0 B13R1.575 CCCNC1=CC(=C(C=C1)Br)OC MCULE-8461945241 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.575 CCCNC1=CC(=C(C=C1)F)OC MCULE-9678633760 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.575 CCCOC1=CC(=C(C=C1)Br)OC MCULE-6420902674 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.575 CCCOC1=CC(=C(C=C1)N)OC MCULE-9948534753 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.575 CCNCC1=CC=C(C(=C1)OC)F MCULE-3049669646 [0,0,0,0,0,0|3,0,1]=4 5 B13R1.575 CCOCC1=CC=C(C(=C1)OC)O MCULE-5664122358 [0,0,0,0,0,0|2,0,1]=3 6 B13R1.575 COC1=C(C=CC(=C1)/C=C/C=O)O MCULE-7395128935 [0,0,0,0,0,0|0,0,2]=2 7 B13R1.575 COC1=C(C=CC(=C1)/C=C/CO)O MCULE-6737978532 [0,0,0,0,0,0|0,0,0]=0 8 B13R1.575 COC1=C(C=CC(=C1)CCCO)F MCULE-2686792983 [0,0,0,0,0,0|1,0,2]=3 9 B13R1.575 COC1=C(C=CC(=C1)OCCO)N MCULE-3927676349 [0,0,0,0,0,0|2,0,1]=3 10 B13R1.575 COC1=CC(=CC=C1Br)OCCO MCULE-4229789060 [0,0,0,0,0,0|2,0,1]=3 11 B13R1.575 COC1=CC(=CC=C1C)CCCO MCULE-4678792350 [0,0,0,0,0,0|1,0,2]=3 12 B13R1.575 COC1=CC(=CC=C1O)C=CC#N MCULE-3495982373 [0,0,0,0,0,0|1,0,1]=2 13 B13R1.575 COC1=CC(=CC=C1O)C=CC=O MCULE-2157553829 [0,0,0,0,0,0|0,0,2]=2 14 B13R1.575 COC1=CC(=CC=C1O)C=CCO MCULE-5569913016 [0,0,0,0,0,0|0,0,0]=0 15 B13R1.575 COC1=CC(=CC=C1O)CCC=O MCULE-4206732803 [0,0,0,0,0,0|0,0,4]=4 16 B13R1.575 COC1=CC(=CC=C1O)CCCO MCULE-4527135958 [0,0,0,0,0,0|0,0,2]=2 17 B12R1.286 C/C=C/C1=CC=C(C(=C1)OC)O MCULE-2620426522 [1,0,0,0,0,0|0,0,0]=1 18 B12R1.286 C=CCC1=CC(=C(C=C1)Br)OC MCULE-2919188713 [1,0,0,0,0,0|1,0,2]=4 19 B12R1.286 C=CCC1=CC(=C(C=C1)F)OC MCULE-4369201342 [1,0,0,0,0,0|1,0,2]=4 20 B12R1.286 C=CCC1=CC=C(C(=C1)OC)Cl MCULE-9659833732 [1,0,0,0,0,0|1,0,2]=4 21 B12R1.286 C=CCC1=CC=C(C(=C1)OC)O MCULE-7731347984 [1,0,0,0,0,0|0,0,2]=3 22 B12R1.286 CC=CC1=CC=C(C(=C1)OC)O MCULE-3255827296 [1,0,0,0,0,0|0,0,0]=1 23 B12R1.286 CCC1=CC(=CC=C1Cl)CCO MCULE-8802259930 [1,0,0,0,0,0|2,0,1]=4 24 B12R1.286 CCCC1=CC=C(C(=C1)OC)O MCULE-7491972346 [1,0,0,0,0,0|0,0,2]=3 25 B12R1.286 CCNC1=CC(=C(C=C1)Br)OC MCULE-6590561644 [1,0,0,0,0,0|2,0,1]=4 26 B12R1.286 CCNC1=CC=C(C(=C1)OC)Cl MCULE-4411432898 [1,0,0,0,0,0|2,0,1]=4 27 B12R1.286 CCNC1=CC=C(C(=C1)OC)F MCULE-1377157142 [1,0,0,0,0,0|2,0,1]=4 28 B12R1.286 CCOC1=CC(=C(C=C1)Br)OC MCULE-3864560411 [1,0,0,0,0,0|2,0,1]=4 29 B12R1.286 CCOC1=CC(=C(C=C1)N)OC MCULE-3218654816 [1,0,0,0,0,0|2,0,1]=4 30 B12R1.286 CNCC1=CC(=C(C=C1)F)OC MCULE-9218349733 [1,0,0,0,0,0|2,0,1]=4 31 B12R1.286 CNCC1=CC(=C(C=C1)O)OC MCULE-3862581910 [1,0,0,0,0,0|1,0,1]=3 32 B12R1.286 CNCC1=CC(=C(C=C1)O)OC MCULE-6076351205 [1,0,0,0,0,0|1,0,1]=3 33 B12R1.286 CNCC1=CC=C(C(=C1)OC)Br MCULE-8209802679 [1,0,0,0,0,0|2,0,1]=4 34 B12R1.286 COC1=C(C=CC(=C1)/C=N/O)O MCULE-9561538830 [1,0,0,0,0,0|1,0,0]=2 35 B12R1.286 COC1=C(C=CC(=C1)C=NO)F MCULE-5366166120 [1,0,0,0,0,0|2,0,0]=3 36 B12R1.286 COC1=C(C=CC(=C1)C=NO)O MCULE-2482806771 [1,0,0,0,0,0|1,0,0]=2 37 B12R1.286 COC1=C(C=CC(=C1)CC#N)O MCULE-3064772006 [1,0,0,0,0,0|1,0,2]=4 38 B12R1.286 COC1=C(C=CC(=C1)CCN)C MCULE-9824242081 [1,0,0,0,0,0|2,0,1]=4 39 B12R1.286 COC1=C(C=CC(=C1)CCN)Cl MCULE-9950563053 [1,0,0,0,0,0|2,0,1]=4 40 B12R1.286 COC1=C(C=CC(=C1)CCN)O MCULE-2832692491 [1,0,0,0,0,0|1,0,1]=3 41 B12R1.286 COC1=C(C=CC(=C1)CCN)O MCULE-3695866663 [1,0,0,0,0,0|1,0,1]=3 42 B12R1.286 COC1=C(C=CC(=C1)CCO)Br MCULE-5652974580 [1,0,0,0,0,0|1,0,1]=3 43 B12R1.286 COC1=C(C=CC(=C1)CCO)N MCULE-3822312323 [1,0,0,0,0,0|1,0,1]=3 44 B12R1.286 COC1=C(C=CC(=C1)CCO)N MCULE-6975675694 [1,0,0,0,0,0|1,0,1]=3 45 B12R1.286 COC1=C(C=CC(=C1)CCO)O MCULE-1314752198 [1,0,0,0,0,0|0,0,1]=2 46 B12R1.286 COC1=C(C=CC(=C1)CNO)O MCULE-4561619999 [1,0,0,0,0,0|1,0,1]=3 47 B12R1.286 COC1=C(C=CC(=C1)SC#N)O MCULE-7359906414 [1,0,0,0,0,0|2,0,1]=4 48 B12R1.286 COC1=CC(=CC=C1Br)CCN MCULE-7920824133 [1,0,0,0,0,0|2,0,1]=4 49 B12R1.286 COC1=CC(=CC=C1Br)CCN MCULE-8530411946 [1,0,0,0,0,0|2,0,1]=4 50 B12R1.286 COC1=CC(=CC=C1F)/C=N/O MCULE-1044271981 [1,0,0,0,0,0|2,0,0]=3 51 B12R1.286 COC1=CC(=CC=C1F)CCN MCULE-1671542047 [1,0,0,0,0,0|2,0,1]=4 52 B12R1.286 COC1=CC(=CC=C1O)CC=O MCULE-6301776631 [1,0,0,0,0,0|0,0,2]=3 53 B12R1.286 COC1=CC(=CC=C1O)CCBr MCULE-4354866516 [1,0,0,0,0,0|1,0,1]=3 54 B12R1.286 COC1=CC(=CC=C1O)CNO MCULE-2607797145 [1,0,0,0,0,0|1,0,1]=3 55 B12R1.286 COCC1=CC(=C(C=C1)O)OC MCULE-7281782363 [1,0,0,0,0,0|1,0,1]=3 56 B12R1.286 COCC1=CC=C(C(=C1)OC)N MCULE-1933285618 [1,0,0,0,0,0|2,0,1]=4 57 B12R1.382 CCCNC1=CC=CC(=C1)OC MCULE-1088660207 [1,0,0,0,0,0|2,0,1]=4 58 B12R1.382 CCNCC1=CC(=CC=C1)OC MCULE-2616901963 [1,0,0,0,0,0|2,0,1]=4 59 B12R1.382 CCNCC1=CC=CC(=C1)OC MCULE-2802262221 [1,0,0,0,0,0|2,0,1]=4 60 B12R1.382 CCSCC1=CC(=CC=C1)OC MCULE-7809075543 [1,0,0,0,0,0|2,0,1]=4 61 B12R1.382 CNC1=CC(=CC=C1)CCCO MCULE-6847178979 [1,0,0,0,0,0|1,0,2]=4 62 B12R1.382 COC1=CC(=CC=C1)C#CCBr MCULE-7333481319 [1,0,0,0,0,0|1,0,2]=4 63 B12R1.382 COC1=CC(=CC=C1)C#CCN MCULE-2449191902 [1,0,0,0,0,0|1,0,2]=4 64 B12R1.382 COC1=CC(=CC=C1)C#CCN MCULE-4672871744 [1,0,0,0,0,0|1,0,2]=4 65 B12R1.382 COC1=CC(=CC=C1)C#CCO MCULE-3778547826 [1,0,0,0,0,0|0,0,2]=3 66 B12R1.382 COC1=CC(=CC=C1)C=CC=O MCULE-8564253529 [1,0,0,0,0,0|0,0,2]=3 67 B12R1.382 COC1=CC(=CC=C1)C=CCO MCULE-5257470041 [1,0,0,0,0,0|0,0,0]=1 68 B12R1.382 COC1=CC(=CC=C1)CCCBr MCULE-8471496956 [1,0,0,0,0,0|1,0,2]=4 69 B12R1.382 COC1=CC(=CC=C1)CCCN MCULE-6848117165 [1,0,0,0,0,0|1,0,2]=4 70 B12R1.382 COC1=CC(=CC=C1)CCCN MCULE-8841364369 [1,0,0,0,0,0|1,0,2]=4 71 B12R1.382 COC1=CC(=CC=C1)CCCO MCULE-4410923645 [1,0,0,0,0,0|0,0,2]=3 72 B12R1.382 COC1=CC(=CC=C1)OCCCl MCULE-6829521569 [1,0,0,0,0,0|2,0,1]=4 73 B12R1.382 COC1=CC(=CC=C1)OCCN MCULE-2182565795 [1,0,0,0,0,0|2,0,1]=4 74 B12R1.382 COC1=CC(=CC=C1)OCCN MCULE-2713131458 [1,0,0,0,0,0|2,0,1]=4 75 B12R1.382 COC1=CC(=CC=C1)SCCBr MCULE-8258867643 [1,0,0,0,0,0|2,0,1]=4 76 B12R1.382 COC1=CC(=CC=C1)SCCN MCULE-1616781352 [1,0,0,0,0,0|2,0,1]=4 77 B12R1.382 COC1=CC(=CN=C1)CCCO MCULE-2572975426 [1,0,0,0,0,0|1,0,2]=4 78 B12R1.382 COC1=CC=CC(=C1)/C=C/C=O MCULE-9445408187 [1,0,0,0,0,0|0,0,2]=3 79 B12R1.382 COC1=CC=CC(=C1)C#CCCl MCULE-1540815059 [1,0,0,0,0,0|1,0,2]=4 80 B12R1.382 COC1=CC=CC(=C1)C=CCN MCULE-3211603174 [1,0,0,0,0,0|1,0,0]=2 81 B12R1.382 COC1=CC=CC(=C1)CCCS MCULE-3564951162 [1,0,0,0,0,0|0,1,2]=4 82 B12R1.382 COC1=CC=CC(=C1)NCCN MCULE-3760360282 [1,0,0,0,0,0|2,0,1]=4 83 B12R1.382 COC1=CC=CC(=C1)OCCBr MCULE-3434257514 [1,0,0,0,0,0|2,0,1]=4 84 B12R1.382 COC1=CC=CC(=C1)SCCO MCULE-5431120061 [1,0,0,0,0,0|1,0,1]=3 85 B12R1.382 COC1=CN=CC(=C1)C#CCO MCULE-4618802906 [1,0,0,0,0,0|1,0,2]=4 86 B12R1.382 COC1=NC(=CC=C1)CCCO MCULE-1860969554 [1,0,0,0,0,0|1,0,2]=4 87 B12R1.382 CSC1=CC=CC(=C1)C#CCO MCULE-8967333200 [1,0,0,0,0,0|0,1,2]=4 88 B12R1.385 CC1=C(C=C(C=C1)CCCO)C MCULE-3902016795 [1,0,0,0,0,0|1,0,2]=4 89 B12R1.385 CC1=C(C=C(C=C1)OCCO)C MCULE-3542936048 [1,0,0,0,0,0|2,0,1]=4 90 B12R1.385 CC1=C(C=C(C=C1)SCCO)C MCULE-4209670202 [1,0,0,0,0,0|2,0,1]=4 91 B12R1.385 CC1=C(C=CC(=C1)OCCO)N MCULE-2137190554 [1,0,0,0,0,0|2,0,1]=4 92 B12R1.385 CC1=CC(=CC=C1Br)NCCO MCULE-5316319011 [1,0,0,0,0,0|2,0,1]=4 93 B12R1.385 CC1=CC(=CC=C1Br)OCCO MCULE-2573120323 [1,0,0,0,0,0|2,0,1]=4 94 B12R1.385 CC1=CC(=CC=C1Br)SCCO MCULE-4592952233 [1,0,0,0,0,0|2,0,1]=4 95 B12R1.385 CC1=CC(=CC=C1Cl)C#CCO MCULE-2424559434 [1,0,0,0,0,0|1,0,2]=4 96 B12R1.385 CC1=CC(=CC=C1F)C#CCO MCULE-8001625675 [1,0,0,0,0,0|1,0,2]=4 97 B12R1.385 CC1=CC=C(C=C1C)C#CCO MCULE-3066967003 [1,0,0,0,0,0|1,0,2]=4 98 B12R1.385 CC1=CC=C(C=C1O)NCCO MCULE-1954847753 [1,0,0,0,0,0|2,0,1]=4 99 B12R1.385 CCCCC1=CC(=C(C=C1)O)C MCULE-4983814166 [1,0,0,0,0,0|1,0,2]=4 100 B12R1.385 CCCCC1=CC=C(C(=C1)O)O MCULE-2126985528 [1,0,0,0,0,0|1,0,2]=4 101 B12R1.385 CCNCC1=CC=C(C(=C1)O)O MCULE-2444208249 [1,0,0,0,0,0|2,0,1]=4 102 B12R1.385 CCNCC1=CC=C(C(=C1)O)O MCULE-7221938574 [1,0,0,0,0,0|2,0,1]=4 103 B12R1.385 NCC=CC1=CC(=C(C=C1)F)F MCULE-5150276188 [1,0,0,0,0,0|3,0,0]=4 104 B12R1.385 NCC=CC1=CC=C(C(=C1)Cl)Cl MCULE-2773537119 [1,0,0,0,0,0|3,0,0]=4 105 B12R1.385 NCCCC1=CC(=C(C=C1)O)O MCULE-7324513174 [1,0,0,0,0,0|1,0,2]=4 106 B12R1.385 NCCCC1=CC=C(C(=C1)O)O MCULE-5502362171 [1,0,0,0,0,0|1,0,2]=4 107 B12R1.385 OC/C=C/C1=CC(=C(C=C1)O)O MCULE-5095249096 [1,0,0,0,0,0|0,0,0]=1 108 B12R1.385 OCC=CC1=CC(=C(C=C1)F)F MCULE-1211318338 [1,0,0,0,0,0|2,0,0]=3 109 B12R1.385 OCC=CC1=CC=C(C(=C1)Br)F MCULE-1684686118 [1,0,0,0,0,0|2,0,0]=3 110 B12R1.385 OCC=CC1=CC=C(C(=C1)Cl)Cl MCULE-5692337561 [1,0,0,0,0,0|2,0,0]=3 111 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(=O)C)O MCULE-4356575066 [0,1,0,0,0,0|0,0,2]=3 112 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(=O)O)F MCULE-5643863850 [0,1,0,0,0,0|1,0,1]=3 113 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(=O)[O-])O MCULE-5476569550 [0,1,0,0,0,0|0,0,2]=3 114 B14R1.42 COC1=C(C=CC(=C1)/C=C\C(=O)O)O MCULE-9882677316 [0,1,0,0,0,0|0,0,1]=2 115 B14R1.42 COC1=C(C=CC(=C1)C=CC(=O)O)F MCULE-8219378484 [0,1,0,0,0,0|1,0,1]=3 116 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)O MCULE-6192664785 [0,1,0,0,0,0|0,0,3]=4 117 B14R1.42 COC1=C(C=CC(=C1)CNC(C)C)O MCULE-5498774862 [0,1,0,0,0,0|2,0,1]=4 118 B14R1.42 COC1=C(C=CC(=C1)CNC(C)C)O MCULE-6444198837 [0,1,0,0,0,0|2,0,1]=4 119 B14R1.42 COC1=CC(=CC=C1Br)/C=C/C(=O)O MCULE-8193123381 [0,1,0,0,0,0|1,0,1]=3 120 B14R1.42 COC1=CC(=CC=C1Br)C=CC(=O)O MCULE-1528038359 [0,1,0,0,0,0|1,0,1]=3 121 B14R1.42 COC1=CC(=CC=C1O)/C=C/C(=O)N MCULE-2542099073 [0,1,0,0,0,0|0,0,2]=3 122 B14R1.42 COC1=CC(=CC=C1O)/C=C/C(=O)O MCULE-8442047802 [0,1,0,0,0,0|0,0,1]=2 123 B14R1.42 COC1=CC(=CC=C1O)/C=C/N(=O)=O MCULE-8308811228 [0,1,0,0,0,0|1,0,1]=3 124 B14R1.42 COC1=CC(=CC=C1O)/C=C\N(=O)=O MCULE-6492123415 [0,1,0,0,0,0|1,0,1]=3 125 B14R1.42 COC1=CC(=CC=C1O)C=CC(=O)C MCULE-3501590803 [0,1,0,0,0,0|0,0,2]=3 126 B14R1.42 COC1=CC(=CC=C1O)C=CC(=O)N MCULE-2564987856 [0,1,0,0,0,0|0,0,2]=3 127 B14R1.42 COC1=CC(=CC=C1O)C=CC(=O)O MCULE-6127598109 [0,1,0,0,0,0|0,0,1]=2 128 B14R1.42 COC1=CC(=CC=C1O)C=CC(=O)[O-] MCULE-9094428143 [0,1,0,0,0,0|0,0,2]=3 129 B14R1.42 COC1=CC(=CC=C1O)C=C[N+](=O)[O-] MCULE-9524225244 [0,1,0,0,0,0|1,0,1]=3 130 B14R1.42 COC1=CC(=CC=C1O)CCC(C)N MCULE-2226728383 [0,1,0,0,0,0|1,0,2]=4 131 B14R1.42 COC1=CC(=CC=C1O)CCC(C)N MCULE-2378106537 [0,1,0,0,0,0|1,0,2]=4 132 B14R1.42 COC1=CC(=CC=C1O)CCC(C)O MCULE-5336896321 [0,1,0,0,0,0|0,0,2]=3 133 B14R1.42 O=CC1=CC(=CC=C1O)/C=C/C(=O)O MCULE-5384875014 [0,1,0,0,0,0|2,0,1]=4 134 B14R1.626 CC=CC(=O)C1=CC=C(C(=C1)OC)Br MCULE-8267103616 [0,1,0,0,0,0|2,0,1]=4 135 B14R1.626 CC=CC(=O)C1=CC=C(C(=C1)OC)Cl MCULE-7024929555 [0,1,0,0,0,0|2,0,1]=4 136 B14R1.626 CC=CC(=O)C1=CC=C(C(=C1)OC)F MCULE-9984199874 [0,1,0,0,0,0|2,0,1]=4 137 B14R1.626 CCCC(=O)C1=CC=C(C(=C1)OC)Br MCULE-2414228830 [0,1,0,0,0,0|2,0,1]=4 138 B14R1.626 CCCC(=O)C1=CC=C(C(=C1)OC)Cl MCULE-3749652002 [0,1,0,0,0,0|2,0,1]=4 139 B14R1.626 CCCC(=O)C1=CC=C(C(=C1)OC)F MCULE-4206167613 [0,1,0,0,0,0|2,0,1]=4 140 B14R1.626 CCCC(=O)C1=CC=C(C(=C1)OC)O MCULE-5478120047 [0,1,0,0,0,0|1,0,1]=3 141 B14R1.626 CCC[C@@H](N)C1=CC=C(C(=C1)OC)O MCULE-4518039121 [0,1,0,0,0,0|1,0,2]=4 142 B14R1.626 CCC[C@@H](N)C1=CC=C(C(=C1)OC)O MCULE-8212666904 [0,1,0,0,0,0|1,0,2]=4 143 B14R1.626 CCC[C@H](N)C1=CC=C(C(=C1)OC)O MCULE-4809804788 [0,1,0,0,0,0|1,0,2]=4 144 B14R1.626 CCC[C@H](N)C1=CC=C(C(=C1)OC)O MCULE-6992429379 [0,1,0,0,0,0|1,0,2]=4 145 B14R1.626 CCNC(=O)C1=CC=C(C(=C1)OC)Br MCULE-4980245083 [0,1,0,0,0,0|3,0,0]=4 146 B14R1.626 CCNC(=O)C1=CC=C(C(=C1)OC)I MCULE-9332811640 [0,1,0,0,0,0|3,0,0]=4 147 B14R1.626 CCNC(=O)C1=CC=C(C(=C1)OC)N MCULE-7962777884 [0,1,0,0,0,0|3,0,0]=4 148 B14R1.626 CCOC(=O)C1=CC(=C(C=C1)C)OC MCULE-7251515826 [0,1,0,0,0,0|3,0,0]=4 149 B14R1.626 CCOC(=O)C1=CC(=C(C=C1)Cl)OC MCULE-9673687237 [0,1,0,0,0,0|3,0,0]=4 150 B14R1.626 CCOC(=O)C1=CC=C(C(=C1)NC)O MCULE-3308926304 [0,1,0,0,0,0|3,0,0]=4 151 B14R1.626 CCOC(=O)C1=CC=C(C(=C1)OC)Br MCULE-4450587112 [0,1,0,0,0,0|3,0,0]=4 152 B14R1.626 CCOC(=O)C1=CC=C(C(=C1)OC)F MCULE-3151927188 [0,1,0,0,0,0|3,0,0]=4 153 B14R1.626 CCOC(=O)C1=CC=C(C(=C1)OC)N MCULE-4390772537 [0,1,0,0,0,0|3,0,0]=4 154 B14R1.626 CCOC(=O)C1=CC=C(C(=C1)OC)O MCULE-6276948791 [0,1,0,0,0,0|2,0,0]=3 155 B14R1.626 COC1=C(C=CC(=C1)C(=O)CCO)O MCULE-4323163724 [0,1,0,0,0,0|0,0,1]=2 156 B14R1.626 COC1=C(C=CC(=C1)[C@@H](N)CCO)C MCULE-3501636432 [0,1,0,0,0,0|1,0,2]=4 157 B14R1.626 COC1=C(C=CC(=C1)[C@@H](N)CCO)C MCULE-4413637241 [0,1,0,0,0,0|1,0,2]=4 158 B14R1.626 COC1=C(C=CC(=C1)[C@@H](N)CCO)F MCULE-1844137024 [0,1,0,0,0,0|1,0,2]=4 159 B14R1.626 COC1=C(C=CC(=C1)[C@@H](N)CCO)F MCULE-5508288778 [0,1,0,0,0,0|1,0,2]=4 160 B14R1.626 COC1=C(C=CC(=C1)[C@H](N)CCO)C MCULE-4732321177 [0,1,0,0,0,0|1,0,2]=4 161 B14R1.626 COC1=C(C=CC(=C1)[C@H](N)CCO)C MCULE-8381210985 [0,1,0,0,0,0|1,0,2]=4 162 B14R1.626 COC1=C(C=CC(=C1)[C@H](N)CCO)F MCULE-6452187933 [0,1,0,0,0,0|1,0,2]=4 163 B14R1.626 COC1=C(C=CC(=C1)[C@H](N)CCO)F MCULE-8500047479 [0,1,0,0,0,0|1,0,2]=4 164 B14R1.626 COC1=CC(=CC=C1Cl)[C@@H](N)CCO MCULE-1091466783 [0,1,0,0,0,0|1,0,2]=4 165 B14R1.626 COC1=CC(=CC=C1Cl)[C@@H](N)CCO MCULE-1326172165 [0,1,0,0,0,0|1,0,2]=4 166 B14R1.626 COC1=CC(=CC=C1Cl)[C@H](N)CCO MCULE-2700782824 [0,1,0,0,0,0|1,0,2]=4 167 B14R1.626 COC1=CC(=CC=C1Cl)[C@H](N)CCO MCULE-5101766118 [0,1,0,0,0,0|1,0,2]=4 168 B14R1.626 COC1=CC(=CC=C1O)C(N)CCO MCULE-6692618155 [0,1,0,0,0,0|0,0,2]=3 169 B14R1.626 COC1=CC(=CC=C1O)C(N)CCO MCULE-8909504526 [0,1,0,0,0,0|0,0,2]=3 170 B14R1.626 COC1=CC(=CC=C1O)[C@@H](N)CCF MCULE-7399464471 [0,1,0,0,0,0|1,0,2]=4 171 B14R1.626 COC1=CC(=CC=C1O)[C@@H](N)CCF MCULE-8225328757 [0,1,0,0,0,0|1,0,2]=4 172 B14R1.626 COC1=CC(=CC=C1O)[C@@H](N)CCN MCULE-3535016679 [0,1,0,0,0,0|1,0,2]=4 173 B14R1.626 COC1=CC(=CC=C1O)[C@@H](N)CCN MCULE-8953839252 [0,1,0,0,0,0|1,0,2]=4 174 B14R1.626 COC1=CC(=CC=C1O)[C@@H](N)CCO MCULE-4933967291 [0,1,0,0,0,0|0,0,2]=3 175 B14R1.626 COC1=CC(=CC=C1O)[C@@H](N)CCO MCULE-5528938085 [0,1,0,0,0,0|0,0,2]=3 176 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCF MCULE-1107682886 [0,1,0,0,0,0|1,0,2]=4 177 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCF MCULE-2927869241 [0,1,0,0,0,0|1,0,2]=4 178 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCN MCULE-5661102788 [0,1,0,0,0,0|1,0,2]=4 179 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCN MCULE-7142622368 [0,1,0,0,0,0|1,0,2]=4 180 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCO MCULE-1231644914 [0,1,0,0,0,0|0,0,2]=3 181 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCO MCULE-1663497503 [0,1,0,0,0,0|0,0,2]=3 182 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCO MCULE-6452510230 [0,1,0,0,0,0|0,0,2]=3 183 B14R1.626 COC1=CC(=CC=C1O)[C@H](N)CCO MCULE-7572129571 [0,1,0,0,0,0|0,0,2]=3 184 B14R1.791 CCNCC1=CC(=C(C=C1)O)OCC MCULE-5205767581 [0,1,0,0,0,0|2,0,1]=4 185 B14R1.791 CCNCC1=CC(=C(C=C1)O)OCC MCULE-7972718996 [0,1,0,0,0,0|2,0,1]=4 186 B14R1.793 CCCNC1=CC=C(C(=C1)OC)OC MCULE-4450009506 [0,1,0,0,0,0|2,0,1]=4 187 B14R1.793 CCNCC1=CC=C(C(=C1)OC)OC MCULE-5280652333 [0,1,0,0,0,0|2,0,1]=4 188 B14R1.793 COC1=C(C=C(C=C1)/C=C/CO)OC MCULE-2540308957 [0,1,0,0,0,0|0,0,0]=1 189 B14R1.793 COC1=C(C=C(C=C1)C=CCN)OC MCULE-8358067549 [0,1,0,0,0,0|1,0,0]=2 190 B14R1.793 COC1=C(C=C(C=C1)CCCO)OC MCULE-5468524872 [0,1,0,0,0,0|0,0,2]=3 191 B14R1.793 COC1=C(C=C(C=C1)NCCN)OC MCULE-2072352373 [0,1,0,0,0,0|2,0,1]=4 192 B14R1.793 COC1=C(C=C(C=C1)OCCBr)OC MCULE-6512161933 [0,1,0,0,0,0|2,0,1]=4 193 B14R1.793 COC1=C(N=C(C=C1)C#CCO)OC MCULE-5010597290 [0,1,0,0,0,0|1,0,2]=4 194 B14R1.793 COC1=C(N=CC(=C1)C#CCO)OC MCULE-1189017770 [0,1,0,0,0,0|1,0,2]=4 195 B14R1.793 COC1=CC=C(C=C1OC)/C=C/C#N MCULE-6973959622 [0,1,0,0,0,0|1,0,1]=3 196 B14R1.793 COC1=CC=C(C=C1OC)C#CCBr MCULE-7363196916 [0,1,0,0,0,0|1,0,2]=4 197 B14R1.793 COC1=CC=C(C=C1OC)C#CCCl MCULE-5346723707 [0,1,0,0,0,0|1,0,2]=4 198 B14R1.793 COC1=CC=C(C=C1OC)C#CCO MCULE-7127551038 [0,1,0,0,0,0|0,0,2]=3 199 B14R1.793 COC1=CC=C(C=C1OC)C=CC#N MCULE-4445578115 [0,1,0,0,0,0|1,0,1]=3 200 B14R1.793 COC1=CC=C(C=C1OC)C=CCO MCULE-1226013190 [0,1,0,0,0,0|0,0,0]=1 201 B14R1.793 COC1=CC=C(C=C1OC)CC=CF MCULE-2245028632 [0,1,0,0,0,0|1,0,2]=4 202 B14R1.793 COC1=CC=C(C=C1OC)CCCBr MCULE-4818016160 [0,1,0,0,0,0|1,0,2]=4 203 B14R1.793 COC1=CC=C(C=C1OC)CCCN MCULE-2679891969 [0,1,0,0,0,0|1,0,2]=4 204 B14R1.793 COC1=CC=C(C=C1OC)CCCN MCULE-9958334781 [0,1,0,0,0,0|1,0,2]=4 205 B14R1.793 CON=CC1=CC=C(C(=C1)OC)OC MCULE-2682451344 [0,1,0,0,0,0|3,0,0]=4 206 B14R1.907 C=CCNCC1=CC(=C(C=C1)O)OC MCULE-8546580731 [0,1,0,0,0,0|2,0,1]=4 207 B14R1.907 C=CCNCC1=CC(=C(C=C1)O)OC MCULE-9782214031 [0,1,0,0,0,0|2,0,1]=4 208 B14R1.907 CCCNCC1=CC(=C(C=C1)O)OC MCULE-1579375179 [0,1,0,0,0,0|1,0,2]=4 209 B14R1.907 CCCNCC1=CC(=C(C=C1)O)OC MCULE-1888904129 [0,1,0,0,0,0|1,0,2]=4 210 B14R1.907 COC/C=C/C1=CC(=C(C=C1)O)OC MCULE-6022384798 [0,1,0,0,0,0|0,0,0]=1 211 B14R1.907 COCC=CC1=CC=C(C(=C1)OC)O MCULE-7010737134 [0,1,0,0,0,0|0,0,0]=1 212 B14R1.907 COCCNC1=CC=C(C(=C1)OC)Cl MCULE-1359836079 [0,1,0,0,0,0|2,0,1]=4 213 B14R1.907 COCCOC1=CC=C(C(=C1)OC)Br MCULE-6405082356 [0,1,0,0,0,0|2,0,1]=4 214 B14R1.907 COCCOC1=CC=C(C(=C1)OC)N MCULE-9056525054 [0,1,0,0,0,0|2,0,1]=4 215 B14R1.3405 CCC(=O)NC1=CC=C(C(=C1)OC)Cl MCULE-3456376911 [0,1,0,0,0,0|3,0,0]=4 216 B14R1.3405 CCC(=O)NC1=CC=C(C(=C1)OC)F MCULE-6287767816 [0,1,0,0,0,0|3,0,0]=4 217 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)O)OC MCULE-9495282938 [0,1,0,0,0,0|2,0,1]=4 218 B14R1.3405 COC1=C(C=CC(=C1)CC(=O)CO)O MCULE-7311560675 [0,1,0,0,0,0|0,0,1]=2 219 B14R1.3405 COC1=C(C=CC(=C1)CC(O)CO)O MCULE-6720173109 [0,1,0,0,0,0|0,0,2]=3 220 B14R1.3405 COC1=C(C=CC(=C1)NC(=O)CBr)O MCULE-8878734491 [0,1,0,0,0,0|2,0,0]=3 221 B14R1.3405 COC1=CC(=CC=C1C)CC(C)CO MCULE-7289434258 [0,1,0,0,0,0|1,0,2]=4 222 B14R1.3405 COC1=CC(=CC=C1Cl)NC(=O)CCl MCULE-4201683727 [0,1,0,0,0,0|3,0,0]=4 223 B14R2.203 COC1=C(C=CC2=C1C=CC=C2)Br MCULE-5652269245 [0,0,0,1,0,0|2,0,1]=4 224 B14R2.203 COC1=C(C=CC2=CC=CC=C12)I MCULE-5111183940 [0,0,0,1,0,0|2,0,1]=4 225 B14R2.203 COC1=C2C=CC=CC2=CC=C1C MCULE-9023149143 [0,0,0,1,0,0|2,0,1]=4 226 B14R2.203 COC1=C2C=CC=CC2=CC=C1O MCULE-1120310560 [0,0,0,1,0,0|1,0,1]=3 227 B14R2.203 COC1=C2N=CC=CC2=CC=C1Br MCULE-6702084580 [0,0,0,1,0,0|2,0,1]=4 228 B14R2.991 BrCCOC1=CC2=C(C=C1)OCO2 MCULE-1019374530 [0,0,0,1,0,0|2,0,1]=4 229 B14R2.991 CCCCC1=CC=C2OCOC2=C1 MCULE-6941111231 [0,0,0,1,0,0|1,0,2]=4 230 B14R2.991 CCNCC1=CC2=C(C=C1)OCO2 MCULE-8359692893 [0,0,0,1,0,0|2,0,1]=4 231 B14R2.991 CCNCC1=CC=C2OCOC2=C1 MCULE-5821363184 [0,0,0,1,0,0|2,0,1]=4 232 B14R2.991 NCCCC1=CC2=C(C=C1)OCO2 MCULE-8008605143 [0,0,0,1,0,0|1,0,2]=4 233 B14R2.991 NCCCC1=CC2=C(C=C1)OCO2 MCULE-8425929284 [0,0,0,1,0,0|1,0,2]=4 234 B14R2.991 NCCOC1=CC2=C(C=C1)OCO2 MCULE-1634313952 [0,0,0,1,0,0|2,0,1]=4 235 B14R2.991 NCCOC1=CC2=C(C=C1)OCO2 MCULE-1768589667 [0,0,0,1,0,0|2,0,1]=4 236 B14R2.991 O=CC=CC1=CC2=C(C=C1)OCO2 MCULE-9056286104 [0,0,0,1,0,0|0,0,2]=3 237 B14R2.991 OC/C=C/C1=CC2=C(C=C1)OCO2 MCULE-4515716813 [0,0,0,1,0,0|0,0,0]=1 238 B14R2.991 OCC=CC1=CC=C2NC=CC2=C1 MCULE-5310419998 [0,0,0,1,0,0|2,0,1]=4 239 B14R2.991 OCCCC1=CC2=C(C=C1)OCC2 MCULE-3835222457 [0,0,0,1,0,0|1,0,2]=4 240 B14R2.991 OCCCC1=CC=C2OCOC2=C1 MCULE-8414347468 [0,0,0,1,0,0|0,0,2]=3 241 B14R2.991 OCCNC1=CC=C2OCOC2=C1 MCULE-4652343766 [0,0,0,1,0,0|1,0,1]=3 242 B14R2.991 OCCNC1=CC=C2OCOC2=C1 MCULE-6339503187 [0,0,0,1,0,0|1,0,1]=3 243 B14R2.991 OCN=CC1=CC2=C(C=C1)OCO2 MCULE-8805966502 [0,0,0,1,0,0|1,0,0]=2 244 B14R2.1128 COC1=C(C=C2C=CC=CC2=C1)Br MCULE-8257506282 [0,0,0,1,0,0|2,0,1]=4 245 B14R2.1128 COC1=C(C=C2C=CC=CC2=C1)N MCULE-8771774368 [0,0,0,1,0,0|2,0,1]=4 246 B14R2.1128 COC1=C(C=C2C=CC=CC2=N1)O MCULE-3082091354 [0,0,0,1,0,0|2,0,1]=4 247 B14R2.1128 COC1=C(C=C2C=NC=CC2=C1)Br MCULE-1705072843 [0,0,0,1,0,0|3,0,0]=4 248 B14R2.1128 COC1=C(C=C2C=NC=CC2=C1)O MCULE-5643627086 [0,0,0,1,0,0|2,0,0]=3 249 B14R2.1128 COC1=C(C=C2CCNCC2=C1)O MCULE-8464777412 [0,0,0,1,0,0|2,0,1]=4 250 B14R2.1128 COC1=C(C=C2N=CC=CC2=C1)Br MCULE-7218875223 [0,0,0,1,0,0|2,0,1]=4 251 B14R2.1128 COC1=C(C=C2N=CC=CC2=C1)C MCULE-5340411185 [0,0,0,1,0,0|2,0,1]=4 252 B14R2.1128 COC1=C(C=C2N=CC=CC2=C1)F MCULE-6360245620 [0,0,0,1,0,0|2,0,1]=4 253 B14R2.1128 COC1=CC2=C(C=C1Br)OCCC2 MCULE-3512303997 [0,0,0,1,0,0|1,0,2]=4 254 B14R2.1128 COC1=CC2=C(C=CC=C2)C=C1O MCULE-4292163690 [0,0,0,1,0,0|1,0,1]=3 255 B14R2.1128 COC1=CC2=C(C=NC=C2)C=C1F MCULE-2132168221 [0,0,0,1,0,0|3,0,0]=4 256 B14R2.1128 COC1=CC2=CC=CC=C2C=C1C MCULE-3466484364 [0,0,0,1,0,0|2,0,1]=4 257 B14R2.1128 COC1=CC2=CC=CC=C2C=C1I MCULE-4694529918 [0,0,0,1,0,0|2,0,1]=4 258 B14R2.3168 COC1=CC(=CC=C1O)CC2CC2 MCULE-5496892297 [0,0,0,1,0,0|1,0,2]=4 259 B14R2.3168 COC1=CC(=CC=C1O)CC2CO2 MCULE-7789938250 [0,0,0,1,0,0|0,0,2]=3 260 B14R2.16149 COC1=CC(=CC=C1O)[C@@H]2CCN2 MCULE-1659101159 [0,0,0,1,0,0|1,0,2]=4 261 B14R2.16149 COC1=CC(=CC=C1O)[C@@H]2CCN2 MCULE-9328972736 [0,0,0,1,0,0|1,0,2]=4 262 B14R2.16149 COC1=CC(=CC=C1O)[C@H]2CCN2 MCULE-4756282720 [0,0,0,1,0,0|1,0,2]=4 263 B14R2.16149 COC1=CC(=CC=C1O)[C@H]2CCN2 MCULE-8368479538 [0,0,0,1,0,0|1,0,2]=4 264 B11R1.189 C=CCC1=CC=CC(=C1)OC MCULE-5070580479 [2,0,0,0,0,0|0,0,2]=4 265 B11R1.189 CCC1=CC=CC(=C1)CCO MCULE-6179189690 [2,0,0,0,0,0|1,0,1]=4 266 B11R1.189 CCCC1=CC(=CC=C1)OC MCULE-8784029729 [2,0,0,0,0,0|0,0,2]=4 267 B11R1.189 CCNC1=CC(=CC=C1)OC MCULE-1091935073 [2,0,0,0,0,0|1,0,1]=4 268 B11R1.189 CCOC1=CC=CC(=C1)OC MCULE-9627659326 [2,0,0,0,0,0|1,0,1]=4 269 B11R1.189 CCSC1=CC(=CC=C1)OC MCULE-5832548258 [2,0,0,0,0,0|1,0,1]=4 270 B11R1.189 CN=CC1=CC(=CC=C1)OC MCULE-5046095034 [2,0,0,0,0,0|1,0,0]=3 271 B11R1.189 CNCC1=CC(=CC=C1)OC MCULE-5111951645 [2,0,0,0,0,0|1,0,1]=4 272 B11R1.189 CNCC1=CC(=CC=C1)OC MCULE-7869674203 [2,0,0,0,0,0|1,0,1]=4 273 B11R1.189 COC1=CC(=CC=C1)CCN MCULE-9084362332 [2,0,0,0,0,0|1,0,1]=4 274 B11R1.189 COC1=CC(=CC=C1)CNO MCULE-2815639953 [2,0,0,0,0,0|1,0,1]=4 275 B11R1.189 COC1=CC(=CN=C1)C=NO MCULE-7497304711 [2,0,0,0,0,0|2,0,0]=4 276 B11R1.189 COC1=CC=CC(=C1)/C=N/O MCULE-9656497631 [2,0,0,0,0,0|1,0,0]=3 277 B11R1.189 COC1=CC=CC(=C1)C=NO MCULE-3429962532 [2,0,0,0,0,0|1,0,0]=3 278 B11R1.189 COC1=CC=CC(=C1)CC=O MCULE-6637745843 [2,0,0,0,0,0|0,0,2]=4 279 B11R1.189 COC1=CC=CC(=C1)CCBr MCULE-7171032199 [2,0,0,0,0,0|1,0,1]=4 280 B11R1.189 COC1=CC=CC(=C1)CCCl MCULE-8210785115 [2,0,0,0,0,0|1,0,1]=4 281 B11R1.189 COC1=CC=CC(=C1)CCN MCULE-3105360363 [2,0,0,0,0,0|1,0,1]=4 282 B11R1.189 COC1=CC=CC(=C1)CCO MCULE-7250566485 [2,0,0,0,0,0|0,0,1]=3 283 B11R1.189 COC1=CC=CC(=C1)CCS MCULE-7631014116 [2,0,0,0,0,0|0,1,1]=4 284 B11R1.189 COC1=CC=CC(=C1)CSC MCULE-4005334714 [2,0,0,0,0,0|1,0,1]=4 285 B11R1.189 COC1=CC=CC(=C1)NC=O MCULE-9949326189 [2,0,0,0,0,0|1,0,1]=4 286 B11R1.189 COC1=CN=CC(=C1)/C=N/O MCULE-4312029089 [2,0,0,0,0,0|2,0,0]=4 287 B11R1.189 COCC1=CC(=CC=C1)OC MCULE-7357212785 [2,0,0,0,0,0|1,0,1]=4 288 B11R1.189 CSC1=CC=CC(=C1)CCO MCULE-3384744458 [2,0,0,0,0,0|0,1,1]=4 289 B11R1.192 C=CCC1=CC=C(C(=C1)O)O MCULE-2364630742 [2,0,0,0,0,0|0,0,2]=4 290 B11R1.192 CC1=C(C=CC(=C1)CCO)Br MCULE-9993976748 [2,0,0,0,0,0|1,0,1]=4 291 B11R1.192 CC1=C(C=CC(=C1)CCO)Cl MCULE-9382234094 [2,0,0,0,0,0|1,0,1]=4 292 B11R1.192 CC1=C(C=CC(=C1)CCO)F MCULE-1946388352 [2,0,0,0,0,0|1,0,1]=4 293 B11R1.192 CC1=CC(=CC=C1F)C=NO MCULE-2352086551 [2,0,0,0,0,0|2,0,0]=4 294 B11R1.192 CC1=CC=C(C=C1C)C=NO MCULE-4537438016 [2,0,0,0,0,0|2,0,0]=4 295 B11R1.192 CC1=CC=C(C=C1C)CCO MCULE-7758054482 [2,0,0,0,0,0|1,0,1]=4 296 B11R1.192 CCCC1=CC=C(C(=C1)O)O MCULE-3343554301 [2,0,0,0,0,0|0,0,2]=4 297 B11R1.192 CCNC1=CC=C(C(=C1)O)O MCULE-2060255958 [2,0,0,0,0,0|1,0,1]=4 298 B11R1.192 CCNC1=CC=C(C(=C1)O)O MCULE-7205284854 [2,0,0,0,0,0|1,0,1]=4 299 B11R1.192 CCOC1=CC(=C(C=C1)O)C MCULE-9228824416 [2,0,0,0,0,0|1,0,1]=4 300 B11R1.192 CCOC1=CC(=C(C=C1)O)O MCULE-3918531537 [2,0,0,0,0,0|1,0,1]=4 301 B11R1.192 CCSC1=CC(=C(C=C1)O)C MCULE-6140713042 [2,0,0,0,0,0|1,0,1]=4 302 B11R1.192 CNCC1=CC=C(C(=C1)O)O MCULE-1750371477 [2,0,0,0,0,0|1,0,1]=4 303 B11R1.192 CNCC1=CC=C(C(=C1)O)O MCULE-9578086608 [2,0,0,0,0,0|1,0,1]=4 304 B11R1.192 COCC1=CC(=C(C=C1)O)O MCULE-6643791519 [2,0,0,0,0,0|1,0,1]=4 305 B11R1.192 NCCC1=CC(=C(C=C1)O)O MCULE-7558764100 [2,0,0,0,0,0|1,0,1]=4 306 B11R1.192 NCCC1=CC(=C(C=C1)O)O MCULE-8844188424 [2,0,0,0,0,0|1,0,1]=4 307 B11R1.192 NCCC1=CC=C(C(=C1)O)O MCULE-1131560690 [2,0,0,0,0,0|1,0,1]=4 308 B11R1.192 O=CCC1=CC(=C(C=C1)O)O MCULE-9734495849 [2,0,0,0,0,0|0,0,2]=4 309 B11R1.192 OC1=C(C=C(C=C1)CCBr)O MCULE-5496005445 [2,0,0,0,0,0|1,0,1]=4 310 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl MCULE-1090489258 [2,0,0,0,0,0|1,0,1]=4 311 B11R1.192 OCCC1=CC=C(C(=C1)Br)O MCULE-2226509344 [2,0,0,0,0,0|1,0,1]=4 312 B11R1.192 OCCC1=CC=C(C(=C1)F)O MCULE-8149162022 [2,0,0,0,0,0|1,0,1]=4 313 B11R1.192 OCCC1=CC=C(C(=C1)O)O MCULE-8853269273 [2,0,0,0,0,0|0,0,1]=3 314 B11R1.192 ON=CC1=CC(=C(C=C1)O)O MCULE-3760750194 [2,0,0,0,0,0|1,0,0]=3 315 B11R1.280 C=CC1=CC(=C(C=C1)Br)OC MCULE-7465803764 [2,0,0,0,0,0|1,0,0]=3 316 B11R1.280 C=CC1=CC(=C(C=C1)C)OC MCULE-9905762322 [2,0,0,0,0,0|1,0,0]=3 317 B11R1.280 C=CC1=CC(=C(C=C1)O)OC MCULE-4834642824 [2,0,0,0,0,0|0,0,0]=2 318 B11R1.280 C=CC1=CC=C(C(=C1)OC)F MCULE-7341709054 [2,0,0,0,0,0|1,0,0]=3 319 B11R1.280 CCC1=C(C=CC(=C1)C=O)O MCULE-9538753077 [2,0,0,0,0,0|1,0,1]=4 320 B11R1.280 CCC1=CC(=C(C=C1)O)OC MCULE-6493096993 [2,0,0,0,0,0|0,0,1]=3 321 B11R1.280 CCC1=CC(=CC=C1Cl)CO MCULE-4437126491 [2,0,0,0,0,0|2,0,0]=4 322 B11R1.280 CCC1=CC(=CC=C1F)CO MCULE-2240927093 [2,0,0,0,0,0|2,0,0]=4 323 B11R1.280 CCC1=CC=C(C(=C1)OC)Br MCULE-9744401163 [2,0,0,0,0,0|1,0,1]=4 324 B11R1.280 CNC1=CC=C(C(=C1)OC)Br MCULE-3271561479 [2,0,0,0,0,0|2,0,0]=4 325 B11R1.280 CNC1=CC=C(C(=C1)OC)Cl MCULE-2159318453 [2,0,0,0,0,0|2,0,0]=4 326 B11R1.280 CNC1=CC=C(C(=C1)OC)F MCULE-5071226028 [2,0,0,0,0,0|2,0,0]=4 327 B11R1.280 COC1=C(C=CC(=C1)C#N)O MCULE-8231766274 [2,0,0,0,0,0|1,0,1]=4 328 B11R1.280 COC1=C(C=CC(=C1)C=O)Cl MCULE-9297800072 [2,0,0,0,0,0|1,0,1]=4 329 B11R1.280 COC1=C(C=CC(=C1)C=O)F MCULE-6933823468 [2,0,0,0,0,0|1,0,1]=4 330 B11R1.280 COC1=C(C=CC(=C1)CBr)C MCULE-8452051415 [2,0,0,0,0,0|2,0,0]=4 331 B11R1.280 COC1=C(C=CC(=C1)CBr)Cl MCULE-5618422742 [2,0,0,0,0,0|2,0,0]=4 332 B11R1.280 COC1=C(C=CC(=C1)CBr)F MCULE-7405228584 [2,0,0,0,0,0|2,0,0]=4 333 B11R1.280 COC1=C(C=CC(=C1)CN)C MCULE-3066482406 [2,0,0,0,0,0|2,0,0]=4 334 B11R1.280 COC1=C(C=CC(=C1)CN)C MCULE-9843159220 [2,0,0,0,0,0|2,0,0]=4 335 B11R1.280 COC1=C(C=CC(=C1)CN)O MCULE-3328007660 [2,0,0,0,0,0|1,0,0]=3 336 B11R1.280 COC1=C(C=CC(=C1)CN)O MCULE-8907351009 [2,0,0,0,0,0|1,0,0]=3 337 B11R1.280 COC1=C(C=CC(=C1)CO)C MCULE-2207207701 [2,0,0,0,0,0|1,0,0]=3 338 B11R1.280 COC1=C(C=CC(=C1)CO)Cl MCULE-8431424121 [2,0,0,0,0,0|1,0,0]=3 339 B11R1.280 COC1=C(C=CC(=C1)CO)F MCULE-1176268426 [2,0,0,0,0,0|1,0,0]=3 340 B11R1.280 COC1=C(C=CC(=C1)CO)N MCULE-9778966986 [2,0,0,0,0,0|1,0,0]=3 341 B11R1.280 COC1=C(C=CC(=C1)SC)N MCULE-5826372247 [2,0,0,0,0,0|2,0,0]=4 342 B11R1.280 COC1=C(C=CC(=C1)SC)N MCULE-6684457223 [2,0,0,0,0,0|2,0,0]=4 343 B11R1.280 COC1=C(C=CC(=N1)CO)Br MCULE-3083549122 [2,0,0,0,0,0|2,0,0]=4 344 B11R1.280 COC1=C(N=CC(=C1)CO)Cl MCULE-9557487103 [2,0,0,0,0,0|2,0,0]=4 345 B11R1.280 COC1=CC(=C(C=C1)Br)OC MCULE-7848417451 [2,0,0,0,0,0|2,0,0]=4 346 B11R1.280 COC1=CC(=C(C=C1)C)OC MCULE-8754469198 [2,0,0,0,0,0|2,0,0]=4 347 B11R1.280 COC1=CC(=C(C=C1)N)OC MCULE-1352942329 [2,0,0,0,0,0|2,0,0]=4 348 B11R1.280 COC1=CC(=C(C=C1)O)SC MCULE-1266663637 [2,0,0,0,0,0|1,1,0]=4 349 B11R1.280 COC1=CC(=C(C=C1)S)OC MCULE-8680875301 [2,0,0,0,0,0|1,1,0]=4 350 B11R1.280 COC1=CC(=CC=C1Br)C=O MCULE-8106273203 [2,0,0,0,0,0|1,0,1]=4 351 B11R1.280 COC1=CC(=CC=C1Br)CBr MCULE-3269349307 [2,0,0,0,0,0|2,0,0]=4 352 B11R1.280 COC1=CC(=CC=C1Br)CCl MCULE-9901216542 [2,0,0,0,0,0|2,0,0]=4 353 B11R1.280 COC1=CC(=CC=C1Br)CN MCULE-2797237437 [2,0,0,0,0,0|2,0,0]=4 354 B11R1.280 COC1=CC(=CC=C1Br)CN MCULE-3329105885 [2,0,0,0,0,0|2,0,0]=4 355 B11R1.280 COC1=CC(=CC=C1Br)CO MCULE-6080961777 [2,0,0,0,0,0|1,0,0]=3 356 B11R1.280 COC1=CC(=CC=C1C)C=O MCULE-9673318529 [2,0,0,0,0,0|1,0,1]=4 357 B11R1.280 COC1=CC(=CC=C1Cl)CCl MCULE-6804004186 [2,0,0,0,0,0|2,0,0]=4 358 B11R1.280 COC1=CC(=CC=C1Cl)CN MCULE-3354367585 [2,0,0,0,0,0|2,0,0]=4 359 B11R1.280 COC1=CC(=CC=C1Cl)CN MCULE-8370316986 [2,0,0,0,0,0|2,0,0]=4 360 B11R1.280 COC1=CC(=CC=C1F)CCl MCULE-1612340292 [2,0,0,0,0,0|2,0,0]=4 361 B11R1.280 COC1=CC(=CC=C1F)CN MCULE-7706838700 [2,0,0,0,0,0|2,0,0]=4 362 B11R1.280 COC1=CC(=CC=C1F)CN MCULE-9232105679 [2,0,0,0,0,0|2,0,0]=4 363 B11R1.280 COC1=CC(=CC=C1F)SC MCULE-3205594346 [2,0,0,0,0,0|2,0,0]=4 364 B11R1.280 COC1=CC(=CC=C1I)C=O MCULE-2859654353 [2,0,0,0,0,0|1,0,1]=4 365 B11R1.280 COC1=CC(=CC=C1I)CBr MCULE-2550522968 [2,0,0,0,0,0|2,0,0]=4 366 B11R1.280 COC1=CC(=CC=C1I)CN MCULE-2184030963 [2,0,0,0,0,0|2,0,0]=4 367 B11R1.280 COC1=CC(=CC=C1I)CN MCULE-8424840322 [2,0,0,0,0,0|2,0,0]=4 368 B11R1.280 COC1=CC(=CC=C1I)CO MCULE-3017704059 [2,0,0,0,0,0|1,0,0]=3 369 B11R1.280 COC1=CC(=CC=C1N)C=O MCULE-7505670200 [2,0,0,0,0,0|1,0,1]=4 370 B11R1.280 COC1=CC(=CC=C1O)C=O MCULE-1294709490 [2,0,0,0,0,0|0,0,1]=3 371 B11R1.280 COC1=CC(=CC=C1O)CO MCULE-9158890331 [2,0,0,0,0,0|0,0,0]=2 372 B11R1.280 COC1=CC(=CN=C1Br)CO MCULE-5910083965 [2,0,0,0,0,0|2,0,0]=4 373 B11R1.280 COC1=CC(=CN=C1O)C=O MCULE-3404677803 [2,0,0,0,0,0|1,0,1]=4 374 B11R1.280 COC1=CC(=NC=C1Br)CO MCULE-6875373722 [2,0,0,0,0,0|2,0,0]=4 375 B11R1.280 COC1=CC=C(C(=C1)OC)Cl MCULE-4680619762 [2,0,0,0,0,0|2,0,0]=4 376 B11R1.280 COC1=CC=C(C(=C1)OC)F MCULE-5471175594 [2,0,0,0,0,0|2,0,0]=4 377 B11R1.280 COC1=CC=C(C(=C1)OC)I MCULE-6947424274 [2,0,0,0,0,0|2,0,0]=4 378 B11R1.280 COC1=CC=C(C(=C1)OC)O MCULE-1733335710 [2,0,0,0,0,0|1,0,0]=3 379 B11R1.280 COC1=CC=C(C(=N1)OC)O MCULE-3215796135 [2,0,0,0,0,0|2,0,0]=4 380 B11R1.280 CSC1=C(C=CC(=C1)C=O)O MCULE-5968112151 [2,0,0,0,0,0|0,1,1]=4 381 B11R1.280 CSC1=C(C=CC(=C1)CO)Cl MCULE-1454886806 [2,0,0,0,0,0|1,1,0]=4 382 B11R1.280 CSC1=CC(=CC=C1C)CO MCULE-3491080602 [2,0,0,0,0,0|1,1,0]=4 383 B11R1.280 CSC1=CC(=CC=C1F)CO MCULE-8605830562 [2,0,0,0,0,0|1,1,0]=4 384 B11R1.280 CSC1=CC=C(C(=C1)SC)O MCULE-1076304096 [2,0,0,0,0,0|1,1,0]=4 385 B11R1.280 O=CC1=CC(=CC=C1O)CO MCULE-2483299934 [2,0,0,0,0,0|2,0,0]=4 386 B11R1.280 OCC1=CC(=C(C=C1)O)CO MCULE-8760500113 [2,0,0,0,0,0|2,0,0]=4 387 B11R1.24 CC1=CC(=CC=C1)/C=C/C=O MCULE-4733426655 [2,0,0,0,0,0|0,0,2]=4 388 B11R1.24 CC1=CC(=CC=C1)/C=C/CO MCULE-9787914536 [2,0,0,0,0,0|0,0,0]=2 389 B11R1.24 CC1=CC(=CC=C1)C#CCO MCULE-5983273900 [2,0,0,0,0,0|0,0,2]=4 390 B11R1.24 CC1=CC(=CC=C1)C=CC=O MCULE-5647254917 [2,0,0,0,0,0|0,0,2]=4 391 B11R1.24 CC1=CC(=CC=C1)C=CCO MCULE-2449933493 [2,0,0,0,0,0|0,0,0]=2 392 B11R1.24 CC1=CC(=CC=C1)CCCO MCULE-1460888437 [2,0,0,0,0,0|0,0,2]=4 393 B11R1.24 CC1=CC(=CC=C1)OCCO MCULE-1992306510 [2,0,0,0,0,0|1,0,1]=4 394 B11R1.24 CC1=CC=CC(=C1)C=CCN MCULE-2419996531 [2,0,0,0,0,0|1,0,0]=3 395 B11R1.24 CC1=CC=CC(=C1)NCCO MCULE-2084203270 [2,0,0,0,0,0|1,0,1]=4 396 B11R1.24 CC1=CC=CC(=C1)SCCO MCULE-1955195829 [2,0,0,0,0,0|1,0,1]=4 397 B11R1.24 NCC=CC1=CC(=CC=C1)Cl MCULE-2274444807 [2,0,0,0,0,0|2,0,0]=4 398 B11R1.24 NCC=CC1=CC(=CC=C1)F MCULE-8355625921 [2,0,0,0,0,0|2,0,0]=4 399 B11R1.24 OC/C=C/C1=CC=CC(=C1)Cl MCULE-4854857934 [2,0,0,0,0,0|1,0,0]=3 400 B11R1.24 OC/C=C/C1=CC=CC(=C1)F MCULE-8391120029 [2,0,0,0,0,0|1,0,0]=3 401 B11R1.24 OCC=CC1=CC(=CC=C1)F MCULE-8385285304 [2,0,0,0,0,0|1,0,0]=3 402 B11R1.24 OCC=CC1=CC=CC(=C1)Cl MCULE-8748678867 [2,0,0,0,0,0|1,0,0]=3 403 B11R1.24 OCCCC1=CC(=CC=C1)O MCULE-5187970951 [2,0,0,0,0,0|0,0,2]=4 404 B11R1.1 BrCC=CC1=CC=C(C=C1)Br MCULE-2257588076 [2,0,0,0,0,0|2,0,0]=4 405 B11R1.1 CC1=CC=C(C=C1)/C=C/CO MCULE-3217079004 [2,0,0,0,0,0|1,0,0]=3 406 B11R1.1 CC1=CC=C(C=C1)C=CCN MCULE-2848722253 [2,0,0,0,0,0|2,0,0]=4 407 B11R1.1 CC1=CC=C(C=C1)C=CCO MCULE-5680135704 [2,0,0,0,0,0|1,0,0]=3 408 B11R1.1 ClC/C=C/C1=CC=C(C=C1)Br MCULE-9798573490 [2,0,0,0,0,0|2,0,0]=4 409 B11R1.1 ClC1=CC=C(C=C1)C=CCBr MCULE-6729099554 [2,0,0,0,0,0|2,0,0]=4 410 B11R1.1 ClCC=CC1=CC=C(C=C1)Br MCULE-6444414810 [2,0,0,0,0,0|2,0,0]=4 411 B11R1.1 ClCC=CC1=CC=C(C=C1)Cl MCULE-5642574241 [2,0,0,0,0,0|2,0,0]=4 412 B11R1.1 FC1=CC=C(C=C1)C=CCBr MCULE-5996941189 [2,0,0,0,0,0|2,0,0]=4 413 B11R1.1 FC1=CC=C(C=C1)C=CCCl MCULE-9741117976 [2,0,0,0,0,0|2,0,0]=4 414 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br MCULE-2189905599 [2,0,0,0,0,0|2,0,0]=4 415 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br MCULE-9358126605 [2,0,0,0,0,0|2,0,0]=4 416 B11R1.1 NCC=CC1=CC=C(C=C1)Br MCULE-4948385234 [2,0,0,0,0,0|2,0,0]=4 417 B11R1.1 NCC=CC1=CC=C(C=C1)Br MCULE-8326861951 [2,0,0,0,0,0|2,0,0]=4 418 B11R1.1 NCC=CC1=CC=C(C=C1)Cl MCULE-1174438668 [2,0,0,0,0,0|2,0,0]=4 419 B11R1.1 NCC=CC1=CC=C(C=C1)F MCULE-5176395309 [2,0,0,0,0,0|2,0,0]=4 420 B11R1.1 O=C/C=C/C1=CC=C(C=C1)O MCULE-1154888936 [2,0,0,0,0,0|0,0,2]=4 421 B11R1.1 O=CC=CC1=CC=C(C=C1)O MCULE-9429867074 [2,0,0,0,0,0|0,0,2]=4 422 B11R1.1 OC/C=C/C1=CC=C(C=C1)Br MCULE-8185891212 [2,0,0,0,0,0|1,0,0]=3 423 B11R1.1 OC/C=C/C1=CC=C(C=C1)Cl MCULE-9189888029 [2,0,0,0,0,0|1,0,0]=3 424 B11R1.1 OC/C=C/C1=CC=C(C=C1)F MCULE-3562533098 [2,0,0,0,0,0|1,0,0]=3 425 B11R1.1 OC/C=C/C1=CC=C(C=C1)O MCULE-3386674818 [2,0,0,0,0,0|0,0,0]=2 426 B11R1.1 OCC=CC1=CC=C(C=C1)Br MCULE-1051095892 [2,0,0,0,0,0|1,0,0]=3 427 B11R1.1 OCC=CC1=CC=C(C=C1)Cl MCULE-2610952734 [2,0,0,0,0,0|1,0,0]=3 428 B11R1.1 OCC=CC1=CC=C(C=C1)F MCULE-3641533528 [2,0,0,0,0,0|1,0,0]=3 429 B11R1.1 OCC=CC1=CC=C(C=C1)O MCULE-4548331432 [2,0,0,0,0,0|0,0,0]=2 430 B11R1.1 OCCCC1=CC=C(C=C1)O MCULE-4368750678 [2,0,0,0,0,0|0,0,2]=4 431 B11R1.1 OCCOC1=CC=C(C=C1)O MCULE-1426055233 [2,0,0,0,0,0|1,0,1]=4 432 B13R1.49 C=C[C@@H](N)C1=CC=C(C(=C1)OC)O MCULE-5718779533 [1,1,0,0,0,0|0,0,2]=4 433 B13R1.49 C=C[C@@H](N)C1=CC=C(C(=C1)OC)O MCULE-7899481294 [1,1,0,0,0,0|0,0,2]=4 434 B13R1.49 C=C[C@H](N)C1=CC=C(C(=C1)OC)O MCULE-2625576237 [1,1,0,0,0,0|0,0,2]=4 435 B13R1.49 C=C[C@H](N)C1=CC=C(C(=C1)OC)O MCULE-6992116547 [1,1,0,0,0,0|0,0,2]=4 436 B13R1.49 CCC(=O)C1=CC(=C(C=C1)O)OC MCULE-7348586424 [1,1,0,0,0,0|0,0,1]=3 437 B13R1.49 CCC(=O)C1=CC=C(C(=C1)OC)Br MCULE-5859208860 [1,1,0,0,0,0|1,0,1]=4 438 B13R1.49 CCC(=O)C1=CC=C(C(=C1)OC)Cl MCULE-6136762240 [1,1,0,0,0,0|1,0,1]=4 439 B13R1.49 CCC(=O)C1=CC=C(C(=C1)OC)F MCULE-5167309345 [1,1,0,0,0,0|1,0,1]=4 440 B13R1.49 CCC(O)C1=CC=C(C(=C1)OC)O MCULE-9276139204 [1,1,0,0,0,0|0,0,2]=4 441 B13R1.49 CCC1=C(C=CC(=C1)C(=O)OC)O MCULE-9629067480 [1,1,0,0,0,0|2,0,0]=4 442 B13R1.49 CC[C@@H](N)C1=CC=C(C(=C1)OC)O MCULE-3248662941 [1,1,0,0,0,0|0,0,2]=4 443 B13R1.49 CC[C@@H](N)C1=CC=C(C(=C1)OC)O MCULE-8589882256 [1,1,0,0,0,0|0,0,2]=4 444 B13R1.49 CC[C@H](N)C1=CC=C(C(=C1)OC)O MCULE-5458874035 [1,1,0,0,0,0|0,0,2]=4 445 B13R1.49 CC[C@H](N)C1=CC=C(C(=C1)OC)O MCULE-7824214531 [1,1,0,0,0,0|0,0,2]=4 446 B13R1.49 CNC(=O)C1=CC=C(C(=C1)OC)Br MCULE-7922704020 [1,1,0,0,0,0|2,0,0]=4 447 B13R1.49 CNC(=O)C1=CC=C(C(=C1)OC)I MCULE-1583255883 [1,1,0,0,0,0|2,0,0]=4 448 B13R1.49 CNC(=O)C1=CC=C(C(=C1)OC)N MCULE-4646943362 [1,1,0,0,0,0|2,0,0]=4 449 B13R1.49 CNC(=O)C1=CC=C(C(=C1)OC)O MCULE-8686696379 [1,1,0,0,0,0|1,0,0]=3 450 B13R1.49 CNC1=CC(=CC=C1O)C(=O)OC MCULE-6359894970 [1,1,0,0,0,0|2,0,0]=4 451 B13R1.49 CNC1=CC(=CC=C1O)C(=O)OC MCULE-8441876309 [1,1,0,0,0,0|2,0,0]=4 452 B13R1.49 COC(=O)C1=CC(=C(C=C1)Br)OC MCULE-8625819533 [1,1,0,0,0,0|2,0,0]=4 453 B13R1.49 COC(=O)C1=CC(=C(C=C1)C)OC MCULE-4964679586 [1,1,0,0,0,0|2,0,0]=4 454 B13R1.49 COC(=O)C1=CC(=C(C=C1)F)OC MCULE-8480595197 [1,1,0,0,0,0|2,0,0]=4 455 B13R1.49 COC(=O)C1=CC(=C(C=C1)I)OC MCULE-2587668755 [1,1,0,0,0,0|2,0,0]=4 456 B13R1.49 COC(=O)C1=CC(=C(C=C1)N)OC MCULE-9258210764 [1,1,0,0,0,0|2,0,0]=4 457 B13R1.49 COC(=O)C1=CC(=C(C=C1)O)OC MCULE-6589732445 [1,1,0,0,0,0|1,0,0]=3 458 B13R1.49 COC(=O)C1=CC(=C(N=C1)O)OC MCULE-5239163893 [1,1,0,0,0,0|2,0,0]=4 459 B13R1.49 COC(=O)C1=CC=C(C(=C1)OC)Cl MCULE-9983388958 [1,1,0,0,0,0|2,0,0]=4 460 B13R1.49 COC(=O)C1=CC=C(C(=C1)SC)O MCULE-7883617708 [1,1,0,0,0,0|1,1,0]=4 461 B13R1.49 COC(=O)C1=NC(=C(C=C1)O)OC MCULE-1745010793 [1,1,0,0,0,0|2,0,0]=4 462 B13R1.49 COC1=C(C=CC(=C1)/C(=N/O)/N)O MCULE-9917275597 [1,1,0,0,0,0|1,0,0]=3 463 B13R1.49 COC1=C(C=CC(=C1)C(=O)NN)O MCULE-7871919927 [1,1,0,0,0,0|2,0,0]=4 464 B13R1.49 COC1=C(C=CC(=C1)C(O)CN)O MCULE-7092290155 [1,1,0,0,0,0|1,0,1]=4 465 B13R1.49 COC1=C(C=CC(=C1)C(O)CN)O MCULE-8609251362 [1,1,0,0,0,0|1,0,1]=4 466 B13R1.49 COC1=C(C=CC(=C1)[C@@H](N)CO)C MCULE-4324439681 [1,1,0,0,0,0|1,0,1]=4 467 B13R1.49 COC1=C(C=CC(=C1)[C@@H](N)CO)C MCULE-6422134311 [1,1,0,0,0,0|1,0,1]=4 468 B13R1.49 COC1=C(C=CC(=C1)[C@@H](N)CO)F MCULE-8230287189 [1,1,0,0,0,0|1,0,1]=4 469 B13R1.49 COC1=C(C=CC(=C1)[C@@H](N)CO)O MCULE-6638438709 [1,1,0,0,0,0|0,0,1]=3 470 B13R1.49 COC1=C(C=CC(=C1)[C@H](N)CO)C MCULE-5813103897 [1,1,0,0,0,0|1,0,1]=4 471 B13R1.49 COC1=C(C=CC(=C1)[C@H](N)CO)C MCULE-9243871735 [1,1,0,0,0,0|1,0,1]=4 472 B13R1.49 COC1=C(C=CC(=C1)[C@H](N)CO)O MCULE-3742883994 [1,1,0,0,0,0|0,0,1]=3 473 B13R1.49 COC1=CC(=CC=C1Br)C(=O)CBr MCULE-2100594245 [1,1,0,0,0,0|2,0,0]=4 474 B13R1.49 COC1=CC(=CC=C1Cl)[C@@H](N)CO MCULE-2083626083 [1,1,0,0,0,0|1,0,1]=4 475 B13R1.49 COC1=CC(=CC=C1Cl)[C@@H](N)CO MCULE-8707973894 [1,1,0,0,0,0|1,0,1]=4 476 B13R1.49 COC1=CC(=CC=C1Cl)[C@H](N)CO MCULE-2803328026 [1,1,0,0,0,0|1,0,1]=4 477 B13R1.49 COC1=CC(=CC=C1Cl)[C@H](N)CO MCULE-5127604692 [1,1,0,0,0,0|1,0,1]=4 478 B13R1.49 COC1=CC(=CC=C1F)/C(=N/O)/N MCULE-3032166465 [1,1,0,0,0,0|2,0,0]=4 479 B13R1.49 COC1=CC(=CC=C1F)C(=O)CBr MCULE-9209519875 [1,1,0,0,0,0|2,0,0]=4 480 B13R1.49 COC1=CC(=CC=C1F)C(N)CO MCULE-3129529768 [1,1,0,0,0,0|1,0,1]=4 481 B13R1.49 COC1=CC(=CC=C1F)C(N)CO MCULE-5431903043 [1,1,0,0,0,0|1,0,1]=4 482 B13R1.49 COC1=CC(=CC=C1F)[C@@H](N)CO MCULE-4002870324 [1,1,0,0,0,0|1,0,1]=4 483 B13R1.49 COC1=CC(=CC=C1F)[C@@H](N)CO MCULE-6330920445 [1,1,0,0,0,0|1,0,1]=4 484 B13R1.49 COC1=CC(=CC=C1F)[C@@H](N)CO MCULE-6535788234 [1,1,0,0,0,0|1,0,1]=4 485 B13R1.49 COC1=CC(=CC=C1F)[C@H](N)CO MCULE-4637874238 [1,1,0,0,0,0|1,0,1]=4 486 B13R1.49 COC1=CC(=CC=C1O)C(=O)CBr MCULE-8514744474 [1,1,0,0,0,0|1,0,0]=3 487 B13R1.49 COC1=CC(=CC=C1O)[C@@H](N)CF MCULE-1216894934 [1,1,0,0,0,0|1,0,1]=4 488 B13R1.49 COC1=CC(=CC=C1O)[C@@H](N)CF MCULE-8587792415 [1,1,0,0,0,0|1,0,1]=4 489 B13R1.49 COC1=CC(=CC=C1O)[C@@H](N)CN MCULE-4043623288 [1,1,0,0,0,0|1,0,1]=4 490 B13R1.49 COC1=CC(=CC=C1O)[C@@H](N)CN MCULE-7165618835 [1,1,0,0,0,0|1,0,1]=4 491 B13R1.49 COC1=CC(=CC=C1O)[C@@H](N)CO MCULE-7335914004 [1,1,0,0,0,0|0,0,1]=3 492 B13R1.49 COC1=CC(=CC=C1O)[C@H](N)CF MCULE-1705368963 [1,1,0,0,0,0|1,0,1]=4 493 B13R1.49 COC1=CC(=CC=C1O)[C@H](N)CF MCULE-9823203798 [1,1,0,0,0,0|1,0,1]=4 494 B13R1.49 COC1=CC(=CC=C1O)[C@H](N)CN MCULE-6464469428 [1,1,0,0,0,0|1,0,1]=4 495 B13R1.49 COC1=CC(=CC=C1O)[C@H](N)CN MCULE-9407952767 [1,1,0,0,0,0|1,0,1]=4 496 B13R1.49 COC1=CC(=CC=C1O)[C@H](N)CO MCULE-6794008513 [1,1,0,0,0,0|0,0,1]=3 497 B13R1.49 [C@@H](N)(CO)C1=CC=C(C(=C1)OC)F MCULE-2381347971 [1,1,0,0,0,0|1,0,1]=4 498 B13R1.52 C=C(C)CC1=CC(=C(C=C1)Br)OC MCULE-8153984668 [1,1,0,0,0,0|1,0,1]=4 499 B13R1.52 C=C(C)CC1=CC=C(C(=C1)OC)Cl MCULE-1388980610 [1,1,0,0,0,0|1,0,1]=4 500 B13R1.52 C=C(C)CC1=CC=C(C(=C1)OC)F MCULE-4250529642 [1,1,0,0,0,0|1,0,1]=4 501 B13R1.52 COC1=C(C=CC(=C1)CC(=O)C)O MCULE-5228649937 [1,1,0,0,0,0|0,0,1]=3 502 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)C MCULE-8778372805 [1,1,0,0,0,0|1,0,1]=4 503 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Cl MCULE-7289901110 [1,1,0,0,0,0|1,0,1]=4 504 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)F MCULE-3825259297 [1,1,0,0,0,0|1,0,1]=4 505 B13R1.52 COC1=C(C=CC(=C1)NC(=O)C)I MCULE-1725856688 [1,1,0,0,0,0|2,0,0]=4 506 B13R1.52 COC1=C(C=CC(=C1)NC(=O)C)N MCULE-2299526366 [1,1,0,0,0,0|2,0,0]=4 507 B13R1.52 COC1=CC(=CC=C1Br)CC(=O)O MCULE-6695009087 [1,1,0,0,0,0|1,0,1]=4 508 B13R1.52 COC1=CC(=CC=C1Cl)NC(=O)C MCULE-7665191410 [1,1,0,0,0,0|2,0,0]=4 509 B13R1.52 COC1=CC(=CC=C1O)CC(=O)O MCULE-8190136486 [1,1,0,0,0,0|0,0,1]=3 510 B13R1.52 COC1=CC(=CC=C1O)CC(C)N MCULE-4369992361 [1,1,0,0,0,0|0,0,2]=4 511 B13R1.52 COC1=CC(=CC=C1O)CC(C)N MCULE-4909629047 [1,1,0,0,0,0|0,0,2]=4 512 B13R1.52 COC1=CC(=CC=C1O)NC(=O)C MCULE-8989763447 [1,1,0,0,0,0|1,0,0]=3 513 B13R1.52 COC1=CC(=CC=C1O)OC(=O)C MCULE-9603945894 [1,1,0,0,0,0|1,0,0]=3 514 B13R1.384 CCOC1=C(C=CC(=C1)CCN)O MCULE-7714967145 [1,1,0,0,0,0|1,0,1]=4 515 B13R1.384 CCOC1=C(C=CC(=C1)CCO)C MCULE-9829595383 [1,1,0,0,0,0|1,0,1]=4 516 B13R1.384 CCOC1=C(C=CC(=C1)CCO)F MCULE-1294046727 [1,1,0,0,0,0|1,0,1]=4 517 B13R1.384 CCOC1=C(C=CC(=C1)CCO)O MCULE-2010085282 [1,1,0,0,0,0|0,0,1]=3 518 B13R1.384 CCOC1=CC(=CC=C1O)C=NO MCULE-1200161273 [1,1,0,0,0,0|1,0,0]=3 519 B13R1.384 CCOC1=CC(=CC=C1O)CCN MCULE-1850883263 [1,1,0,0,0,0|1,0,1]=4 520 B13R1.386 C/C=C/C1=CC=C(C(=C1)OC)OC MCULE-2583381235 [1,1,0,0,0,0|0,0,0]=2 521 B13R1.386 C/C=C\C1=CC(=C(C=C1)OC)OC MCULE-3391441306 [1,1,0,0,0,0|0,0,0]=2 522 B13R1.386 C=CCC1=CC=C(C(=C1)OC)OC MCULE-1548625966 [1,1,0,0,0,0|0,0,2]=4 523 B13R1.386 CC=CC1=CC=C(C(=C1)OC)OC MCULE-8248595337 [1,1,0,0,0,0|0,0,0]=2 524 B13R1.386 CCCC1=CC(=C(C=C1)CO)OC MCULE-4143288676 [1,1,0,0,0,0|0,0,2]=4 525 B13R1.386 CCCC1=CC(=C(C=C1)OC)OC MCULE-9563894197 [1,1,0,0,0,0|0,0,2]=4 526 B13R1.386 CCNC1=CC(=C(C=C1)OC)OC MCULE-7137468720 [1,1,0,0,0,0|1,0,1]=4 527 B13R1.386 CCOC1=CC(=C(C=C1)CO)OC MCULE-1124179331 [1,1,0,0,0,0|1,0,1]=4 528 B13R1.386 CCSC1=CC=C(C(=C1)OC)OC MCULE-8690244986 [1,1,0,0,0,0|1,0,1]=4 529 B13R1.386 CNCC1=CC(=C(C=C1)OC)OC MCULE-5696343404 [1,1,0,0,0,0|1,0,1]=4 530 B13R1.386 CNCC1=CC=C(C(=C1)OC)OC MCULE-2939147727 [1,1,0,0,0,0|1,0,1]=4 531 B13R1.386 COC1=C(C=C(C=C1)/C=N/O)OC MCULE-4827445217 [1,1,0,0,0,0|1,0,0]=3 532 B13R1.386 COC1=C(C=C(C=C1)C=NO)OC MCULE-8786611492 [1,1,0,0,0,0|1,0,0]=3 533 B13R1.386 COC1=C(C=C(C=C1)CCN)OC MCULE-5517861565 [1,1,0,0,0,0|1,0,1]=4 534 B13R1.386 COC1=C(C=C(C=C1)CCN)OC MCULE-6376761343 [1,1,0,0,0,0|1,0,1]=4 535 B13R1.386 COC1=C(C=C(C=C1)CCO)OC MCULE-1582845595 [1,1,0,0,0,0|0,0,1]=3 536 B13R1.386 COC1=C(C=C(C=C1)CCS)OC MCULE-1467689326 [1,1,0,0,0,0|0,1,1]=4 537 B13R1.386 COC1=C(N=C(C=C1)/C=N/O)OC MCULE-9989369072 [1,1,0,0,0,0|2,0,0]=4 538 B13R1.386 COC1=C(N=C(C=C1)C=NO)OC MCULE-1397717623 [1,1,0,0,0,0|2,0,0]=4 539 B13R1.386 COC1=CC(=CC=C1C#N)CCO MCULE-1887317823 [1,1,0,0,0,0|1,0,1]=4 540 B13R1.386 COC1=CC(=CN=C1OC)/C=N/O MCULE-5428543848 [1,1,0,0,0,0|2,0,0]=4 541 B13R1.386 COC1=CC(=CN=C1OC)C=NO MCULE-5281586634 [1,1,0,0,0,0|2,0,0]=4 542 B13R1.386 COC1=CC=C(C=C1OC)/C=N\O MCULE-8159177293 [1,1,0,0,0,0|1,0,0]=3 543 B13R1.386 COC1=CC=C(C=C1OC)CC=O MCULE-6046050276 [1,1,0,0,0,0|0,0,2]=4 544 B13R1.386 COC1=CC=C(C=C1OC)CCBr MCULE-1621048701 [1,1,0,0,0,0|1,0,1]=4 545 B13R1.386 COC1=CC=C(C=C1OC)CCCl MCULE-2838076971 [1,1,0,0,0,0|1,0,1]=4 546 B13R1.2900 COC1=C(C=C(C(=C1)C=NO)Br)O MCULE-2666513150 [1,1,0,0,0,0|1,0,0]=3 547 B13R1.2900 COC1=C(C=C(C(=C1)C=NO)F)F MCULE-2476519262 [1,1,0,0,0,0|2,0,0]=4 548 B13R1.4030 COC1=C(C(=CC(=C1)C=NO)Br)O MCULE-1444524157 [1,1,0,0,0,0|1,0,0]=3 549 B13R1.4030 COC1=C(C(=CC(=C1)C=NO)I)O MCULE-2557158515 [1,1,0,0,0,0|1,0,0]=3 550 B13R1.4030 COC1=C(C(=CC(=C1)CCO)F)F MCULE-6501672548 [1,1,0,0,0,0|1,0,1]=4 551 B13R1.4030 COC1=CC(=CC(=C1O)N)/C=N/O MCULE-4976343459 [1,1,0,0,0,0|1,0,0]=3 552 B13R1.4030 COC1=CC(=CC(=C1O)N)C=NO MCULE-5190533944 [1,1,0,0,0,0|1,0,0]=3 553 B13R1.81 CCC(=O)CC1=CC(=CC=C1)OC MCULE-3597022262 [1,1,0,0,0,0|1,0,1]=4 554 B13R1.81 CCC(=O)NC1=CC(=CC=C1)OC MCULE-1861213474 [1,1,0,0,0,0|2,0,0]=4 555 B13R1.81 COC1=CC(=CC=C1)CC(N)CO MCULE-3024448572 [1,1,0,0,0,0|0,0,2]=4 556 B13R1.81 COC1=CC(=CC=C1)NC(=O)CBr MCULE-1267919699 [1,1,0,0,0,0|2,0,0]=4 557 B13R1.81 COC1=CC(=CC=C1)NC(=O)CI MCULE-4866848159 [1,1,0,0,0,0|2,0,0]=4 558 B13R1.81 COC1=CC(=CC=C1)NC(=O)CN MCULE-5386960138 [1,1,0,0,0,0|2,0,0]=4 559 B13R1.81 COC1=CC(=CC=C1)NC(=O)CN MCULE-7057642158 [1,1,0,0,0,0|2,0,0]=4 560 B13R1.81 COC1=CC(=CC=C1)NC(=O)CS MCULE-4740976680 [1,1,0,0,0,0|1,1,0]=4 561 B13R1.81 COC1=CC=CC(=C1)C/C(=N/O)/N MCULE-3738150891 [1,1,0,0,0,0|1,0,1]=4 562 B13R1.81 COC1=CC=CC(=C1)C/C(=N/O)/N MCULE-9220231008 [1,1,0,0,0,0|1,0,1]=4 563 B13R1.81 COC1=CC=CC(=C1)CC(=O)CCl MCULE-5235164594 [1,1,0,0,0,0|1,0,1]=4 564 B13R1.81 COC1=CC=CC(=C1)C[C@H](N)CO MCULE-3582960497 [1,1,0,0,0,0|0,0,2]=4 565 B13R1.81 COC1=CC=CC(=C1)NC(=O)CCl MCULE-6160216051 [1,1,0,0,0,0|2,0,0]=4 566 B13R1.81 COC1=CC=CC(=C1)NC(=O)CO MCULE-3564580812 [1,1,0,0,0,0|1,0,0]=3 567 B13R1.81 CSC1=CC=CC(=C1)NC(=O)CO MCULE-6644331991 [1,1,0,0,0,0|1,1,0]=4 568 B13R1.460 C=C=CC(=O)C1=CC=CC(=C1)OC MCULE-3145964024 [1,1,0,0,0,0|1,0,1]=4 569 B13R1.460 CC=CC(=O)C1=CC(=CC=C1)OC MCULE-3021540013 [1,1,0,0,0,0|1,0,1]=4 570 B13R1.460 CCCC(=O)C1=CC=CC(=C1)OC MCULE-6502408080 [1,1,0,0,0,0|1,0,1]=4 571 B13R1.460 CCNC(=O)C1=CC(=CC=C1)OC MCULE-3395912477 [1,1,0,0,0,0|2,0,0]=4 572 B13R1.460 CCOC(=N)C1=CC(=CC=C1)OC MCULE-3230597631 [1,1,0,0,0,0|2,0,0]=4 573 B13R1.460 CCOC(=N)C1=CC(=CC=C1)OC MCULE-6663860593 [1,1,0,0,0,0|2,0,0]=4 574 B13R1.460 CCOC(=O)C1=CC=CC(=C1)OC MCULE-2177723101 [1,1,0,0,0,0|2,0,0]=4 575 B13R1.460 COC1=CC(=CC=C1)N(C)CCO MCULE-4989033102 [1,1,0,0,0,0|1,0,1]=4 576 B13R1.460 COC1=CC(=CC=C1)[C@@H](N)CCO MCULE-9018373434 [1,1,0,0,0,0|0,0,2]=4 577 B13R1.460 COC1=CC(=CC=C1)[C@H](N)CCO MCULE-3815954025 [1,1,0,0,0,0|0,0,2]=4 578 B13R1.460 COC1=CC=CC(=C1)C(N)CCO MCULE-7793071138 [1,1,0,0,0,0|0,0,2]=4 579 B13R1.460 COC1=CC=CC(=C1)[C@@H](N)CCO MCULE-6702257117 [1,1,0,0,0,0|0,0,2]=4 580 B13R1.460 COC1=CC=CC(=C1)[C@H](N)CCO MCULE-2523461541 [1,1,0,0,0,0|0,0,2]=4 581 B13R1.643 COC1=CC(=CC=C1)/C=C/C(=O)O MCULE-6328059715 [1,1,0,0,0,0|0,0,1]=3 582 B13R1.643 COC1=CC(=CC=C1)C=CC(=O)C MCULE-4223757837 [1,1,0,0,0,0|0,0,2]=4 583 B13R1.643 COC1=CC(=CC=C1)C=CC(=O)O MCULE-5752702758 [1,1,0,0,0,0|0,0,1]=3 584 B13R1.643 COC1=CC(=CC=C1)C=C[N+](=O)[O-] MCULE-8269398464 [1,1,0,0,0,0|1,0,1]=4 585 B13R1.643 COC1=CC=CC(=C1)/C=C/N(=O)=O MCULE-4927882801 [1,1,0,0,0,0|1,0,1]=4 586 B13R1.643 COC1=CC=CC(=C1)C#CC(C)O MCULE-8410410407 [1,1,0,0,0,0|0,0,2]=4 587 B13R1.643 COC1=CC=CC(=C1)C=CC(=O)Cl MCULE-8888814642 [1,1,0,0,0,0|0,0,2]=4 588 B13R1.643 COC1=CC=CC(=C1)OCC(C)O MCULE-9292152697 [1,1,0,0,0,0|1,0,1]=4 589 B13R1.666 CNCC=CC1=CC=CC(=C1)OC MCULE-6961820944 [1,1,0,0,0,0|1,0,0]=3 590 B13R1.666 COC1=CC(=CC=C1)CCCCO MCULE-6356155369 [1,1,0,0,0,0|0,0,2]=4 591 B13R1.666 COC1=CC(=CN=C1)C=CCCBr MCULE-2051867774 [1,1,0,0,0,0|2,0,0]=4 592 B13R1.666 COC1=CC(=CN=C1)C=CCCBr MCULE-2756329430 [1,1,0,0,0,0|2,0,0]=4 593 B13R1.666 COC1=CC=CC(=C1)C#CCCO MCULE-4793480359 [1,1,0,0,0,0|0,0,2]=4 594 B13R1.666 COC1=CC=CC(=C1)CNCCO MCULE-1618195274 [1,1,0,0,0,0|0,0,2]=4 595 B13R1.136 CC1=CC(=CC(=C1O)C)/C=C/C#N MCULE-9552408750 [1,1,0,0,0,0|1,0,1]=4 596 B13R1.136 CC1=CC(=CC(=C1O)C)CCCO MCULE-6246486683 [1,1,0,0,0,0|0,0,2]=4 597 B13R1.466 CC1=C(C=CC(=C1)[C@@H](N)CCO)O MCULE-4065222537 [1,1,0,0,0,0|0,0,2]=4 598 B13R1.466 CC1=C(C=CC(=C1)[C@@H](N)CCO)O MCULE-4192005050 [1,1,0,0,0,0|0,0,2]=4 599 B13R1.466 CC1=C(C=CC(=C1)[C@H](N)CCO)O MCULE-1608200675 [1,1,0,0,0,0|0,0,2]=4 600 B13R1.466 CC1=C(C=CC(=C1)[C@H](N)CCO)O MCULE-4945731966 [1,1,0,0,0,0|0,0,2]=4 601 B13R1.466 CCCC(=O)C1=CC(=C(C=C1)O)O MCULE-4686455721 [1,1,0,0,0,0|1,0,1]=4 602 B13R1.466 CCOC(=O)C1=CC=C(C(=C1)C)O MCULE-6129353468 [1,1,0,0,0,0|2,0,0]=4 603 B13R1.466 CCOC(=O)C1=CC=C(C(=C1)O)O MCULE-9181060649 [1,1,0,0,0,0|2,0,0]=4 604 B13R1.466 N[C@@H](CCO)C1=CC=C(C(=C1)O)O MCULE-3059537972 [1,1,0,0,0,0|0,0,2]=4 605 B13R1.466 N[C@@H](CCO)C1=CC=C(C(=C1)O)O MCULE-4172675142 [1,1,0,0,0,0|0,0,2]=4 606 B13R1.466 N[C@H](CCO)C1=CC=C(C(=C1)O)O MCULE-1370960891 [1,1,0,0,0,0|0,0,2]=4 607 B13R1.466 N[C@H](CCO)C1=CC=C(C(=C1)O)O MCULE-3901172324 [1,1,0,0,0,0|0,0,2]=4 608 B13R1.511 CC(=O)/C=C/C1=CC(=C(C=C1)O)O MCULE-9987567980 [1,1,0,0,0,0|0,0,2]=4 609 B13R1.511 CC(=O)C=CC1=CC=C(C(=C1)O)O MCULE-6986896881 [1,1,0,0,0,0|0,0,2]=4 610 B13R1.511 CC1=C(C=C(C=C1)/C=C/C(=O)O)C MCULE-8675537801 [1,1,0,0,0,0|1,0,1]=4 611 B13R1.511 CC1=C(C=C(C=C1)C=CC(=O)O)C MCULE-6959300564 [1,1,0,0,0,0|1,0,1]=4 612 B13R1.511 CC1=C(C=CC(=C1)/C=C/C(=O)O)F MCULE-5173802637 [1,1,0,0,0,0|1,0,1]=4 613 B13R1.511 CC1=C(C=CC(=C1)C=CC(=O)O)F MCULE-2657198608 [1,1,0,0,0,0|1,0,1]=4 614 B13R1.511 NC(=O)/C=C/C1=CC(=C(C=C1)O)O MCULE-2035675836 [1,1,0,0,0,0|0,0,2]=4 615 B13R1.511 NC(=O)C=CC1=CC=C(C(=C1)O)O MCULE-9007618991 [1,1,0,0,0,0|0,0,2]=4 616 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)O)Br MCULE-7396580804 [1,1,0,0,0,0|1,0,1]=4 617 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)O)Cl MCULE-3292670858 [1,1,0,0,0,0|1,0,1]=4 618 B13R1.511 O=C(O)/C=C/C1=CC=C(C(=C1)O)O MCULE-7843599914 [1,1,0,0,0,0|0,0,1]=3 619 B13R1.511 O=C(O)/C=C\C1=CC=C(C(=C1)O)O MCULE-3932376334 [1,1,0,0,0,0|0,0,1]=3 620 B13R1.511 O=C(O)C=CC1=CC(=C(C=C1)O)Br MCULE-9742346554 [1,1,0,0,0,0|1,0,1]=4 621 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)Cl)O MCULE-4338551904 [1,1,0,0,0,0|1,0,1]=4 622 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)F)O MCULE-8266589882 [1,1,0,0,0,0|1,0,1]=4 623 B13R1.511 O=C(O)C=CC1=CC=C(C(=C1)O)O MCULE-2069871168 [1,1,0,0,0,0|0,0,1]=3 624 B13R1.577 COC1=C(C=C(C=C1)CCCO)C MCULE-1845012783 [1,1,0,0,0,0|0,0,2]=4 625 B13R1.577 COC1=C(C=C(C=C1)CCCO)O MCULE-7002236238 [1,1,0,0,0,0|0,0,2]=4 626 B13R1.577 COC1=CC=C(C=C1O)C=CCO MCULE-6423120733 [1,1,0,0,0,0|0,0,0]=2 627 B13R1.669 CC1=C(C=C(C=C1)C=CCCBr)C MCULE-9336638163 [1,1,0,0,0,0|2,0,0]=4 628 B13R1.669 CC1=C(C=C(C=C1)C=CCCN)C MCULE-3739083427 [1,1,0,0,0,0|2,0,0]=4 629 B13R1.669 COC/C=C/C1=CC(=C(C=C1)O)O MCULE-6858443755 [1,1,0,0,0,0|0,0,0]=2 630 B13R1.1630 CC1=CC(=C(C=C1C=CCO)C)C MCULE-9562314361 [1,1,0,0,0,0|1,0,0]=3 631 B15R1.392 COC1=C(C(=CC(=C1)/C=C/C(=O)O)Br)O MCULE-4514871088 [0,2,0,0,0,0|0,0,1]=3 632 B15R1.392 COC1=C(C(=CC(=C1)/C=C/C(=O)O)O)O MCULE-3790432930 [0,2,0,0,0,0|0,0,1]=3 633 B15R1.392 COC1=C(C(=CC(=C1)C=CC(=O)O)Br)O MCULE-5531510358 [0,2,0,0,0,0|0,0,1]=3 634 B15R1.392 COC1=C(C(=CC(=C1)C=CC(=O)O)Cl)O MCULE-9923599536 [0,2,0,0,0,0|0,0,1]=3 635 B15R1.392 COC1=C(C(=CC(=C1)C=CC(=O)O)I)O MCULE-6769285431 [0,2,0,0,0,0|0,0,1]=3 636 B15R1.392 COC1=C(C(=CC(=C1)C=CC(=O)O)O)O MCULE-7642803239 [0,2,0,0,0,0|0,0,1]=3 637 B15R1.392 COC1=C(C(=CC(=C1)C=C[N+](=O)[O-])I)O MCULE-1014825068 [0,2,0,0,0,0|1,0,1]=4 638 B15R1.392 COC1=CC(=CC(=C1O)Br)C=C[N+](=O)[O-] MCULE-2798012330 [0,2,0,0,0,0|1,0,1]=4 639 B15R1.392 COC1=CC(=CC(=C1O)Cl)C=C[N+](=O)[O-] MCULE-6461271561 [0,2,0,0,0,0|1,0,1]=4 640 B15R1.531 CCOC1=C(C=CC(=C1)C=CC(=O)O)O MCULE-3495229494 [0,2,0,0,0,0|0,0,1]=3 641 B15R1.531 CCOC1=C(C=CC(=C1)C=C[N+](=O)[O-])O MCULE-6964149763 [0,2,0,0,0,0|1,0,1]=4 642 B15R1.531 CCOC1=C(C=CC(=C1)CCC(C)O)O MCULE-3798670147 [0,2,0,0,0,0|0,0,2]=4 643 B15R1.4038 COC1=C(C=CC(=C1)/C=C(/C)\N(=O)=O)O MCULE-2212959535 [0,2,0,0,0,0|1,0,1]=4 644 B15R1.4038 COC1=C(C=CC(=C1)C=C(C)[N+](=O)[O-])O MCULE-1328172000 [0,2,0,0,0,0|1,0,1]=4 645 B15R1.4038 COC1=C(C=CC(=C1)CC(=O)C(=O)O)O MCULE-8932848796 [0,2,0,0,0,0|0,0,2]=4 646 B15R1.4039 COC(=O)/C=C/C1=CC(=C(C=C1)O)OC MCULE-7084750759 [0,2,0,0,0,0|0,0,1]=3 647 B15R1.4039 COC(=O)C=CC1=CC(=C(C=C1)O)OC MCULE-1297302420 [0,2,0,0,0,0|0,0,1]=3 648 B15R1.4039 COC1=C(C=CC(=C1)CCC(=NO)C)O MCULE-2237831038 [0,2,0,0,0,0|1,0,1]=4 649 B15R1.5194 COC1=C(C(=CC=C1Cl)/C=C/C(=O)O)F MCULE-5234545699 [0,2,0,0,0,0|1,0,1]=4 650 B15R1.5194 COC1=C(C(=CC=C1Cl)C=CC(=O)O)F MCULE-9138149703 [0,2,0,0,0,0|1,0,1]=4 651 B15R1.5194 COC1=C(C(=CC=C1F)/C=C/C(=O)O)F MCULE-7486955161 [0,2,0,0,0,0|1,0,1]=4 652 B15R1.5194 COC1=C(C(=CC=C1F)C=CC(=O)O)F MCULE-8018177330 [0,2,0,0,0,0|1,0,1]=4 653 B15R1.12854 COC1=C(C=C(C=C1)/C=C/C(=O)N)OC MCULE-5228677622 [0,2,0,0,0,0|0,0,2]=4 654 B15R1.12854 COC1=C(C=C(C=C1)C=CC(=O)N)OC MCULE-2258101306 [0,2,0,0,0,0|0,0,2]=4 655 B15R1.12854 COC1=C(C=C(C=C1)C=CC(=O)O)OC MCULE-5134512966 [0,2,0,0,0,0|0,0,1]=3 656 B15R1.12854 COC1=C(C=C(C=C1)C=CC(C)N)OC MCULE-1433122793 [0,2,0,0,0,0|1,0,0]=3 657 B15R1.12854 COC1=C(C=C(C=C1)C=C[N+](=O)[O-])OC MCULE-6691035491 [0,2,0,0,0,0|1,0,1]=4 658 B15R1.12854 COC1=CC=C(C=C1OC)/C=C/C(=O)Cl MCULE-8629984081 [0,2,0,0,0,0|0,0,2]=4 659 B15R1.12854 COC1=CC=C(C=C1OC)/C=C/C(=O)O MCULE-4648711215 [0,2,0,0,0,0|0,0,1]=3 660 B15R1.12854 COC1=CC=C(C=C1OC)/C=C/N(=O)=O MCULE-2865570569 [0,2,0,0,0,0|1,0,1]=4 661 B15R1.12854 COC1=CC=C(C=C1OC)C#CC(C)O MCULE-2694300924 [0,2,0,0,0,0|0,0,2]=4 662 B15R1.12854 COC1=CC=C(C=C1OC)C=CC(=O)C MCULE-4945321547 [0,2,0,0,0,0|0,0,2]=4 663 B15R1.12854 COC1=CC=C(C=C1OC)C=CC(=O)Cl MCULE-8183939612 [0,2,0,0,0,0|0,0,2]=4 664 B15R1.815 C=C=CC(=O)C1=CC=C(C(=C1)OC)OC MCULE-2583459776 [0,2,0,0,0,0|1,0,1]=4 665 B15R1.815 CC=CC(=O)C1=CC=C(C(=C1)OC)OC MCULE-1146621506 [0,2,0,0,0,0|1,0,1]=4 666 B15R1.815 CCCC(=O)C1=CC(=C(C=C1)OC)OC MCULE-4161692744 [0,2,0,0,0,0|1,0,1]=4 667 B15R1.815 CCNC(=O)C1=CC(=C(C=C1)OC)OC MCULE-1389617624 [0,2,0,0,0,0|2,0,0]=4 668 B15R1.815 CCOC(=N)C1=CC(=C(C=C1)OC)OC MCULE-3512581034 [0,2,0,0,0,0|2,0,0]=4 669 B15R1.815 CCOC(=N)C1=CC(=C(C=C1)OC)OC MCULE-6516434593 [0,2,0,0,0,0|2,0,0]=4 670 B15R1.815 CCOC(=O)C1=CC(=C(C=C1)OC)OC MCULE-2673447545 [0,2,0,0,0,0|2,0,0]=4 671 B15R1.815 COC1=C(C=C(C=C1)C(=O)CCCl)OC MCULE-3966930039 [0,2,0,0,0,0|1,0,1]=4 672 B15R1.815 COC1=CC=C(C=C1OC)C(=CCN)C MCULE-2602142233 [0,2,0,0,0,0|1,0,0]=3 673 B15R1.815 COC1=CC=C(C=C1OC)C(N)CCO MCULE-3025473984 [0,2,0,0,0,0|0,0,2]=4 674 B15R1.815 COC1=CC=C(C=C1OC)[C@@H](N)CCO MCULE-5028782825 [0,2,0,0,0,0|0,0,2]=4 675 B15R1.815 COC1=CC=C(C=C1OC)[C@@H](N)CCO MCULE-6297196121 [0,2,0,0,0,0|0,0,2]=4 676 B15R1.815 COC1=CC=C(C=C1OC)[C@H](N)CCO MCULE-3277820209 [0,2,0,0,0,0|0,0,2]=4 677 B15R1.815 COC1=CC=C(C=C1OC)[C@H](N)CCO MCULE-7310704153 [0,2,0,0,0,0|0,0,2]=4 678 B15R1.1243 CCCOC(=O)C1=CC(=C(C=C1)O)OC MCULE-9437340347 [0,2,0,0,0,0|1,0,1]=4 679 B15R1.1243 COC1=C(C=CC(=C1)C(=O)NCCO)O MCULE-4184351568 [0,2,0,0,0,0|0,0,1]=3 680 B15R1.1243 COC1=CC(=CC=C1Br)C(=O)NCCO MCULE-2723585406 [0,2,0,0,0,0|1,0,1]=4 681 B15R1.1243 COC1=CC(=CC=C1O)C(=S)NCCO MCULE-6496378908 [0,2,0,0,0,0|0,0,1]=3 682 B15R1.1243 COC1=CC(=CC=C1O)[C@@H](N)CCCO MCULE-2850922737 [0,2,0,0,0,0|0,0,2]=4 683 B15R1.1243 COC1=CC(=CC=C1O)[C@@H](N)CCCO MCULE-5148318849 [0,2,0,0,0,0|0,0,2]=4 684 B15R1.1243 COC1=CC(=CC=C1O)[C@H](N)CCCO MCULE-6961084328 [0,2,0,0,0,0|0,0,2]=4 685 B15R1.1243 COC1=CC(=CC=C1O)[C@H](N)CCCO MCULE-9507811020 [0,2,0,0,0,0|0,0,2]=4 686 B15R1.4029 COC1=C(C=CC(=C1)C(=O)C(O)CO)O MCULE-8174619806 [0,2,0,0,0,0|0,0,1]=3 687 B15R1.4029 COC1=C(C=CC(=C1)[C@@H](O)[C@H](O)CO)O MCULE-6872942277 [0,2,0,0,0,0|0,0,2]=4 688 B15R1.4029 COC1=C(C=CC(=C1)[C@H](O)[C@H](O)CO)O MCULE-5583747814 [0,2,0,0,0,0|0,0,2]=4 689 B15R1.4029 COC1=CC(=CC=C1O)[C@@H](O)[C@@H](O)CO MCULE-5240137493 [0,2,0,0,0,0|0,0,2]=4 690 B15R1.4029 COC1=CC(=CC=C1O)[C@@H](O)[C@H](O)CO MCULE-9785680946 [0,2,0,0,0,0|0,0,2]=4 691 B15R1.9230 CCOC1=C(C=CC(=C1)[C@@H](N)CCO)O MCULE-4232028434 [0,2,0,0,0,0|0,0,2]=4 692 B15R1.9230 CCOC1=C(C=CC(=C1)[C@@H](N)CCO)O MCULE-7548554028 [0,2,0,0,0,0|0,0,2]=4 693 B15R1.9230 CCOC1=C(C=CC(=C1)[C@H](N)CCO)O MCULE-6169954327 [0,2,0,0,0,0|0,0,2]=4 694 B15R1.9230 CCOC1=C(C=CC(=C1)[C@H](N)CCO)O MCULE-9266000882 [0,2,0,0,0,0|0,0,2]=4 695 B15R1.36497 CCOC(=O)C1=CC(=C(C(=C1)Cl)O)OC MCULE-1209210445 [0,2,0,0,0,0|2,0,0]=4 696 B15R1.36497 CCOC(=O)C1=CC(=C(C(=C1)OC)O)O MCULE-1409153444 [0,2,0,0,0,0|2,0,0]=4 697 B15R1.36497 COC1=C(C(=CC(=C1)[C@@H](N)CCO)Br)O MCULE-7220531917 [0,2,0,0,0,0|0,0,2]=4 698 B15R1.36497 COC1=C(C(=CC(=C1)[C@@H](N)CCO)Br)O MCULE-9593051520 [0,2,0,0,0,0|0,0,2]=4 699 B15R1.36497 COC1=C(C(=CC(=C1)[C@H](N)CCO)Br)O MCULE-7521213106 [0,2,0,0,0,0|0,0,2]=4 700 B15R1.36497 COC1=C(C(=CC(=C1)[C@H](N)CCO)Br)O MCULE-8729762158 [0,2,0,0,0,0|0,0,2]=4 701 B15R1.36497 COC1=CC(=CC(=C1O)Cl)[C@@H](N)CCO MCULE-2156431715 [0,2,0,0,0,0|0,0,2]=4 702 B15R1.36497 COC1=CC(=CC(=C1O)Cl)[C@@H](N)CCO MCULE-8613489434 [0,2,0,0,0,0|0,0,2]=4 703 B15R1.36497 COC1=CC(=CC(=C1O)Cl)[C@H](N)CCO MCULE-2310382296 [0,2,0,0,0,0|0,0,2]=4 704 B15R1.36497 COC1=CC(=CC(=C1O)Cl)[C@H](N)CCO MCULE-4647114378 [0,2,0,0,0,0|0,0,2]=4 705 B15R1.1195 COC1=C(C=C(C=C1)/C=C/CCO)OC MCULE-3706422336 [0,2,0,0,0,0|0,0,0]=2 706 B15R1.1195 COC1=C(C=C(C=C1)CCCON)OC MCULE-7286697853 [0,2,0,0,0,0|0,0,2]=4 707 B15R1.1195 COC1=CC=C(C=C1OC)C#CCCO MCULE-8321075460 [0,2,0,0,0,0|0,0,2]=4 708 B15R1.1195 COC1=CC=C(C=C1OC)C=CCCO MCULE-9716048467 [0,2,0,0,0,0|0,0,0]=2 709 B15R1.1195 COC1=CC=C(C=C1OC)CCCON MCULE-3163668651 [0,2,0,0,0,0|0,0,2]=4 710 B15R1.1195 COC1=CC=C(C=C1OC)CNCCO MCULE-9139429076 [0,2,0,0,0,0|0,0,2]=4 711 B15R1.1195 COC1=CC=C(C=C1OC)CNCCO MCULE-9454057738 [0,2,0,0,0,0|0,0,2]=4 712 B15R1.1195 COCCNC1=CC(=C(C=C1)OC)OC MCULE-3702146011 [0,2,0,0,0,0|1,0,1]=4 713 B15R1.3769 CCC(=O)CC1=CC(=C(C=C1)OC)OC MCULE-1057991584 [0,2,0,0,0,0|1,0,1]=4 714 B15R1.3769 CCC(=O)NC1=CC=C(C(=C1)OC)OC MCULE-3625488735 [0,2,0,0,0,0|2,0,0]=4 715 B15R1.3769 COC1=C(C=C(C=C1)CC(=O)CCl)OC MCULE-3439047394 [0,2,0,0,0,0|1,0,1]=4 716 B15R1.3769 COC1=C(C=C(C=C1)CC(=O)NO)OC MCULE-9688705751 [0,2,0,0,0,0|1,0,1]=4 717 B15R1.3769 COC1=C(C=C(C=C1)NC(=O)CN)OC MCULE-8391917643 [0,2,0,0,0,0|2,0,0]=4 718 B15R1.3769 COC1=C(C=C(C=C1)NC(=O)CO)OC MCULE-6175868926 [0,2,0,0,0,0|1,0,0]=3 719 B15R1.3769 COC1=CC=C(C=C1OC)C/C(=N/O)/N MCULE-8809668152 [0,2,0,0,0,0|1,0,1]=4 720 B15R1.3769 COC1=CC=C(C=C1OC)CC(O)CO MCULE-8391710743 [0,2,0,0,0,0|0,0,2]=4 721 B15R1.3769 COC1=CC=C(C=C1OC)NC(=O)CCl MCULE-5334837372 [0,2,0,0,0,0|2,0,0]=4 722 B15R1.3769 COC1=CC=C(C=C1OC)NC(=O)CN MCULE-9922449938 [0,2,0,0,0,0|2,0,0]=4 723 B15R1.12140 CCOC1=C(C=C(C=C1)C=CC=O)OC MCULE-1062759052 [0,2,0,0,0,0|0,0,2]=4 724 B15R1.23243 COC1=C(C(=C(C=C1)C=CC#N)Cl)OC MCULE-6627884220 [0,2,0,0,0,0|1,0,1]=4 725 B15R1.1277 CCOC(=O)CC1=CC(=C(C=C1)O)OC MCULE-3812885566 [0,2,0,0,0,0|1,0,1]=4 726 B15R1.4040 COC1=C(C=CC(=C1)C=C(C#N)C#N)O MCULE-9571387119 [0,2,0,0,0,0|1,0,1]=4 727 B15R1.5536 C(=C/C1=CC(=C(C(=C1)OC)O)OC)\CO MCULE-8431305757 [0,2,0,0,0,0|0,0,0]=2 728 B15R1.5536 C(=CC1=CC(=C(C(=C1)OC)O)OC)CO MCULE-2489307192 [0,2,0,0,0,0|0,0,0]=2 729 B15R1.5536 COC1=CC(=CC(=C1O)OC)/C=C/C=O MCULE-7562503053 [0,2,0,0,0,0|0,0,2]=4 730 B15R1.5536 COC1=CC(=CC(=C1O)OC)C=CC=O MCULE-1224444606 [0,2,0,0,0,0|0,0,2]=4 731 B15R1.5536 COC1=CC(=CC(=C1O)OC)CCCO MCULE-2262833432 [0,2,0,0,0,0|0,0,2]=4 732 B13R1.433 C=CC1=CC(=C(C(=C1)OC)O)OC MCULE-7882887232 [0,0,1,1,0,0|2,0,0]=4 733 B13R1.433 COC1=C(C(=CC(=C1)C=O)CCl)O MCULE-7105957485 [0,0,1,1,0,0|2,0,0]=4 734 B13R2.121 COC1=C(N=CC2=C1OC=C2)Br MCULE-8346898591 [1,0,0,1,0,0|2,0,0]=4 735 B13R2.121 COC1=C2C=CNC2=CC=C1O MCULE-6828609689 [1,0,0,1,0,0|1,0,1]=4 736 B13R2.121 COC1=C2NC=CC2=CC=C1Br MCULE-2174834949 [1,0,0,1,0,0|2,0,0]=4 737 B13R2.449 BrCCC1=CC=C2OCOC2=C1 MCULE-6396501165 [1,0,0,1,0,0|1,0,1]=4 738 B13R2.449 C=CCC1=CC=C2OCOC2=C1 MCULE-9230440530 [1,0,0,1,0,0|0,0,2]=4 739 B13R2.449 CC=CC1=CC=C2OCOC2=C1 MCULE-3948562990 [1,0,0,1,0,0|0,0,0]=2 740 B13R2.449 CCCC1=CC=C2OCOC2=C1 MCULE-5027839214 [1,0,0,1,0,0|0,0,2]=4 741 B13R2.449 CCNC1=CC=C2OCOC2=C1 MCULE-7476074537 [1,0,0,1,0,0|1,0,1]=4 742 B13R2.449 CCSC1=CC=C2OCOC2=C1 MCULE-6640931369 [1,0,0,1,0,0|1,0,1]=4 743 B13R2.449 CNCC1=CC2=C(C=C1)OCO2 MCULE-5431670714 [1,0,0,1,0,0|1,0,1]=4 744 B13R2.449 CNCC1=CC=C2OCOC2=C1 MCULE-3828652362 [1,0,0,1,0,0|1,0,1]=4 745 B13R2.449 ClCCC1=CC2=C(C=C1)OCO2 MCULE-4827565643 [1,0,0,1,0,0|1,0,1]=4 746 B13R2.449 NCCC1=CC2=C(C=C1)OCO2 MCULE-9727151778 [1,0,0,1,0,0|1,0,1]=4 747 B13R2.449 NCCC1=CC=C2OCOC2=C1 MCULE-1470305202 [1,0,0,1,0,0|1,0,1]=4 748 B13R2.449 NN=CC1=CC=C2OCOC2=C1 MCULE-8106762847 [1,0,0,1,0,0|2,0,0]=4 749 B13R2.449 O=CCC1=CC=C2OCOC2=C1 MCULE-5590209207 [1,0,0,1,0,0|0,0,2]=4 750 B13R2.449 OCCC1=CC2=C(C=C1)OCC2 MCULE-1214083103 [1,0,0,1,0,0|1,0,1]=4 751 B13R2.449 OCCC1=CC2=C(C=C1)OCO2 MCULE-5189882213 [1,0,0,1,0,0|0,0,1]=3 752 B13R2.449 ON=CC1=CC2=C(C=C1)OCC2 MCULE-8357834991 [1,0,0,1,0,0|2,0,0]=4 753 B13R2.449 ON=CC1=CC2=C(C=C1)OCO2 MCULE-1484616607 [1,0,0,1,0,0|1,0,0]=3 754 B13R2.449 SCCC1=CC2=C(C=C1)OCO2 MCULE-3970362631 [1,0,0,1,0,0|0,1,1]=4 755 B13R2.599 COC1=C(C=C2NC=CC2=C1)Cl MCULE-2006702493 [1,0,0,1,0,0|2,0,0]=4 756 B13R2.599 COC1=C(C=C2NC=CC2=C1)F MCULE-8682744697 [1,0,0,1,0,0|2,0,0]=4 757 B13R2.599 COC1=CC2=C(C=C1Br)NC=C2 MCULE-9399857898 [1,0,0,1,0,0|2,0,0]=4 758 B13R2.599 COC1=CC2=C(C=C1C)NC=C2 MCULE-6886871290 [1,0,0,1,0,0|2,0,0]=4 759 B13R2.599 COC1=CC2=C(C=C1N)NC=C2 MCULE-4103264954 [1,0,0,1,0,0|2,0,0]=4 760 B13R2.599 COC1=CC2=C(C=C1N)OCO2 MCULE-1182257005 [1,0,0,1,0,0|2,0,0]=4 761 B13R2.599 COC1=CC2=C(C=C1N)OCO2 MCULE-7169024529 [1,0,0,1,0,0|2,0,0]=4 762 B13R2.599 COC1=CC2=C(C=C1O)NN=C2 MCULE-5607039435 [1,0,0,1,0,0|2,0,0]=4 763 B13R2.599 COC1=CC2=C(C=CN2)C=C1O MCULE-4412270774 [1,0,0,1,0,0|1,0,1]=4 764 B13R2.599 COC1=CC2=C(N=C1O)NC=C2 MCULE-6844819936 [1,0,0,1,0,0|2,0,0]=4 765 B13R2.57 COC1=CC2=C(C=C1)C=NC=C2 MCULE-9363483133 [1,0,0,1,0,0|2,0,0]=4 766 B13R2.57 COC1=CC2=C(C=C1)OCCO2 MCULE-3900434244 [1,0,0,1,0,0|1,0,1]=4 767 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 MCULE-8210517299 [1,0,0,1,0,0|1,0,1]=4 768 B13R2.57 COC1=CC2=CC=CN=C2C=C1 MCULE-4318623716 [1,0,0,1,0,0|1,0,1]=4 769 B13R2.57 COC1=CC=C2C=NC=CC2=C1 MCULE-6429878777 [1,0,0,1,0,0|2,0,0]=4 770 B13R2.57 COC1=CC=C2OCC=CC2=C1 MCULE-7391388515 [1,0,0,1,0,0|0,0,0]=2 771 B13R2.57 COC1=CC=C2OCCCC2=C1 MCULE-4155488907 [1,0,0,1,0,0|0,0,2]=4 772 B13R2.57 COC1=CC=C2OCCNC2=C1 MCULE-4306443267 [1,0,0,1,0,0|1,0,1]=4 773 B13R2.582 COC1=C2C(=CSC2=CC=C1)O MCULE-9894129744 [1,0,0,1,0,0|1,0,1]=4 774 B13R2.582 COC1=CC=CC2=C1N(N=C2)O MCULE-3999363999 [1,0,0,1,0,0|2,0,0]=4 775 B13R2.1613 COC1=C2C=CC=CC2=CC=C1 MCULE-9145939167 [1,0,0,1,0,0|1,0,1]=4 776 B13R2.1613 COC1=C2C=NC=CC2=CC=C1 MCULE-5955154797 [1,0,0,1,0,0|2,0,0]=4 777 B13R2.1613 COC1=C2N=CC=CC2=CC=C1 MCULE-9285159400 [1,0,0,1,0,0|1,0,1]=4 778 B13R2.1613 COC1=C2OCCCC2=CC=C1 MCULE-1317587178 [1,0,0,1,0,0|0,0,2]=4 779 B13R2.1613 COC1=C2OCCNC2=CC=C1 MCULE-1483221263 [1,0,0,1,0,0|1,0,1]=4 780 B13R2.2038 COC1=CC(=CC=C1)CC2CO2 MCULE-2907507057 [1,0,0,1,0,0|0,0,2]=4 781 B13R2.2130 COC1=CC2=C(C=C1)C(CC2)O MCULE-5983065990 [1,0,0,1,0,0|0,0,2]=4 782 B13R2.2130 COC1=CC2=C(C=C1)N(C=C2)C MCULE-8468461329 [1,0,0,1,0,0|2,0,0]=4 783 B13R2.2130 COC1=CC=C2C(=O)C=CC2=C1 MCULE-2615724664 [1,0,0,1,0,0|0,0,2]=4 784 B13R2.2130 COC1=NC2=C(C=C1)N(C=C2)O MCULE-3496528890 [1,0,0,1,0,0|2,0,0]=4 785 B13R2.32 CC1=C(C=CC2=C1C=CC=C2)O MCULE-7804476790 [1,0,0,1,0,0|1,0,1]=4 786 B13R2.32 OC1=CC=C2C=CC=CC2=C1O MCULE-2045884486 [1,0,0,1,0,0|1,0,1]=4 787 B13R2.369 CC1=C(C=C2C=CC=CC2=C1)O MCULE-2019328184 [1,0,0,1,0,0|1,0,1]=4 788 B13R2.369 CC1=C(C=C2N=CC=CC2=C1)O MCULE-5981171376 [1,0,0,1,0,0|1,0,1]=4 789 B13R2.369 CC1=CC2=C(C=NC=C2)C=C1O MCULE-5448496477 [1,0,0,1,0,0|2,0,0]=4 790 B13R2.369 OC1=CC2=C(C=C1O)CCN=C2 MCULE-7256416174 [1,0,0,1,0,0|2,0,0]=4 791 B13R2.369 OC1=CC2=C(C=C1O)OCCO2 MCULE-9049977900 [1,0,0,1,0,0|1,0,1]=4 792 B13R2.369 OC1=CC2=C(C=CC=C2)C=C1O MCULE-4288408578 [1,0,0,1,0,0|1,0,1]=4 793 B15R2.1754 COC1=CC2=C(C=C1O)OC(=O)C=C2 MCULE-6077230919 [0,1,0,1,0,0|0,0,1]=3 794 B15R2.7688 CC(=O)/C=C/C1=CC=C2OCOC2=C1 MCULE-1948560877 [0,1,0,1,0,0|0,0,2]=4 795 B15R2.7688 CC(=O)C=CC1=CC2=C(C=C1)OCO2 MCULE-3672741146 [0,1,0,1,0,0|0,0,2]=4 796 B15R2.7688 CC(O)CCC1=CC2=C(C=C1)OCO2 MCULE-3985575371 [0,1,0,1,0,0|0,0,2]=4 797 B15R2.7688 NC(=O)C=CC1=CC2=C(C=C1)OCO2 MCULE-3754366372 [0,1,0,1,0,0|0,0,2]=4 798 B15R2.7688 O=C(Cl)/C=C/C1=CC2=C(C=C1)OCO2 MCULE-8867118825 [0,1,0,1,0,0|0,0,2]=4 799 B15R2.7688 O=C(Cl)C=CC1=CC=C2OCOC2=C1 MCULE-6961382964 [0,1,0,1,0,0|0,0,2]=4 800 B15R2.7688 O=C(O)/C=C/C1=CC2=C(C=C1)OCC2 MCULE-8717972710 [0,1,0,1,0,0|1,0,1]=4 801 B15R2.7688 O=C(O)/C=C/C1=CC2=C(C=C1)OCO2 MCULE-4602416073 [0,1,0,1,0,0|0,0,1]=3 802 B15R2.7688 O=C(O)C=CC1=CC2=C(C=C1)OCC2 MCULE-6381054176 [0,1,0,1,0,0|1,0,1]=4 803 B15R2.7688 O=C(O)C=CC1=CC2=C(C=C1)OCO2 MCULE-1823540360 [0,1,0,1,0,0|0,0,1]=3 804 B15R2.7688 O=N(=O)/C=C/C1=CC=C2OCOC2=C1 MCULE-3288703645 [0,1,0,1,0,0|1,0,1]=4 805 B15R2.7688 O=[N+]([O-])C=CC1=CC2=C(C=C1)OCO2 MCULE-4416021386 [0,1,0,1,0,0|1,0,1]=4 806 B15R2.36352 COC1=C(C=CC2=C1OC(=O)C=C2)O MCULE-8110335853 [0,1,0,1,0,0|0,0,1]=3 807 B15R2.1350 CC=CC(=O)C1=CC=C2OCOC2=C1 MCULE-6728005777 [0,1,0,1,0,0|1,0,1]=4 808 B15R2.1350 CCCC(=O)C1=CC2=C(C=C1)OCO2 MCULE-1160190135 [0,1,0,1,0,0|1,0,1]=4 809 B15R2.1350 CCOC(=O)C1=CC=C2OCOC2=C1 MCULE-7857720465 [0,1,0,1,0,0|2,0,0]=4 810 B15R2.1350 NC(CCO)C1=CC=C2OCOC2=C1 MCULE-4199402035 [0,1,0,1,0,0|0,0,2]=4 811 B15R2.1350 NC(CCO)C1=CC=C2OCOC2=C1 MCULE-6957526376 [0,1,0,1,0,0|0,0,2]=4 812 B15R2.1350 N[C@@H](CCO)C1=CC2=C(C=C1)OCO2 MCULE-1621504760 [0,1,0,1,0,0|0,0,2]=4 813 B15R2.1350 N[C@@H](CCO)C1=CC2=C(C=C1)OCO2 MCULE-4210092148 [0,1,0,1,0,0|0,0,2]=4 814 B15R2.1350 N[C@H](CCO)C1=CC2=C(C=C1)OCO2 MCULE-2210643781 [0,1,0,1,0,0|0,0,2]=4 815 B15R2.1350 N[C@H](CCO)C1=CC2=C(C=C1)OCO2 MCULE-7225643982 [0,1,0,1,0,0|0,0,2]=4 816 B15R2.2234 COC1=C(C=CC(=C1)C2=NNC=N2)O MCULE-9955096884 [0,1,0,1,0,0|2,0,0]=4 817 B15R2.2234 COC1=CC(=CC=C1Br)C2=CN=CO2 MCULE-9953025985 [0,1,0,1,0,0|1,0,1]=4 818 B15R2.2393 COC1=C(C=C2N=CC=C(C2=C1)Cl)O MCULE-2808796177 [0,1,0,1,0,0|1,0,1]=4 819 B15R2.2393 COC1=C(C=C2OCCC(=O)C2=C1)Br MCULE-8932351985 [0,1,0,1,0,0|1,0,1]=4 820 B15R2.352 OCCCC1=CC2=C(C=C1)OCCO2 MCULE-9530439499 [0,1,0,1,0,0|0,0,2]=4 821 B15R2.117 COC1=C(C=C2CCN=CC2=C1)OC MCULE-8060676956 [0,1,0,1,0,0|2,0,0]=4 822 B15R2.117 COC1=C(C=C2CCN=CC2=C1)OC MCULE-9769243066 [0,1,0,1,0,0|2,0,0]=4 823 B15R2.117 COC1=C(C=C2N=CC=CC2=C1)OC MCULE-5913721591 [0,1,0,1,0,0|1,0,1]=4 824 B15R2.117 COC1=C(C=C2N=CCCC2=C1)OC MCULE-2200702564 [0,1,0,1,0,0|2,0,0]=4 825 B15R2.117 COC1=C(C=C2OCCNC2=C1)OC MCULE-1665464221 [0,1,0,1,0,0|1,0,1]=4 826 B15R2.117 COC1=C(C=C2OCCNC2=C1)OC MCULE-7792097354 [0,1,0,1,0,0|1,0,1]=4 827 B15R2.117 COC1=CC2=C(C=C1OC)OCCO2 MCULE-5524648335 [0,1,0,1,0,0|1,0,1]=4 828 B15R2.117 COC1=CC2=C(C=CC=C2)C=C1CO MCULE-8733283277 [0,1,0,1,0,0|1,0,1]=4 829 B15R2.117 COC1=CC2=C(C=NC=C2)C=C1OC MCULE-6882343029 [0,1,0,1,0,0|2,0,0]=4 830 B15R2.117 COC1=CC2=CC=CC=C2C=C1OC MCULE-6511152466 [0,1,0,1,0,0|1,0,1]=4 831 B15R2.2115 COC1=C(C=CC2=C1C=CC=C2)CO MCULE-2414607763 [0,1,0,1,0,0|1,0,1]=4 832 B15R2.3136 COC1=CC=C2CCC(C2=C1OC)O MCULE-8649317346 [0,1,0,1,0,0|0,0,2]=4 833 B15R2.20737 COC1=C(C=C2C(=CC2=C1)C#N)OC MCULE-5585000258 [0,1,0,1,0,0|1,0,1]=4 834 B15R2.21574 COC1=C(C=C2C(=C1)C=CN2C)OC MCULE-6535563150 [0,1,0,1,0,0|2,0,0]=4 835 B15R2.2039 COC1=C(C=C2C(=CC=NC2=C1)Cl)O MCULE-5976549951 [0,1,0,1,0,0|1,0,1]=4 836 B15R2.2039 COC1=C(C=C2C(=CC=NC2=C1)O)Br MCULE-8911712013 [0,1,0,1,0,0|1,0,1]=4 837 B15R2.2123 OCCCCC1=CC2=C(C=C1)OCO2 MCULE-4387424075 [0,1,0,1,0,0|0,0,2]=4 838 B15R2.2123 OCCCOC1=CC2=C(C=C1)OCO2 MCULE-6563783241 [0,1,0,1,0,0|0,0,2]=4 839 B15R2.2123 OCCNCC1=CC2=C(C=C1)OCO2 MCULE-9922026088 [0,1,0,1,0,0|0,0,2]=4 840 B15R2.2123 OCCNCC1=CC=C2OCOC2=C1 MCULE-9547556353 [0,1,0,1,0,0|0,0,2]=4 841 B15R2.1888 COC1=C(N=CC2=C1OC(=C2)CO)Br MCULE-7371273324 [0,1,0,1,0,0|2,0,0]=4 842 B15R2.4343 CC(=CC1=CC2=C(C=C1)OCO2)C=O MCULE-7078314229 [0,1,0,1,0,0|0,0,2]=4 843 B15R2.4343 CCC(=O)CC1=CC2=C(C=C1)OCO2 MCULE-1136799796 [0,1,0,1,0,0|1,0,1]=4 844 B15R2.4343 CCC(=O)NC1=CC2=C(C=C1)OCO2 MCULE-6265598023 [0,1,0,1,0,0|2,0,0]=4 845 B15R2.4343 NCC(=O)NC1=CC2=C(C=C1)OCO2 MCULE-6639559709 [0,1,0,1,0,0|2,0,0]=4 846 B15R2.4343 NCC(=O)NC1=CC2=C(C=C1)OCO2 MCULE-7240972456 [0,1,0,1,0,0|2,0,0]=4 847 B15R2.4343 O=C(CBr)NC1=CC2=C(C=C1)OCO2 MCULE-4466607657 [0,1,0,1,0,0|2,0,0]=4 848 B15R2.4343 O=C(CCl)NC1=CC=C2OCOC2=C1 MCULE-5390096954 [0,1,0,1,0,0|2,0,0]=4 849 B15R2.4343 O=C(CS)NC1=CC=C2OCOC2=C1 MCULE-8049654385 [0,1,0,1,0,0|1,1,0]=4 850 B15R2.4343 OCC(O)CC1=CC=C2OCOC2=C1 MCULE-1341874849 [0,1,0,1,0,0|0,0,2]=4 851 B15R2.6124 COC1=C2C=CC=CC2=C(C=C1O)F MCULE-1338045841 [0,1,0,1,0,0|1,0,1]=4 852 B15R2.21243 COC1=CC2=C(C=CC=C2)C(=C1O)Br MCULE-5040710718 [0,1,0,1,0,0|1,0,1]=4 853 B15R3.4379 C1=CC2=C(C=C1CC3CO3)OCO2 MCULE-7678089482 [0,0,0,2,0,0|0,0,2]=4 854 B15R3.10059 OC1CCC2=C1C=C3OCOC3=C2 MCULE-9812591046 [0,0,0,2,0,0|0,0,2]=4