0 B22R2.11664 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCCCC2 MCULE-3415981297 [0,0,0,0,0,0|1,0,0]=1 1 B22R2.11664 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCCNC2 MCULE-7954570811 [0,0,0,0,0,0|0,0,0]=0 2 B22R2.11664 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCNCC2 MCULE-1552813337 [0,0,0,0,0,0|2,0,0]=2 3 B22R2.11664 COC1=CC(=CC(=C1OC)OC)C(=O)NN2CCOCC2 MCULE-9727913828 [0,0,0,0,0,0|3,0,0]=3 4 B22R2.11664 COC1=CC(=CC(=C1OC)OC)C(=S)NC2CCCCC2 MCULE-6694666308 [0,0,0,0,0,0|1,1,0]=2 5 B22R2.11664 [NH+]1(CCOCC1)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC MCULE-9478955756 [0,0,0,0,0,0|3,0,0]=3 6 B21R2.10362 COC1=CC(=CC(=C1OC)OC)CNC2CCCCC2 MCULE-1769666870 [1,0,0,0,0,0|1,0,1]=3 7 B21R2.10362 COC1=CC(=CC(=C1OC)OC)CNC2CCCCC2 MCULE-5112935133 [1,0,0,0,0,0|1,0,1]=3 8 B21R2.10362 COC1=CC(=CC(=C1OC)OC)CNC2CCCCC2 MCULE-6414060724 [1,0,0,0,0,0|1,0,1]=3 9 B23R2.12711 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCC(CC2)C MCULE-2160078292 [0,1,0,0,0,0|1,0,0]=2 10 B23R2.12711 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCN(CC2)C MCULE-5642566578 [0,1,0,0,0,0|2,0,0]=3 11 B23R2.12711 COC1=CC(=CC(=C1OC)OC)C(=O)NN2CCN(CC2)C MCULE-6846121195 [0,1,0,0,0,0|3,0,0]=4 12 B23R2.12711 COC1=CC(=CC(=C1OC)OC)C(=O)OC2CCN(CC2)C MCULE-5154813061 [0,1,0,0,0,0|3,0,0]=4 13 B23R2.12711 COC1=CC(=CC(=C1OC)OC)C(=O)OC2CCN(CC2)C MCULE-6658359824 [0,1,0,0,0,0|3,0,0]=4 14 B23R2.12711 [NH+]1(CCN(CC1)C)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC MCULE-1425207959 [0,1,0,0,0,0|3,0,0]=4 15 B23R2.398911 COC1=CC(=CC(=C1OC)OC)C(=O)N(C)C2CCCCC2 MCULE-3114760534 [0,1,0,0,0,0|1,0,0]=2 16 B23R2.409490 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCCCC2O MCULE-3848895942 [0,1,0,0,0,0|1,0,0]=2 17 B21R2.10407 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCCC2 MCULE-3548542849 [0,0,0,0,1,0|2,0,0]=3 18 B21R2.10407 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCNCC2 MCULE-4219473335 [0,0,0,0,1,0|3,0,0]=4 19 B21R2.10407 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCNCC2 MCULE-5768307867 [0,0,0,0,1,0|3,0,0]=4 20 B21R2.10407 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCOCC2 MCULE-1259064926 [0,0,0,0,1,0|3,0,0]=4 21 B21R2.10407 COC1=CC(=CC(=C1OC)OC)[C@@H](N)C2CCCCC2 MCULE-1955002348 [0,0,0,0,1,0|2,0,1]=4 22 B21R2.10407 COC1=CC(=CC(=C1OC)OC)[C@@H](N)C2CCCCC2 MCULE-3839631284 [0,0,0,0,1,0|2,0,1]=4 23 B21R2.10407 COC1=CC(=CC(=C1OC)OC)[C@H](N)C2CCCCC2 MCULE-2636259767 [0,0,0,0,1,0|2,0,1]=4 24 B21R2.10407 COC1=CC(=CC(=C1OC)OC)[C@H](N)C2CCCCC2 MCULE-4761239100 [0,0,0,0,1,0|2,0,1]=4 25 B21R2.227533 COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NCCS2 MCULE-2880118252 [0,0,0,0,1,0|1,0,2]=4 26 B21R2.227533 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCCC2 MCULE-1667265377 [0,0,0,0,1,0|0,0,0]=1 27 B23R2.12664 COC1=CC(=CC(=C1OC)OC)NC(=O)NC2CCCCC2 MCULE-1728561946 [0,0,0,0,0,1|1,0,0]=2 28 B23R2.12664 COC1=CC(=CC(=C1OC)OC)NC(=S)NC2CCCCC2 MCULE-9462506761 [0,0,0,0,0,1|1,1,0]=3 29 B23R2.398914 COC1=CC(=CC(=C1OC)OC)C(=O)NCC2CCCCC2 MCULE-1715386630 [0,0,0,0,0,1|1,0,0]=2 30 B23R2.398914 COC1=CC(=CC(=C1OC)OC)C(=O)NCC2CCCOC2 MCULE-1441369639 [0,0,0,0,0,1|1,0,0]=2 31 B23R2.8404917 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCCCCC2 MCULE-6699501189 [0,0,0,0,0,1|1,0,0]=2 32 B20R1.1517515 CCCC(C)NC(=O)C1=CC(=C(C(=C1)OC)OC)OC MCULE-7953431911 [1,0,1,0,0,0|0,0,0]=2 33 B20R1.3373550 CCCC=NNC(=O)C1=CC(=C(C(=C1)OC)OC)OC MCULE-7260818214 [1,0,1,0,0,0|1,0,1]=4 34 B20R1.3373550 CCCCCNC(=O)C1=CC(=C(C(=C1)OC)OC)OC MCULE-3338669204 [1,0,1,0,0,0|0,0,0]=2 35 B20R1.3373550 CCCCONC(=O)C1=CC(=C(C(=C1)OC)OC)OC MCULE-9674209549 [1,0,1,0,0,0|1,0,0]=3 36 B20R1.3373550 COCCCNC(=O)C1=CC(=C(C(=C1)OC)OC)OC MCULE-6009576971 [1,0,1,0,0,0|1,0,0]=3 37 B20R1.24338 CCC(CC)NC(=O)C1=CC(=C(C(=C1)OC)OC)OC MCULE-4294618869 [1,0,1,0,0,0|0,0,0]=2 38 B20R1.24338 CCC(CO)NC(=O)C1=CC(=C(C(=C1)OC)OC)OC MCULE-6547937155 [1,0,1,0,0,0|1,0,0]=3 39 B20R2.41170 COC1=C(C=C(C=C1)C(=O)NC2CCCCC2)OC MCULE-2965844574 [2,0,0,0,0,0|1,0,0]=3 40 B20R2.41170 COC1=CC=C(C=C1OC)C(=O)NC2CCNCC2 MCULE-7904776419 [2,0,0,0,0,0|2,0,0]=4 41 B20R2.41170 COC1=CC=C(C=C1OC)C(=O)NN2CCCCC2 MCULE-3098654127 [2,0,0,0,0,0|2,0,0]=4 42 B20R2.9174 COC1=CC(=CC(=C1)C(=O)NC2CCCCC2)OC MCULE-2986575447 [2,0,0,0,0,0|1,0,0]=3 43 B20R2.9174 COC1=CC(=CC(=C1)C(=O)NN2CCCCC2)OC MCULE-3109971066 [2,0,0,0,0,0|2,0,0]=4 44 B22R1.26643 COC1=CC(=CC(=C1OC)OC)C(=O)NCCCC(=O)NN MCULE-2253193865 [0,1,1,0,0,0|1,0,1]=4 45 B22R2.11613 COC1=CC(=CC(=C1OC)OC)CNC2CCC(CC2)C MCULE-8046158517 [1,1,0,0,0,0|1,0,1]=4 46 B22R2.11663 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCC(C2)C MCULE-8625459946 [0,1,0,0,1,0|2,0,0]=4 47 B22R2.310518 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)C MCULE-5988271316 [0,1,0,0,1,0|2,0,0]=4 48 B22R2.310518 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)N MCULE-1957957444 [0,1,0,0,1,0|2,0,0]=4 49 B22R2.310518 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)N MCULE-2352991326 [0,1,0,0,1,0|2,0,0]=4 50 B22R2.317034 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCCC2C MCULE-6024865136 [0,1,0,0,1,0|2,0,0]=4 51 B22R2.317037 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCOC2=O MCULE-7431566824 [0,1,0,0,1,0|1,0,1]=4 52 B22R2.317037 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCSC2=O MCULE-5447288669 [0,1,0,0,1,0|1,0,1]=4 53 B22R2.423039 COC1=C(C(=C(C(=C1)C(=O)NC2CCCC2)Br)OC)OC MCULE-4487082112 [0,1,0,0,1,0|0,0,0]=2 54 B24R2.495343 COC1=CC(=CC(=C1OC)OC)NC(=O)NC2CCCC(C2)O MCULE-2219872376 [0,1,0,0,0,1|1,0,0]=3 55 B24R2.495313 COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)N2CCCCC2 MCULE-5876032354 [0,1,0,0,0,1|2,0,0]=4 56 B24R2.495356 COC1=CC(=CC(=C1OC)OC)C(=O)NCC2=CCCN(C2)C MCULE-6347534535 [0,1,0,0,0,1|0,0,2]=4 57 B24R2.56684598 CCN1CCC(CC1)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC MCULE-5594364693 [0,2,0,0,0,0|2,0,0]=4 58 B24R2.56684598 COC1=CC(=CC(=C1OC)OC)C(=O)N[C@H]2CC[C@@H](CC2)OC MCULE-6685077428 [0,2,0,0,0,0|1,0,0]=3 59 B24R2.11124770 COC1=CC(=CC(=C1OC)OC)C(=O)N(C)C2CCCCC2O MCULE-4261728692 [0,2,0,0,0,0|1,0,0]=3 60 B22R2.315249 COC1=CC(=CC(=C1OC)OC)C(=O)NCC2CCCO2 MCULE-8133712581 [0,0,1,1,0,0|1,0,0]=3 61 B22R2.6224093 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCCCC2 MCULE-6004894142 [0,0,1,1,0,0|1,0,0]=3 62 B22R2.6224093 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCNCC2 MCULE-1666566663 [0,0,1,1,0,0|0,0,0]=2 63 B22R2.6224093 COC1=CC(=CC(=C1OC)OC)C(=S)N2CCCCCC2 MCULE-7429080631 [0,0,1,1,0,0|1,1,0]=4 64 B20R2.157154 COC1=CC(=CC(=C1OC)OC)CNC2CCCC2 MCULE-5215772309 [1,0,0,0,1,0|0,0,1]=3 65 B20R2.157154 COC1=CC(=CC(=C1OC)OC)CNC2CCCC2 MCULE-6051827635 [1,0,0,0,1,0|0,0,1]=3 66 B20R2.157154 COC1=CC(=CC(=C1OC)OC)CNC2CCCC2 MCULE-9778232999 [1,0,0,0,1,0|0,0,1]=3 67 B20R2.9187 COC1=CC(=CC(=C1Br)OC)C(=O)NC2CCCC2 MCULE-5848225288 [1,0,0,0,1,0|1,0,0]=3 68 B20R2.9110 COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCC2 MCULE-6398458850 [0,0,0,0,2,0|1,0,0]=3 69 B20R2.9110 COC1=CC(=CC(=C1OC)OC)C(=S)N2CCCC2 MCULE-1382228963 [0,0,0,0,2,0|1,1,0]=4 70 B20R2.9110 COC1=CC(=CC(=C1OC)OC)[C@@H](N)C2CCCC2 MCULE-2211694997 [0,0,0,0,2,0|1,0,1]=4 71 B20R2.9110 COC1=CC(=CC(=C1OC)OC)[C@@H](N)C2CCCC2 MCULE-7348638140 [0,0,0,0,2,0|1,0,1]=4 72 B20R2.9110 COC1=CC(=CC(=C1OC)OC)[C@H](N)C2CCCC2 MCULE-1064162395 [0,0,0,0,2,0|1,0,1]=4 73 B20R2.9110 COC1=CC(=CC(=C1OC)OC)[C@H](N)C2CCCC2 MCULE-2886808162 [0,0,0,0,2,0|1,0,1]=4 74 B22R2.6216543 COC1=CC(=CC(=C1OC)OC)CNC2CCCCCC2 MCULE-1962724691 [1,0,0,0,0,1|1,0,1]=4 75 B22R2.6216543 COC1=CC(=CC(=C1OC)OC)CNC2CCCCCC2 MCULE-6138216668 [1,0,0,0,0,1|1,0,1]=4 76 B22R2.6216543 COC1=CC(=CC(=C1OC)OC)CNC2CCCCCC2 MCULE-7685930090 [1,0,0,0,0,1|1,0,1]=4 77 B22R2.670651 COC1=CC(=C(C=C1C(=O)NC2CCCCC2)OC)OC MCULE-1917216495 [0,0,0,0,1,1|1,0,0]=3 78 B24R2.485294 COC1=CC(=CC(=C1OC)OC)C=CC(=O)NC2CCCCC2 MCULE-2594335294 [0,0,0,0,0,2|1,0,0]=3 79 B24R2.485294 COC1=CC(=CC(=C1OC)OC)CCC(=O)NC2CCCCC2 MCULE-9076159442 [0,0,0,0,0,2|1,0,0]=3 80 B24R2.495344 COC1=CC(=CC(=C1OC)OC)NC(=O)CCC2CCCCC2 MCULE-7005738420 [0,0,0,0,0,2|2,0,0]=4 81 B24R2.495357 COC1=CC(=CC(=C1OC)OC)C(=O)NCCN2CCCCC2 MCULE-2552969143 [0,0,0,0,0,2|2,0,0]=4 82 B24R2.495357 COC1=CC(=CC(=C1OC)OC)C(=O)NN=CC2CC=CCC2 MCULE-9806687917 [0,0,0,0,0,2|1,0,1]=4 83 B24R2.495357 COC1=CC(=CC(=C1OC)OC)C(=O)NN=CC2CCCCC2 MCULE-3239366596 [0,0,0,0,0,2|1,0,0]=3 84 B24R2.11235438 COC1=CC(=CC(=C1OC)OC)C(=O)NN=C2CCCCCC2 MCULE-7835153877 [0,0,0,0,0,2|1,0,1]=4 85 B24R2.11235589 COC1=CC(=CC(=C1OC)OC)C(=O)NC2CCCCCCC2 MCULE-8206467891 [0,0,0,0,0,2|1,0,0]=3