0 B16R1.4547 CC(=NOC(=O)C1=CC=CC=C1C(=O)O)C MCULE-2047219945 [0,0,0,0,0,0|4,0,0]=4 1 B16R1.4547 CC(=O)COC(=O)C1=CC=CC=C1N(=O)=O MCULE-7600453667 [0,0,0,0,0,0|3,0,1]=4 2 B16R1.4547 CC(=O)OCC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-5328159396 [0,0,0,0,0,0|3,0,1]=4 3 B16R1.4547 CC(C)COC(=O)C1=CC=CC=C1C(=O)O MCULE-9799546999 [0,0,0,0,0,0|3,0,1]=4 4 B16R1.4547 N=C(N)NNC(=O)C1=C(C=CC=C1)C(=O)O MCULE-6634353572 [0,0,0,0,0,0|4,0,0]=4 5 B16R1.4547 NC(=S)NNC(=O)C1=CC=CC=C1C(=O)O MCULE-1976578950 [0,0,0,0,0,0|3,1,0]=4 6 B16R1.4547 O=C(O)CCS(=O)C1=CC=CC=C1C(=O)O MCULE-2629347111 [0,0,0,0,0,0|1,0,0]=1 7 B16R1.4547 O=C(O)CNC(=O)C1=C(C=CC=C1)C(=O)O MCULE-1057926292 [0,0,0,0,0,0|1,0,0]=1 8 B16R1.4547 O=C(O)CNC(=O)C1=CC=CC=C1N(=O)=O MCULE-5943365719 [0,0,0,0,0,0|2,0,1]=3 9 B15R1.86 CCC1=CC=CC=C1C(=O)CCC(=O)O MCULE-2828820186 [1,0,0,0,0,0|1,0,1]=3 10 B15R1.86 COC1=C(C=CC=C1)C(=O)CCC(=O)O MCULE-4905025368 [1,0,0,0,0,0|2,0,0]=3 11 B15R1.86 COC1=C(C=CC=C1)C(=O)NCC(=O)O MCULE-3790932369 [1,0,0,0,0,0|3,0,0]=4 12 B15R1.86 CSC1=C(C=CC=C1)C(=O)CCC(=O)O MCULE-2263895939 [1,0,0,0,0,0|2,0,0]=3 13 B15R1.1239 C#CCOC(=O)C1=C(C=CC=C1)C(=O)O MCULE-2239232378 [1,0,0,0,0,0|2,0,1]=4 14 B15R1.1239 C=CCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-2005596014 [1,0,0,0,0,0|2,0,1]=4 15 B15R1.1239 C=CCC[C@@H](N)C1=CC=CC=C1C(=O)O MCULE-8339923798 [1,0,0,0,0,0|2,0,1]=4 16 B15R1.1239 C=CCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-4356681112 [1,0,0,0,0,0|2,0,1]=4 17 B15R1.1239 C=CCC[C@H](N)C1=CC=CC=C1C(=O)O MCULE-7511005010 [1,0,0,0,0,0|2,0,1]=4 18 B15R1.1239 N[C@@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-4094023274 [1,0,0,0,0,0|1,0,2]=4 19 B15R1.1239 N[C@@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-5476358371 [1,0,0,0,0,0|1,0,2]=4 20 B15R1.1239 N[C@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-4815289925 [1,0,0,0,0,0|1,0,2]=4 21 B15R1.1239 N[C@H](CCCO)C1=CC=CC=C1C(=O)O MCULE-6265157443 [1,0,0,0,0,0|1,0,2]=4 22 B15R1.1239 O=C(O)C1=C(C=CC=C1)C(=O)NCCO MCULE-9013972677 [1,0,0,0,0,0|1,0,1]=3 23 B15R1.1239 O=C(O)C1=C(C=CC=C1)C(=O)OCCO MCULE-7534953084 [1,0,0,0,0,0|1,0,1]=3 24 B15R1.8882 CC(=O)NN=CC1=CC=CC=C1C(=O)O MCULE-7684832914 [1,0,0,0,0,0|3,0,0]=4 25 B15R1.8882 NC(=O)C1=C(C=CC=C1)OCCC(=O)O MCULE-5366729688 [1,0,0,0,0,0|2,0,0]=3 26 B15R1.8882 NC(=O)NN=CC1=CC=CC=C1C(=O)O MCULE-1114395354 [1,0,0,0,0,0|3,0,0]=4 27 B15R1.8882 O=C(O)CCCC1=CC=CC=C1C(=O)O MCULE-2920528773 [1,0,0,0,0,0|0,0,1]=2 28 B15R1.8882 O=C(O)CCCC1=CC=CC=C1N(=O)=O MCULE-4449407937 [1,0,0,0,0,0|1,0,2]=4 29 B15R1.8882 O=C(O)CCNC1=C(C=CC=C1)N(=O)=O MCULE-7510321589 [1,0,0,0,0,0|2,0,1]=4 30 B15R1.8882 O=C(O)CCNC1=CC=CC=C1C(=O)O MCULE-9090913741 [1,0,0,0,0,0|1,0,0]=2 31 B15R1.8882 O=C(O)CCOC1=C(C=CC=C1)N(=O)=O MCULE-1516287091 [1,0,0,0,0,0|2,0,1]=4 32 B15R1.8882 O=C(O)CCSC1=C(C=CC=C1)C(=O)O MCULE-5392426794 [1,0,0,0,0,0|1,0,0]=2 33 B15R1.8882 O=C(O)CCSC1=NC=CC=C1C(=O)O MCULE-8885194364 [1,0,0,0,0,0|2,0,0]=3 34 B17R1.1228 COC(=O)C1=CC=CC=C1C(=O)COC(=O)C MCULE-7626985079 [0,1,0,0,0,0|2,0,0]=3 35 B17R1.5007 O=C(O)CCC(=O)C1=C(C=CC=C1)C(F)(F)F MCULE-8109806390 [0,1,0,0,0,0|2,0,1]=4 36 B17R1.9061 COC(=O)CCC(=O)C1=C(C=CC=C1)C(C)C MCULE-4316062648 [0,1,0,0,0,0|2,0,1]=4 37 B17R1.9061 COC(=O)CCC(=O)C1=CC=CC=C1N(C)C MCULE-2840922786 [0,1,0,0,0,0|3,0,0]=4 38 B17R1.9061 COC(=O)CNC(=O)C1=CC=CC=C1N(=O)=O MCULE-3113547063 [0,1,0,0,0,0|2,0,1]=4 39 B17R1.9061 COC(=O)COC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-6708915028 [0,1,0,0,0,0|2,0,1]=4 40 B17R1.9061 COC(=O)NNC(=O)C1=C(C=CC=C1)C(=O)O MCULE-2403870849 [0,1,0,0,0,0|2,0,0]=3 41 B17R1.14432 O=C(O)CNC(=O)C1=C(C=CC=C1Cl)N(=O)=O MCULE-9289540090 [0,1,0,0,0,0|2,0,1]=4 42 B17R1.16327 CN(CC(=O)O)C(=O)C1=CC=CC=C1C(=O)O MCULE-1217978410 [0,1,0,0,0,0|1,0,0]=2 43 B17R2.38284 CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)O MCULE-5561438959 [0,0,0,1,0,0|3,0,0]=4 44 B17R2.38284 O=C(O)CN1NC(=O)C2=C(C1=O)C=CC=C2 MCULE-5577158828 [0,0,0,1,0,0|2,0,0]=3 45 B17R2.39629 CC1=CC=C(C2=C1C=CC=C2)CCC(=O)O MCULE-3283203148 [0,0,0,1,0,0|3,0,0]=4 46 B17R2.39629 O=C(O)CCC1=C2C=CC=CC2=C(C=C1)F MCULE-8590627917 [0,0,0,1,0,0|3,0,0]=4 47 B17R2.39629 O=C(O)CCC1=C2C=CC=NC2=C(C=C1)O MCULE-5642160823 [0,0,0,1,0,0|3,0,0]=4 48 B17R2.39629 O=C(O)CCC1=NNC(=O)C2=CC=CC=C12 MCULE-3427392665 [0,0,0,1,0,0|2,0,0]=3 49 B17R2.39629 O=C(O)CCN1C=CC(=O)C2=CC=CC=C12 MCULE-7767216414 [0,0,0,1,0,0|3,0,0]=4 50 B17R2.39629 O=C(O)CCN1N=CC(=O)C2=C1C=CC=C2 MCULE-3495361579 [0,0,0,1,0,0|3,0,0]=4 51 B17R2.197571 O=C(O)CN1C(=O)C2=C(S1(=O)=O)C=CC=C2 MCULE-6379917511 [0,0,0,1,0,0|2,0,1]=4 52 B15R1.5509 CC(=O)CC(=O)C1=CC=CC=C1N(=O)=O MCULE-9208472310 [0,0,0,0,1,0|2,0,1]=4 53 B15R1.5509 CN(CC(=O)O)C1=C(C=CC=C1)C(=O)O MCULE-7199079546 [0,0,0,0,1,0|2,0,0]=3 54 B15R1.5509 NC(=O)NC(=O)C1=C(C=CC=C1)C(=O)O MCULE-1446901931 [0,0,0,0,1,0|2,0,0]=3 55 B15R1.5509 O=C(O)C1=C(C=CC=C1)C(=O)CN(=O)=O MCULE-2423115181 [0,0,0,0,1,0|1,0,1]=3 56 B15R1.5509 O=C(O)CC(=O)C1=C(C=CC=C1)C(=O)O MCULE-1093098064 [0,0,0,0,1,0|0,0,0]=1 57 B15R1.5509 O=C(O)CC(=O)C1=C(C=CC=C1)N(=O)=O MCULE-4272264414 [0,0,0,0,1,0|1,0,1]=3 58 B15R1.5509 O=C(O)CS(=O)C1=CC=CC=C1C(=O)O MCULE-5786664890 [0,0,0,0,1,0|1,0,0]=2 59 B15R1.5509 O=C(O)CS(=O)C1=CC=CC=C1N(=O)=O MCULE-9824656918 [0,0,0,0,1,0|2,0,1]=4 60 B17R1.5006 CC(=O)OCC(=O)C1=CC=CC=C1OC(=O)C MCULE-3555914409 [0,0,0,0,0,1|3,0,0]=4 61 B17R1.16385 CC(=O)C1=CC=CC=C1C(=S)NCCC(=O)N MCULE-4189573554 [0,0,0,0,0,1|2,1,0]=4 62 B17R1.16385 CC(C)CCOC(=O)C1=CC=CC=C1C(=O)O MCULE-2545930490 [0,0,0,0,0,1|2,0,1]=4 63 B17R1.16385 CN(C)CCOC(=O)C1=C(C=CC=C1)C(=O)O MCULE-9445259674 [0,0,0,0,0,1|3,0,0]=4 64 B17R1.16385 O=C(O)CCNC(=O)C1=NC=CN=C1C(=O)O MCULE-7328398819 [0,0,0,0,0,1|2,0,0]=3 65 B17R1.16418 CC(=O)C1=CC=CC=C1NC(=O)C=CC(=O)O MCULE-7311787804 [0,0,0,0,0,1|1,0,2]=4 66 B17R1.16418 CC(=O)C1=CC=CC=C1NC(=O)CCC(=O)O MCULE-6041918247 [0,0,0,0,0,1|1,0,0]=2 67 B17R1.16418 CC(C)C1=C(C=CC=C1)NC(=O)CCC(=O)O MCULE-8886188176 [0,0,0,0,0,1|2,0,1]=4 68 B17R1.16418 NC(=O)C1=C(C=CC=C1)NC(=O)/C=C/C(=O)O MCULE-1424808310 [0,0,0,0,0,1|1,0,2]=4 69 B17R1.16418 NC(=O)C1=C(C=CC=C1)NC(=O)C=CC(=O)O MCULE-5496100382 [0,0,0,0,0,1|1,0,2]=4 70 B17R1.16418 NC(=O)C1=C(C=CC=C1)NC(=O)CCC(=O)O MCULE-7221256701 [0,0,0,0,0,1|1,0,0]=2 71 B17R1.16418 O=C(O)/C=C/C(=O)NC1=C(C=CC=C1)C(=O)O MCULE-5982801963 [0,0,0,0,0,1|0,0,2]=3 72 B17R1.16418 O=C(O)C=CC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-6641348437 [0,0,0,0,0,1|0,0,2]=3 73 B17R1.16418 O=C(O)CCC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-1511659425 [0,0,0,0,0,1|0,0,0]=1 74 B17R1.16418 O=C(O)CCC(=O)NC1=CC=CC=C1N(=O)=O MCULE-8108387821 [0,0,0,0,0,1|1,0,1]=3 75 B17R1.16418 O=C(O)CNC(=O)NC1=C(C=CC=C1)N(=O)=O MCULE-6306282691 [0,0,0,0,0,1|2,0,1]=4 76 B14R1.96 O=CC1=C(C=CC=C1)OCCC(=O)O MCULE-5025555093 [2,0,0,0,0,0|1,0,0]=3 77 B14R1.160 CC1=C(C=CC=C1)C(=O)CCC(=O)O MCULE-2701695748 [2,0,0,0,0,0|0,0,1]=3 78 B14R1.160 CC1=C(C=CC=C1)C(=O)NCC(=O)O MCULE-6971330465 [2,0,0,0,0,0|1,0,1]=4 79 B14R1.160 NC1=C(C=CC=C1)C(=O)NCC(=O)O MCULE-6337040358 [2,0,0,0,0,0|2,0,0]=4 80 B14R1.160 NC1=C(C=CC=C1)C(=O)NCC(=O)O MCULE-7892803957 [2,0,0,0,0,0|2,0,0]=4 81 B14R1.160 O=C(O)CCC(=O)C1=C(C=CC=C1)Br MCULE-5626452166 [2,0,0,0,0,0|1,0,0]=3 82 B14R1.160 O=C(O)CCC(=O)C1=C(C=CC=C1)F MCULE-2439050217 [2,0,0,0,0,0|1,0,0]=3 83 B14R1.160 O=C(O)CCC(=O)C1=C(C=CC=C1)I MCULE-4955543307 [2,0,0,0,0,0|1,0,0]=3 84 B14R1.160 O=C(O)CCC(=O)C1=CC=CC=C1Cl MCULE-7314693029 [2,0,0,0,0,0|1,0,0]=3 85 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)Cl MCULE-9247448113 [2,0,0,0,0,0|2,0,0]=4 86 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)F MCULE-7821238762 [2,0,0,0,0,0|2,0,0]=4 87 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)I MCULE-5889271418 [2,0,0,0,0,0|2,0,0]=4 88 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)O MCULE-5194764394 [2,0,0,0,0,0|1,0,0]=3 89 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=N1)O MCULE-6903676397 [2,0,0,0,0,0|2,0,0]=4 90 B14R1.160 O=C(O)CNC(=O)C1=CC=CC=C1Br MCULE-1952492828 [2,0,0,0,0,0|2,0,0]=4 91 B14R1.160 O=C(O)CSC(=O)C1=CC=CC=C1Cl MCULE-8267772871 [2,0,0,0,0,0|2,0,0]=4 92 B14R1.623 N[C@@H](CCO)C1=CC=CC=C1C(=O)O MCULE-2964614242 [2,0,0,0,0,0|1,0,1]=4 93 B14R1.623 N[C@@H](CCO)C1=CC=CC=C1C(=O)O MCULE-6981692938 [2,0,0,0,0,0|1,0,1]=4 94 B14R1.623 N[C@H](CCO)C1=CC=CC=C1C(=O)O MCULE-5600559750 [2,0,0,0,0,0|1,0,1]=4 95 B14R1.623 N[C@H](CCO)C1=CC=CC=C1C(=O)O MCULE-8456943868 [2,0,0,0,0,0|1,0,1]=4 96 B14R1.623 O=C(O)C1=CC=CC=C1S(=O)CCO MCULE-2177222526 [2,0,0,0,0,0|1,0,0]=3 97 B14R1.623 O=CNC(=O)C1=CC=CC=C1C(=O)O MCULE-8045595064 [2,0,0,0,0,0|1,0,0]=3 98 B16R1.697 CCOC1=C(C=CC=C1)C(=O)CCC(=O)O MCULE-7578465182 [1,1,0,0,0,0|1,0,1]=4 99 B16R1.697 O=CNC1=CC=CC=C1C(=O)CCC(=O)O MCULE-4492335987 [1,1,0,0,0,0|0,0,0]=2 100 B16R1.4361 COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)O MCULE-6249925493 [1,1,0,0,0,0|2,0,0]=4 101 B16R1.4361 COC1=C(C=C(C=C1)Cl)C(=O)CCC(=O)O MCULE-1947044257 [1,1,0,0,0,0|2,0,0]=4 102 B16R1.4361 COC1=C(C=C(C=C1)F)C(=O)CCC(=O)O MCULE-8972805620 [1,1,0,0,0,0|2,0,0]=4 103 B16R1.4361 COC1=CC=C(C=C1C(=O)CCC(=O)O)C MCULE-3078444888 [1,1,0,0,0,0|2,0,0]=4 104 B16R1.4719 COC1=C(C=CC(=C1)Cl)C(=O)CCC(=O)O MCULE-5868475784 [1,1,0,0,0,0|2,0,0]=4 105 B16R1.5567 CCC1=CC=CC=C1C(=O)CCC(=O)OC MCULE-2402018820 [1,1,0,0,0,0|1,0,1]=4 106 B16R1.5567 COC(=O)CCC(=O)C1=C(C=CC=C1)SC MCULE-1949995477 [1,1,0,0,0,0|2,0,0]=4 107 B16R1.5567 COC(=O)CCC(=O)C1=CC=CC=C1C#N MCULE-5285100360 [1,1,0,0,0,0|1,0,1]=4 108 B16R1.5567 COC(=O)CCC(=O)C1=CC=CC=C1OC MCULE-1878380654 [1,1,0,0,0,0|2,0,0]=4 109 B16R1.1500 C=CCCC(=O)C1=CC=CC=C1C(=O)OC MCULE-5208247935 [1,1,0,0,0,0|1,0,0]=3 110 B16R1.1500 CCCCC(=O)C1=CC=CC=C1C(=O)OC MCULE-3658264732 [1,1,0,0,0,0|1,0,1]=4 111 B16R1.1500 COC(=O)C1=CC=CC=C1C(=O)CCCCl MCULE-9510881340 [1,1,0,0,0,0|1,0,1]=4 112 B16R1.1500 COC(=O)C1=CC=CC=C1C(=O)CCSC MCULE-3588720105 [1,1,0,0,0,0|2,0,0]=4 113 B16R1.1730 CCCCOC(=O)C1=C(C=CC=C1)C(=O)O MCULE-2631461077 [1,1,0,0,0,0|1,0,1]=4 114 B16R1.1730 COCCNC(=O)C1=CC=CC=C1C(=O)O MCULE-3694440354 [1,1,0,0,0,0|1,0,1]=4 115 B16R1.1730 COCCOC(=O)C1=CC=CC=C1C(=O)O MCULE-9789945933 [1,1,0,0,0,0|1,0,1]=4 116 B16R1.1730 O=C(O)C1=C(C=CC=C1)C(=O)NCCCO MCULE-4259118378 [1,1,0,0,0,0|0,0,1]=3 117 B16R1.1178 CNC(=O)C1=C(C=CC=C1)SCCC(=O)O MCULE-4313330284 [1,1,0,0,0,0|2,0,0]=4 118 B16R1.3262 COC(=O)NN=CC1=CC=CC=C1C(=O)O MCULE-8593536876 [1,1,0,0,0,0|2,0,0]=4 119 B16R1.11454 O=C(O)CCNC1=C(C=C(C=C1)Br)C(=O)O MCULE-2765052568 [1,1,0,0,0,0|1,0,0]=3 120 B16R1.12463 O=C(O)CC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-9457944975 [1,1,0,0,0,0|1,0,1]=4 121 B16R1.12449 O=C(O)CS(=O)(=O)C1=C(C=CC=C1)C(=O)O MCULE-4746968213 [0,1,0,0,1,0|1,0,0]=3 122 B16R1.16697 COC(=O)C1=C(C=CC=C1)C(=O)CN(=O)=O MCULE-4477347094 [0,1,0,0,1,0|1,0,1]=4 123 B18R1.10294 COC(=O)CCC(=O)C1=CC=CC=C1OC(=O)C MCULE-9259690668 [0,1,0,0,0,1|1,0,0]=3 124 B18R1.36877 CN(C(=O)CCC(=O)O)C1=C(C=CC=C1)C(=O)O MCULE-1817342675 [0,1,0,0,0,1|2,0,0]=4 125 B18R1.10382 O=C(O)C=CC(=O)NC1=C(C=CC(=C1)Cl)C(=O)O MCULE-2334288098 [0,1,0,0,0,1|0,0,2]=4 126 B18R1.17951 O=C(O)C=CC(=O)NC1=C(C=C(C=C1)Br)C(=O)O MCULE-8214463379 [0,1,0,0,0,1|0,0,2]=4 127 B18R1.17951 O=C(O)CCC(=O)NC1=CC=C(C=C1C(=O)O)Br MCULE-9879380795 [0,1,0,0,0,1|0,0,0]=2 128 B18R1.32940 CNC(=O)C1=C(C=CC=C1)NC(=O)CCC(=O)O MCULE-1199255204 [0,1,0,0,0,1|1,0,0]=3 129 B18R1.32940 COC(=O)C1=C(C=CC=C1)NC(=O)C=CC(=O)O MCULE-8116822014 [0,1,0,0,0,1|0,0,2]=4 130 B18R1.32940 COC(=O)C1=C(C=CC=C1)NC(=O)CCC(=O)O MCULE-3648565124 [0,1,0,0,0,1|0,0,0]=2 131 B18R1.32940 COC(=O)C1=CC=CC=C1NC(=O)CSC(=O)N MCULE-2015716203 [0,1,0,0,0,1|2,0,0]=4 132 B18R1.34056 COC(=O)CCC(=O)NC1=C(C=CC=C1)C(=O)N MCULE-9508191457 [0,1,0,0,0,1|1,0,0]=3 133 B18R1.34056 COC(=O)CCC(=O)NC1=C(C=CC=C1)N(=O)=O MCULE-7978328040 [0,1,0,0,0,1|1,0,1]=4 134 B18R1.923 CCOC(=O)C1=CC=CC=C1C(=O)COC(=O)C MCULE-5129227962 [0,2,0,0,0,0|2,0,0]=4 135 B18R1.10296 COC(=O)CCC(=O)C1=CC=CC=C1C(=O)OC MCULE-7810385789 [0,2,0,0,0,0|0,0,0]=2 136 B18R1.10296 COC(=O)CNC(=O)C1=C(C=CC=C1)C(=O)NN MCULE-2519498553 [0,2,0,0,0,0|2,0,0]=4 137 B18R1.33043 COC(=O)C1=CC(=CC=C1C(=O)COC(=O)C)Cl MCULE-1134164301 [0,2,0,0,0,0|2,0,0]=4 138 B16R2.16183 C=C1C2=C(C=CC=C2)C(=O)N1CC(=O)O MCULE-6459001952 [1,0,0,1,0,0|2,0,0]=4 139 B16R2.16183 CC(=O)CN1C(=O)C2=CC=CC=C2C1=O MCULE-9364818587 [1,0,0,1,0,0|2,0,0]=4 140 B16R2.16183 NC(=O)CN1C(=O)C2=C(C1=O)C=CC=C2 MCULE-9554679800 [1,0,0,1,0,0|2,0,0]=4 141 B16R2.16183 O=C(Cl)CN1C(=O)C2=C(C1=O)C=CC=C2 MCULE-2253368824 [1,0,0,1,0,0|2,0,0]=4 142 B16R2.16183 O=C(O)CN1C(=O)C2=C(C1=O)C=CC=C2 MCULE-5036899786 [1,0,0,1,0,0|1,0,0]=3 143 B16R2.16183 O=C(O)CN1C(=O)C2=CC=CN=C2C1=O MCULE-4329843377 [1,0,0,1,0,0|2,0,0]=4 144 B16R2.16183 O=C(O)CN1C(=O)C2=CC=NC=C2C1=O MCULE-9675733676 [1,0,0,1,0,0|2,0,0]=4 145 B16R2.23331 CC(=O)C1NC(=O)C2=C(C1=O)C=CC=C2 MCULE-2051058653 [1,0,0,1,0,0|2,0,0]=4 146 B16R2.23331 O=C1N[C@@H](C(=O)C2=CC=CC=C12)C(=O)Cl MCULE-8160756656 [1,0,0,1,0,0|2,0,0]=4 147 B16R2.83538 O=C(O)CN1C=CC2=CC=CC=C2C1=O MCULE-9347076532 [1,0,0,1,0,0|2,0,0]=4 148 B16R2.83538 O=C(O)CN1N=CC2=CC=CC=C2C1=O MCULE-6838122312 [1,0,0,1,0,0|2,0,0]=4 149 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=CC=C1 MCULE-6755596415 [1,0,0,1,0,0|2,0,0]=4 150 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=CN=C1 MCULE-4075360632 [1,0,0,1,0,0|2,0,0]=4 151 B16R2.24441 O=C(O)C1=C2C(=O)NNC(=O)C2=CC=C1 MCULE-9972608210 [1,0,0,1,0,0|2,0,0]=4 152 B16R2.24933 O=C(O)CC1=CC2=C(C=CC=C2)C(=O)N1 MCULE-1389517041 [1,0,0,1,0,0|1,0,1]=4 153 B16R2.16139 O=C1NC(=O)C2=C(C=CC=C2N1)C(=O)O MCULE-5204456861 [0,0,0,1,1,0|2,0,0]=4 154 B16R2.24414 O=C(O)CC1=NNC(=O)C2=C1C=CC=C2 MCULE-1747279667 [0,0,0,1,1,0|2,0,0]=4 155 B16R2.356350 O=C(O)C1=CC=CC2=C1C(=O)OI2(=O)O MCULE-9446532059 [0,0,0,1,1,0|2,0,0]=4 156 B18R2.7063 O=C(O)C1=C(C=CC=C1)C2NC(CS2)C(=O)O MCULE-3858840091 [0,0,0,1,0,1|1,0,1]=4 157 B18R2.7063 O=C(O)C1=C(C=CC=C1)C2N[C@@H](CS2)C(=O)O MCULE-5172069876 [0,0,0,1,0,1|1,0,1]=4 158 B18R2.60824 CC1=NN(C(=O)C2=CC=CC=C12)CCC(=O)O MCULE-7058703267 [0,0,0,1,0,1|2,0,0]=4 159 B18R2.60824 O=C(O)CCN1N=C(C2=CC=CC=C2C1=O)O MCULE-8265031248 [0,0,0,1,0,1|1,0,0]=3 160 B18R2.360915 O=C(O)CCN1C(=O)C2=C(S1(=O)=O)C=CC=C2 MCULE-6360544962 [0,0,0,1,0,1|1,0,1]=4 161 B18R2.60949 NC(=O)CC1NC(=O)C2=CC=CC=C2NC1=O MCULE-7601901921 [0,0,0,1,0,1|2,0,0]=4 162 B18R2.60949 O=C(O)CC1N=C(C2=CC=CC=C2N=C1O)O MCULE-2859002049 [0,0,0,1,0,1|1,0,1]=4 163 B18R2.60949 O=C(O)C[C@@H]1NC(=O)C2=CC=CC=C2NC1=O MCULE-6491185513 [0,0,0,1,0,1|1,0,0]=3 164 B18R2.60949 O=C(O)C[C@H]1N=C(C2=CC=CC=C2N=C1O)O MCULE-7690477308 [0,0,0,1,0,1|1,0,1]=4 165 B18R2.60949 O=C(O)C[C@H]1NC(=O)C2=C(C=CC=C2)NC1=O MCULE-6145757660 [0,0,0,1,0,1|1,0,0]=3 166 B18R2.131796 CC1=NN(C2=CC=CC=C12)C(=O)CCC(=O)O MCULE-2472574188 [0,0,0,1,0,1|2,0,0]=4 167 B18R2.58796 CN1N=C(C2=CC=CC=C2C1=O)CCC(=O)O MCULE-9351123169 [0,1,0,1,0,0|2,0,0]=4 168 B18R2.111152 COC1=C2C=CC=CC2=C(C=C1)CCC(=O)O MCULE-4763090916 [0,1,0,1,0,0|2,0,0]=4 169 B18R2.694144 COC(=O)CN1NC(=O)C2=C(C1=O)C=CC=C2 MCULE-4158918407 [0,1,0,1,0,0|2,0,0]=4 170 B18R2.33138 O=C1CCN(C(=O)N1)C2=CC=CC=C2C(=O)O MCULE-5512936133 [0,1,0,1,0,0|2,0,0]=4 171 B18R2.488857 O=C(O)CCN1C(=O)NC(=O)C2=C1C=CC=C2 MCULE-1860492144 [0,1,0,1,0,0|2,0,0]=4 172 B14R1.4522 C=C(Br)CCC1=CC=CC=C1C(=O)O MCULE-7756520121 [1,0,0,0,1,0|2,0,0]=4 173 B14R1.4522 C=C(C)CCC1=CC=CC=C1C(=O)O MCULE-5465546948 [1,0,0,0,1,0|2,0,0]=4 174 B14R1.4522 C=C(Cl)CCC1=CC=CC=C1C(=O)O MCULE-6377226889 [1,0,0,0,1,0|2,0,0]=4 175 B14R1.4522 CC(=O)C1=CC=CC=C1OCC(=O)O MCULE-3363266465 [1,0,0,0,1,0|2,0,0]=4 176 B14R1.4522 CC(=O)CSC1=CC=CC=C1C(=O)O MCULE-6104140904 [1,0,0,0,1,0|2,0,0]=4 177 B14R1.4522 NC(=O)C1=C(C=CC=C1)CCC(=O)O MCULE-2466282902 [1,0,0,0,1,0|1,0,0]=3 178 B14R1.4522 NC(=O)C1=C(C=CC=C1)NCC(=O)O MCULE-7889488839 [1,0,0,0,1,0|2,0,0]=4 179 B14R1.4522 NC(=O)C1=CC=CC=C1OCC(=O)O MCULE-5913894164 [1,0,0,0,1,0|2,0,0]=4 180 B14R1.4522 NC(=O)CNC1=CC=CC=C1C(=O)O MCULE-1789700031 [1,0,0,0,1,0|2,0,0]=4 181 B14R1.4522 NC(=O)COC1=C(C=CC=C1)C(=O)O MCULE-2788333356 [1,0,0,0,1,0|2,0,0]=4 182 B14R1.4522 NC(=O)CSC1=CC=CC=C1C(=O)O MCULE-9086395929 [1,0,0,0,1,0|2,0,0]=4 183 B14R1.4522 O=C(O)/C=C/C1=C(C=CC=C1)C(=O)O MCULE-7597048629 [1,0,0,0,1,0|0,0,1]=3 184 B14R1.4522 O=C(O)C1=C(C=CC=C1)CCN(=O)=O MCULE-9004713169 [1,0,0,0,1,0|1,0,1]=4 185 B14R1.4522 O=C(O)C=CC1=C(C=CC=C1)C(=O)O MCULE-2584094431 [1,0,0,0,1,0|0,0,1]=3 186 B14R1.4522 O=C(O)CCC1=C(C=CC=C1)B(O)O MCULE-7761254539 [1,0,0,0,1,0|1,0,1]=4 187 B14R1.4522 O=C(O)CCC1=C(C=CC=C1)C(=O)O MCULE-9938671725 [1,0,0,0,1,0|0,0,0]=2 188 B14R1.4522 O=C(O)CCC1=CC=CC=C1N(=O)=O MCULE-1121309373 [1,0,0,0,1,0|1,0,1]=4 189 B14R1.4522 O=C(O)CNC1=C(C=CC=N1)C(=O)O MCULE-5242443715 [1,0,0,0,1,0|2,0,0]=4 190 B14R1.4522 O=C(O)CNC1=CC=CC=C1C(=O)O MCULE-7070341796 [1,0,0,0,1,0|1,0,0]=3 191 B14R1.4522 O=C(O)COC1=C(C=CC=C1)C(=O)O MCULE-9315481619 [1,0,0,0,1,0|1,0,0]=3 192 B14R1.4522 O=C(O)CSC1=C(C=CC=C1)C(=O)O MCULE-5082048769 [1,0,0,0,1,0|1,0,0]=3 193 B14R1.4522 O=C(O)CSC1=C(C=CC=N1)C(=O)O MCULE-2158207814 [1,0,0,0,1,0|2,0,0]=4 194 B14R1.4522 O=C([O-])CNC1=CC=CC=C1C(=O)O MCULE-5192747004 [1,0,0,0,1,0|1,0,1]=4 195 B14R1.429 CC(C(=O)O)C1=C(C=CC=C1)C(=O)O MCULE-4321520344 [0,0,0,0,2,0|1,0,1]=4 196 B14R1.429 O=C(O)C(=O)C1=C(C=CC=C1)N(=O)=O MCULE-9243242502 [0,0,0,0,2,0|1,0,1]=4 197 B14R1.429 O=C(O)C(=O)C1=CC=CC=C1C(=O)O MCULE-9220630853 [0,0,0,0,2,0|0,0,0]=2 198 B16R1.1369 CCC1=CC=CC=C1NC(=O)CCC(=O)O MCULE-4718213130 [1,0,0,0,0,1|1,0,1]=4 199 B16R1.1369 COC1=C(C=CC=C1)NC(=O)CCC(=O)O MCULE-6778027857 [1,0,0,0,0,1|2,0,0]=4 200 B16R1.1369 CSC1=CC=CC=C1NC(=O)CCC(=O)O MCULE-5047461113 [1,0,0,0,0,1|2,0,0]=4 201 B16R1.18704 CCC1=CC=CC=C1C(=O)CCCC(=O)O MCULE-1653566703 [1,0,0,0,0,1|1,0,1]=4 202 B16R1.18704 CCC1=CC=CC=C1C(=O)CSCC(=O)O MCULE-2666742772 [1,0,0,0,0,1|1,0,1]=4 203 B16R1.18704 COC1=C(C=CC=C1)C(=O)CCCC(=O)O MCULE-3923837522 [1,0,0,0,0,1|2,0,0]=4 204 B16R1.18704 COC1=C(C=CC=C1)C(=O)NCCC(=O)O MCULE-6747574640 [1,0,0,0,0,1|2,0,0]=4 205 B16R1.18704 COC1=CC=CC=C1C(=O)CSCC(=O)O MCULE-6372955057 [1,0,0,0,0,1|2,0,0]=4 206 B16R1.18704 CSC1=C(C=CC=C1)C(=O)CCCC(=O)O MCULE-3682388645 [1,0,0,0,0,1|2,0,0]=4 207 B16R1.1498 C=CCCC(=O)C1=CC=CC=C1OC(=O)C MCULE-9548502857 [1,0,0,0,0,1|2,0,0]=4 208 B16R1.4493 CCCCC(=O)NC1=C(C=CC=C1)C(=O)O MCULE-5854540764 [1,0,0,0,0,1|1,0,1]=4 209 B16R1.4493 CCCCC(=O)OC1=CC=CC=C1C(=O)O MCULE-1656822175 [1,0,0,0,0,1|1,0,1]=4 210 B16R1.12322 O=C(O)CCCNC1=C(C=CC=C1)C(=O)O MCULE-4351064322 [1,0,0,0,0,1|0,0,1]=3 211 B16R1.4544 O=C(O)CCC(=O)C1=CC=CC(=C1)N(=O)=O MCULE-8593770782 [0,0,0,0,1,1|1,0,1]=4 212 B18R1.20990 O=C(O)CCCNC(=O)C1=CC=CC=C1C(=O)O MCULE-1020706829 [0,0,0,0,0,2|0,0,0]=2 213 B18R1.36947 CC(=O)C1=CC=CC=C1NC(=O)CCCC(=O)O MCULE-5869063365 [0,0,0,0,0,2|1,0,0]=3 214 B18R1.36947 CC(=O)C1=CC=CC=C1NC(=O)CSCC(=O)O MCULE-3426934840 [0,0,0,0,0,2|1,0,0]=3 215 B18R1.36947 NC(=O)C1=C(C=CC=C1)NC(=O)COCC(=O)O MCULE-6789810379 [0,0,0,0,0,2|1,0,0]=3 216 B18R1.36947 NC(=O)C1=CC=CC=C1NC(=O)CCCC(=O)O MCULE-4944195916 [0,0,0,0,0,2|1,0,0]=3 217 B18R1.36947 O=C(O)CCCC(=O)NC1=CC=CC=C1C(=O)O MCULE-6936034832 [0,0,0,0,0,2|0,0,0]=2 218 B18R1.36947 O=C(O)CCCC(=O)NC1=CC=CC=C1N(=O)=O MCULE-4042866234 [0,0,0,0,0,2|1,0,1]=4 219 B18R1.36947 O=C(O)COCC(=O)NC1=C(C=CC=C1)N(=O)=O MCULE-2600014680 [0,0,0,0,0,2|1,0,1]=4 220 B18R1.106042 O=C(O)CCC(=O)NNC1=C(C=CC=C1)N(=O)=O MCULE-6566629969 [0,0,0,0,0,2|1,0,1]=4