0 B17R3.8707 C1=CC(=C2C=CNC2=C1)N3CCNCC3 MCULE-3464111339 [0,0,0,0,0,0|4,0,0]=4 1 B17R3.8707 C1=CC(=C2C=CNC2=C1)N3CCNCC3 MCULE-3914188384 [0,0,0,0,0,0|4,0,0]=4 2 B17R3.8707 C1=CC(=C2SC=CC2=N1)N3CCNCC3 MCULE-2813375829 [0,0,0,0,0,0|4,0,0]=4 3 B17R3.8707 C1=CC(=C2SC=CC2=N1)N3CCNCC3 MCULE-8532641948 [0,0,0,0,0,0|4,0,0]=4 4 B17R3.8707 C1=CC(=C2SC=CC2=N1)N3CCOCC3 MCULE-8948951069 [0,0,0,0,0,0|3,0,0]=3 5 B17R3.8707 C1=CC2=C(C=CO2)C(=N1)N3CCNCC3 MCULE-8505172136 [0,0,0,0,0,0|4,0,0]=4 6 B17R3.8707 C1=CC2=C(C=CO2)C(=N1)N3CCNCC3 MCULE-8704935568 [0,0,0,0,0,0|4,0,0]=4 7 B17R3.8707 C1=CC2=C(C=CO2)C(=N1)N3CCOCC3 MCULE-4982749881 [0,0,0,0,0,0|3,0,0]=3 8 B17R3.8707 C1=CC2=C(N1)C(=NC=N2)N3CCNCC3 MCULE-7566019777 [0,0,0,0,0,0|2,0,1]=3 9 B17R3.8707 C1=CC2=C(N1)C(=NC=N2)N3CCNCC3 MCULE-8040402316 [0,0,0,0,0,0|2,0,1]=3 10 B17R3.8707 C1=CC2=C(N=CC=C2S1)N3CCNCC3 MCULE-1031977884 [0,0,0,0,0,0|4,0,0]=4 11 B17R3.8707 C1=CC2=C(N=CC=C2S1)N3CCNCC3 MCULE-1835620065 [0,0,0,0,0,0|4,0,0]=4 12 B17R3.8707 C1=CC2=C(N=CN=C2N1)N3CCNCC3 MCULE-3871238079 [0,0,0,0,0,0|2,0,0]=2 13 B17R3.8707 C1=CC2=C(N=CN=C2N1)N3CCOCC3 MCULE-9729764802 [0,0,0,0,0,0|1,0,0]=1 14 B17R3.8707 C1=CC2=C(N=CN=C2S1)N3CCNCC3 MCULE-6714459164 [0,0,0,0,0,0|3,0,0]=3 15 B17R3.8707 C1=CC2=C(N=CNC2=N1)N3CCNCC3 MCULE-7223456159 [0,0,0,0,0,0|2,0,2]=4 16 B17R3.8707 C1=CC2=C(N=CO2)C(=C1)N3CCNCC3 MCULE-7653468067 [0,0,0,0,0,0|4,0,0]=4 17 B17R3.8707 C1=CC2=C(SC=C2)C(=N1)N3CCNCC3 MCULE-2365188068 [0,0,0,0,0,0|4,0,0]=4 18 B17R3.8707 C1=CC2=C(SC=C2)C(=N1)N3CCNCC3 MCULE-3424520897 [0,0,0,0,0,0|4,0,0]=4 19 B17R3.8707 C1=CC2=NC=NC(=C2S1)N3CCNCC3 MCULE-3522335295 [0,0,0,0,0,0|3,0,0]=3 20 B17R3.8707 C1=CC2=NC=NC(=C2S1)N3CCOCC3 MCULE-9369034548 [0,0,0,0,0,0|2,0,0]=2 21 B17R3.8707 C1=CCN(CC1)C2=C3SC=CC3=NC=N2 MCULE-2654074890 [0,0,0,0,0,0|3,0,1]=4 22 B17R3.8707 C1=CN2C=CN=C(C2=N1)N3CCNCC3 MCULE-8648621689 [0,0,0,0,0,0|4,0,0]=4 23 B17R3.8707 C1=NC(=C2CCCC2=N1)N3CCSCC3 MCULE-2617294890 [0,0,0,0,0,0|2,1,1]=4 24 B17R3.8707 C1=NC2=C(CCC2)C(=N1)N3CCNCC3 MCULE-6319591290 [0,0,0,0,0,0|3,0,1]=4 25 B17R3.8707 C1=NC2=C(CCC2)C(=N1)N3CCNCC3 MCULE-9183779609 [0,0,0,0,0,0|3,0,1]=4 26 B17R3.8707 C1=NC2=C(N=CN2)C(=N1)N3CCCCC3 MCULE-7811991518 [0,0,0,0,0,0|1,0,0]=1 27 B17R3.8707 C1=NC2=C(N=CN2)C(=N1)N3CCNCC3 MCULE-7985829690 [0,0,0,0,0,0|1,0,0]=1 28 B17R3.8707 C1=NC2=C(N=CN2)C(=N1)N3CCOCC3 MCULE-3709523641 [0,0,0,0,0,0|0,0,0]=0 29 B17R3.8707 C1=NC2=C(N=CN=C2N1)N3CCCCC3 MCULE-6161586311 [0,0,0,0,0,0|1,0,0]=1 30 B17R3.8707 C1=NC2=C(NC=N2)C(=N1)N3CC[NH2+]CC3 MCULE-9434529660 [0,0,0,0,0,0|1,0,2]=3 31 B17R3.8707 C1=NNC2=C1C(=NC=N2)N3CCNCC3 MCULE-1632198560 [0,0,0,0,0,0|3,0,0]=3 32 B17R3.8707 C1=NNC2=C1C(=NC=N2)N3CCNCC3 MCULE-4020769386 [0,0,0,0,0,0|3,0,0]=3 33 B17R3.8707 C1=NNC2=C1C(=NC=N2)N3CCOCC3 MCULE-6871887508 [0,0,0,0,0,0|2,0,0]=2 34 B17R3.8707 C1=NNC2=C1C(=NC=N2)N3CCSCC3 MCULE-4169001264 [0,0,0,0,0,0|2,1,0]=3 35 B18R3.1 CC1=CSC2=C1N=CN=C2N3CCCCC3 MCULE-6249599179 [0,1,0,0,0,0|3,0,0]=4 36 B18R3.1 CC1=CSC2=C1N=CN=C2N3CCNCC3 MCULE-9066120840 [0,1,0,0,0,0|3,0,0]=4 37 B18R3.1 CC1=CSC2=C1N=CN=C2N3CCOCC3 MCULE-9050801717 [0,1,0,0,0,0|2,0,0]=3 38 B18R3.1 CC1=CSC2=C1N=CN=C2N3CCSCC3 MCULE-7847242637 [0,1,0,0,0,0|2,1,0]=4 39 B18R3.1 CN1C=NC2=C(N=CN=C12)N3CCNCC3 MCULE-5380514710 [0,1,0,0,0,0|1,0,0]=2 40 B18R3.1 CN1C=NC2=C(N=CN=C12)N3CCSCC3 MCULE-2426721398 [0,1,0,0,0,0|0,1,0]=2 41 B18R3.1 CN1C=NC2=C1C=CN=C2N3CCCCC3 MCULE-7266566891 [0,1,0,0,0,0|2,0,0]=3 42 B18R3.1 CN1N=CC2=C1N=CN=C2N3CCCCC3 MCULE-2377382889 [0,1,0,0,0,0|3,0,0]=4 43 B18R3.1 CN1N=CC2=C1N=CN=C2N3CCNCC3 MCULE-6114761207 [0,1,0,0,0,0|3,0,0]=4 44 B18R3.1 CN1N=CC2=C1N=CN=C2N3CCOCC3 MCULE-5780977372 [0,1,0,0,0,0|2,0,0]=3 45 B18R3.1 CN1N=CC2=C1N=CN=C2N3CCSCC3 MCULE-5543588263 [0,1,0,0,0,0|2,1,0]=4 46 B18R3.1 CN1N=NC2=C1C=CN=C2N3CCCCC3 MCULE-1051040382 [0,1,0,0,0,0|3,0,0]=4 47 B18R3.1 CN1N=NC2=C1N=CN=C2N3CCNCC3 MCULE-1400514012 [0,1,0,0,0,0|2,0,0]=3 48 B18R3.1 CN1N=NC2=C1N=CN=C2N3CCNCC3 MCULE-2285222703 [0,1,0,0,0,0|2,0,0]=3 49 B18R3.1 CN1N=NC2=C1N=CN=C2N3CCOCC3 MCULE-9273107310 [0,1,0,0,0,0|1,0,0]=2 50 B18R3.174 CC1=NC(=C2CCCC2=N1)N3CCOCC3 MCULE-9578010512 [0,1,0,0,0,0|2,0,1]=4 51 B18R3.174 CC1=NC2=C(C=CS2)C(=N1)N3CCCCC3 MCULE-5142642657 [0,1,0,0,0,0|3,0,0]=4 52 B18R3.174 CC1=NC2=C(C=CS2)C(=N1)N3CCCCC3 MCULE-9456965606 [0,1,0,0,0,0|3,0,0]=4 53 B18R3.174 CC1=NC2=C(C=CS2)C(=N1)N3CCSCC3 MCULE-8977719258 [0,1,0,0,0,0|2,1,0]=4 54 B18R3.174 CC1=NC2=CC=NN2C(=C1)N3CCOCC3 MCULE-4029715418 [0,1,0,0,0,0|3,0,0]=4 55 B18R3.174 CC1=NC2=NC=NN2C(=C1)N3CCOCC3 MCULE-4602292839 [0,1,0,0,0,0|2,0,1]=4 56 B18R3.174 ClC1=NC(=C2C=CNC2=N1)N3CCCCC3 MCULE-7575351579 [0,1,0,0,0,0|2,0,0]=3 57 B18R3.174 ClC1=NC(=C2N=CNC2=N1)N3CCNCC3 MCULE-2167664469 [0,1,0,0,0,0|1,0,0]=2 58 B18R3.174 ClC1=NC(=C2N=CNC2=N1)N3CCNCC3 MCULE-6416108965 [0,1,0,0,0,0|1,0,0]=2 59 B18R3.174 ClC1=NC(=C2N=CNC2=N1)N3CCNCC3 MCULE-8163453626 [0,1,0,0,0,0|1,0,0]=2 60 B18R3.174 ClC1=NC(=C2N=CSC2=N1)N3CCOCC3 MCULE-5127600269 [0,1,0,0,0,0|1,0,0]=2 61 B18R3.174 ClC1=NC(=C2NC=CC2=N1)N3CCOCC3 MCULE-2111468878 [0,1,0,0,0,0|1,0,1]=3 62 B18R3.174 ClC1=NC(=C2SC=NC2=N1)N3CCOCC3 MCULE-5276870958 [0,1,0,0,0,0|1,0,1]=3 63 B18R3.174 ClC1=NC2=C(C=CN2)C(=N1)N3CCOCC3 MCULE-7306899137 [0,1,0,0,0,0|1,0,0]=2 64 B18R3.174 ClC1=NC2=C(C=CS2)C(=N1)N3CCOCC3 MCULE-6439587945 [0,1,0,0,0,0|2,0,0]=3 65 B18R3.174 ClC1=NC2=C(NC=N2)C(=N1)N3CCOCC3 MCULE-5859313141 [0,1,0,0,0,0|0,0,2]=3 66 B18R3.174 ClC1=NC2=C(SC=C2)C(=N1)N3CCCCC3 MCULE-7429862034 [0,1,0,0,0,0|3,0,0]=4 67 B18R3.174 ClC1=NC2=C(SC=C2)C(=N1)N3CCNCC3 MCULE-4523323609 [0,1,0,0,0,0|3,0,0]=4 68 B18R3.174 ClC1=NC2=C(SC=C2)C(=N1)N3CCNCC3 MCULE-8234692808 [0,1,0,0,0,0|3,0,0]=4 69 B18R3.174 ClC1=NC2=C(SC=C2)C(=N1)N3CCOCC3 MCULE-9567973153 [0,1,0,0,0,0|2,0,0]=3 70 B18R3.174 ClC1=NN2C=CC=C2C(=N1)N3CCOCC3 MCULE-9670651749 [0,1,0,0,0,0|3,0,0]=4 71 B18R3.174 ClC1=NN2C=CN=C2C(=C1)N3CCOCC3 MCULE-6624532040 [0,1,0,0,0,0|3,0,0]=4 72 B18R3.174 NC1=CC2=NC=NN2C(=N1)N3CCOCC3 MCULE-2168089720 [0,1,0,0,0,0|2,0,1]=4 73 B18R3.174 NC1=NC2=C(N=CN2)C(=N1)N3CCNCC3 MCULE-1983912296 [0,1,0,0,0,0|1,0,0]=2 74 B18R3.174 NC1=NC2=C(N=CN2)C(=N1)N3CCNCC3 MCULE-5376862142 [0,1,0,0,0,0|1,0,0]=2 75 B18R3.174 NC1=NC2=C(NC=N2)C(=N1)N3CCNCC3 MCULE-9503468585 [0,1,0,0,0,0|1,0,2]=4 76 B18R3.174 NC1=NC2=C(NC=N2)C(=N1)N3CCOCC3 MCULE-2272524205 [0,1,0,0,0,0|0,0,2]=3 77 B18R3.213 BrC1=CC2=C(N=CN=C2S1)N3CCNCC3 MCULE-4623894167 [0,1,0,0,0,0|3,0,0]=4 78 B18R3.213 CC1=CC2=C(S1)N=CN=C2N3CCCCC3 MCULE-2631580568 [0,1,0,0,0,0|3,0,0]=4 79 B18R3.213 CC1=CC2=C(S1)N=CN=C2N3CCCCC3 MCULE-3020789713 [0,1,0,0,0,0|3,0,0]=4 80 B18R3.213 CC1=CC2=C(S1)N=CN=C2N3CCNCC3 MCULE-5014166201 [0,1,0,0,0,0|3,0,0]=4 81 B18R3.213 CC1=CC2=C(S1)N=CN=C2N3CCOCC3 MCULE-7857126409 [0,1,0,0,0,0|2,0,0]=3 82 B18R3.213 CC1=CC2=C(S1)N=CN=C2N3CCOCC3 MCULE-8815585200 [0,1,0,0,0,0|2,0,0]=3 83 B18R3.213 CC1=NC2=C(N1)C(=NC=N2)N3CCCCC3 MCULE-4247259272 [0,1,0,0,0,0|1,0,2]=4 84 B18R3.213 CC1=NC2=C(N1)C(=NC=N2)N3CCOCC3 MCULE-8489246348 [0,1,0,0,0,0|0,0,2]=3 85 B18R3.213 CC1=NC2=C(N1)C(=NC=N2)N3CCSCC3 MCULE-7298462159 [0,1,0,0,0,0|0,1,2]=4 86 B18R3.213 CN1C=C2C(=N1)N=CN=C2N3CCOCC3 MCULE-7737337591 [0,1,0,0,0,0|2,0,1]=4 87 B18R3.213 NC1=NC2=C(C=CC=C2S1)N3CCOCC3 MCULE-7640321258 [0,1,0,0,0,0|3,0,0]=4 88 B18R3.3140 CC1CCCCN1C2=NC=NC3=C2C=NN3 MCULE-1400915974 [0,1,0,0,0,0|3,0,0]=4 89 B18R3.8788 CC1CCN(CC1)C2=C3C=CSC3=NC=N2 MCULE-3994728044 [0,1,0,0,0,0|3,0,0]=4 90 B18R3.8788 CC1CCN(CC1)C2=NC=NC3=C2C=NN3 MCULE-3554231265 [0,1,0,0,0,0|3,0,0]=4 91 B18R3.8788 CC1CCN(CC1)C2=NC=NC3=C2NC=N3 MCULE-9055951948 [0,1,0,0,0,0|1,0,2]=4 92 B18R3.8788 CN1CCN(CC1)C2=NC=NC3=C2C=NN3 MCULE-3911932397 [0,1,0,0,0,0|3,0,0]=4 93 B18R3.8788 CN1CCN(CC1)C2=NC=NC3=C2C=NN3 MCULE-5980154466 [0,1,0,0,0,0|3,0,0]=4 94 B18R3.8788 CN1CCN(CC1)C2=NC=NC3=C2NC=N3 MCULE-5386395090 [0,1,0,0,0,0|1,0,2]=4 95 B18R3.8788 NC1CCN(CC1)C2=C3C=CNC3=NC=N2 MCULE-1024662804 [0,1,0,0,0,0|2,0,0]=3 96 B18R3.8788 NC1CCN(CC1)C2=C3N=CN=C3N=CN2 MCULE-9546926951 [0,1,0,0,0,0|1,0,2]=4 97 B18R3.8788 NC1CCN(CC1)C2=C3N=CN=C3N=CN2 MCULE-9688538197 [0,1,0,0,0,0|1,0,2]=4 98 B18R3.8788 NC1CCN(CC1)C2=CC=NC3=C2C=CN3 MCULE-9149700567 [0,1,0,0,0,0|3,0,0]=4 99 B18R3.8788 NC1CCN(CC1)C2=NC=NC3=C2C=CN3 MCULE-9855542710 [0,1,0,0,0,0|2,0,0]=3 100 B18R3.8788 O=C1CCN(CC1)C2=NC=NC3=C2C=CS3 MCULE-4818329717 [0,1,0,0,0,0|3,0,0]=4 101 B18R3.8788 O=C1CCN(CC1)C2=NC=NC3=C2C=NN3 MCULE-4287548398 [0,1,0,0,0,0|3,0,0]=4 102 B18R3.31674 CC1CCCN(C1)C2=NC=NC3=C2C=NN3 MCULE-6826958105 [0,1,0,0,0,0|3,0,0]=4 103 B18R3.51480 CC1=CSC2=C1C(=NC=N2)N3CCCCC3 MCULE-1144230783 [0,1,0,0,0,0|3,0,0]=4 104 B18R3.51480 CC1=NOC2=C1C(=NC=N2)N3CCOCC3 MCULE-8057431191 [0,1,0,0,0,0|3,0,0]=4 105 B18R3.51480 IC1=NNC2=NC=NC(=C12)N3CCCCC3 MCULE-5082555537 [0,1,0,0,0,0|3,0,0]=4 106 B16R2.2602 O=CC1=C(N=CN=C1Cl)N2CCOCC2 MCULE-7621419671 [0,0,1,0,0,0|3,0,0]=4 107 B16R2.11632 CCCCCSC1=NC=NC2=C1N=CN2 MCULE-7578430275 [0,0,1,0,0,0|2,0,0]=3 108 B16R2.11632 OCCCCNC1=NC=NC2=C1N=CN2 MCULE-9885558903 [0,0,1,0,0,0|2,0,0]=3 109 B16R3.5924 C1=CC2=C(C=CO2)C(=N1)N3CCCC3 MCULE-2154423968 [0,0,0,0,1,0|3,0,0]=4 110 B16R3.5924 C1=NC2=C(N=CN2)C(=N1)N3CCCC3 MCULE-3551935649 [0,0,0,0,1,0|0,0,0]=1 111 B16R3.5924 C1=NNC2=NC=NC(=C21)N3CCCC3 MCULE-2553668387 [0,0,0,0,1,0|2,0,0]=3 112 B18R3.2108 C1=CC2=C(C=C1)C(=NC=C2)N3CCOCC3 MCULE-6025130801 [0,0,0,0,0,1|3,0,0]=4 113 B18R3.2108 C1=CC2=C(C=N1)N=CN=C2N3CCSCC3 MCULE-9054675923 [0,0,0,0,0,1|1,1,1]=4 114 B18R3.2108 C1=CC2=NC=NC(=C2C=C1)N3CCCCC3 MCULE-8511224530 [0,0,0,0,0,1|3,0,0]=4 115 B18R3.2108 C1=CC=C2C(=C1)N=CN=C2N3CCCCC3 MCULE-4014206839 [0,0,0,0,0,1|3,0,0]=4 116 B18R3.2108 C1=CC=C2C(=C1)N=CN=C2N3CCNCC3 MCULE-2015837945 [0,0,0,0,0,1|3,0,0]=4 117 B18R3.2108 C1=CC=C2C(=C1)N=CN=C2N3CCNCC3 MCULE-7475759675 [0,0,0,0,0,1|3,0,0]=4 118 B18R3.2108 C1=CC=C2C(=C1)N=CN=C2N3CCNCC3 MCULE-8685082059 [0,0,0,0,0,1|3,0,0]=4 119 B18R3.2108 C1=CC=C2C(=C1)N=CN=C2N3CCOCC3 MCULE-1980158250 [0,0,0,0,0,1|2,0,0]=3 120 B18R3.2108 C1=CC=C2C(=C1)N=CN=C2N3CCSCC3 MCULE-7686760908 [0,0,0,0,0,1|2,1,0]=4 121 B18R3.2108 C1=CN=C2N=CN=C(C2=C1)N3CCNCC3 MCULE-6055684536 [0,0,0,0,0,1|2,0,1]=4 122 B18R3.2108 C1=CN=C2N=CN=C(C2=C1)N3CCNCC3 MCULE-6431098128 [0,0,0,0,0,1|2,0,1]=4 123 B18R3.2115 C1=CC2=C(S1)C(=NC=N2)NN3CCCCC3 MCULE-9552523357 [0,0,0,0,0,1|3,0,0]=4 124 B18R3.2115 C1=NC2=C(N=CN2)C(=N1)NC3CCCCC3 MCULE-9903209339 [0,0,0,0,0,1|2,0,0]=3 125 B18R3.1440748 C1=CC2=C(N=CN=C2S1)N3CCCCCC3 MCULE-3683884383 [0,0,0,0,0,1|3,0,0]=4 126 B18R3.1440748 C1=CC2=NC=NC(=C2S1)N3CCCOCC3 MCULE-1649084745 [0,0,0,0,0,1|2,0,0]=3 127 B18R3.1440748 C1=NC2=C(N=CN2)C(=N1)N3CCCCCC3 MCULE-5118619432 [0,0,0,0,0,1|1,0,0]=2 128 B18R3.1440748 C1=NC2=C(N=CN=C2N1)N3CCCNCC3 MCULE-4709417414 [0,0,0,0,0,1|1,0,0]=2 129 B18R3.1440748 C1=NC2=NC=NC(=C2N1)N3CCCNCC3 MCULE-4896056881 [0,0,0,0,0,1|1,0,2]=4 130 B18R3.1440748 C1=NNC2=C1C(=NC=N2)N3CCCCCC3 MCULE-8574765892 [0,0,0,0,0,1|3,0,0]=4 131 B15R2.17 COC1=NC=NC(=C1)N2CCOCC2 MCULE-6466039931 [1,0,1,0,0,0|1,0,1]=4 132 B15R2.17 NNC1=CC(=NC=N1)N2CCOCC2 MCULE-4197929904 [1,0,1,0,0,0|0,0,1]=3 133 B15R2.17 O=CC1=CC(=NC=C1)N2CCOCC2 MCULE-7858712023 [1,0,1,0,0,0|2,0,0]=4 134 B15R2.32 CC1=NC=NC(=C1C)N2CCOCC2 MCULE-2840619035 [1,0,1,0,0,0|1,0,1]=4 135 B15R2.32 CC1=NC=NC(=C1F)N2CCOCC2 MCULE-2979232704 [1,0,1,0,0,0|1,0,1]=4 136 B15R2.32 ClC1=C(C(=NC=N1)N2CCOCC2)Br MCULE-2980081915 [1,0,1,0,0,0|2,0,0]=4 137 B15R2.32 ClC1=NC=NC(=C1Cl)N2CCOCC2 MCULE-6891587866 [1,0,1,0,0,0|2,0,0]=4 138 B15R2.32 NC1=C(C(=NC=N1)N2CCCCC2)N MCULE-6180248574 [1,0,1,0,0,0|1,0,1]=4 139 B15R2.32 NC1=C(C(=NC=N1)N2CCOCC2)N MCULE-2678858009 [1,0,1,0,0,0|0,0,1]=3 140 B15R2.32 NC1=C(N=CN=C1N2CCOCC2)Cl MCULE-1095802460 [1,0,1,0,0,0|1,0,1]=4 141 B15R2.21 NCC1=C(N=CC=C1)N2CCOCC2 MCULE-9572255223 [1,0,1,0,0,0|1,0,1]=4 142 B15R2.21 NCC1=CC=CN=C1N2CCOCC2 MCULE-3935518717 [1,0,1,0,0,0|1,0,1]=4 143 B15R2.21 O=CC1=CC=CN=C1N2CCOCC2 MCULE-6966379469 [1,0,1,0,0,0|2,0,0]=4 144 B15R2.395 NC1=C(N=CN1)C(=O)N2CCOCC2 MCULE-1313233119 [1,0,1,0,0,0|1,0,1]=4 145 B15R2.4278 CCCCOC1=C2N=CNC2=NC=N1 MCULE-9736863248 [1,0,1,0,0,0|1,0,0]=3 146 B15R2.4278 COCCNC1=NC=NC2=C1N=CN2 MCULE-3156167697 [1,0,1,0,0,0|0,0,0]=2 147 B15R2.4278 ClCCCSC1=NC=NC2=C1N=CN2 MCULE-8472606509 [1,0,1,0,0,0|2,0,0]=4 148 B15R2.4278 OCCCNC1=NC=NC2=C1N=CN2 MCULE-1960301888 [1,0,1,0,0,0|1,0,0]=3 149 B15R2.17340 CN(CCO)C1=C2C=CSC2=NC=N1 MCULE-8002776477 [1,0,1,0,0,0|2,0,0]=4 150 B15R2.15972 CCN(CC)C1=NC=NC2=C1C=CS2 MCULE-2651227542 [1,0,1,0,0,0|2,0,0]=4 151 B15R2.15972 CCN(CC)C1=NC=NC2=C1SC=C2 MCULE-1705601765 [1,0,1,0,0,0|2,0,0]=4 152 B17R2.5291 NC1=C(C(=NC=N1)N2CCOCC2)N(=O)=O MCULE-6803915825 [0,1,1,0,0,0|1,0,1]=4 153 B17R2.10878 CCCCCCNC1=NC=NC2=C1C=CN2 MCULE-7585087979 [0,1,1,0,0,0|2,0,0]=4 154 B17R2.10878 OCCOCCNC1=NC=NC2=C1N=CN2 MCULE-9543258570 [0,1,1,0,0,0|0,0,0]=2 155 B17R2.74946 CCOC(=O)CNC1=C2N=CNC2=NC=N1 MCULE-3714424648 [0,1,1,0,0,0|0,0,1]=3 156 B17R2.74946 CCOC(=O)CSC1=NC=NC2=C1N=CN2 MCULE-4375169758 [0,1,1,0,0,0|1,0,1]=4 157 B17R2.21752 CCN(CCO)C1=C2C=NN(C2=NC=N1)C MCULE-7217881658 [0,1,1,0,0,0|2,0,0]=4 158 B17R2.312270 CCCN(CCC)C1=C2N=CNC2=NC=N1 MCULE-6062568154 [0,1,1,0,0,0|1,0,0]=3 159 B17R3.3 CC1=CSC2=C1N=CN=C2N3CCCC3 MCULE-5237032162 [0,1,0,0,1,0|2,0,0]=4 160 B17R3.3 CN1N=CC2=C(N=CN=C12)N3CCCC3 MCULE-1452201241 [0,1,0,0,1,0|2,0,0]=4 161 B17R3.3 CN1N=NC2=C1N=CN=C2N3CCCC3 MCULE-4549992657 [0,1,0,0,1,0|1,0,0]=3 162 B17R3.104 CC1=NC2=C(C=CS2)C(=N1)N3CCCC3 MCULE-1520646918 [0,1,0,0,1,0|2,0,0]=4 163 B17R3.104 ClC1=NC(=C2SC=CC2=N1)N3CCCC3 MCULE-3314457212 [0,1,0,0,1,0|2,0,0]=4 164 B17R3.104 ClC1=NC2=C(N=CN2)C(=N1)N3CCCC3 MCULE-1173783029 [0,1,0,0,1,0|0,0,0]=2 165 B17R3.104 NC1=NC2=C(NC=N2)C(=N1)N3CCCC3 MCULE-5819404428 [0,1,0,0,1,0|0,0,2]=4 166 B17R3.17527 OC1CCN(C1)C2=NC=NC3=C2C=CS3 MCULE-2463333314 [0,1,0,0,1,0|2,0,0]=4 167 B17R3.17527 OC1CCN(C1)C2=NC=NC3=C2N=CN3 MCULE-8986877242 [0,1,0,0,1,0|0,0,0]=2 168 B17R3.30068 IC1=NNC2=NC=NC(=C12)N3CCCC3 MCULE-8250626169 [0,1,0,0,1,0|2,0,0]=4 169 B19R3.294 CC1=NC(=C2C=CC=CC2=N1)N3CCOCC3 MCULE-6966353168 [0,1,0,0,0,1|2,0,0]=4 170 B19R3.294 CC1=NC2=CC=CC=C2C(=N1)N3CCOCC3 MCULE-7129436246 [0,1,0,0,0,1|2,0,0]=4 171 B19R3.294 ClC1=NC2=C(C=CC=C2)C(=N1)N3CCOCC3 MCULE-6682261378 [0,1,0,0,0,1|2,0,0]=4 172 B19R3.294 ClC1=NC2=C(NC=CN2)C(=N1)N3CCCCC3 MCULE-1630573798 [0,1,0,0,0,1|1,0,1]=4 173 B19R3.421 CC1CCN(CC1)C2=NC=NC3=NC=CN=C23 MCULE-1401747570 [0,1,0,0,0,1|1,0,1]=4 174 B19R3.4066 BrC1=CC2=C(C=C1)N=CN=C2N3CCOCC3 MCULE-4874018173 [0,1,0,0,0,1|2,0,0]=4 175 B19R3.4066 FC1=CC=C2N=CN=C(C2=C1)N3CCOCC3 MCULE-8251316321 [0,1,0,0,0,1|2,0,0]=4 176 B19R3.4066 IC1=CC2=C(C=C1)N=CN=C2N3CCOCC3 MCULE-1172125190 [0,1,0,0,0,1|2,0,0]=4 177 B19R3.4066 O=C1CNC2=NC=NC(=C2N1)N3CCCCC3 MCULE-9067651236 [0,1,0,0,0,1|1,0,1]=4 178 B19R3.4066 O=C1CNC2=NC=NC(=C2N1)N3CCOCC3 MCULE-1634996440 [0,1,0,0,0,1|0,0,1]=3 179 B19R3.4066 O=C1CNC2=NC=NC(=C2N1)N3CCSCC3 MCULE-6409829424 [0,1,0,0,0,1|0,1,1]=4 180 B19R3.9 CN1N=NC2=C1N=CN=C2NN3CCOCC3 MCULE-3394546315 [0,1,0,0,0,1|1,0,0]=3 181 B19R3.284 ClC1=NC(=C2N=CNC2=N1)NC3CCCCC3 MCULE-3604158167 [0,1,0,0,0,1|2,0,0]=4 182 B19R3.1799921 CN(C1=C2N=CNC2=NC=N1)C3CCOCC3 MCULE-9431181745 [0,1,0,0,0,1|1,0,0]=3 183 B19R3.1799921 CN(C1=NC=NC2=C1N=CN2)C3CCCCC3 MCULE-1337881244 [0,1,0,0,0,1|2,0,0]=4 184 B19R3.2337419 OC1COCCN(C1)C2=NC=NC3=C2SC=C3 MCULE-3634184926 [0,1,0,0,0,1|2,0,0]=4 185 B19R3.2342854 CN1CCCN(CC1)C2=NC=NC3=C2N=CN3 MCULE-7983274410 [0,1,0,0,0,1|1,0,0]=3 186 B19R3.2 CCN1C=NC2=C(N=CN=C12)N3CCNCC3 MCULE-2901128432 [0,2,0,0,0,0|1,0,0]=3 187 B19R3.2 CCN1C=NC2=C(N=CN=C12)N3CCOCC3 MCULE-1679987975 [0,2,0,0,0,0|0,0,0]=2 188 B19R3.2 CCN1C=NC2=C1N=CN=C2N3CCCCC3 MCULE-8849406923 [0,2,0,0,0,0|1,0,0]=3 189 B19R3.2 CCN1N=NC2=C1N=CN=C2N3CCNCC3 MCULE-2718822660 [0,2,0,0,0,0|2,0,0]=4 190 B19R3.2 CCN1N=NC2=C1N=CN=C2N3CCNCC3 MCULE-5410441485 [0,2,0,0,0,0|2,0,0]=4 191 B19R3.5829 CC1=CSC2=C(N=C(N=C12)Cl)N3CCOCC3 MCULE-9460345776 [0,2,0,0,0,0|2,0,0]=4 192 B19R3.5829 CN1C=NC2=C(N=C(N=C12)Cl)N3CCOCC3 MCULE-4056610226 [0,2,0,0,0,0|0,0,0]=2 193 B19R3.5829 CN1N=CC2=C(N=C(N=C12)Cl)N3CCOCC3 MCULE-4738067849 [0,2,0,0,0,0|2,0,0]=4 194 B19R3.5829 ClC1=NC(=C2SC=C(C2=N1)Br)N3CCOCC3 MCULE-2859784031 [0,2,0,0,0,0|2,0,0]=4 195 B19R3.239595 CC1CCN(CC1)C2=NC=NC3=C2N=NN3C MCULE-4954334593 [0,2,0,0,0,0|2,0,0]=4 196 B19R3.239595 CN1CCN(CC1)C2=NC=CC3=C2N=CN3C MCULE-2903849229 [0,2,0,0,0,0|2,0,0]=4 197 B19R3.239595 CN1CCN(CC1)C2=NC=CC3=C2N=CN3C MCULE-3647432722 [0,2,0,0,0,0|2,0,0]=4 198 B19R3.239595 CN1CCN(CC1)C2=NC=CC3=C2N=CN3C MCULE-8146090362 [0,2,0,0,0,0|2,0,0]=4 199 B19R3.2145874 C=C1CCCN(C1)C2=NC=NC3=C2N=CN3C MCULE-1395687359 [0,2,0,0,0,0|1,0,1]=4 200 B19R3.2145874 CC1CCCN(C1)C2=NC=NC3=C2N=NN3C MCULE-1255423956 [0,2,0,0,0,0|2,0,0]=4 201 B19R3.328 CC1=CC2=NC(=NC(=C2S1)N3CCOCC3)Cl MCULE-1901382453 [0,2,0,0,0,0|2,0,0]=4 202 B19R3.506 CSC1=NC2=C(C=CS2)C(=N1)N3CCOCC3 MCULE-9885491788 [0,2,0,0,0,0|2,0,0]=4 203 B19R3.506 CSC1=NC2=C(SC=C2)C(=N1)N3CCOCC3 MCULE-3093826715 [0,2,0,0,0,0|2,0,0]=4 204 B19R3.2130831 CN1CCN(CC1)C2=NC(=NC3=C2N=CN3)N MCULE-5913590368 [0,2,0,0,0,0|1,0,0]=3 205 B19R3.2130831 CN1CCN(CC1)C2=NC(=NC3=C2N=CN3)N MCULE-7723905268 [0,2,0,0,0,0|1,0,0]=3 206 B19R3.561 CCC1=CC2=C(S1)N=CN=C2N3CCOCC3 MCULE-2024154542 [0,2,0,0,0,0|2,0,0]=4 207 B19R3.9720 CC1=C(C2=C(S1)N=CN=C2N3CCOCC3)C MCULE-2420443488 [0,2,0,0,0,0|2,0,0]=4 208 B19R3.4561 FCC1CCN(CC1)C2=C3C=CNC3=NC=N2 MCULE-4760461522 [0,2,0,0,0,0|2,0,0]=4 209 B19R3.4561 FCC1CCN(CC1)C2=NC=NC3=C2N=CN3 MCULE-3597066733 [0,2,0,0,0,0|1,0,0]=3 210 B19R3.4561 NCC1CCN(CC1)C2=NC=NC3=C2C=CN3 MCULE-7173900481 [0,2,0,0,0,0|2,0,0]=4 211 B19R3.240555 O[C@H]1CCN(C[C@@H]1O)C2=NC=NC3=C2N=CN3 MCULE-6185144422 [0,2,0,0,0,0|1,0,0]=3 212 B19R3.7158914 FC1(CCN(CC1)C2=NC=NC3=C2N=CN3)F MCULE-4021834954 [0,2,0,0,0,0|1,0,0]=3 213 B19R3.2122942 CC1CC(CN(C1)C2=C3N=CNC3=NC=N2)C MCULE-8226320527 [0,2,0,0,0,0|1,0,0]=3 214 B19R3.2122942 CC1CC(CN(C1)C2=NC=NC3=C2N=CN3)C MCULE-7156625279 [0,2,0,0,0,0|1,0,0]=3 215 B19R3.2122942 CC1CN(CC(O1)C)C2=NC=NC3=C2N=CN3 MCULE-4211986830 [0,2,0,0,0,0|0,0,0]=2 216 B19R3.2122942 CC1CN(CC(O1)C)C2=NC=NC3=C2SC=C3 MCULE-8396602520 [0,2,0,0,0,0|2,0,0]=4 217 B17R3.1910 C1=NC(=C2N=CNC2=N1)NC3CCCC3 MCULE-8618857187 [0,0,1,1,0,0|1,0,0]=3 218 B17R3.1910 C1=NC(=C2N=CNC2=N1)NC3CCNC3 MCULE-4662991396 [0,0,1,1,0,0|1,0,0]=3 219 B19R4.1389723 C1=NC2=C(N=CN2)C(=N1)N3C4CCC3CC4 MCULE-9106309003 [0,0,0,1,0,1|2,0,0]=4 220 B19R4.1389728 C1=CC2=C(N=CN=C2S1)N3CC4CC3CO4 MCULE-6879977223 [0,1,0,1,0,0|2,0,0]=4 221 B19R4.1389728 C1=CC2=NC=NC(=C2S1)N3CC4CC3CO4 MCULE-3572060335 [0,1,0,1,0,0|2,0,0]=4 222 B15R2.66 O=CNC1=NN=C(S1)N2CCOCC2 MCULE-2285931013 [0,0,1,0,1,0|2,0,0]=4 223 B15R3.6952 C1=CC2=C(N=CN=C2N1)N3CCC3 MCULE-7767756273 [0,0,0,0,2,0|1,0,0]=3 224 B15R3.6952 C1=NC2=NC=NC(=C2N1)N3CCC3 MCULE-9125703475 [0,0,0,0,2,0|0,0,2]=4 225 B19R3.19245 C(=CC1CCCCC1)C2=NC=NC3=C2N=CN3 MCULE-2469103107 [0,0,0,0,0,2|2,0,0]=4