2.21 N[C@@H]1CCC[C@@H](C1)C2=CC=CC=C2 MCULE-2476123758 [0,0,0,1,1,0|2,0,0]=4 675 B14R2.21 N[C@@H]1CCC[C@H](C1)C2=CC=CC=C2 MCULE-2311110913 [0,0,0,1,1,0|2,0,0]=4 676 B14R2.21 N[C@@H]1CCO[C@H](C1)C2=CC=CC=C2 MCULE-4308661260 [0,0,0,1,1,0|2,0,0]=4 677 B14R2.21 N[C@@H]1CCO[C@H](C1)C2=CC=CC=C2 MCULE-4939196446 [0,0,0,1,1,0|2,0,0]=4 678 B14R2.21 N[C@H]1CCC[C@@H](C1)C2=CC=CC=C2 MCULE-7851499652 [0,0,0,1,1,0|2,0,0]=4 679 B14R2.21 N[C@H]1CCC[C@H](C1)C2=CC=CC=C2 MCULE-5160126400 [0,0,0,1,1,0|2,0,0]=4 680 B14R2.21 O=C1CCNC(C1)C2=CC=CC=C2 MCULE-7081488482 [0,0,0,1,1,0|1,0,1]=4 681 B14R2.21 O=C1CCNC(C1)C2=CC=CC=C2 MCULE-8279076647 [0,0,0,1,1,0|1,0,1]=4 682 B14R2.21 O=S1CCNC(C1)C2=CC=CC=C2 MCULE-7934769387 [0,0,0,1,1,0|2,0,0]=4 683 B14R2.21 OC1CCCC(C1)C2=CC=CC=C2 MCULE-8386168916 [0,0,0,1,1,0|2,0,0]=4 684 B14R2.21 OC1CCNC(C1)C2=CC=CC=C2 MCULE-5158829494 [0,0,0,1,1,0|1,0,0]=3 685 B14R2.21 OC1CCNC(C1)C2=CC=CC=C2 MCULE-9938358879 [0,0,0,1,1,0|1,0,0]=3 686 B14R2.21 OC1CCOC(C1)C2=CC=CC=C2 MCULE-5336834453 [0,0,0,1,1,0|2,0,0]=4 687 B14R2.21 O[C@@H]1CCO[C@H](C1)C2=CC=CC=C2 MCULE-9187229351 [0,0,0,1,1,0|2,0,0]=4 688 B14R2.114 CC(C1=CC=CC=C1)C2CCCN2 MCULE-8755930393 [0,0,0,1,1,0|2,0,0]=4 689 B14R2.114 CC(C1=CC=CC=C1)N2CCCC2 MCULE-6923331100 [0,0,0,1,1,0|1,0,0]=3 690 B14R2.792 CC(NCC1CC1)C2=CC=CC=C2 MCULE-3771200675 [0,0,0,1,1,0|1,0,0]=3 691 B14R2.792 CC(NCC1CC1)C2=CC=CC=C2 MCULE-7367995835 [0,0,0,1,1,0|1,0,0]=3 692 B14R2.794 CC(NC1CCC1)C2=CC=CC=C2 MCULE-6050320588 [0,0,0,1,1,0|1,0,0]=3 693 B14R2.5540 CC1(COCCN1)C2=CC=CC=C2 MCULE-1820766471 [0,0,0,1,1,0|2,0,0]=4 694 B14R2.5540 CC1(OCCCO1)C2=CC=CC=C2 MCULE-6780778997 [0,0,0,1,1,0|2,0,0]=4 695 B14R2.5540 C[C@@]1(CCCCN1)C2=CC=CC=C2 MCULE-3474364920 [0,0,0,1,1,0|1,0,0]=3 696 B14R2.5540 C[C@@]1(CCCCN1)C2=CC=CC=C2 MCULE-9530745797 [0,0,0,1,1,0|1,0,0]=3 697 B14R2.5540 C[C@]1(CCCCN1)C2=CC=CC=C2 MCULE-6778470456 [0,0,0,1,1,0|1,0,0]=3 698 B14R2.5540 C[C@]1(CCCCN1)C2=CC=CC=C2 MCULE-9898470292 [0,0,0,1,1,0|1,0,0]=3 699 B14R2.2840 C1=CSC(=C1)CC2CCCCCN2 MCULE-7452787574 [0,0,0,1,1,0|2,0,0]=4 700 B14R2.2840 C1=CSC(=C1)CC2CCCCCN2 MCULE-7934996125 [0,0,0,1,1,0|2,0,0]=4 701 B16R2.252 OC1CCCC(C1)OCC2=CC=CC=C2 MCULE-7823550261 [0,0,0,1,0,1|2,0,0]=4 702 B16R2.252 O[C@@H]1CCC[C@@H](C1)NCC2=CC=CC=C2 MCULE-6422336248 [0,0,0,1,0,1|2,0,0]=4 703 B16R2.2441 COCCNC1CCC2=C(C1)C=CC=C2 MCULE-4380769765 [0,0,0,1,0,1|2,0,0]=4 704 B16R2.2441 ClCCCCN1CCC2=CC=CC=C2C1 MCULE-3439989718 [0,0,0,1,0,1|2,0,0]=4 705 B16R2.2441 ClCCCCN1CCC2=CC=CC=C2C1 MCULE-4353785958 [0,0,0,1,0,1|2,0,0]=4 706 B16R2.5334 C1=CC=C(C=C1)C=CC2CCCCCN2 MCULE-3152714682 [0,0,0,1,0,1|1,0,1]=4 707 B16R2.5334 C1=CC=C(C=C1)CNC2CCCCCC2 MCULE-4077690025 [0,0,0,1,0,1|2,0,0]=4 708 B16R2.23 ClCC1CCCN(C1)CC2=CC=CC=C2 MCULE-2172723618 [0,1,0,1,0,0|2,0,0]=4 709 B16R2.23 ClCC1CCCN(C1)CC2=CC=CC=C2 MCULE-9397546031 [0,1,0,1,0,0|2,0,0]=4 710 B16R2.23 ClCC1CN(CCO1)CC2=CC=CC=C2 MCULE-1217501593 [0,1,0,1,0,0|2,0,0]=4 711 B16R2.23 ClCC1CN(CCO1)CC2=CC=CC=C2 MCULE-8200455934 [0,1,0,1,0,0|2,0,0]=4 712 B16R2.23 ClCC1CN(CCO1)CC2=CC=CC=C2 MCULE-9514981461 [0,1,0,1,0,0|2,0,0]=4 713 B16R2.23 ClC[C@@H]1CN(CCO1)CC2=CC=CC=C2 MCULE-5337571695 [0,1,0,1,0,0|2,0,0]=4 714 B16R2.23 ClC[C@@H]1CN(CCO1)CC2=CC=CC=C2 MCULE-8895336996 [0,1,0,1,0,0|2,0,0]=4 715 B16R2.23 ClC[C@H]1CN(CCO1)CC2=CC=CC=C2 MCULE-1512955698 [0,1,0,1,0,0|2,0,0]=4 716 B16R2.23 ClC[C@H]1CN(CCO1)CC2=CC=CC=C2 MCULE-1689488660 [0,1,0,1,0,0|2,0,0]=4 717 B16R2.524 NC(CC1=CC=CC=C1)CN2CCCC2 MCULE-3790748280 [0,1,0,1,0,0|2,0,0]=4 718 B16R2.524 NC(CC1=CC=CC=C1)CN2CCCC2 MCULE-5708699431 [0,1,0,1,0,0|2,0,0]=4 719 B16R2.524 N[C@@H](CC1=CC=CC=C1)CN2CCCC2 MCULE-1242112997 [0,1,0,1,0,0|2,0,0]=4 720 B16R2.524 N[C@@H](CC1=CC=CC=C1)CN2CCCC2 MCULE-1648851761 [0,1,0,1,0,0|2,0,0]=4 721 B16R2.524 N[C@@H](CC1=CC=CC=C1)CN2CCCC2 MCULE-2034551715 [0,1,0,1,0,0|2,0,0]=4 722 B16R2.524 N[C@@H](CC1=CC=CC=C1)CN2CCCC2 MCULE-7825583195 [0,1,0,1,0,0|2,0,0]=4 723 B16R2.524 N[C@@H](CC1=CC=CC=C1)CN2CCCC2 MCULE-8700718681 [0,1,0,1,0,0|2,0,0]=4 724 B16R2.524 N[C@H](CC1=CC=CC=C1)CN2CCCC2 MCULE-6291631599 [0,1,0,1,0,0|2,0,0]=4 725 B16R2.524 N[C@H](CC1=CC=CC=C1)CN2CCCC2 MCULE-7878895583 [0,1,0,1,0,0|2,0,0]=4 726 B16R2.2209 CC(C1=CC=CC=C1)C2CCCCCN2 MCULE-5461938076 [0,1,0,1,0,0|1,0,0]=3 727 B16R2.2209 OC(C1=CC=CC=C1)C2CCCCCC2 MCULE-3700196436 [0,1,0,1,0,0|2,0,0]=4 728 B16R2.6780 CC(C(=O)C1=CC=CC=C1)N2CCCC2 MCULE-8294129708 [0,1,0,1,0,0|1,0,1]=4 729 B16R2.6780 CC(C(=O)C1=CC=CC=C1)N2CCCC2 MCULE-8408163523 [0,1,0,1,0,0|1,0,1]=4 730 B16R2.6780 CC(C(O)C1=CC=CC=C1)N2CCCC2 MCULE-5658804444 [0,1,0,1,0,0|1,0,0]=3 731 B16R2.6780 C[C@@H]([C@H](O)C1=CC=CC=C1)N2CCCC2 MCULE-1036425325 [0,1,0,1,0,0|1,0,0]=3 732 B16R2.6780 C[C@@H]([C@H](O)C1=CC=CC=C1)N2CCCC2 MCULE-6243332278 [0,1,0,1,0,0|1,0,0]=3 733 B16R2.6780 C[C@H]([C@@H](O)C1=CC=CC=C1)N2CCCC2 MCULE-8867822678 [0,1,0,1,0,0|1,0,0]=3 734 B16R2.6780 C[C@H]([C@@H](O)C1=CC=CC=C1)N2CCCC2 MCULE-9665987812 [0,1,0,1,0,0|1,0,0]=3 735 B16R2.6780 [C@H](O)(C1=CC=CC=C1)[C@@H](C)N2CCCC2 MCULE-4405461121 [0,1,0,1,0,0|1,0,0]=3 736 B16R2.131 NC1CCNC(C1)CC2=CC=C(C=C2)Cl MCULE-1514354295 [0,1,0,1,0,0|1,0,0]=3 737 B16R2.2114 CNCCN(C)C1CC1C2=CC=CC=C2 MCULE-4208389801 [0,1,0,1,0,0|2,0,0]=4 738 B16R2.734 COCC(C)NC1CC2=C(C1)C=CC=C2 MCULE-2885363941 [0,1,0,1,0,0|2,0,0]=4 739 B16R2.29842 CC1CC2=C(N1C(=O)CCCl)C=CC=C2 MCULE-7072087230 [0,1,0,1,0,0|0,0,1]=3 740 B16R2.2 ClCC1CCN(CC1)CC2=CC=CC=C2 MCULE-5940683553 [0,1,0,1,0,0|2,0,0]=4 741 B16R2.2 ClCC1CCN(CC1)CC2=CC=CC=C2 MCULE-9849290826 [0,1,0,1,0,0|2,0,0]=4 742 B16R2.101 NCC(CC1=CC=CC=C1)N2CCCC2 MCULE-6213949443 [0,1,0,1,0,0|1,0,0]=3 743 B16R2.101 OCC(CC1=CC=CC=C1)N2CCCC2 MCULE-4495590565 [0,1,0,1,0,0|1,0,0]=3 744 B16R2.101 OC[C@@H](CC1=CC=CC=C1)N2CCCC2 MCULE-9544601998 [0,1,0,1,0,0|1,0,0]=3 745 B16R2.7942 CNC1(CCCCC1)CC2=CC=CC=C2 MCULE-4952001311 [0,1,0,1,0,0|2,0,0]=4 746 B16R2.7942 CNC1(CCCCC1)CC2=CC=CC=C2 MCULE-6459052988 [0,1,0,1,0,0|2,0,0]=4 747 B16R2.7942 NCC1(CCCCC1)CC2=CC=CC=C2 MCULE-1214556084 [0,1,0,1,0,0|2,0,0]=4 748 B16R2.7942 NCC1(CCCCC1)CC2=CC=CC=C2 MCULE-3409622240 [0,1,0,1,0,0|2,0,0]=4 749 B16R2.24848 CC1=C(C=CC=C1)CC2CCCCCN2 MCULE-7597263807 [0,1,0,1,0,0|1,0,0]=3 750 B16R2.24848 CC1=C(C=CN=C1)CC2CCCCCN2 MCULE-1143982792 [0,1,0,1,0,0|2,0,0]=4 751 B16R2.24848 ClC1=C(C=CC=C1)CC2CCCCCN2 MCULE-4843672941 [0,1,0,1,0,0|1,0,0]=3 752 B16R2.365386 C=CCC1NC(CC2=C1C=CC=C2)(C)C MCULE-2190402911 [0,1,0,1,0,0|1,0,1]=4 753 B16R2.365386 C=CCC1NC(CC2=C1C=CC=C2)(C)C MCULE-6071629483 [0,1,0,1,0,0|1,0,1]=4 754 B16R3.1739 NC1C2CCC(C2)C1C3=CC=CC=C3 MCULE-2963191960 [0,0,0,2,0,0|2,0,0]=4 755 B16R3.1739 NC1C2CCC(C2)C1C3=CC=CC=C3 MCULE-5967426777 [0,0,0,2,0,0|2,0,0]=4 756 B16R3.1722 C1=CC2=C(C=C1)N3CCCNCC3C2 MCULE-6215686120 [0,0,0,2,0,0|1,0,0]=3 757 B16R3.15144 CC12NCCC1(C3=C(N2)C=CC=C3)C MCULE-1947830549 [0,0,0,2,0,0|2,0,0]=4 758 B16R3.1726 C1=CC2=C(C=C1)C3CC=CCC(C2)N3 MCULE-6327297017 [0,0,0,2,0,0|1,0,1]=4 759 B16R3.275948 C1=CC2=C(C=C1)CC(C2)NCC3CC3 MCULE-7855813388 [0,0,0,2,0,0|1,0,0]=3 760 B12R1.30 C#CCNC(C)C1=CC=CC=C1 MCULE-9257705460 [1,0,0,0,1,0|0,0,2]=4 761 B12R1.30 C(C)(NCC=C)C1=CC=CC=C1 MCULE-3839062268 [1,0,0,0,1,0|0,0,2]=4 762 B12R1.30 C=CCCC(C)C1=CC=CC=C1 MCULE-5529093931 [1,0,0,0,1,0|1,0,1]=4 763 B12R1.30 C=CCN[C@@H](C)C1=CC=CC=C1 MCULE-4788869412 [1,0,0,0,1,0|0,0,2]=4 764 B12R1.30 C=CCN[C@H](C)C1=CC=CC=C1 MCULE-3136249123 [1,0,0,0,1,0|0,0,2]=4 765 B12R1.30 CC(CCCO)C1=CC=CC=C1 MCULE-4761908756 [1,0,0,0,1,0|1,0,0]=3 766 B12R1.30 CC(NCCCl)C1=CC=CC=C1 MCULE-2342848215 [1,0,0,0,1,0|0,0,0]=2 767 B12R1.30 CC(NCCCl)C1=CC=CC=C1 MCULE-5885988699 [1,0,0,0,1,0|0,0,0]=2 768 B12R1.30 CC(NCCN)C1=CC=CC=C1 MCULE-2804734149 [1,0,0,0,1,0|1,0,0]=3 769 B12R1.30 CC(NCCO)C1=CC=CC=C1 MCULE-2672517245 [1,0,0,0,1,0|1,0,0]=3 770 B12R1.30 CC(NCCO)C1=CC=CC=C1 MCULE-6045242627 [1,0,0,0,1,0|1,0,0]=3 771 B12R1.30 CC(NCCO)C1=NC=CC=C1 MCULE-5505928304 [1,0,0,0,1,0|2,0,0]=4 772 B12R1.30 CC(OCCO)C1=CC=CC=C1 MCULE-6404349739 [1,0,0,0,1,0|2,0,0]=4 773 B12R1.30 CCCCC(N)C1=CC=CC=C1 MCULE-2373492691 [1,0,0,0,1,0|2,0,0]=4 774 B12R1.30 CCCCC(O)C1=CC=CC=C1 MCULE-2566719464 [1,0,0,0,1,0|2,0,0]=4 775 B12R1.30 CCCC[C@@H](N)C1=CC=CC=C1 MCULE-6404127981 [1,0,0,0,1,0|2,0,0]=4 776 B12R1.30 CCCC[C@@H](N)C1=CC=CC=C1 MCULE-9817190525 [1,0,0,0,1,0|2,0,0]=4 777 B12R1.30 CCCC[C@H](N)C1=CC=CC=C1 MCULE-4372639128 [1,0,0,0,1,0|2,0,0]=4 778 B12R1.30 CCCC[C@H](N)C1=CC=CC=C1 MCULE-6835497445 [1,0,0,0,1,0|2,0,0]=4 779 B12R1.30 CCCC[C@H](O)C1=CC=CC=C1 MCULE-4574834253 [1,0,0,0,1,0|2,0,0]=4 780 B12R1.30 CCCNC(=O)C1=CC=CC=C1 MCULE-4241205995 [1,0,0,0,1,0|1,0,1]=4 781 B12R1.30 CCCNC(C)C1=CC=CC=C1 MCULE-6320883219 [1,0,0,0,1,0|0,0,0]=2 782 B12R1.30 CCCNC(C)C1=CC=CC=C1 MCULE-9965892271 [1,0,0,0,1,0|0,0,0]=2 783 B12R1.30 CCNCC(C)C1=CC=CC=C1 MCULE-5244062353 [1,0,0,0,1,0|2,0,0]=4 784 B12R1.30 CCNCC(C)C1=CC=CC=C1 MCULE-7840647979 [1,0,0,0,1,0|2,0,0]=4 785 B12R1.30 CN(CCCBr)C1=CC=CC=C1 MCULE-6291848265 [1,0,0,0,1,0|1,1,0]=4 786 B12R1.30 CN(CCCBr)C1=CC=CC=C1 MCULE-7222161318 [1,0,0,0,1,0|1,1,0]=4 787 B12R1.30 CN(CCCN)C1=CC=CC=C1 MCULE-1115100476 [1,0,0,0,1,0|2,0,0]=4 788 B12R1.30 CN(CCCO)C1=CC=CC=C1 MCULE-4948528445 [1,0,0,0,1,0|2,0,0]=4 789 B12R1.30 C[C@@H](NCCO)C1=CC=CC=C1 MCULE-2129664411 [1,0,0,0,1,0|1,0,0]=3 790 B12R1.30 C[C@@H](NCCO)C1=CC=CC=C1 MCULE-7330953105 [1,0,0,0,1,0|1,0,0]=3 791 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 MCULE-1337308037 [1,0,0,0,1,0|1,0,0]=3 792 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 MCULE-9436913854 [1,0,0,0,1,0|1,0,0]=3 793 B12R1.30 NC(CCCO)C1=CC=CC=C1 MCULE-2286567849 [1,0,0,0,1,0|2,0,0]=4 794 B12R1.30 NC(CCCO)C1=CC=CC=C1 MCULE-6969734818 [1,0,0,0,1,0|2,0,0]=4 795 B12R1.30 NC(CCCO)C1=CC=CC=C1 MCULE-7976235281 [1,0,0,0,1,0|2,0,0]=4 796 B12R1.30 NC(CCCO)C1=CC=CC=C1 MCULE-8290632214 [1,0,0,0,1,0|2,0,0]=4 797 B12R1.30 NCCC[C@@H](N)C1=CC=CC=C1 MCULE-4796912358 [1,0,0,0,1,0|2,0,0]=4 798 B12R1.30 NCCC[C@@H](N)C1=CC=CC=C1 MCULE-6083765128 [1,0,0,0,1,0|2,0,0]=4 799 B12R1.30 NCCC[C@H](N)C1=CC=CC=C1 MCULE-2712407348 [1,0,0,0,1,0|2,0,0]=4 800 B12R1.30 NCCC[C@H](N)C1=CC=CC=C1 MCULE-7977410416 [1,0,0,0,1,0|2,0,0]=4 801 B12R1.30 N[C@@H](CCCO)C1=CC=CC=C1 MCULE-3829305528 [1,0,0,0,1,0|2,0,0]=4 802 B12R1.30 N[C@@H](CCCO)C1=CC=CC=C1 MCULE-4611516979 [1,0,0,0,1,0|2,0,0]=4 803 B12R1.30 N[C@@H](CCCO)C1=CC=CC=C1 MCULE-6206308547 [1,0,0,0,1,0|2,0,0]=4 804 B12R1.30 N[C@@H](CCCO)C1=CC=CC=C1 MCULE-9907516077 [1,0,0,0,1,0|2,0,0]=4 805 B12R1.30 N[C@H](CCCO)C1=CC=CC=C1 MCULE-4115524376 [1,0,0,0,1,0|2,0,0]=4 806 B12R1.30 N[C@H](CCCO)C1=CC=CC=C1 MCULE-9349686383 [1,0,0,0,1,0|2,0,0]=4 807 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 MCULE-2148211370 [1,0,0,0,1,0|1,0,1]=4 808 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 MCULE-5248066172 [1,0,0,0,1,0|1,0,1]=4 809 B12R1.30 OCCCC(O)C1=CC=CC=C1 MCULE-6644785905 [1,0,0,0,1,0|2,0,0]=4