0 B18R3.5893 O=C1CCCC2=C1N=C(N2)C3=CC=CC=C3 MCULE-2662897437 [0,0,0,0,0,0|3,0,0]=3 1 B18R3.5893 O=C1CCCC2=C1SC(=N2)C3=CC=CC=C3 MCULE-9888625383 [0,0,0,0,0,0|3,0,1]=4 2 B18R3.5893 O=C1CCCC2=NN(C=C12)C3=CC=CC=C3 MCULE-5603665111 [0,0,0,0,0,0|3,0,1]=4 3 B18R3.5893 O=C1NC=CC2=C1C=C(S2)C3=CC=CC=C3 MCULE-2143932621 [0,0,0,0,0,0|2,0,2]=4 4 B18R3.5893 O=C1NC=CN2C1=CC(=N2)C3=CC=NC=C3 MCULE-6296676907 [0,0,0,0,0,0|1,0,3]=4 5 B18R3.5893 O=C1NC=NC2=C1C=C(S2)C3=CC=CC=C3 MCULE-4320811185 [0,0,0,0,0,0|3,0,1]=4 6 B18R3.5893 O=C1NCCC2=C1C=C(N2)C3=CC=NC=C3 MCULE-2483807724 [0,0,0,0,0,0|0,0,0]=0 7 B18R3.5893 O=C1NCCC2=C1C=C(N2)C3=CC=NC=C3 MCULE-9017718467 [0,0,0,0,0,0|0,0,0]=0 8 B18R3.5893 O=C1NCCC2=C1C=C(O2)C3=CC=CC=C3 MCULE-9430624351 [0,0,0,0,0,0|2,0,0]=2 9 B18R3.5893 O=C1NCCC2=C1C=C(S2)C3=CC=CC=C3 MCULE-3772901453 [0,0,0,0,0,0|2,0,0]=2 10 B18R3.5893 O=C1NN=NC2=C1C=C(S2)C3=CC=CC=C3 MCULE-5320078334 [0,0,0,0,0,0|4,0,0]=4 11 B17R3.8708 C1=CC2=C(N=C1)NC(=C2)C3=CC=NC=C3 MCULE-8916472440 [1,0,0,0,0,0|2,0,1]=4 12 B17R3.8708 C1=CC=C(C=C1)C2=CC3=C(N2)CCCC3 MCULE-1076272011 [1,0,0,0,0,0|2,0,1]=4 13 B17R3.8708 C1=CC=C(C=C1)C2=CC3=C(N2)CCNC3 MCULE-6446350075 [1,0,0,0,0,0|1,0,1]=3 14 B17R3.8708 C1=CC=C(C=C1)C2=CC3=C(O2)CCNC3 MCULE-1625813043 [1,0,0,0,0,0|2,0,1]=4 15 B17R3.8708 C1=CC=C(C=C1)C2=CC3=C(O2)CCNC3 MCULE-8423809391 [1,0,0,0,0,0|2,0,1]=4 16 B17R3.8708 C1=CC=C(C=C1)C2=NC3=C(N2)CCNC3 MCULE-1706693486 [1,0,0,0,0,0|2,0,1]=4 17 B17R3.8708 C1=CC=C(C=C1)C2=NC3=C(N2)CCNC3 MCULE-4992053927 [1,0,0,0,0,0|2,0,1]=4 18 B17R3.8708 C1=CC=C2NC(=CC2=C1)C3=CC=NC=C3 MCULE-4236414864 [1,0,0,0,0,0|1,0,2]=4 19 B19R3.3835 CC1=CC=C(C=C1)C2=NN3CCNC(=O)C3=C2 MCULE-3424139917 [0,1,0,0,0,0|2,0,1]=4 20 B19R3.3835 O=C1NCCN2C1=CC(=N2)C3=CC=C(C=C3)Cl MCULE-7998796667 [0,1,0,0,0,0|2,0,1]=4 21 B19R3.3835 O=C1NCCN2C1=CC(=N2)C3=CC=C(C=C3)F MCULE-2895981511 [0,1,0,0,0,0|2,0,1]=4 22 B19R3.3938 O=C1NCCC2=C1C=C(N2)C3=CC(=NC=C3)Cl MCULE-4500144204 [0,1,0,0,0,0|0,0,0]=1 23 B19R3.3938 O=C1NCCN2C1=CC(=N2)C3=CC=CC(=C3)F MCULE-3984377498 [0,1,0,0,0,0|2,0,1]=4 24 B19R3.9012 O=C1NCC(N2C1=CC(=N2)C3=CC=CC=C3)O MCULE-9667087173 [0,1,0,0,0,0|2,0,1]=4 25 B19R3.150524 CN1C(=CC2=C1CCCC2=O)C3=CC=CC=C3 MCULE-6319550103 [0,1,0,0,0,0|2,0,0]=3 26 B19R3.150524 O=C1CCCC2=C1N=C(N2O)C3=CC=CC=C3 MCULE-4214271441 [0,1,0,0,0,0|3,0,0]=4 27 B17R2.172 CCNC(=O)C1=CC(=NN1)C2=CC=CC=C2 MCULE-1573466932 [0,0,1,0,0,0|2,0,1]=4 28 B17R2.172 CCNC(=O)C1=CC=C(S1)C2=CC=NC=C2 MCULE-4984534400 [0,0,1,0,0,0|2,0,0]=3 29 B17R2.172 CCNC(=O)C1=NC(=CS1)C2=CC=NC=C2 MCULE-2840285076 [0,0,1,0,0,0|3,0,0]=4 30 B17R2.172 CCOC(=O)C1=CNC(=C1)C2=CC=CC=C2 MCULE-4832972179 [0,0,1,0,0,0|2,0,0]=3 31 B17R2.172 CCOC(=O)C1=CNC(=C1)C2=NC=CC=C2 MCULE-2006915595 [0,0,1,0,0,0|3,0,0]=4 32 B17R2.172 CCOC(=O)C1=CNC(=N1)C2=CC=CC=C2 MCULE-6750955240 [0,0,1,0,0,0|3,0,0]=4 33 B17R2.172 CCOC(=O)C1=CSC(=N1)C2=CC=NC=C2 MCULE-3522312245 [0,0,1,0,0,0|3,0,0]=4 34 B17R2.172 CCOC(=O)C1=NNC(=C1)C2=CC=CC=C2 MCULE-3390331833 [0,0,1,0,0,0|3,0,0]=4 35 B17R2.172 CCOC(=O)C1=NNC(=C1)C2=CC=NC=C2 MCULE-6543075027 [0,0,1,0,0,0|2,0,0]=3 36 B17R2.172 CCOC(=O)C1=NOC(=C1)C2=CC=NC=C2 MCULE-5146533139 [0,0,1,0,0,0|3,0,0]=4 37 B17R2.268 O=CNCCC1=NC(=CS1)C2=CC=CC=C2 MCULE-5104796024 [0,0,1,0,0,0|2,0,1]=4 38 B17R2.575 CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)NN MCULE-7174420155 [0,0,1,0,0,0|3,0,0]=4 39 B17R2.575 CNC(=O)C1=C(N=C(O1)C2=CC=CC=C2)C MCULE-4469004429 [0,0,1,0,0,0|2,0,1]=4 40 B17R2.575 CNC(=O)C1=C(N=C(S1)C2=CC=CC=C2)C MCULE-7446491586 [0,0,1,0,0,0|2,0,1]=4 41 B17R2.575 CNC(=O)C1=C(NC(=N1)C2=CC=CC=C2)C MCULE-8548713446 [0,0,1,0,0,0|2,0,0]=3 42 B17R2.575 CNC(=O)C1=C(OC(=N1)C2=CC=CC=C2)C MCULE-2775031029 [0,0,1,0,0,0|3,0,0]=4 43 B17R2.575 CNC(=O)C1=CN(N=C1C)C2=CC=CC=C2 MCULE-2466313865 [0,0,1,0,0,0|2,0,1]=4 44 B17R2.575 COC(=O)C1=C(NC(=C1)C2=CC=NC=C2)C MCULE-3550857154 [0,0,1,0,0,0|1,0,0]=2 45 B17R2.575 COC(=O)C1=CC(=NN1C)C2=CC=NC=C2 MCULE-9811560680 [0,0,1,0,0,0|2,0,1]=4 46 B17R2.2607 CCC1=C(C=C(N1)C2=CC=CC=C2)C(=O)O MCULE-8510003711 [0,0,1,0,0,0|2,0,0]=3 47 B17R2.2607 CSC1=C(C=C(N1)C2=CC=CC=C2)C(=O)C MCULE-5942988894 [0,0,1,0,0,0|3,0,0]=4 48 B17R2.3426 O=C(/C=C\1/NCCNC1=O)C2=CC=CC=C2 MCULE-6561343435 [0,0,1,0,0,0|3,0,0]=4 49 B17R2.3426 O=C(C=C1NCCNC1=O)C2=CC=CC=C2 MCULE-1137798782 [0,0,1,0,0,0|3,0,0]=4 50 B17R2.3426 O=C(C=C1OCCNC1=O)C2=CC=CC=C2 MCULE-1443673504 [0,0,1,0,0,0|3,0,0]=4 51 B17R2.5293 CN(NC1=CC(=O)NCC1)C2=CC=CC=C2 MCULE-2952642905 [0,0,1,0,0,0|2,0,1]=4 52 B19R3.8275 O=C1CCCC2=C1C=CC(=C2)C3=CC=CC=C3 MCULE-9866690190 [0,0,0,0,0,1|3,0,0]=4 53 B19R3.8275 O=C1CCCC2=C1C=NC(=N2)C3=CC=NC=C3 MCULE-5227617142 [0,0,0,0,0,1|1,0,1]=3 54 B19R3.8275 O=C1CCCC2=NC(=NC=C12)C3=CC=CC=C3 MCULE-9839945314 [0,0,0,0,0,1|2,0,1]=4 55 B19R3.8275 O=C1NCCC2=C1C=CC(=C2)C3=CC=CC=C3 MCULE-1957403062 [0,0,0,0,0,1|2,0,0]=3 56 B19R3.9535 O=C1NCCCN2C1=CC(=N2)C3=CC=CC=C3 MCULE-9820151573 [0,0,0,0,0,1|2,0,1]=4 57 B19R3.9535 O=C1NCCCN2C1=CC(=N2)C3=CC=NC=C3 MCULE-4318628278 [0,0,0,0,0,1|1,0,1]=3 58 B19R3.152686 O=C1NC=CC2=C1C=C(C=C2)C3=CC=NC=C3 MCULE-6383467790 [0,0,0,0,0,1|1,0,2]=4 59 B19R3.152686 O=C1NCCC2=C1C=C(C=C2)C3=CC=CC=C3 MCULE-7305879875 [0,0,0,0,0,1|2,0,0]=3 60 B16R2.141 CCC(=O)C1=CSC(=C1)C2=CC=CC=C2 MCULE-9944856048 [1,0,1,0,0,0|2,0,0]=4 61 B16R2.141 CNC(=O)C1=CSC(=N1)C2=CC=NC=C2 MCULE-4646577966 [1,0,1,0,0,0|2,0,0]=4 62 B16R2.2888 CC(=O)C1=C(N=C(S1)C2=CC=NC=C2)C MCULE-3664653143 [1,0,1,0,0,0|1,0,1]=4 63 B16R2.2888 CC(=O)C1=C(NC(=C1)C2=CC=NC=C2)C MCULE-4387911894 [1,0,1,0,0,0|0,0,0]=2 64 B16R2.2888 CC(=O)C1=C(NC(=N1)C2=CC=CC=C2)C MCULE-6171186102 [1,0,1,0,0,0|2,0,0]=4 65 B16R2.2888 CC(=O)C1=C(SC(=C1)C2=CC=CC=C2)C MCULE-1433128335 [1,0,1,0,0,0|2,0,0]=4 66 B16R2.2888 CC(=O)C1=C([NH+]=C(S1)C2=CC=NC=C2)C MCULE-2779138880 [1,0,1,0,0,0|1,0,1]=4 67 B16R2.2888 CC1=C(C=C(N1)C2=CC=CC=C2)C(=O)O MCULE-7639885824 [1,0,1,0,0,0|2,0,0]=4 68 B16R2.2888 CC1=C(C=C(N1)C2=CC=NC=C2)C(=O)O MCULE-5107963950 [1,0,1,0,0,0|1,0,0]=3 69 B16R2.2888 CC1=C(C=C(O1)C2=CC=CC=C2)C(=O)N MCULE-2325949080 [1,0,1,0,0,0|2,0,0]=4 70 B18R2.3766 CC(C)NC(=O)C1=CSC(=N1)C2=CC=NC=C2 MCULE-1868026897 [0,1,1,0,0,0|2,0,0]=4 71 B18R2.8097 CCOC(=O)C1=CNC(=C1)C2=CC=CC=C2F MCULE-9584795665 [0,1,1,0,0,0|2,0,0]=4 72 B18R2.8107 CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)C MCULE-7776015045 [0,1,1,0,0,0|2,0,0]=4 73 B18R2.8107 CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)Cl MCULE-5089631523 [0,1,1,0,0,0|2,0,0]=4 74 B18R2.8107 CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)N MCULE-5665341642 [0,1,1,0,0,0|2,0,0]=4 75 B18R2.8107 CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)O MCULE-9416754513 [0,1,1,0,0,0|2,0,0]=4 76 B18R2.81634 CCNC(=O)C1=C(C(=NS1)C2=CC=NC=C2)N MCULE-2116020754 [0,1,1,0,0,0|1,0,1]=4 77 B18R2.288 CNC(=O)C1=C(OC(=C1)C2=CC=C(C=C2)Cl)C MCULE-6184824077 [0,1,1,0,0,0|2,0,0]=4 78 B18R2.9421 CNC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C)C MCULE-5478165154 [0,1,1,0,0,0|1,0,0]=3 79 B18R2.9421 COC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C)C MCULE-4414312028 [0,1,1,0,0,0|2,0,0]=4 80 B18R2.689338 COC(=O)C1=C(NC(=C1O)C2=CC=CC=C2)C MCULE-6729751416 [0,1,1,0,0,0|2,0,0]=4 81 B18R3.6926 CC1CC2=C(C1=O)C=C(S2)C3=CC=CC=C3 MCULE-6989129809 [0,1,0,0,1,0|2,0,0]=4 82 B20R3.247868 O=C1NCCC2=NC(=NC(=C12)Cl)C3=CC=CC=C3 MCULE-3067368592 [0,1,0,0,0,1|1,0,1]=4 83 B20R3.247868 O=C1NCCC2=NC(=NC(=C12)O)C3=CC=CC=C3 MCULE-2694810731 [0,1,0,0,0,1|1,0,1]=4 84 B20R3.2753246 O=C1NCCCC2=C1N=C(N2)C3=CC=C(C=C3)Cl MCULE-4642469552 [0,1,0,0,0,1|2,0,0]=4 85 B20R3.2753246 O=C1NCCCC2=C1N=C(N2)C3=CC=C(C=C3)F MCULE-1095874667 [0,1,0,0,0,1|2,0,0]=4 86 B20R3.2786028 O=C1NCCCC2=C1N=C(N2)C3=CC=CC(=C3)Cl MCULE-6589787176 [0,1,0,0,0,1|2,0,0]=4 87 B20R3.87996 O=C1CCCC2=C1C(=C(N2)C3=CC=C(C=C3)F)O MCULE-7956266618 [0,2,0,0,0,0|2,0,0]=4 88 B20R3.83589 CCN1C(=CC2=C1CCNC2=O)C3=CC=NC=C3 MCULE-4506130048 [0,2,0,0,0,0|0,0,0]=2 89 B16R2.2948 O=C1CCC(=C1/C=C/C2=CC=CC=C2)O MCULE-9235299736 [0,0,1,0,1,0|2,0,0]=4 90 B18R2.228 CCNC(=O)C1=CC=C(C=C1)C2=CC=CC=C2 MCULE-9285783800 [0,0,1,0,0,1|2,0,0]=4 91 B18R2.228 CCNC(=O)C1=CC=C(C=C1)C2=CC=NN=C2 MCULE-2321445994 [0,0,1,0,0,1|2,0,0]=4 92 B18R2.228 CCNC(=O)C1=CN=C(C=C1)C2=CC=NN=C2 MCULE-4326537126 [0,0,1,0,0,1|1,0,1]=4 93 B18R2.228 CCOC(=O)C1=CC=C(C=C1)C2=CC=NC=C2 MCULE-2131549138 [0,0,1,0,0,1|2,0,0]=4 94 B18R2.231 CCOC(=O)C1=CC=NC(=C1)C2=CC=NC=C2 MCULE-1238516551 [0,0,1,0,0,1|1,0,1]=4 95 B18R2.284 CNC(=O)C1=CC(=CC(=C1)Br)C2=CC=NC=C2 MCULE-1764088411 [0,0,1,0,0,1|2,0,0]=4 96 B18R2.9323 CNC(=O)C1=CC(=CC=C1Cl)C2=CC=NC=C2 MCULE-2542202939 [0,0,1,0,0,1|2,0,0]=4 97 B18R2.9323 CNC(=O)C1=CC(=CC=C1Cl)C2=CC=NC=C2 MCULE-8587304133 [0,0,1,0,0,1|2,0,0]=4 98 B18R2.2584 COC1=CC=C(C=C1C(=O)N)C2=CC=NC=C2 MCULE-6529051788 [0,0,1,0,0,1|2,0,0]=4 99 B18R3.4180 O=C1CCC2=CC(=CC=C12)C3=CC=CC=C3 MCULE-1893591094 [0,0,0,0,1,1|2,0,0]=4 100 B18R3.4180 O=C1NNC2=C1C=CC(=N2)C3=CC=NC=C3 MCULE-2852810320 [0,0,0,0,1,1|1,0,1]=4 101 B20R3.13942 O=C1NCCCC2=C1N=C(N2)CC3=CC=NC=C3 MCULE-6452256206 [0,0,0,0,0,2|1,0,0]=3