0 B18R3.117422 CC(=O)C1=NC=CC2=C1NC3=CC=CC=C23 MCULE-4641136775 [0,0,0,0,0,0|0,0,0]=0 1 B18R3.117422 CN(C)C1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-1409933534 [0,0,0,0,0,0|3,0,0]=3 2 B18R3.117422 CN(C)C1=NC=NC2=C1OC3=CC=CC=C23 MCULE-7791221235 [0,0,0,0,0,0|4,0,0]=4 3 B18R3.117422 C[NH+](C)C1=NC=NC2=C1OC3=CC=CC=C23 MCULE-2336893736 [0,0,0,0,0,0|4,0,0]=4 4 B18R3.117422 O=C(O)C1=C2NC3=C(C2=CC=N1)C=CC=C3 MCULE-5392927650 [0,0,0,0,0,0|1,0,0]=1 5 B18R3.117422 O=C(O)C1=C2SC3=C(C2=CC=C1)C=CC=C3 MCULE-9745645065 [0,0,0,0,0,0|3,0,0]=3 6 B18R3.117422 O=C(O)C1=CC=CC2=C1CC3=C2C=CC=C3 MCULE-6717176496 [0,0,0,0,0,0|3,0,0]=3 7 B18R3.117422 O=C(O)C1=CC=CC2=C1OC3=CC=CC=C23 MCULE-1831227947 [0,0,0,0,0,0|3,0,0]=3 8 B18R3.117422 O=N(=O)C1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-6355596343 [0,0,0,0,0,0|3,0,0]=3 9 B18R3.117422 OB(O)C1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-1861972330 [0,0,0,0,0,0|3,0,1]=4 10 B17R3.633 CCC1=CC=CC2=C1SC3=C2C=CC=C3 MCULE-4907047884 [1,0,0,0,0,0|2,0,1]=4 11 B17R3.633 CCC1=NC=CC2=C1NC3=C2C=CC=C3 MCULE-1498694893 [1,0,0,0,0,0|0,0,1]=2 12 B17R3.633 CNC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-2077341808 [1,0,0,0,0,0|2,0,0]=3 13 B17R3.633 CNC1=NC=NC2=C1OC3=CC=CC=C23 MCULE-6875919003 [1,0,0,0,0,0|3,0,0]=4 14 B17R3.633 COC1=C2OC3=C(C2=NC=N1)C=CC=C3 MCULE-9743927800 [1,0,0,0,0,0|3,0,0]=4 15 B17R3.633 COC1=C2SC3=CC=CC=C3C2=CC=C1 MCULE-1131226257 [1,0,0,0,0,0|3,0,0]=4 16 B17R3.633 COC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-8515416423 [1,0,0,0,0,0|2,0,0]=3 17 B17R3.633 CSC1=NC=NC2=C1OC3=CC=CC=C23 MCULE-2080846358 [1,0,0,0,0,0|3,0,0]=4 18 B17R3.633 C[NH2+]C1=NC=NC2=C1OC3=CC=CC=C23 MCULE-2364086289 [1,0,0,0,0,0|3,0,0]=4 19 B17R3.633 NNC1=NC=NC2=C1NC3=CC=CC=C23 MCULE-9398972951 [1,0,0,0,0,0|3,0,0]=4 20 B17R3.633 O=CC1=C2OC3=C(C2=CC=C1)C=CC=C3 MCULE-4633949671 [1,0,0,0,0,0|2,0,0]=3 21 B17R3.633 O=CC1=C2SC3=C(C2=CC=C1)C=CC=C3 MCULE-5168464923 [1,0,0,0,0,0|2,0,0]=3 22 B17R3.633 O=CC1=NC=CC2=C1NC3=C2C=CC=C3 MCULE-4537422152 [1,0,0,0,0,0|0,0,0]=1 23 B17R3.633 OCC1=NC=CC2=C1NC3=CC=CC=C23 MCULE-5002670980 [1,0,0,0,0,0|0,0,2]=3 24 B19R3.87197 CC(=O)C1=NC=CC2=C1NC3=CC(=CC=C23)O MCULE-9171534139 [0,1,0,0,0,0|0,0,0]=1 25 B19R3.90030 NC1=C(C2=C(C=C1)C3=C(O2)C=CC=C3)C(=O)O MCULE-3589489916 [0,1,0,0,0,0|3,0,0]=4 26 B19R3.90030 O=C(O)C1=C(C=CC2=C1NC3=CC=CC=C23)O MCULE-4662748309 [0,1,0,0,0,0|2,0,0]=3 27 B19R3.166928 NC(=O)C1=CN=C(C2=C1NC3=C2C=CC=C3)Cl MCULE-5116626860 [0,1,0,0,0,0|3,0,0]=4 28 B19R3.246468 COC(=O)C1=C2SC3=CC=CC=C3C2=CC=C1 MCULE-2862650893 [0,1,0,0,0,0|2,0,0]=3 29 B19R3.246468 COC(=O)C1=CC=CC2=C1CC3=C2C=CC=C3 MCULE-3392685547 [0,1,0,0,0,0|2,0,0]=3 30 B19R3.246468 COC(=O)C1=CC=CC2=C1OC3=C2C=CC=C3 MCULE-8549992061 [0,1,0,0,0,0|2,0,0]=3 31 B19R3.246468 COC(=O)C1=NC=CC2=C1NC3=CC=CC=C23 MCULE-3228348243 [0,1,0,0,0,0|0,0,0]=1 32 B19R3.2544422 CN1C2=C(C=CC=C2)C3=C1C(=CC=C3)N(=O)=O MCULE-4789571394 [0,1,0,0,0,0|3,0,0]=4 33 B19R3.2544422 O=C(O)C1=CC=CC2=C1C(=O)C3=CC=CC=C23 MCULE-1687901001 [0,1,0,0,0,0|3,0,0]=4 34 B19R3.7790954 CC1=CC2=C(C=C1)NC3=C2N=CN=C3N(C)C MCULE-4682792935 [0,1,0,0,0,0|3,0,0]=4 35 B19R3.7790954 CN(C)C1=NC=NC2=C1NC3=C2C=C(C=C3)F MCULE-9723825732 [0,1,0,0,0,0|3,0,0]=4 36 B17R2.3948 CC(=O)C1=CC(=CC=C1)C2=C(C=CC=C2)F MCULE-9557106765 [0,0,1,0,0,0|2,0,0]=3 37 B17R2.3948 CC(=O)C1=CC(=CC=C1)C2=C(C=NC=C2)N MCULE-2707450641 [0,0,1,0,0,0|2,0,0]=3 38 B17R2.3948 CC(=O)C1=CC=CC(=C1)C2=C(C=CC=C2)Cl MCULE-9020779175 [0,0,1,0,0,0|2,0,0]=3 39 B17R2.3948 CC(=O)C1=CC=CC(=C1)C2=C(C=CC=C2)N MCULE-5400133295 [0,0,1,0,0,0|1,0,0]=2 40 B17R2.3948 CC(=O)C1=CC=CC(=C1)C2=C(C=CC=C2)N MCULE-9900849373 [0,0,1,0,0,0|1,0,0]=2 41 B17R2.3948 CC(=O)C1=CC=CC(=C1)C2=C(C=NC=C2)C MCULE-5356145611 [0,0,1,0,0,0|3,0,0]=4 42 B17R2.3948 CC(=O)C1=CC=CC(=C1)C2=NC=CC=C2F MCULE-6114599581 [0,0,1,0,0,0|3,0,0]=4 43 B17R2.3948 CC1=C(C=CC=C1)C2=CC(=NC=C2)C(=O)O MCULE-2611411725 [0,0,1,0,0,0|2,0,0]=3 44 B17R2.3948 CC1=C(C=CC=C1)C2=CC=CC(=C2)C(=O)O MCULE-5364112791 [0,0,1,0,0,0|3,0,0]=4 45 B17R2.3948 NC1=C(C=CC=C1)C2=CC=CC(=C2)C(=O)O MCULE-2534594458 [0,0,1,0,0,0|2,0,0]=3 46 B17R2.3948 NC1=C(C=CC=C1)C2=CC=CC(=C2)C(=O)O MCULE-6310839383 [0,0,1,0,0,0|2,0,0]=3 47 B17R2.3948 NC1=CC=CC=C1C2=CC=CC(=C2)N(=O)=O MCULE-3616237143 [0,0,1,0,0,0|3,0,0]=4 48 B17R2.3948 NC1=CC=CC=C1C2=CC=CC(=N2)C(=O)O MCULE-4468046975 [0,0,1,0,0,0|3,0,0]=4 49 B17R2.3948 NC1=CC=CN=C1C2=CC(=CC=C2)C(=O)O MCULE-4114654699 [0,0,1,0,0,0|3,0,0]=4 50 B17R2.3948 O=C(O)C1=CC(=CC=C1)C2=CC=CC=C2Cl MCULE-7631928673 [0,0,1,0,0,0|3,0,0]=4 51 B17R2.3948 O=C(O)C1=CC(=CC=C1)C2=CC=CC=C2F MCULE-1226993518 [0,0,1,0,0,0|3,0,0]=4 52 B17R2.3948 O=C(O)C1=CC(=CC=C1)C2=CC=CC=C2I MCULE-4694338439 [0,0,1,0,0,0|3,0,0]=4 53 B17R2.3948 O=C(O)C1=CC(=CC=C1)C2=CC=CC=C2O MCULE-9138172615 [0,0,1,0,0,0|3,0,0]=4 54 B17R2.3948 O=C(O)C1=CC=CC(=C1)C2=CC=CC=C2Br MCULE-8232272573 [0,0,1,0,0,0|3,0,0]=4 55 B17R2.3948 O=C(O)C1=NC=CC(=C1)C2=C(C=CC=C2)F MCULE-3422995447 [0,0,1,0,0,0|2,0,0]=3 56 B17R2.3948 O=C(O)C1=NC=NC(=C1)C2=CC=CC=C2Cl MCULE-2805680291 [0,0,1,0,0,0|3,0,0]=4 57 B17R2.5618 CC(=O)C1=C(C=CC=C1)OC2=CC=CC=C2 MCULE-2291214473 [0,0,1,0,0,0|2,0,0]=3 58 B17R2.5618 NC(=O)C1=C(C=CC=C1)NC2=CC=CC=C2 MCULE-6691808486 [0,0,1,0,0,0|2,0,0]=3 59 B17R2.5618 NC(=O)C1=CC=CC=C1OC2=CC=CC=C2 MCULE-1503641736 [0,0,1,0,0,0|3,0,0]=4 60 B17R2.5618 O=C(Cl)C1=C(C=CC=C1)OC2=CC=CC=C2 MCULE-2535428516 [0,0,1,0,0,0|3,0,0]=4 61 B17R2.5618 O=C(O)C1=C(C=CC=C1)CC2=CC=CC=C2 MCULE-8867091691 [0,0,1,0,0,0|3,0,0]=4 62 B17R2.5618 O=C(O)C1=C(C=CC=C1)NC2=CC=CC=C2 MCULE-6051331548 [0,0,1,0,0,0|2,0,0]=3 63 B17R2.5618 O=C(O)C1=C(C=CC=C1)NC2=CC=CC=N2 MCULE-6844528879 [0,0,1,0,0,0|3,0,0]=4 64 B17R2.5618 O=C(O)C1=C(C=CC=C1)OC2=CC=CC=C2 MCULE-6989463799 [0,0,1,0,0,0|3,0,0]=4 65 B17R2.5618 O=C(O)C1=C(C=CC=C1)SC2=CC=CC=C2 MCULE-6634431383 [0,0,1,0,0,0|3,0,0]=4 66 B17R2.5618 O=C(O)C1=C(C=CC=N1)OC2=CC=CC=C2 MCULE-9703796911 [0,0,1,0,0,0|2,0,0]=3 67 B17R2.5618 O=C(O)C1=C(C=CN=C1)NC2=CC=CC=C2 MCULE-2981941884 [0,0,1,0,0,0|3,0,0]=4 68 B17R2.5618 O=C(O)C1=C(C=CN=C1)NC2=CC=CC=C2 MCULE-8131065073 [0,0,1,0,0,0|3,0,0]=4 69 B17R2.5618 O=C(O)C1=C(N=CC=N1)SC2=CC=CC=C2 MCULE-1221372295 [0,0,1,0,0,0|3,0,0]=4 70 B17R2.5618 O=C(O)C1=CC=CC=C1NC2=CC=NC=C2 MCULE-1785150659 [0,0,1,0,0,0|3,0,0]=4 71 B17R2.5618 O=C(O)C1=CC=CC=C1NC2=CC=NC=C2 MCULE-5772022110 [0,0,1,0,0,0|3,0,0]=4 72 B17R2.5618 O=C(O)C1=CC=CN=C1NC2=CC=CC=C2 MCULE-4703790132 [0,0,1,0,0,0|3,0,0]=4 73 B17R2.5618 O=C(O)C1=NC=CN=C1OC2=CC=CC=C2 MCULE-4285536285 [0,0,1,0,0,0|3,0,0]=4 74 B17R2.5618 O=C([O-])C1=C(C=CC=C1)[I+]C2=CC=CC=C2 MCULE-1309727934 [0,0,1,0,0,0|3,0,0]=4 75 B17R2.5618 O=N(=O)C1=CC=CC=C1NC2=CC=CC=C2 MCULE-7437671615 [0,0,1,0,0,0|3,0,0]=4 76 B17R2.24238 CC(=O)C1=C(C(=CC=C1)C2=CC=CC=C2)O MCULE-7433063691 [0,0,1,0,0,0|2,0,0]=3 77 B17R2.24238 CC1=C(C=CC=C1C(=O)O)C2=CC=CC=C2 MCULE-4033069080 [0,0,1,0,0,0|3,0,0]=4 78 B17R2.24238 NC1=C(C=CC=C1C2=CC=CC=C2)C(=O)O MCULE-7641901683 [0,0,1,0,0,0|2,0,0]=3 79 B17R2.24238 NC1=C(N=CC=C1C(=O)O)C2=CC=CC=C2 MCULE-7144674406 [0,0,1,0,0,0|3,0,0]=4 80 B17R2.24238 O=C(O)C1=C(C(=CC=C1)C2=CC=CC=C2)Br MCULE-6024211110 [0,0,1,0,0,0|3,0,0]=4 81 B17R2.24238 O=C(O)C1=C(C(=CC=C1)C2=CC=CC=C2)F MCULE-6667618366 [0,0,1,0,0,0|3,0,0]=4 82 B17R2.24238 O=C(O)C1=CC=CC(=C1O)C2=CC=CC=C2 MCULE-6321189821 [0,0,1,0,0,0|3,0,0]=4 83 B17R3.66024 O=C(O)C1=C2NC3=CC=CC=C3C2=CN1 MCULE-7872695752 [0,0,0,0,1,0|1,0,1]=3 84 B17R3.66024 O=C(O)C1=NNC2=C1CC3=C2C=CC=C3 MCULE-5200653196 [0,0,0,0,1,0|3,0,0]=4 85 B19R3.197545 CC(=O)NC1=CC=CC2=C1CC3=C2C=CC=C3 MCULE-1949208047 [0,0,0,0,0,1|2,0,0]=3 86 B19R3.197545 CC(=O)NC1=CC=CC2=C1OC3=C2C=CC=C3 MCULE-3561206369 [0,0,0,0,0,1|2,0,0]=3 87 B19R3.197545 CC(C)OC1=NC=NC2=C1NC3=CC=CC=C23 MCULE-3219967053 [0,0,0,0,0,1|2,0,1]=4 88 B19R3.197545 O=C(O)CC1=C2NC3=C(C2=CC=C1)C=CC=C3 MCULE-1125696468 [0,0,0,0,0,1|2,0,0]=3 89 B19R3.655141 CC(=O)C1=CC=CC2=CC3=C(C=CC=C3)C=C12 MCULE-4250610330 [0,0,0,0,0,1|2,0,0]=3 90 B19R3.655141 CC(=O)C1=CC=CC2=NC3=CC=CC=C3N=C12 MCULE-4876437097 [0,0,0,0,0,1|1,0,1]=3 91 B19R3.655141 CC(=O)C1=CC=CC2=NC3=CC=CC=C3N=C12 MCULE-5742966503 [0,0,0,0,0,1|1,0,1]=3 92 B19R3.655141 NC(=O)C1=CC=CC2=CC3=C(C=CC=C3)C=C12 MCULE-3437098628 [0,0,0,0,0,1|3,0,0]=4 93 B19R3.655141 NC(=O)C1=CC=CC2=NC3=C(C=CC=C3)N=C12 MCULE-2034820246 [0,0,0,0,0,1|2,0,1]=4 94 B19R3.655141 O=C(O)C1=C2N=C3C=CC=CC3=NC2=CC=C1 MCULE-9785758903 [0,0,0,0,0,1|2,0,1]=4 95 B19R3.655141 O=C(O)C1=C2OC3=C(C=CC=C3)NC2=CC=C1 MCULE-5380574034 [0,0,0,0,0,1|3,0,0]=4 96 B19R3.655141 O=C(O)C1=CC=CC2=CC3=CC=CC=C3C=C12 MCULE-4666617161 [0,0,0,0,0,1|3,0,0]=4 97 B19R3.655141 O=C(O)C1=CC=CC2=CC3=CC=CC=C3N=C12 MCULE-8958537892 [0,0,0,0,0,1|2,0,1]=4 98 B16R2.86 CC(=O)C1=CC(=CC=C1)C2=CC=CC=C2 MCULE-9383738141 [1,0,1,0,0,0|1,0,0]=3 99 B16R2.86 CC(=O)C1=CC(=CC=C1)C2=CC=NC=C2 MCULE-8167745158 [1,0,1,0,0,0|2,0,0]=4 100 B16R2.86 CC(=O)C1=CC(=CC=C1)C2=NC=CC=C2 MCULE-9733159928 [1,0,1,0,0,0|2,0,0]=4 101 B16R2.86 CC(=O)C1=NC(=CC=C1)C2=CC=CC=C2 MCULE-9254487866 [1,0,1,0,0,0|2,0,0]=4 102 B16R2.86 O=C(Cl)C1=CC(=CC=C1)C2=CC=CC=C2 MCULE-6438635927 [1,0,1,0,0,0|2,0,0]=4 103 B16R2.86 O=C(O)C1=CC(=CC=N1)C2=CC=NC=C2 MCULE-7479669619 [1,0,1,0,0,0|2,0,0]=4 104 B16R2.86 O=C(O)C1=CC=CC(=C1)C2=CC=CC=C2 MCULE-6359889829 [1,0,1,0,0,0|2,0,0]=4 105 B16R2.86 O=C(O)C1=NC=CC(=C1)C2=CC=CC=C2 MCULE-1072690086 [1,0,1,0,0,0|1,0,0]=3 106 B16R2.86 O=C(O)C1=NC=CC(=N1)C2=CC=CC=C2 MCULE-1514618290 [1,0,1,0,0,0|2,0,0]=4 107 B16R2.86 O=C(O)C1=NC=NC(=C1)C2=CC=CC=C2 MCULE-1839950450 [1,0,1,0,0,0|2,0,0]=4 108 B16R2.2415 CC1=CC=CC=C1C2=CC=CC(=C2)C=O MCULE-7744745436 [1,0,1,0,0,0|2,0,0]=4 109 B16R2.2415 COC1=CC=CC(=C1)C2=C(C=CC=C2)N MCULE-4597423217 [1,0,1,0,0,0|2,0,0]=4 110 B16R2.2415 COC1=CC=CC(=C1)C2=C(C=CC=C2)N MCULE-9528295711 [1,0,1,0,0,0|2,0,0]=4 111 B16R2.2415 NC1=C(C=CN=C1)C2=CC(=CC=C2)C=O MCULE-1567783729 [1,0,1,0,0,0|2,0,0]=4 112 B16R2.2415 O=CC1=CC(=CC=C1)C2=C(C=CC=C2)Br MCULE-8938653349 [1,0,1,0,0,0|2,0,0]=4 113 B16R2.2415 O=CC1=CC(=CC=C1)C2=C(C=CC=C2)F MCULE-2588328697 [1,0,1,0,0,0|2,0,0]=4 114 B16R2.2415 O=CC1=CC(=CC=C1)C2=CC=CC=C2Cl MCULE-4636577825 [1,0,1,0,0,0|2,0,0]=4 115 B16R2.172 O=CC1=C(C=CC=C1)NC2=CC=CC=C2 MCULE-4467467444 [1,0,1,0,0,0|1,0,0]=3 116 B16R2.172 O=CC1=C(C=CC=C1)SC2=CC=CC=C2 MCULE-5862840973 [1,0,1,0,0,0|2,0,0]=4 117 B16R2.172 O=CC1=CC=CC=C1CC2=CC=CC=C2 MCULE-4069270088 [1,0,1,0,0,0|2,0,0]=4 118 B16R2.172 O=CC1=CC=CC=C1OC2=CC=CC=C2 MCULE-3683008412 [1,0,1,0,0,0|2,0,0]=4 119 B16R2.24 CC1=C(C=CC=C1C2=CC=CC=C2)C=O MCULE-3403894739 [1,0,1,0,0,0|2,0,0]=4 120 B16R2.24 COC1=C(C(=CC=C1)C2=CC=CC=C2)N MCULE-7790887171 [1,0,1,0,0,0|2,0,0]=4 121 B16R2.24 O=CC1=C(C(=CC=C1)C2=CC=CC=C2)O MCULE-1593433695 [1,0,1,0,0,0|2,0,0]=4 122 B16R2.24 O=CC1=CC=CC(=C1F)C2=CC=CC=C2 MCULE-6794329655 [1,0,1,0,0,0|2,0,0]=4 123 B16R3.3329 BrC1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-4840876718 [2,0,0,0,0,0|2,0,0]=4 124 B16R3.3329 BrC1=NC=CC2=C1NC3=C2C=CC=C3 MCULE-3912879453 [2,0,0,0,0,0|1,0,0]=3 125 B16R3.3329 CC1=C2CC3=C(C2=CC=C1)C=CC=C3 MCULE-6678178996 [2,0,0,0,0,0|2,0,0]=4 126 B16R3.3329 CC1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-8739693160 [2,0,0,0,0,0|1,0,0]=3 127 B16R3.3329 CC1=CC=CC2=C1SC3=C2C=CC=C3 MCULE-7862063218 [2,0,0,0,0,0|2,0,0]=4 128 B16R3.3329 CC1=NC=CC2=C1NC3=C2C=CC=C3 MCULE-5624408480 [2,0,0,0,0,0|0,0,0]=2 129 B16R3.3329 CC1=NC=CC2=C1NC3=CC=CC=C23 MCULE-7967173312 [2,0,0,0,0,0|0,0,0]=2 130 B16R3.3329 CC1=NCCC2=C1NC3=C2C=CC=C3 MCULE-2765797747 [2,0,0,0,0,0|0,0,2]=4 131 B16R3.3329 C[N+]1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-4462885668 [2,0,0,0,0,0|2,0,0]=4 132 B16R3.3329 ClC1=CC=CC2=C1NC3=C2C=CC=C3 MCULE-9311683530 [2,0,0,0,0,0|2,0,0]=4 133 B16R3.3329 ClC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-5077619424 [2,0,0,0,0,0|2,0,0]=4 134 B16R3.3329 ClC1=NC=[NH+]C2=C1NC3=C2C=CC=C3 MCULE-3601819292 [2,0,0,0,0,0|2,0,0]=4 135 B16R3.3329 ClC1=NN=CC2=C1NC3=C2C=CC=C3 MCULE-2029786487 [2,0,0,0,0,0|2,0,0]=4 136 B16R3.3329 FC1=C2NC3=C(C2=CC=C1)C=CC=C3 MCULE-9316723264 [2,0,0,0,0,0|2,0,0]=4 137 B16R3.3329 NC1=CC=CC2=C1NC3=CC=CC=C23 MCULE-9073642155 [2,0,0,0,0,0|2,0,0]=4 138 B16R3.3329 O=C1NC=CC2=C1NC3=C2C=CC=C3 MCULE-7536068251 [2,0,0,0,0,0|0,0,1]=3 139 B16R3.3329 O=C1NC=NC2=C1NC3=C2C=CC=C3 MCULE-5202535583 [2,0,0,0,0,0|1,0,1]=4 140 B16R3.3329 O=C1NN=CC2=C1NC3=CC=CC=C23 MCULE-3054406305 [2,0,0,0,0,0|1,0,1]=4 141 B16R3.3329 OC1=CC=CC2=C1NC3=CC=CC=C23 MCULE-2067221726 [2,0,0,0,0,0|1,0,1]=4 142 B16R3.3329 SC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-5839417305 [2,0,0,0,0,0|1,1,0]=4 143 B18R2.178 CC(=CC(=O)O)C=CC1=CNC2=C1C=CC=C2 MCULE-6191879016 [0,1,1,0,0,0|2,0,0]=4 144 B18R2.178 CC(=CC(=O)[O-])C=CC1=CNC2=C1C=CC=C2 MCULE-2844463081 [0,1,1,0,0,0|2,0,0]=4 145 B18R2.9446 CNC(=O)C1=CC(=CC=C1)C2=CC=CC=C2O MCULE-2209863655 [0,1,1,0,0,0|2,0,0]=4 146 B18R2.9446 COC(=O)C1=CC(=CC=C1)C2=C(C=CC=C2)C MCULE-2341939152 [0,1,1,0,0,0|2,0,0]=4 147 B18R2.9446 COC(=O)C1=CC(=CC=C1)C2=CC=CC=C2N MCULE-2120678844 [0,1,1,0,0,0|1,0,0]=3 148 B18R2.9446 COC(=O)C1=CC(=CC=C1)C2=CC=CC=C2O MCULE-7227969271 [0,1,1,0,0,0|2,0,0]=4 149 B18R2.12470 CC(=O)C1=CC(=CC=C1)C2=CC=CC=C2C=O MCULE-4576698545 [0,1,1,0,0,0|2,0,0]=4 150 B18R2.12470 COC1=C(C=CC=C1)C2=CC(=NC=C2)C(=O)O MCULE-8064852612 [0,1,1,0,0,0|2,0,0]=4 151 B18R2.66875 CC1=CC=C(C(=C1)C)C2=CC=NC(=C2)C(=O)O MCULE-3900783018 [0,1,1,0,0,0|2,0,0]=4 152 B18R2.66875 O=C(O)C1=NC=CC(=C1)C2=CC=C(C=C2F)F MCULE-9442269026 [0,1,1,0,0,0|2,0,0]=4 153 B18R2.332894 CC1=CC(=CC(=C1)C(=O)O)C2=CC=CC=C2N MCULE-3053388660 [0,1,1,0,0,0|2,0,0]=4 154 B18R2.3764 CC(=O)C1=C(C=CC=C1)SC2=CC=C(C=C2)Cl MCULE-9642406637 [0,1,1,0,0,0|2,0,0]=4 155 B18R2.3764 CC1=CC=C(C=C1)NC2=C(C=CC=C2)C(=O)O MCULE-5345270847 [0,1,1,0,0,0|2,0,0]=4 156 B18R2.3764 NC(=O)C1=C(C=CC=C1)NC2=CC=C(C=C2)Cl MCULE-6884817479 [0,1,1,0,0,0|2,0,0]=4 157 B18R2.3764 O=C(O)C1=C(C=CC=C1)NC2=CC=C(C=C2)Br MCULE-4637584509 [0,1,1,0,0,0|2,0,0]=4 158 B18R2.3764 O=C(O)C1=CC=CC=C1NC2=CC=C(C=C2)Cl MCULE-8039000523 [0,1,1,0,0,0|2,0,0]=4 159 B18R2.3764 O=C(O)C1=CC=CC=C1NC2=CC=C(C=C2)F MCULE-2923341862 [0,1,1,0,0,0|2,0,0]=4 160 B18R2.3919 CC(=O)C1=CC=CC=C1OC2=CC=CC(=C2)Cl MCULE-5895506999 [0,1,1,0,0,0|2,0,0]=4 161 B18R2.3919 CC1=CC(=CC=C1)NC2=CC=CC=C2C(=O)O MCULE-7926168441 [0,1,1,0,0,0|2,0,0]=4 162 B18R2.3919 NC(=O)C1=C(C=CC=C1)NC2=CC=CC(=C2)Cl MCULE-5164256306 [0,1,1,0,0,0|2,0,0]=4 163 B18R2.3919 O=C(O)C1=C(C=CC=C1)NC2=CC=CC(=C2)Cl MCULE-6419335832 [0,1,1,0,0,0|2,0,0]=4 164 B18R2.3919 O=C(O)C1=CC=CC=C1NC2=CC=CC(=C2)Br MCULE-2203967830 [0,1,1,0,0,0|2,0,0]=4 165 B18R2.3919 O=C(O)C1=CC=CC=C1NC2=CC=CC(=C2)F MCULE-8175510001 [0,1,1,0,0,0|2,0,0]=4 166 B18R2.4064 O=C(O)C1=CC=C(C=C1NC2=CC=CC=C2)Cl MCULE-4711596028 [0,1,1,0,0,0|2,0,0]=4 167 B18R2.4064 O=N(=O)C1=NC=C(C=C1NC2=CC=CC=C2)Br MCULE-1349143040 [0,1,1,0,0,0|2,0,0]=4 168 B18R2.4750 CC1=CC=CC=C1NC2=CC=CC=C2C(=O)O MCULE-8163650743 [0,1,1,0,0,0|2,0,0]=4 169 B18R2.4750 NC(=O)C1=C(C=CC=C1)NC2=CC=CC=C2Cl MCULE-9904205624 [0,1,1,0,0,0|2,0,0]=4 170 B18R2.4750 O=C(O)C1=C(C=CC=C1)NC2=CC=CC=C2Cl MCULE-1261582840 [0,1,1,0,0,0|2,0,0]=4 171 B18R2.4750 O=C(O)C1=C(C=CC=C1)NC2=CC=CC=C2F MCULE-5795908573 [0,1,1,0,0,0|2,0,0]=4 172 B18R2.6545 CC(=O)C1=C(C=CC(=C1)Cl)SC2=CC=CC=C2 MCULE-1298544787 [0,1,1,0,0,0|2,0,0]=4 173 B18R2.6545 CC(=O)C1=CC(=CC=C1OC2=CC=CC=C2)Cl MCULE-9379666767 [0,1,1,0,0,0|2,0,0]=4 174 B18R2.7139 CC(=O)C1=CC=CC=C1C(=O)C2=CC=CC=C2 MCULE-1405687892 [0,1,1,0,0,0|2,0,0]=4 175 B18R2.7139 CN(C1=CC=CC=C1)C2=C(C=CC=C2)C(=O)O MCULE-5566550346 [0,1,1,0,0,0|2,0,0]=4 176 B18R2.7139 O=C(O)C1=C(C=CC=N1)C(=O)C2=CC=CC=C2 MCULE-5696195427 [0,1,1,0,0,0|2,0,0]=4 177 B18R2.7139 O=C(O)C1=C(C=CC=N1)C(=O)C2=CC=CC=C2 MCULE-6988912237 [0,1,1,0,0,0|2,0,0]=4 178 B18R2.9309 CNC(=O)C1=C(C=CC=C1)CC2=CC=CC=C2 MCULE-1794149728 [0,1,1,0,0,0|2,0,0]=4 179 B18R2.9309 CNC(=O)C1=C(C=CC=C1)NC2=CC=CC=C2 MCULE-3736029576 [0,1,1,0,0,0|1,0,0]=3 180 B18R2.9309 CNC(=O)C1=CC=CC=C1SC2=CC=CC=C2 MCULE-6589266373 [0,1,1,0,0,0|2,0,0]=4 181 B18R2.9309 COC(=O)C1=CC=CC=C1NC2=CC=CC=C2 MCULE-7832051702 [0,1,1,0,0,0|1,0,0]=3 182 B18R2.9309 COC(=O)C1=CC=CC=C1OC2=CC=CC=C2 MCULE-5505576142 [0,1,1,0,0,0|2,0,0]=4 183 B18R2.9309 COC(=O)C1=CC=CC=C1[Br+]C2=CC=CC=C2 MCULE-4268915712 [0,1,1,0,0,0|2,0,0]=4 184 B18R2.9309 COC(=O)C1=CC=CC=C1[Br+]C2=CC=CC=C2 MCULE-7568527368 [0,1,1,0,0,0|2,0,0]=4 185 B18R2.9309 O=C(CBr)C1=CC=CC=C1OC2=CC=CC=C2 MCULE-2920414492 [0,1,1,0,0,0|2,0,0]=4 186 B18R2.38897 NC1=CC=CC(=C1NC2=CC=CC=C2)C(=O)O MCULE-8724355647 [0,1,1,0,0,0|2,0,0]=4 187 B18R2.291 CCC(=O)C1=C(C(=CC=C1)C2=CC=CC=C2)C MCULE-9975200233 [0,1,1,0,0,0|2,0,0]=4 188 B18R2.3318 N#CC1=C(N=CC=C1C2=CC=CC=C2)C(=O)O MCULE-6536151498 [0,1,1,0,0,0|1,0,1]=4 189 B18R2.66985 CC(=O)C1=C(C=CC(=C1F)C2=CC=CC=C2)F MCULE-7966325466 [0,1,1,0,0,0|2,0,0]=4 190 B18R3.5244 CCOC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-2418319652 [1,1,0,0,0,0|1,0,1]=4 191 B18R3.152976 CNC1=NC=NC2=C1NC3=C2C=C(C=C3)C MCULE-5909368681 [1,1,0,0,0,0|2,0,0]=4 192 B18R3.152976 COC1=NC=NC2=C1NC3=C2C=C(C=C3)C MCULE-1217564025 [1,1,0,0,0,0|2,0,0]=4 193 B18R3.152976 COC1=NC=NC2=C1NC3=C2C=C(C=C3)F MCULE-8470008428 [1,1,0,0,0,0|2,0,0]=4 194 B18R3.152976 COC1=NC=NC2=C1NC3=CC=C(C=C23)Cl MCULE-7603067217 [1,1,0,0,0,0|2,0,0]=4 195 B18R3.152990 CCC1=C2NC3=C(C2=CC=C1)C=CC(=C3)N MCULE-6876830399 [1,1,0,0,0,0|1,0,1]=4 196 B18R3.164906 CCC1=NC(=CC2=C1NC3=C2C=CC=C3)C MCULE-1968816277 [1,1,0,0,0,0|0,0,1]=3 197 B18R3.164906 CCC1=NC(=CC2=C1SC3=C2C=CC=C3)C MCULE-4394382018 [1,1,0,0,0,0|1,0,1]=4 198 B18R3.164906 CCC1=NC(=CC2=C1SC3=C2C=CC=C3)C MCULE-7743295566 [1,1,0,0,0,0|1,0,1]=4 199 B18R3.164906 COC1=CC(=CC2=C1NC3=C2C=CC=C3)C MCULE-6197991135 [1,1,0,0,0,0|2,0,0]=4 200 B18R3.140294 COC(=O)C1=NNC2=C1CC3=C2C=CC=C3 MCULE-7634133520 [0,1,0,0,1,0|2,0,0]=4 201 B20R3.247921 O=C(O)CC1=C2NC3=C(C2=CC=C1)C=CC=C3Cl MCULE-1387025096 [0,1,0,0,0,1|2,0,0]=4 202 B20R3.3479688 O=C(O)C1=CC=CC2=C1NC3=C(C2=O)C=CC=C3 MCULE-8913775666 [0,1,0,0,0,1|2,0,0]=4 203 B20R3.5938251 COC(=O)C1=CC=CC2=CC3=CC=CC=C3N=C12 MCULE-1743244997 [0,1,0,0,0,1|1,0,1]=4 204 B20R3.5938251 COC(=O)C1=CC=CC2=NC3=CC=CC=C3N=C12 MCULE-7716944230 [0,1,0,0,0,1|1,0,1]=4 205 B20R3.521069 COC1=CC2=C(C=C1)C3=C(N2)C(=NC=C3)C(=O)O MCULE-3165759133 [0,2,0,0,0,0|1,0,0]=3 206 B20R3.5958898 COC(=O)C1=N(=O)C=CC2=C1NC3=CC=CC=C23 MCULE-1330645363 [0,2,0,0,0,0|0,0,1]=3 207 B20R3.353551 CCOC(=O)C1=CC=CC2=C1SC3=C2C=CC=C3 MCULE-4867004806 [0,2,0,0,0,0|2,0,0]=4 208 B20R3.353551 CCOC(=O)C1=NC=CC2=C1NC3=CC=CC=C23 MCULE-6532598915 [0,2,0,0,0,0|0,0,0]=2 209 B20R3.5939382 COC(=O)C1=CC=CC2=C1C(=O)C3=CC=CC=C23 MCULE-4893418345 [0,2,0,0,0,0|2,0,0]=4 210 B18R3.115616 CC(=O)C1=CC2=C(C=C1)CC3=CC=CC=C23 MCULE-1457057637 [0,0,1,1,0,0|2,0,0]=4 211 B18R3.115616 CC(=O)C1=CC2=C(C=C1)NC3=C2C=CC=C3 MCULE-2374896501 [0,0,1,1,0,0|1,0,0]=3 212 B18R3.115616 CC(=O)C1=CC2=C(C=C1)OC3=C2C=CC=C3 MCULE-5042203621 [0,0,1,1,0,0|2,0,0]=4 213 B18R3.115616 O=C(O)C1=CC2=C(C=C1)NC3=C2C=CC=C3 MCULE-1155424066 [0,0,1,1,0,0|2,0,0]=4 214 B18R3.115616 O=C(O)C1=CC2=C(C=N1)NC3=C2C=CC=C3 MCULE-1332557093 [0,0,1,1,0,0|1,0,0]=3 215 B18R3.11551 CC1=NN(C2=C1N=CC=N2)C3=CC=CC=C3 MCULE-1966506309 [0,0,1,1,0,0|2,0,0]=4 216 B18R3.11551 O=C1CC(C2=C1C=CC=C2)C3=CC=CC=C3 MCULE-9726442255 [0,0,1,1,0,0|2,0,0]=4 217 B18R3.92719 O=C1CC2=C(C=CC=C2)CC3=CC=CC=C13 MCULE-3971356827 [0,0,1,1,0,0|2,0,0]=4 218 B18R3.92719 O=C1CC2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-7274065981 [0,0,1,1,0,0|2,0,0]=4 219 B18R3.92719 O=C1CC2=CC=CC=C2NC3=CC=CC=C13 MCULE-4117617884 [0,0,1,1,0,0|1,0,0]=3 220 B18R3.92719 O=C1NC2=C(C=CC=C2)NC3=C1C=CC=C3 MCULE-5976983373 [0,0,1,1,0,0|2,0,0]=4 221 B18R3.117881 CC(=O)C1=CC2=C(O1)C=CC3=CC=CC=C23 MCULE-1467964007 [0,0,1,1,0,0|2,0,0]=4 222 B16R2.36 CC(=O)NN=CC1=CNC2=C1C=CC=C2 MCULE-5420752814 [0,0,1,0,1,0|1,0,0]=3 223 B16R2.36 NC(=O)NN=CC1=CNC2=C1C=CC=C2 MCULE-3098683675 [0,0,1,0,1,0|2,0,0]=4 224 B16R2.3270 CC(=O)C1=CC=C(O1)C2=C(C=CC=C2)Cl MCULE-1253969916 [0,0,1,0,1,0|2,0,0]=4 225 B16R2.3270 CC(=O)C1=CC=C(S1)C2=C(C=CC=C2)Br MCULE-5566127174 [0,0,1,0,1,0|2,0,0]=4 226 B16R2.3270 CC(=O)C1=CC=C(S1)C2=C(C=CC=C2)C MCULE-5505075722 [0,0,1,0,1,0|2,0,0]=4 227 B16R2.3270 CC(=O)C1=CC=C(S1)C2=C(C=CC=C2)Cl MCULE-9650197844 [0,0,1,0,1,0|2,0,0]=4 228 B16R2.3270 CC(=O)C1=CC=C(S1)C2=C(C=CC=C2)F MCULE-1321174321 [0,0,1,0,1,0|2,0,0]=4 229 B16R2.3270 NC1=C(C=CC=C1)C2=CC=C(O2)C(=O)O MCULE-3897893509 [0,0,1,0,1,0|2,0,0]=4 230 B16R2.87 CC(=O)C1=C(C=CC=C1)C2=CC=CC=C2 MCULE-6513692447 [0,0,1,0,1,0|1,0,0]=3 231 B16R2.87 NC(=O)C1=C(C=CC=C1)C2=CC=CC=C2 MCULE-9114594962 [0,0,1,0,1,0|2,0,0]=4 232 B16R2.87 O=C(Cl)C1=CC=CC=C1C2=CC=CC=C2 MCULE-7159342062 [0,0,1,0,1,0|2,0,0]=4 233 B16R2.87 O=C(O)C1=C(C=CC=C1)C2=CC=CC=C2 MCULE-3327468892 [0,0,1,0,1,0|2,0,0]=4 234 B16R2.87 O=C(O)C1=NC=CC=C1C2=CC=CC=C2 MCULE-1878910182 [0,0,1,0,1,0|1,0,0]=3 235 B16R2.87 O=C(O)C1=NC=CC=C1C2=CC=CC=C2 MCULE-9202227344 [0,0,1,0,1,0|1,0,0]=3 236 B16R2.87 O=C(O)C1=NC=CC=C1C2=CC=CC=N2 MCULE-6929419001 [0,0,1,0,1,0|2,0,0]=4 237 B16R2.87 O=C(O)C1=NC=CN=C1C2=CC=CC=C2 MCULE-5123681955 [0,0,1,0,1,0|2,0,0]=4 238 B16R2.87 O=C(O)C1=NC=NC=C1C2=CC=CC=C2 MCULE-1722718144 [0,0,1,0,1,0|2,0,0]=4 239 B16R2.464 O=C(O)C1=C(SC=N1)NC2=CC=CC=C2 MCULE-4807800121 [0,0,1,0,1,0|2,0,0]=4 240 B16R2.12348 CC(=O)C1=C(C(=NO1)C2=CC=CC=C2)N MCULE-4304609869 [0,0,1,0,1,0|2,0,0]=4 241 B16R2.12348 CC(=O)C1=NC=C(N1C)C2=CC=CC=C2 MCULE-9441803958 [0,0,1,0,1,0|2,0,0]=4 242 B18R2.6302 O=C(O)C1=NC=CC(=C1)OC2=C(C=CC=C2)Cl MCULE-1466852743 [0,0,1,0,0,1|2,0,0]=4 243 B18R2.6302 O=C(O)C1=NC=CC(=C1)OC2=C(C=CC=C2)F MCULE-8144902438 [0,0,1,0,0,1|2,0,0]=4 244 B18R2.7138 CC(=O)C1=C(C=CC=C1)OCC2=CC=CC=C2 MCULE-5391820218 [0,0,1,0,0,1|2,0,0]=4 245 B18R2.7138 CC(=O)C1=CC=CC=C1C#CC2=CC=CC=C2 MCULE-8464208935 [0,0,1,0,0,1|2,0,0]=4 246 B18R2.7138 CC(=O)C1=CC=CC=C1C=CC2=CC=CC=C2 MCULE-5875236024 [0,0,1,0,0,1|2,0,0]=4 247 B18R2.7138 O=C(O)C1=C(C=CC=C1)NCC2=CC=CC=C2 MCULE-5172319560 [0,0,1,0,0,1|2,0,0]=4 248 B18R2.7138 O=C(O)C1=NC=CC=C1OCC2=CC=CC=C2 MCULE-6707045162 [0,0,1,0,0,1|2,0,0]=4 249 B18R2.7181 CC(=O)CC1=C(C=CC=C1)OC2=CC=CC=C2 MCULE-3864132037 [0,0,1,0,0,1|2,0,0]=4 250 B18R2.7181 CC(=O)NC1=C(C=CC=C1)CC2=CC=CC=C2 MCULE-4682053879 [0,0,1,0,0,1|2,0,0]=4 251 B18R2.7181 CC(=O)NC1=C(C=CC=C1)NC2=CC=CC=C2 MCULE-1937986470 [0,0,1,0,0,1|1,0,0]=3 252 B18R2.7181 CC(=O)NC1=CC=CC=C1OC2=CC=CC=C2 MCULE-3295298940 [0,0,1,0,0,1|2,0,0]=4 253 B18R2.7181 CC(=O)NC1=CC=CC=C1SC2=CC=CC=C2 MCULE-7331256392 [0,0,1,0,0,1|2,0,0]=4 254 B18R2.7181 O=C(O)CC1=CC=CC=C1NC2=CC=CC=C2 MCULE-4384848839 [0,0,1,0,0,1|2,0,0]=4 255 B18R3.151679 O=CC1=C2OC3=C(C=CC=C3)OC2=CC=C1 MCULE-8381009038 [1,0,0,0,0,1|2,0,0]=4 256 B18R3.116932 CC(=O)C1=CC2=C(C=C1)C3=C(C2)C=CC=C3 MCULE-7317188589 [0,0,0,0,1,1|1,0,0]=3 257 B18R3.116932 CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3O2 MCULE-9877410611 [0,0,0,0,1,1|1,0,0]=3 258 B18R3.116932 CC(=O)C1=CC=C2C(=C1)NC3=C2C=CC=C3 MCULE-3985354766 [0,0,0,0,1,1|0,0,0]=2 259 B18R3.116932 O=C(O)C1=CC2=C(C=C1)C3=C(C2)C=CC=C3 MCULE-2380033133 [0,0,0,0,1,1|2,0,0]=4 260 B18R3.116932 O=C(O)C1=CC2=C(C=C1)C3=CC=CC=C3N2 MCULE-9859484884 [0,0,0,0,1,1|1,0,0]=3 261 B18R3.116932 O=C(O)C1=CC2=C(C=C1)C3=CC=CC=C3O2 MCULE-6915616176 [0,0,0,0,1,1|2,0,0]=4 262 B18R3.116932 O=N(=O)C1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-3336053897 [0,0,0,0,1,1|2,0,0]=4 263 B20R3.426858 CC(=O)CSC1=NC=NC2=C1OC3=C2C=CC=C3 MCULE-1770668242 [0,0,0,0,0,2|2,0,0]=4 264 B20R3.426858 NC(=O)CSC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-7139278610 [0,0,0,0,0,2|2,0,0]=4 265 B20R3.426858 O=C(O)CCC1=NC=CC2=C1NC3=CC=CC=C23 MCULE-7451301973 [0,0,0,0,0,2|1,0,0]=3 266 B20R3.5070115 CC(=O)NC1=CC=CC2=CC3=C(C=CC=C3)C=C12 MCULE-3136295776 [0,0,0,0,0,2|2,0,0]=4 267 B15R2.17 COC1=NC=CC(=C1)C2=CC=CC=C2 MCULE-6024188818 [2,0,1,0,0,0|1,0,0]=4 268 B15R2.17 O=CC1=CC=CC(=C1)C2=CC=CC=C2 MCULE-5817407667 [2,0,1,0,0,0|1,0,0]=4 269 B15R2.17 O=CC1=NC=CC(=C1)C2=CC=CC=C2 MCULE-8029451644 [2,0,1,0,0,0|0,0,0]=3 270 B15R2.332 CC1=CC(=CC=C1)C2=C(C=CC=C2)N MCULE-2849414868 [2,0,1,0,0,0|1,0,0]=4 271 B15R2.332 CC1=CC(=CC=C1)C2=C(C=CC=C2)N MCULE-8620009645 [2,0,1,0,0,0|1,0,0]=4 272 B15R2.38 CC1=C(N=CC=N1)NC2=CC=CC=C2 MCULE-5339560561 [2,0,1,0,0,0|1,0,0]=4 273 B15R2.38 CC1=CC=CC=C1NC2=CC=CC=C2 MCULE-4331268188 [2,0,1,0,0,0|1,0,0]=4 274 B15R2.32 CC1=C(C(=CC=C1)C2=CC=CC=C2)N MCULE-9310885896 [2,0,1,0,0,0|1,0,0]=4 275 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-7610805198 [3,0,0,0,0,0|1,0,0]=4 276 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=NC=C3 MCULE-5748858495 [3,0,0,0,0,0|0,0,0]=3 277 B15R3.3 C1=CC2=C(C=C1)C3=CC=NC=C3N2 MCULE-7379210172 [3,0,0,0,0,0|0,0,0]=3 278 B17R2.206 CC(=O)C1=C(C=CC(=C1)C2=CC=CC=C2)O MCULE-3093412494 [1,1,1,0,0,0|1,0,0]=4 279 B17R2.220 CC(=O)C1=CC(=C(C=C1)F)C2=CC=CC=C2 MCULE-3733177642 [1,1,1,0,0,0|1,0,0]=4 280 B17R2.227 CCC(=O)C1=CC(=CC=C1)C2=CC=CC=C2 MCULE-1886792800 [1,1,1,0,0,0|1,0,0]=4 281 B17R2.227 COC(=O)C1=CC=CC(=C1)C2=CC=CC=C2 MCULE-9472763814 [1,1,1,0,0,0|1,0,0]=4 282 B17R2.227 COC(=O)C1=NC=CC(=C1)C2=CC=CC=C2 MCULE-7847344481 [1,1,1,0,0,0|0,0,0]=3 283 B17R2.227 COC(=O)C1=NC=CC(=N1)C2=CC=CC=C2 MCULE-5224210942 [1,1,1,0,0,0|1,0,0]=4 284 B17R2.3221 CC1=CC(=CC(=N1)C(=O)O)C2=CC=CC=C2 MCULE-8503156002 [1,1,1,0,0,0|1,0,0]=4 285 B17R2.3221 O=C(O)C1=NC(=CC(=C1)C2=CC=CC=C2)Cl MCULE-1397021266 [1,1,1,0,0,0|1,0,0]=4 286 B17R2.3281 CC(=O)C1=CC(=CC=C1)C2=CC=C(C=C2)Cl MCULE-9883255884 [1,1,1,0,0,0|1,0,0]=4 287 B17R2.3281 CC(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)F MCULE-2922497781 [1,1,1,0,0,0|1,0,0]=4 288 B17R2.3281 CC(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)N MCULE-1671339918 [1,1,1,0,0,0|1,0,0]=4 289 B17R2.3281 CC(=O)C1=CC=CC(=C1)C2=CC=C(C=C2)N MCULE-9837320620 [1,1,1,0,0,0|1,0,0]=4 290 B17R2.3281 CC1=CC=C(C=C1)C2=CC(=NC=C2)C(=O)O MCULE-7751262218 [1,1,1,0,0,0|1,0,0]=4 291 B17R2.3281 O=C(O)C1=NC=CC(=C1)C2=CC=C(C=C2)Cl MCULE-2352897347 [1,1,1,0,0,0|1,0,0]=4 292 B17R2.3281 O=C(O)C1=NC=CC(=C1)C2=CC=C(C=C2)F MCULE-6856147288 [1,1,1,0,0,0|1,0,0]=4 293 B17R2.3376 CC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)Cl MCULE-4861212901 [1,1,1,0,0,0|1,0,0]=4 294 B17R2.3376 CC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)N MCULE-6162231386 [1,1,1,0,0,0|1,0,0]=4 295 B17R2.3376 CC(=O)C1=CC(=CC=C1)C2=CC(=CC=C2)O MCULE-2172192269 [1,1,1,0,0,0|1,0,0]=4 296 B17R2.3376 CC1=CC=CC(=C1)C2=CC(=NC=C2)C(=O)O MCULE-8532305249 [1,1,1,0,0,0|1,0,0]=4 297 B17R2.3376 O=C(O)C1=CC(=CC=N1)C2=CC(=CC=C2)Cl MCULE-4398601476 [1,1,1,0,0,0|1,0,0]=4 298 B17R2.3376 O=C(O)C1=NC=CC(=C1)C2=CC=CC(=C2)F MCULE-9250180912 [1,1,1,0,0,0|1,0,0]=4 299 B17R2.566 COC(=O)C1=CC=C(O1)C2=CC=CC=C2N MCULE-1255430511 [0,1,1,0,1,0|1,0,0]=4 300 B17R2.231 CCC(=O)C1=C(C=CC=C1)C2=CC=CC=C2 MCULE-7369329950 [0,1,1,0,1,0|1,0,0]=4 301 B17R2.231 CNC(=O)C1=CC=CC=C1C2=CC=CC=C2 MCULE-2046295322 [0,1,1,0,1,0|1,0,0]=4 302 B17R2.231 COC(=O)C1=CC=CC=C1C2=CC=CC=C2 MCULE-5528001192 [0,1,1,0,1,0|1,0,0]=4 303 B17R2.350 CC(=O)C1=C(C=CC=C1)C2=CC=C(C=C2)F MCULE-4741211998 [0,1,1,0,1,0|1,0,0]=4 304 B17R2.350 CC(=O)C1=CC=CC=C1C2=CC=C(C=C2)C MCULE-4938975976 [0,1,1,0,1,0|1,0,0]=4 305 B17R2.350 CC(=O)C1=CC=CC=C1C2=CC=C(C=C2)Cl MCULE-7989159046 [0,1,1,0,1,0|1,0,0]=4 306 B17R2.350 CC1=CC=C(C=C1)C2=C(N=CC=C2)C(=O)O MCULE-6565763091 [0,1,1,0,1,0|1,0,0]=4 307 B17R2.350 CC1=CC=C(C=C1)C2=CC=CN=C2C(=O)N MCULE-6445923938 [0,1,1,0,1,0|1,0,0]=4 308 B17R2.350 NC1=CC=C(C=C1)C2=CC=CN=C2C(=O)O MCULE-7519463430 [0,1,1,0,1,0|1,0,0]=4 309 B17R2.350 O=C(O)C1=NC=CC=C1C2=CC=C(C=C2)Cl MCULE-8351414850 [0,1,1,0,1,0|1,0,0]=4 310 B17R2.350 O=C(O)C1=NC=CC=C1C2=CC=C(C=C2)F MCULE-7934597532 [0,1,1,0,1,0|1,0,0]=4 311 B17R2.350 O=C(O)C1=NC=CC=C1C2=CC=C(C=C2)O MCULE-8278635646 [0,1,1,0,1,0|1,0,0]=4 312 B17R2.3363 CC(=O)C1=C(C=CC=C1)C2=CC(=CC=C2)F MCULE-3921414645 [0,1,1,0,1,0|1,0,0]=4 313 B17R2.3363 CC1=CC=CC(=C1)C2=C(N=CC=C2)C(=O)O MCULE-9241804278 [0,1,1,0,1,0|1,0,0]=4 314 B17R2.3363 O=C(O)C1=C(C=CC=N1)C2=CC(=CC=C2)Cl MCULE-2732634783 [0,1,1,0,1,0|1,0,0]=4 315 B17R2.3363 O=C(O)C1=C(C=CC=N1)C2=CC(=CC=C2)F MCULE-2798871984 [0,1,1,0,1,0|1,0,0]=4 316 B17R2.3445 CC1=CC=CC=C1C2=C(N=CC=C2)C(=O)O MCULE-8014008633 [0,1,1,0,1,0|1,0,0]=4 317 B17R2.3445 O=C(O)C1=C(C=CC=N1)C2=CC=CC=C2Cl MCULE-1312093671 [0,1,1,0,1,0|1,0,0]=4 318 B17R2.3445 O=C(O)C1=C(C=CC=N1)C2=CC=CC=C2F MCULE-9075884660 [0,1,1,0,1,0|1,0,0]=4 319 B17R2.3445 O=C(O)C1=NC=CC=C1C2=CC=CC=C2O MCULE-2558004168 [0,1,1,0,1,0|1,0,0]=4 320 B17R2.5366 CC1=NC(=C(C=C1)C2=CC=CC=C2)C(=O)O MCULE-5394339853 [0,1,1,0,1,0|1,0,0]=4 321 B17R2.520 COC(=O)C1=C(SC=N1)NC2=CC=CC=C2 MCULE-3127601687 [0,1,1,0,1,0|1,0,0]=4 322 B17R2.58067 COC(=O)C1=C(C(=CN1)C2=CC=CC=C2)N MCULE-4583111409 [0,1,1,0,1,0|0,0,1]=4 323 B17R2.58067 COC(=O)C1=C(C(=CS1)C2=CC=CC=C2)N MCULE-3910615400 [0,1,1,0,1,0|1,0,0]=4 324 B17R3.30495 CC1=C2NC3=C(C2=CC=N1)C=CC(=C3)O MCULE-4264809349 [2,1,0,0,0,0|0,0,0]=3 325 B17R3.30495 CC1=CC2=C(C=C1)C3=C(N2)C(=CC=C3)C MCULE-8797130966 [2,1,0,0,0,0|1,0,0]=4 326 B17R3.30495 CC1=NC=CC2=C1NC3=C2C=CC(=C3)O MCULE-1541330566 [2,1,0,0,0,0|0,0,0]=3 327 B17R3.34483 CC1=C2NC3=C(C2=CC(=O)O1)C=CC=C3 MCULE-3449642814 [2,1,0,0,0,0|1,0,0]=4 328 B17R3.34483 CC1=CC2=C(NC3=C2C=CC=C3)C(=C1)C MCULE-8487001449 [2,1,0,0,0,0|1,0,0]=4 329 B17R3.34483 CC1=CC2=C(NC3=C2C=CC=C3)C(=N1)C MCULE-7501161156 [2,1,0,0,0,0|0,0,0]=3 330 B17R3.34483 CC1=CC2=C(NC3=C2C=CC=C3)C(=N1)C MCULE-9135168350 [2,1,0,0,0,0|0,0,0]=3 331 B17R3.34483 CC1=CC2=C(SC3=C2C=CC=C3)C(=N1)C MCULE-4625017788 [2,1,0,0,0,0|1,0,0]=4 332 B17R3.34483 CC1=CC2=C(SC3=C2C=CC=C3)C(=N1)C MCULE-5428757402 [2,1,0,0,0,0|1,0,0]=4 333 B17R3.34483 CC1=NC(=CC2=C1NC3=CC=CC=C23)O MCULE-1212456468 [2,1,0,0,0,0|0,0,0]=3 334 B17R3.34483 CC1=NC(=CC2=C1SC3=C2C=CC=C3)O MCULE-1570641848 [2,1,0,0,0,0|1,0,0]=4 335 B17R3.51120 CC1=CC=CC2=C1NC3=C2C=CC=C3C MCULE-4261126393 [2,1,0,0,0,0|1,0,0]=4 336 B17R3.51174 CC1=NC=CC2=C1N(C3=CC=CC=C23)C MCULE-7195760275 [2,1,0,0,0,0|0,0,0]=3 337 B17R3.56301 CC1=CC=C(C2=C1NC3=C2C=CC=C3)C MCULE-8984316212 [2,1,0,0,0,0|1,0,0]=4 338 B19R2.12698 CNC(=O)C1=NC=CC(=C1)OC2=C(C=CC=C2)N MCULE-2114013125 [0,1,1,0,0,1|0,0,0]=3 339 B19R2.12698 COC(=O)C1=CC=CC(=C1)OC2=CC=CC=C2N MCULE-5880256776 [0,1,1,0,0,1|1,0,0]=4 340 B19R2.111410 CC(=O)C=C1NC2=C(C=CC=C2)NC1=CC(=O)C MCULE-2533537550 [0,1,1,0,0,1|1,0,0]=4 341 B19R2.8831 CC(=O)C1=C(C=CC=C1)NC(=O)C2=CC=CC=C2 MCULE-9434884645 [0,1,1,0,0,1|1,0,0]=4 342 B19R2.12753 CNC(=O)C1=NC=CC=C1OCC2=CC=CC=C2 MCULE-4282702714 [0,1,1,0,0,1|1,0,0]=4 343 B19R2.12753 COC(=O)C1=CC=CC=C1NCC2=CC=CC=C2 MCULE-9551460963 [0,1,1,0,0,1|1,0,0]=4 344 B19R2.12753 COC(=O)C1=CC=CC=C1SNC2=CC=CC=C2 MCULE-9754180628 [0,1,1,0,0,1|1,0,0]=4 345 B19R2.4543 CC(=O)NC1=C(C=CC(=C1)Cl)NC2=CC=CC=C2 MCULE-1712728065 [0,1,1,0,0,1|1,0,0]=4 346 B19R2.156713 COC(=O)C1=CC=CC=C1NC2=CC=CC=C2Br MCULE-3437341815 [0,2,1,0,0,0|1,0,0]=4 347 B19R2.10501 CCNC(=O)C1=C(C=CC=C1)NC2=CC=CC=C2 MCULE-2513425631 [0,2,1,0,0,0|1,0,0]=4 348 B19R3.284881 C=CC1=NC=C(C2=C1NC3=CC=CC=C23)OC MCULE-4715135459 [1,2,0,0,0,0|0,0,1]=4 349 B19R3.284881 CCC1=NC=C(C2=C1NC3=CC=CC=C23)OC MCULE-3341247778 [1,2,0,0,0,0|0,0,1]=4 350 B19R3.86767 CC(=O)C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)Br MCULE-4258391836 [0,1,0,0,1,1|1,0,0]=4 351 B19R3.245714 COC(=O)C1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-1804926584 [0,1,0,0,1,1|0,0,0]=3 352 B19R3.245714 O=C(CBr)C1=CC2=C(C=C1)C3=C(C2)C=CC=C3 MCULE-7610322744 [0,1,0,0,1,1|1,0,0]=4 353 B19R3.2545759 CC(=O)C1=CC2=C(C=C1)C3=CC=CC=C3N2C MCULE-8029084170 [0,1,0,0,1,1|0,0,0]=3 354 B21R3.229567 O=C(O)CCC1=NC=CC2=C1NC3=CC(=CC=C23)O MCULE-3738530372 [0,1,0,0,0,2|1,0,0]=4 355 B21R3.667737 COC(=O)CCC1=NC=CC2=C1NC3=CC=CC=C23 MCULE-4584324614 [0,1,0,0,0,2|0,0,0]=3 356 B21R3.667737 COC(=O)CSC1=NC=NC2=C1NC3=C2C=CC=C3 MCULE-3406043615 [0,1,0,0,0,2|1,0,0]=4 357 B21R3.9636935 COC(=O)C1=CC=CC2=C1NC3=CC=CC=C3CC2 MCULE-3855459663 [0,1,0,0,0,2|1,0,0]=4 358 B21R3.781861 COC(=O)C1=NC=C(C2=C1NC3=CC=CC=C23)OC MCULE-7753174167 [0,3,0,0,0,0|0,0,0]=3 359 B17R3.1513 O=CC1=CC2=C(C=C1)NC3=CC=CC=C23 MCULE-3595989963 [1,0,1,1,0,0|1,0,0]=4 360 B17R3.1513 O=CC1=CC2=C(C=N1)NC3=C2C=CC=C3 MCULE-6796931366 [1,0,1,1,0,0|0,0,0]=3 361 B17R3.35227 O=C1C2=C(C=CC=C2)NC3=C1C=CC=C3 MCULE-1876725898 [1,0,1,1,0,0|1,0,0]=4 362 B17R3.35227 O=C1C2=C(C=CC=C2)OC3=C1N=CC=C3 MCULE-6719194531 [1,0,1,1,0,0|1,0,0]=4 363 B17R3.8708 C1=CN=C(C=C1)C2=CC3=C(N2)C=CC=C3 MCULE-1435066150 [1,0,1,1,0,0|0,0,1]=4 364 B17R3.26 CC1=NC=C(O1)C2=CNC3=C2C=CC=C3 MCULE-2270556959 [0,0,1,1,1,0|0,0,1]=4 365 B17R3.54615 O=C1OC2=CC=CC=C2C3=C1N=CC=C3 MCULE-9883320660 [0,0,1,1,1,0|1,0,0]=4 366 B19R3.202037 CC(=O)NC1=CC2=C(C=C1)NC3=CC=CC=C23 MCULE-1212199018 [0,0,1,1,0,1|1,0,0]=4 367 B19R3.9171 O=C1CC(NC2=C1C=CC=C2)C3=CC=CC=C3 MCULE-8966952796 [0,0,1,1,0,1|1,0,0]=4 368 B19R3.9171 O=C1C[C@@H](NC2=C1C=CC=C2)C3=CC=CC=C3 MCULE-6131305844 [0,0,1,1,0,1|1,0,0]=4 369 B19R3.629728 CC(=O)N1C2=C(C=CC=C2)NC3=C1C=CC=C3 MCULE-4149131826 [0,0,1,1,0,1|1,0,0]=4 370 B19R3.243403 CNC(=O)C1=NC=C2NC3=C(C2=C1)C=CC=C3 MCULE-1827591360 [0,1,1,1,0,0|0,0,0]=3 371 B19R3.243403 COC(=O)C1=CC2=C(C=C1)NC3=CC=CC=C23 MCULE-6274371167 [0,1,1,1,0,0|1,0,0]=4 372 B19R3.243403 COC(=O)C1=CC2=C(C=N1)NC3=C2C=CC=C3 MCULE-6149532060 [0,1,1,1,0,0|0,0,0]=3 373 B19R3.243403 COC(=O)C1=NC=C2NC3=NC=CC=C3C2=C1 MCULE-5707809956 [0,1,1,1,0,0|1,0,0]=4 374 B19R3.2544412 CC(=O)C1=CC2=C(C=C1)N(C3=C2C=CC=C3)C MCULE-2225293089 [0,1,1,1,0,0|1,0,0]=4 375 B19R3.171405 CC1=C2NC3=C(C2=CC(=N1)C(=O)O)C=CC=C3 MCULE-5302808345 [0,1,1,1,0,0|1,0,0]=4 376 B19R3.9008 O=C1CCN(C2=CC=CC=C12)C3=CC=CC=C3 MCULE-1555690623 [0,1,1,1,0,0|1,0,0]=4 377 B19R3.2184606 CN1C(=O)C2=CC=CC=C2NC3=CC=CC=C13 MCULE-5158860120 [0,1,1,1,0,0|1,0,0]=4 378 B21R4.50982 O=C1C(=CC2=NC=CC3=C2N1C4=CC=CC=C34)O MCULE-1694724295 [0,1,0,1,0,1|1,0,0]=4 379 B21R4.5001012 O=C1C=C(C2=C3N1C4=C(C3=CC=N2)C=CC=C4)O MCULE-8756104401 [0,2,0,1,0,0|1,0,0]=4 380 B15R2.59 CC(=O)C1=CC=C(O1)C2=CC=CC=C2 MCULE-8326835081 [1,0,1,0,1,0|1,0,0]=4 381 B15R2.59 CC(=O)C1=CC=C(S1)C2=CC=CC=C2 MCULE-2421022767 [1,0,1,0,1,0|1,0,0]=4 382 B15R2.59 CC(=O)C1=NC=C(O1)C2=CC=CC=C2 MCULE-1445907405 [1,0,1,0,1,0|1,0,0]=4 383 B15R2.59 CC(=O)C1=NOC(=C1)C2=CC=CC=C2 MCULE-4005177618 [1,0,1,0,1,0|1,0,0]=4 384 B15R2.21 COC1=NC=CC=C1C2=CC=CC=C2 MCULE-6764292388 [1,0,1,0,1,0|1,0,0]=4 385 B15R2.21 O=CC1=C(C=CC=C1)C2=CC=CC=C2 MCULE-1005566867 [1,0,1,0,1,0|1,0,0]=4 386 B15R2.6 CC(=O)C=CC1=CNC2=CC=CC=C12 MCULE-1503677397 [0,0,1,0,2,0|0,0,0]=3 387 B15R2.6 O=C(O)/C=C/C1=CNC2=C1C=CC=C2 MCULE-6532813939 [0,0,1,0,2,0|1,0,0]=4 388 B15R2.6 O=C(O)/C=C\C1=CNC2=CC=CC=C12 MCULE-5749603036 [0,0,1,0,2,0|1,0,0]=4 389 B15R2.6 O=C(O)C=CC1=CNC2=CC=CC=C12 MCULE-2676235699 [0,0,1,0,2,0|1,0,0]=4 390 B15R2.6 O=C([O-])C=CC1=CNC2=CC=CC=C12 MCULE-2887903829 [0,0,1,0,2,0|1,0,0]=4 391 B17R2.262 O=CC1=NC=CC=C1OCC2=CC=CC=C2 MCULE-9498653674 [1,0,1,0,0,1|1,0,0]=4 392 B17R2.3935 CC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2)C MCULE-3438691846 [0,0,1,0,1,1|1,0,0]=4 393 B17R2.3935 CC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2)Cl MCULE-6854507110 [0,0,1,0,1,1|1,0,0]=4 394 B17R2.3935 CC(=O)C1=CC=C(C=C1)C2=C(C=CC=C2)O MCULE-5915491335 [0,0,1,0,1,1|1,0,0]=4 395 B17R2.3935 CC(=O)C1=CC=C(N=C1)C2=CC=CC=C2C MCULE-6138971701 [0,0,1,0,1,1|1,0,0]=4 396 B17R2.3935 NC1=C(C=CC=C1)C2=CC=C(C=C2)C(=O)O MCULE-2331271059 [0,0,1,0,1,1|1,0,0]=4 397 B17R2.3935 NC1=C(C=CC=C1)C2=CC=C(C=C2)C(=O)O MCULE-2842885317 [0,0,1,0,1,1|1,0,0]=4 398 B17R2.3198 CC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2)F MCULE-6480821405 [0,0,1,0,1,1|1,0,0]=4 399 B17R2.3198 CC(=O)C1=CC=C(C(=C1)C)C2=CC=CC=C2 MCULE-3208002557 [0,0,1,0,1,1|1,0,0]=4 400 B17R2.3201 NC1=C(C=CC(=C1)C2=CC=CC=C2)C(=O)O MCULE-5091369491 [0,0,1,0,1,1|1,0,0]=4 401 B17R3.1577 COC1=CC=C2C(=C1)NC3=C2C=CC=C3 MCULE-7608124863 [1,0,0,0,1,1|1,0,0]=4 402 B17R3.1577 CSC1=NC2=C(C=N1)C3=C(N2)C=CC=C3 MCULE-5562209859 [1,0,0,0,1,1|1,0,0]=4 403 B17R3.1577 O=CC1=CC2=C(C=C1)C3=C(C2)C=CC=C3 MCULE-2102300178 [1,0,0,0,1,1|1,0,0]=4 404 B17R3.1577 O=CC1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-9470315530 [1,0,0,0,1,1|0,0,0]=3 405 B19R2.7522 CC(=O)NC1=CC=CC(=C1)OC2=C(C=CC=C2)N MCULE-6435310267 [0,0,1,0,0,2|1,0,0]=4 406 B19R2.7522 CC(=O)NC1=CC=CC(=C1)OC2=CC=CC=C2N MCULE-9913440179 [0,0,1,0,0,2|1,0,0]=4