0 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=CC=C3 MCULE-7610805198 [0,0,0,0,0,0|1,0,3]=4 1 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=NC=C3 MCULE-5748858495 [0,0,0,0,0,0|2,0,2]=4 2 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)C=NCC3 MCULE-6354656291 [0,0,0,0,0,0|2,0,1]=3 3 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CCCC3 MCULE-3200900424 [0,0,0,0,0,0|1,0,0]=1 4 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CCNC3 MCULE-8381914634 [0,0,0,0,0,0|0,0,0]=0 5 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-4828650242 [0,0,0,0,0,0|2,0,0]=2 6 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-6905321940 [0,0,0,0,0,0|2,0,0]=2 7 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)N=CN=N3 MCULE-3237438091 [0,0,0,0,0,0|2,0,2]=4 8 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)SCCS3 MCULE-1785031196 [0,0,0,0,0,0|3,0,0]=3 9 B15R3.3 C1=CC2=C(C=C1)C3=C(O2)C=NCC3 MCULE-4800954387 [0,0,0,0,0,0|3,0,1]=4 10 B15R3.3 C1=CC2=C(C=C1)C3=C(O2)CCNC3 MCULE-3219352873 [0,0,0,0,0,0|1,0,0]=1 11 B15R3.3 C1=CC2=C(C=C1)C3=CC=NC=C3N2 MCULE-7379210172 [0,0,0,0,0,0|2,0,2]=4 12 B15R3.3 C1=CC2=C(C=C1)C3=CNC=CC3=N2 MCULE-5371603359 [0,0,0,0,0,0|0,0,4]=4 13 B15R3.3 C1=CC2=C(C=C1)C3=NC=CN=C3N2 MCULE-1631663449 [0,0,0,0,0,0|3,0,1]=4 14 B15R3.3 C1=CC2=C(C=C1)C3CCCCC3N2 MCULE-5558658063 [0,0,0,0,0,0|1,0,2]=3 15 B15R3.3 C1=CC2=C(C=C1)N3CCCCC3=C2 MCULE-4968800116 [0,0,0,0,0,0|3,0,0]=3 16 B15R3.3 C1=CC2=C(C=C1)N3CCCCC3=N2 MCULE-8593477758 [0,0,0,0,0,0|2,0,1]=3 17 B15R3.3 C1=CC2=C(C=C1)N3CCCSC3=N2 MCULE-6652586759 [0,0,0,0,0,0|3,0,1]=4 18 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=C2 MCULE-3078447775 [0,0,0,0,0,0|4,0,0]=4 19 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=C2 MCULE-5044267728 [0,0,0,0,0,0|4,0,0]=4 20 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=N2 MCULE-4319801830 [0,0,0,0,0,0|3,0,1]=4 21 B15R3.3 C1=CC2=C(N=C1)C3=C(N2)CCCC3 MCULE-2436551783 [0,0,0,0,0,0|2,0,0]=2 22 B15R3.3 C1=CC2=C(N=C1)NC3=C2CCCC3 MCULE-4747769341 [0,0,0,0,0,0|2,0,0]=2 23 B15R3.3 C1=CC=C2C(=C1)C=C3N2CCNC3 MCULE-9045893120 [0,0,0,0,0,0|4,0,0]=4 24 B15R3.3 C1=CC=C2C(=C1)CC3=C2CCCC3 MCULE-7831803792 [0,0,0,0,0,0|2,0,0]=2 25 B15R3.3 C1=CC=C2C(=C1)CC3=C2CNCC3 MCULE-3470944153 [0,0,0,0,0,0|1,0,0]=1 26 B15R3.3 C1=CC=C2C(=C1)CC3=C2CNCC3 MCULE-5777181248 [0,0,0,0,0,0|1,0,0]=1 27 B15R3.3 C1=CC=C2C(=C1)N=C3N2CCCN3 MCULE-7385098913 [0,0,0,0,0,0|3,0,1]=4 28 B15R3.3 C1=CC=C2C(=C1)N=C3N2CCCN3 MCULE-7724752096 [0,0,0,0,0,0|3,0,1]=4 29 B15R3.3 C1=CC=C2C(=C1)NC3=C2C=CC=N3 MCULE-1165894563 [0,0,0,0,0,0|2,0,2]=4 30 B15R3.3 C1=CC=C2C(=C1)NC3=C2C=NC=C3 MCULE-8436257661 [0,0,0,0,0,0|0,0,4]=4 31 B15R3.3 C1=CC=C2C(=C1)NC3=C2CNCC3 MCULE-4930882559 [0,0,0,0,0,0|0,0,0]=0 32 B15R3.3 C1=CC=C2C(=C1)NC3=C2CSCC3 MCULE-7167351202 [0,0,0,0,0,0|1,0,0]=1 33 B15R3.3 C1=CC=C2C(=C1)NC3C2CCNC3 MCULE-2741135452 [0,0,0,0,0,0|2,0,2]=4 34 B15R3.3 C1=CC=C2C(=C1)NC3C2CNCC3 MCULE-1304488851 [0,0,0,0,0,0|0,0,2]=2 35 B15R3.3 C1=CC=C2C(=C1)OC3=C2CCNC3 MCULE-1229221862 [0,0,0,0,0,0|3,0,0]=3 36 B15R3.3 C1=CC=C2C(=C1)OC3=C2CCNC3 MCULE-2801127557 [0,0,0,0,0,0|3,0,0]=3 37 B15R3.3 C1=CN=C2C(=C1)NC3=C2C=CC=C3 MCULE-3024575954 [0,0,0,0,0,0|2,0,2]=4 38 B15R3.3 C1=CN=C2NC3=C(C2=C1)CCNC3 MCULE-1362231090 [0,0,0,0,0,0|3,0,0]=3 39 B15R3.3 C1=CN=C2NC3=C(C2=C1)CCNC3 MCULE-2558946277 [0,0,0,0,0,0|3,0,0]=3 40 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-3466108861 [0,1,0,0,0,0|1,0,0]=2 41 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2CNCC3 MCULE-1742487907 [0,1,0,0,0,0|0,0,0]=1 42 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2CSCC3 MCULE-3232034985 [0,1,0,0,0,0|1,0,0]=2 43 B16R3.2583 BrC1=CC=C2NC3=C(C2=C1)CCNC3 MCULE-4471938661 [0,1,0,0,0,0|2,0,0]=3 44 B16R3.2583 BrC1=CC=C2NC3=C(C2=C1)CNCC3 MCULE-4974314572 [0,1,0,0,0,0|0,0,0]=1 45 B16R3.2583 BrC1=CN2C(=NC3=C2CCCC3)C=C1 MCULE-7672920270 [0,1,0,0,0,0|2,0,1]=4 46 B16R3.2583 BrC1=CN=C2NC3=C(C2=C1)CNCC3 MCULE-4533527246 [0,1,0,0,0,0|1,0,0]=2 47 B16R3.2583 CC1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-4548111260 [0,1,0,0,0,0|1,0,0]=2 48 B16R3.2583 CC1=CC2=C(C=C1)NC3C2CCCC3 MCULE-5514606635 [0,1,0,0,0,0|1,0,2]=4 49 B16R3.2583 CC1=CC=C2NC3=C(C2=C1)CCNC3 MCULE-8655177500 [0,1,0,0,0,0|2,0,0]=3 50 B16R3.2583 CC1=CC=C2NC3=C(C2=C1)CCNC3 MCULE-9115853836 [0,1,0,0,0,0|2,0,0]=3 51 B16R3.2583 CC1=CC=C2NC3=C(C2=C1)CNCC3 MCULE-8410342784 [0,1,0,0,0,0|0,0,0]=1 52 B16R3.2583 CC1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-5054591436 [0,1,0,0,0,0|1,0,0]=2 53 B16R3.2583 CN1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-8448402067 [0,1,0,0,0,0|0,0,0]=1 54 B16R3.2583 CN1CCC2NC3=C(C2C1)C=CC=C3 MCULE-4887016304 [0,1,0,0,0,0|0,0,2]=3 55 B16R3.2583 CN1CCC2NC3=C(C2C1)C=CC=C3 MCULE-8792021668 [0,1,0,0,0,0|0,0,2]=3 56 B16R3.2583 ClC1=CC2=C(C=C1)NC3=C2CCNC3 MCULE-5539551203 [0,1,0,0,0,0|2,0,0]=3 57 B16R3.2583 ClC1=CC2=C(C=C1)NC3=C2CNCC3 MCULE-3218499889 [0,1,0,0,0,0|0,0,0]=1 58 B16R3.2583 ClC1=CC2=C(C=C1)NC3C2CNCC3 MCULE-5809926374 [0,1,0,0,0,0|0,0,2]=3 59 B16R3.2583 ClC1=CC2=C(C=C1)NC3C2CNCC3 MCULE-7365611736 [0,1,0,0,0,0|0,0,2]=3 60 B16R3.2583 ClC1=CC=C2NC3=C(C2=C1)CCCC3 MCULE-3292887439 [0,1,0,0,0,0|1,0,0]=2 61 B16R3.2583 ClC1=CC=C2NC3=C(C2=C1)CCNC3 MCULE-8719392985 [0,1,0,0,0,0|2,0,0]=3 62 B16R3.2583 ClC1=CC=C2NC3=C(C2=C1)CNCC3 MCULE-4325384592 [0,1,0,0,0,0|0,0,0]=1 63 B16R3.2583 FC1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-6953186875 [0,1,0,0,0,0|1,0,0]=2 64 B16R3.2583 FC1=CC2=C(C=C1)NC3=C2CCNC3 MCULE-4207991202 [0,1,0,0,0,0|2,0,0]=3 65 B16R3.2583 FC1=CC=C2NC3=C(C2=C1)CNCC3 MCULE-1623986723 [0,1,0,0,0,0|0,0,0]=1 66 B16R3.2583 FC1=CC=C2NC3=C(C2=C1)CNCC3 MCULE-5283144672 [0,1,0,0,0,0|0,0,0]=1 67 B16R3.2583 N1C2=CC=C(C=C2C3=C1CCNC3)C MCULE-7108945953 [0,1,0,0,0,0|0,0,0]=1 68 B16R3.2583 NC1=CC2=C(C=C1)NC3=C2CSCC3 MCULE-3165511074 [0,1,0,0,0,0|1,0,0]=2 69 B16R3.2583 NC1=CC2=C(C=C1)OC3=C2CCCC3 MCULE-1315904997 [0,1,0,0,0,0|2,0,0]=3 70 B16R3.2583 NC1=CC2=C(C=C1)OC3=C2CCCC3 MCULE-3831614527 [0,1,0,0,0,0|2,0,0]=3 71 B16R3.2583 NC1=CC=C2NC3=C(C2=C1)CCCC3 MCULE-9232817150 [0,1,0,0,0,0|1,0,0]=2 72 B16R3.2583 NC1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-3649161710 [0,1,0,0,0,0|1,0,0]=2 73 B16R3.2583 NC1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-4789002335 [0,1,0,0,0,0|1,0,0]=2 74 B16R3.2583 N[C@@H]1CCC2=C(C1)C3=C(N2)C=CC=C3 MCULE-2153037710 [0,1,0,0,0,0|1,0,0]=2 75 B16R3.2583 N[C@@H]1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-1614449060 [0,1,0,0,0,0|1,0,0]=2 76 B16R3.2583 N[C@H]1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-4777384764 [0,1,0,0,0,0|1,0,0]=2 77 B16R3.2583 N[C@H]1CCC2=C(C1)C3=CC=CC=C3N2 MCULE-8998431018 [0,1,0,0,0,0|1,0,0]=2 78 B16R3.2583 O=C1CCC2=C(C1)C3=C(N2)C=CC=C3 MCULE-6291596002 [0,1,0,0,0,0|1,0,0]=2 79 B16R3.2583 OC1=CC2=C(C=C1)NC3=C2CCNC3 MCULE-2794805192 [0,1,0,0,0,0|2,0,0]=3 80 B16R3.2583 OC1=CC2=C(C=C1)OC3=C2CCCC3 MCULE-5671976673 [0,1,0,0,0,0|2,0,0]=3 81 B16R3.2583 OC1CCC2=C(C1)C3=C(N2)C=CC=C3 MCULE-1425332117 [0,1,0,0,0,0|1,0,0]=2 82 B16R3.2583 [C@@H]12CCCC[C@@H]1C3=C(N2)C=CC(=C3)Br MCULE-1932920225 [0,1,0,0,0,0|1,0,2]=4 83 B16R3.2583 [C@@H]12CCCC[C@@H]1C3=C(N2)C=CC(=C3)Br MCULE-8118313296 [0,1,0,0,0,0|1,0,2]=4 84 B16R3.2583 [C@H]12CCN(C[C@@H]1C3=CC=CC=C3N2)C MCULE-4044468172 [0,1,0,0,0,0|0,0,2]=3 85 B16R3.2637 BrC1=CC2=C(C=C1)C3=C(N2)CCCC3 MCULE-6821209982 [0,1,0,0,0,0|1,0,0]=2 86 B16R3.2637 BrC1=CC2=C(C=C1)C3=C(N2)CCNC3 MCULE-6500944713 [0,1,0,0,0,0|0,0,0]=1 87 B16R3.2637 BrC1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-7277163229 [0,1,0,0,0,0|2,0,0]=3 88 B16R3.2637 BrC1=CC2=C(N=C1)C3=C(N2)CCCC3 MCULE-7948213007 [0,1,0,0,0,0|2,0,0]=3 89 B16R3.2637 BrC1=CC=C2C(=C1)NC3=C2CNCC3 MCULE-2359877075 [0,1,0,0,0,0|0,0,0]=1 90 B16R3.2637 BrC1=CC=C2C(=N1)NC3=C2CNCC3 MCULE-5274708801 [0,1,0,0,0,0|1,0,0]=2 91 B16R3.2637 BrC1=CC=C2C(=N1)NC3C2CNCC3 MCULE-1114762341 [0,1,0,0,0,0|1,0,2]=4 92 B16R3.2637 CC1=CC2=C(C=C1)C3CCCCC3N2 MCULE-4478413958 [0,1,0,0,0,0|1,0,2]=4 93 B16R3.2637 CC1CCN2C(=NC3=C2C=CC=C3)C1 MCULE-8492664804 [0,1,0,0,0,0|2,0,1]=4 94 B16R3.2637 CN1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-2318549673 [0,1,0,0,0,0|2,0,0]=3 95 B16R3.2637 C[N+]1=CC2=C(CC1)C3=C(N2)C=CC=C3 MCULE-1304770593 [0,1,0,0,0,0|2,0,1]=4 96 B16R3.2637 C[N+]1=CC2=C(CC1)C3=C(N2)C=CC=C3 MCULE-4957211827 [0,1,0,0,0,0|2,0,1]=4 97 B16R3.2637 ClC1=CC2=C(C=C1)C3=C(N2)CCNC3 MCULE-9560798173 [0,1,0,0,0,0|0,0,0]=1 98 B16R3.2637 ClC1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-1786810062 [0,1,0,0,0,0|2,0,0]=3 99 B16R3.2637 ClC1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-2377574286 [0,1,0,0,0,0|2,0,0]=3 100 B16R3.2637 ClC1=CC=C2C(=C1)NC3C2CNCC3 MCULE-5673173565 [0,1,0,0,0,0|0,0,2]=3 101 B16R3.2637 FC1=CC2=C(C=C1)C3=C(N2)CNCC3 MCULE-2334903028 [0,1,0,0,0,0|2,0,0]=3 102 B16R3.2637 NC1=CC2=C(C=C1)C3CCCCC3N2 MCULE-4746625328 [0,1,0,0,0,0|1,0,2]=4 103 B16R3.2637 NC1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-7431006251 [0,1,0,0,0,0|1,0,0]=2 104 B16R3.2637 O=C1CC2=C(CN1)C3=C(N2)C=CC=C3 MCULE-3979644775 [0,1,0,0,0,0|0,0,1]=2 105 B16R3.2637 O=C1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-1954151692 [0,1,0,0,0,0|1,0,1]=3 106 B16R3.2637 O=C1N=C2NC3=CC=CC=C3C2=NN1 MCULE-4521836550 [0,1,0,0,0,0|2,0,1]=4 107 B16R3.3329 BrC1=C2NC3=C(C2=CC=C1)CNCC3 MCULE-2326419697 [0,1,0,0,0,0|0,0,0]=1 108 B16R3.3329 BrC1=C2NC3=C(C2=CC=C1)CNCC3 MCULE-7950549183 [0,1,0,0,0,0|0,0,0]=1 109 B16R3.3329 BrC1=C2NC3=C(C2=CC=C1)CSCC3 MCULE-7550110495 [0,1,0,0,0,0|1,0,0]=2 110 B16R3.3329 BrC1=C2N[C@H]3CCNC[C@H]3C2=CC=C1 MCULE-7977709938 [0,1,0,0,0,0|0,0,2]=3 111 B16R3.3329 BrC1=CC=CC2=C1NC3=C2CCNC3 MCULE-7485983703 [0,1,0,0,0,0|2,0,0]=3 112 B16R3.3329 BrC1=CC=CC2=C1NC3C2CNCC3 MCULE-6707844424 [0,1,0,0,0,0|0,0,2]=3 113 B16R3.3329 CC1=C2NC3=C(C2=CC=C1)CCNC3 MCULE-7784572327 [0,1,0,0,0,0|2,0,0]=3 114 B16R3.3329 CC1=C2NC3=C(C2=CC=C1)CCNC3 MCULE-9696721547 [0,1,0,0,0,0|2,0,0]=3 115 B16R3.3329 CC1=C2NC3=C(C2=CC=C1)CNCC3 MCULE-1562686997 [0,1,0,0,0,0|0,0,0]=1 116 B16R3.3329 CC1=CC=CC2=C1NC3=C2CNCC3 MCULE-5024304636 [0,1,0,0,0,0|0,0,0]=1 117 B16R3.3329 CC1=NCCC2=C1NC3=C2C=CC=C3 MCULE-2765797747 [0,1,0,0,0,0|2,0,1]=4 118 B16R3.3329 CC1NCCC2=C1NC3=C2C=CC=C3 MCULE-3839421650 [0,1,0,0,0,0|2,0,0]=3 119 B16R3.3329 CC1NCCC2=C1NC3=CC=CC=C23 MCULE-3287499983 [0,1,0,0,0,0|2,0,0]=3 120 B16R3.3329 ClC1=C2NC3=C(C2=CC=C1)CCCC3 MCULE-9393585253 [0,1,0,0,0,0|1,0,0]=2 121 B16R3.3329 ClC1=C2NC3=C(C2=CC=C1)CNCC3 MCULE-7288715759 [0,1,0,0,0,0|0,0,0]=1 122 B16R3.3329 ClC1=CC=CC2=C1NC3=C2CNCC3 MCULE-2228906187 [0,1,0,0,0,0|0,0,0]=1 123 B16R3.3329 FC1=C2NC3=C(C2=CC=C1)CNCC3 MCULE-1456187624 [0,1,0,0,0,0|0,0,0]=1 124 B16R3.3329 FC1=CC=CC2=C1NC3=C2CNCC3 MCULE-2474674151 [0,1,0,0,0,0|0,0,0]=1 125 B16R3.3329 NC1=CC=CC2=C1OC3=C2CCCC3 MCULE-1808591308 [0,1,0,0,0,0|2,0,0]=3 126 B16R3.3329 NC1=CC=CC2=C1OC3=C2CCCC3 MCULE-7856735604 [0,1,0,0,0,0|2,0,0]=3 127 B16R3.3329 NC1CCCC2=C1NC3=C2C=CC=C3 MCULE-3493050433 [0,1,0,0,0,0|1,0,0]=2 128 B16R3.3329 NC1CCCC2=C1NC3=C2C=CC=C3 MCULE-5554185141 [0,1,0,0,0,0|1,0,0]=2 129 B16R3.3329 O=C1CCCC2=C1NC3=C2C=CC=C3 MCULE-8165438115 [0,1,0,0,0,0|1,0,1]=3 130 B16R3.3329 O=C1CCCC2=C1SC3=C2C=CC=C3 MCULE-9438365848 [0,1,0,0,0,0|2,0,1]=4 131 B16R3.3329 O=C1NCCC2=C1NC3=C2C=CC=C3 MCULE-9673359265 [0,1,0,0,0,0|2,0,1]=4 132 B16R3.3329 OC1CCCC2=C1NC3=CC=CC=C23 MCULE-8096623094 [0,1,0,0,0,0|1,0,0]=2 133 B16R3.3329 [C@H]12CCNC[C@H]1C3=C(N2)C(=CC=C3)Br MCULE-1501057999 [0,1,0,0,0,0|0,0,2]=3 134 B16R3.3329 [C@H]12CCNC[C@H]1C3=C(N2)C(=CC=C3)Br MCULE-3954665982 [0,1,0,0,0,0|0,0,2]=3 135 B16R3.20606 CN1C2=C(C=CC=C2)C3=C1CCNC3 MCULE-8242540915 [0,1,0,0,0,0|0,0,0]=1 136 B16R3.20606 CN1C2=C(C=CC=C2)C3=C1CNCC3 MCULE-1480707720 [0,1,0,0,0,0|2,0,0]=3 137 B16R3.20606 CN1C2=CC=CC=C2C3C1CCNC3 MCULE-2176885951 [0,1,0,0,0,0|0,0,2]=3 138 B16R3.20606 CN1C2=CC=CC=C2C3C1CCNC3 MCULE-5404217081 [0,1,0,0,0,0|0,0,2]=3 139 B16R3.20606 CN1C2=NCCCN2C3=C1C=CC=C3 MCULE-9280978026 [0,1,0,0,0,0|3,0,0]=4 140 B16R3.20606 CN1C2=[NH+]CCCN2C3=C1C=CC=C3 MCULE-5896636885 [0,1,0,0,0,0|3,0,0]=4 141 B16R3.20606 O=C1C2=C(C=CC=C2)C3C1CCNC3 MCULE-6737869864 [0,1,0,0,0,0|1,0,2]=4 142 B16R3.20606 O=C1C2=CC=CC=C2C3N1CCNC3 MCULE-8584526095 [0,1,0,0,0,0|2,0,1]=4 143 B16R3.20606 O=C1C2=CC=CC=C2C3N1CCNC3 MCULE-8785852578 [0,1,0,0,0,0|2,0,1]=4 144 B16R3.27838 BrC1=C2C(=CC=C1)NC3=C2CNCC3 MCULE-3421584187 [0,1,0,0,0,0|0,0,0]=1 145 B16R3.27838 BrC1=C2C(=CC=C1)NC3=C2CNCC3 MCULE-4046328193 [0,1,0,0,0,0|0,0,0]=1 146 B16R3.27838 ClC1=C2C(=NC=N1)NC3=C2CCCC3 MCULE-1106625914 [0,1,0,0,0,0|3,0,0]=4 147 B16R3.27838 FC1=CC=CC2=C1C3=C(N2)CNCC3 MCULE-3403637833 [0,1,0,0,0,0|2,0,0]=3 148 B16R3.27838 O=C1CCCC2=C1C3=C(N2)C=CC=C3 MCULE-1851720499 [0,1,0,0,0,0|1,0,1]=3 149 B16R3.27838 O=C1NC=CC2=C1C3=C(N2)CCCC3 MCULE-2220998954 [0,1,0,0,0,0|2,0,0]=3 150 B16R3.27838 OC1=C2C(=NC=N1)NC3=C2CCCC3 MCULE-6706042211 [0,1,0,0,0,0|3,0,0]=4 151 B14R2.3 CCCCN1C=CC2=CC=CC=C12 MCULE-5111709732 [0,0,1,0,0,0|3,0,0]=4 152 B14R2.3 CCCCN1C=NC2=C1C=CC=C2 MCULE-6256443076 [0,0,1,0,0,0|2,0,1]=4 153 B14R2.3 CCCCN1C=NC2=CC=CC=C12 MCULE-4822937951 [0,0,1,0,0,0|2,0,1]=4 154 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 MCULE-4097971327 [0,0,1,0,0,0|0,0,0]=1 155 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 MCULE-9425269407 [0,0,1,0,0,0|0,0,0]=1 156 B14R2.3 CNCCC1=CNC2=CC=CN=C12 MCULE-6308406696 [0,0,1,0,0,0|3,0,0]=4 157 B14R2.3 N#CCCC1=CNC2=CC=CC=C12 MCULE-9844349638 [0,0,1,0,0,0|2,0,1]=4 158 B14R2.3 NCCCC1=CNC2=C1C=CC=N2 MCULE-6962821583 [0,0,1,0,0,0|3,0,0]=4 159 B14R2.3 NCCCC1=CNC2=CC=CC=C12 MCULE-4742640218 [0,0,1,0,0,0|2,0,0]=3 160 B14R2.3 NCCSC1=CNC2=C1C=CC=C2 MCULE-5852531217 [0,0,1,0,0,0|3,0,0]=4 161 B14R2.3 NCCSC1=CNC2=C1C=CC=C2 MCULE-6122840857 [0,0,1,0,0,0|3,0,0]=4 162 B14R2.3 NNCCC1=CNC2=CC=CC=C12 MCULE-3881420803 [0,0,1,0,0,0|3,0,0]=4 163 B14R2.3 O=CCCC1=CNC2=CC=CC=C12 MCULE-6631491514 [0,0,1,0,0,0|2,0,1]=4 164 B14R2.3 OCCCC1=CNC2=C1C=CC=C2 MCULE-2483523215 [0,0,1,0,0,0|2,0,0]=3 165 B14R2.3 ON=CCC1=CNC2=C1C=CC=C2 MCULE-2984317759 [0,0,1,0,0,0|3,0,0]=4 166 B14R2.3 OOCCC1=CNC2=CC=CC=C12 MCULE-6615259809 [0,0,1,0,0,0|3,0,0]=4 167 B14R2.6 C1=CC(=CC=N1)NC2CCNCC2 MCULE-4262960038 [0,0,1,0,0,0|1,0,2]=4 168 B14R2.6 C1=CC(=CC=N1)NC2CCNCC2 MCULE-6295474727 [0,0,1,0,0,0|1,0,2]=4 169 B14R2.6 C1=CC(=CN=C1)NC2CCNCC2 MCULE-1449598235 [0,0,1,0,0,0|1,0,2]=4 170 B14R2.6 C1=CC=C(C=C1)C=C2CCCCC2 MCULE-8569996984 [0,0,1,0,0,0|2,0,1]=4 171 B14R2.6 C1=CC=C(C=C1)C=C2CCNCC2 MCULE-2903238350 [0,0,1,0,0,0|1,0,1]=3 172 B14R2.6 C1=CC=C(C=C1)C=C2CCNCC2 MCULE-9072764384 [0,0,1,0,0,0|1,0,1]=3 173 B14R2.6 C1=CC=C(C=C1)CC2CCNCC2 MCULE-9399214134 [0,0,1,0,0,0|1,0,2]=4 174 B14R2.6 C1=CC=C(C=C1)CN2CCNCC2 MCULE-1144586968 [0,0,1,0,0,0|2,0,1]=4 175 B14R2.6 C1=CC=C(C=C1)CN2CCNCC2 MCULE-2301913248 [0,0,1,0,0,0|2,0,1]=4 176 B14R2.6 C1=CC=C(C=C1)CN2CCNCC2 MCULE-3746428106 [0,0,1,0,0,0|2,0,1]=4 177 B14R2.6 C1=CC=C(C=C1)CN2CCNCC2 MCULE-7844552110 [0,0,1,0,0,0|2,0,1]=4 178 B14R2.6 C1=CC=C(C=C1)NC2=NCCCS2 MCULE-1261999789 [0,0,1,0,0,0|3,0,0]=4 179 B14R2.6 C1=CC=C(C=C1)NC2=NCCCS2 MCULE-5789913732 [0,0,1,0,0,0|3,0,0]=4 180 B14R2.6 C1=CC=C(C=C1)NC2=NCCOC2 MCULE-5076859525 [0,0,1,0,0,0|3,0,0]=4 181 B14R2.6 C1=CC=C(C=C1)NC2CCCCC2 MCULE-2061369885 [0,0,1,0,0,0|1,0,2]=4 182 B14R2.6 C1=CC=C(C=C1)NC2CCCCC2 MCULE-6051641261 [0,0,1,0,0,0|1,0,2]=4 183 B14R2.6 C1=CC=C(C=C1)NC2CCNCC2 MCULE-1922457631 [0,0,1,0,0,0|0,0,2]=3 184 B14R2.6 C1=CC=C(C=C1)NC2CCNCC2 MCULE-8572207377 [0,0,1,0,0,0|0,0,2]=3 185 B14R2.6 C1=CC=C(C=C1)NC2CCNCC2 MCULE-8858487972 [0,0,1,0,0,0|0,0,2]=3 186 B14R2.6 C1=CC=C(C=C1)NC2CCOCC2 MCULE-3857043530 [0,0,1,0,0,0|1,0,2]=4 187 B14R2.6 C1=CC=C(C=C1)NC2CCOCC2 MCULE-9821647293 [0,0,1,0,0,0|1,0,2]=4 188 B14R2.6 C1=CC=C(C=C1)NN2CCOCC2 MCULE-2520629938 [0,0,1,0,0,0|2,0,1]=4 189 B14R2.6 C1=CC=C(C=C1)OC2=CCCCC2 MCULE-2298366221 [0,0,1,0,0,0|2,0,0]=3 190 B14R2.6 C1=CC=C(C=C1)OC2CCNCC2 MCULE-6313249249 [0,0,1,0,0,0|1,0,2]=4 191 B14R2.6 C1=CC=C(C=C1)OC2CCNCC2 MCULE-7870311752 [0,0,1,0,0,0|1,0,2]=4 192 B14R2.6 C1=CC=C(C=C1)SC2CCNCC2 MCULE-8312066372 [0,0,1,0,0,0|1,0,2]=4 193 B14R2.6 C1=CC=C(C=C1)SC2CCNCC2 MCULE-9346707429 [0,0,1,0,0,0|1,0,2]=4 194 B14R2.6 C1=CN=C(C=C1)NC2CCNCC2 MCULE-6522904528 [0,0,1,0,0,0|1,0,2]=4 195 B14R2.6 C1=CN=C(C=C1)NC2CCNCC2 MCULE-8087493697 [0,0,1,0,0,0|1,0,2]=4 196 B14R2.24 BrC1=C(C=CC=C1)C2CNCCO2 MCULE-8291330509 [0,0,1,0,0,0|2,0,1]=4 197 B14R2.24 BrC1=C(C=CC=C1)[C@H]2CCCNC2 MCULE-1435239636 [0,0,1,0,0,0|1,0,2]=4 198 B14R2.24 BrC1=C(C=CC=C1)[C@H]2CCCNC2 MCULE-2449205373 [0,0,1,0,0,0|1,0,2]=4 199 B14R2.24 BrC1=CC=CC=C1C2CNCCN2 MCULE-7613097742 [0,0,1,0,0,0|2,0,1]=4 200 B14R2.24 BrC1=CC=CC=C1[C@@H]2CCCNC2 MCULE-3873975290 [0,0,1,0,0,0|1,0,2]=4 201 B14R2.24 BrC1=CC=CC=C1[C@@H]2CCCNC2 MCULE-9792148885 [0,0,1,0,0,0|1,0,2]=4 202 B14R2.24 BrC1=CC=CC=C1[C@@H]2CNCCN2 MCULE-1231701599 [0,0,1,0,0,0|2,0,1]=4 203 B14R2.24 BrC1=CC=CC=C1[C@@H]2CNCCN2 MCULE-4916064559 [0,0,1,0,0,0|2,0,1]=4 204 B14R2.24 BrC1=CC=CC=C1[C@H]2CNCCN2 MCULE-6280901288 [0,0,1,0,0,0|2,0,1]=4 205 B14R2.24 BrC1=CC=CC=C1[C@H]2CNCCN2 MCULE-7738521098 [0,0,1,0,0,0|2,0,1]=4 206 B14R2.24 CC1=C(C=CC=C1)C2=CCNCC2 MCULE-7991796529 [0,0,1,0,0,0|3,0,0]=4 207 B14R2.24 CC1=C(C=CC=C1)C2=CCNCC2 MCULE-9050124133 [0,0,1,0,0,0|3,0,0]=4 208 B14R2.24 CC1=C(C=CC=C1)C2CCCNC2 MCULE-1694760560 [0,0,1,0,0,0|1,0,2]=4 209 B14R2.24 CC1=C(C=CC=C1)C2CCCNC2 MCULE-2764747661 [0,0,1,0,0,0|1,0,2]=4 210 B14R2.24 CC1=C(C=CC=C1)C2CNCCO2 MCULE-3405637396 [0,0,1,0,0,0|2,0,1]=4 211 B14R2.24 CC1=CC=CC=C1C2CNCCN2 MCULE-1562225115 [0,0,1,0,0,0|2,0,1]=4 212 B14R2.24 CC1=CC=CC=C1C2CNCCN2 MCULE-3715529862 [0,0,1,0,0,0|2,0,1]=4 213 B14R2.24 CC1=CC=CC=C1C2CNCCN2 MCULE-9495234418 [0,0,1,0,0,0|2,0,1]=4 214 B14R2.24 CC1CCNCC1C2=CC=CC=C2 MCULE-6494947862 [0,0,1,0,0,0|1,0,2]=4 215 B14R2.24 CC1CCNCC1C2=CC=CC=C2 MCULE-7673488701 [0,0,1,0,0,0|1,0,2]=4 216 B14R2.24 CN1CCNCC1C2=CC=CC=C2 MCULE-6690890859 [0,0,1,0,0,0|2,0,1]=4 217 B14R2.24 CN1CCNCC1C2=CC=CC=C2 MCULE-9658567665 [0,0,1,0,0,0|2,0,1]=4 218 B14R2.24 ClC1=C(C=CC=C1)C2CNCCN2 MCULE-8086503421 [0,0,1,0,0,0|2,0,1]=4 219 B14R2.24 ClC1=C(C=CC=C1)C2CNCCO2 MCULE-1252832334 [0,0,1,0,0,0|2,0,1]=4 220 B14R2.24 ClC1=C(C=CC=C1)[C@@H]2CNCCN2 MCULE-2330140107 [0,0,1,0,0,0|2,0,1]=4 221 B14R2.24 ClC1=C(C=CC=C1)[C@@H]2CNCCN2 MCULE-9457592467 [0,0,1,0,0,0|2,0,1]=4 222 B14R2.24 ClC1=C(C=CC=C1)[C@H]2CNCCN2 MCULE-3714195831 [0,0,1,0,0,0|2,0,1]=4 223 B14R2.24 ClC1=C(C=CC=C1)[C@H]2CNCCN2 MCULE-7437262198 [0,0,1,0,0,0|2,0,1]=4 224 B14R2.24 ClC1=CC=CC=C1C2CNCCO2 MCULE-7883648170 [0,0,1,0,0,0|2,0,1]=4 225 B14R2.24 ClC1=CC=CC=C1C2CNCCS2 MCULE-5599754485 [0,0,1,0,0,0|2,0,1]=4 226 B14R2.24 ClC1=CC=CC=C1C2CNCCS2 MCULE-9353726213 [0,0,1,0,0,0|2,0,1]=4 227 B14R2.24 FC1=C(C=CC=C1)C2=CCNCC2 MCULE-9618982020 [0,0,1,0,0,0|3,0,0]=4 228 B14R2.24 FC1=C(C=CC=C1)C2CCCNC2 MCULE-6368959438 [0,0,1,0,0,0|1,0,2]=4 229 B14R2.24 FC1=C(C=CC=C1)C2CNCCN2 MCULE-3976395820 [0,0,1,0,0,0|2,0,1]=4 230 B14R2.24 FC1=C(C=CC=C1)C2CNCCN2 MCULE-9457088063 [0,0,1,0,0,0|2,0,1]=4 231 B14R2.24 FC1=C(C=CC=C1)C2CNCCO2 MCULE-9428579710 [0,0,1,0,0,0|2,0,1]=4 232 B14R2.24 FC1=CC=CC=C1C2CCCNC2 MCULE-1864576956 [0,0,1,0,0,0|1,0,2]=4 233 B14R2.24 FC1=CC=CC=C1C2CNCCO2 MCULE-2569704671 [0,0,1,0,0,0|2,0,1]=4 234 B14R2.24 FC1=CC=CC=C1[C@@H]2CNCCN2 MCULE-4601555589 [0,0,1,0,0,0|2,0,1]=4 235 B14R2.24 FC1=CC=CC=C1[C@@H]2CNCCN2 MCULE-5648235106 [0,0,1,0,0,0|2,0,1]=4 236 B14R2.24 FC1=CC=CC=C1[C@H]2CNCCN2 MCULE-7027092667 [0,0,1,0,0,0|2,0,1]=4 237 B14R2.24 FC1=CC=CC=C1[C@H]2CNCCN2 MCULE-7594766584 [0,0,1,0,0,0|2,0,1]=4 238 B14R2.24 NC1=C(C=CC=C1)N2CCCCC2 MCULE-4076095392 [0,0,1,0,0,0|2,0,1]=4 239 B14R2.24 NC1=NC=CC=C1[C@@H]2CNCCN2 MCULE-5807202533 [0,0,1,0,0,0|2,0,1]=4 240 B14R2.24 NC1=NC=CC=C1[C@@H]2CNCCN2 MCULE-9629276588 [0,0,1,0,0,0|2,0,1]=4 241 B14R2.24 NC1=NC=CC=C1[C@H]2CNCCN2 MCULE-2082130616 [0,0,1,0,0,0|2,0,1]=4 242 B14R2.24 NC1=NC=CC=C1[C@H]2CNCCN2 MCULE-3249250044 [0,0,1,0,0,0|2,0,1]=4 243 B14R2.24 NC1CCCCC1C2=CC=CC=C2 MCULE-7985714463 [0,0,1,0,0,0|1,0,2]=4 244 B14R2.24 N[C@@H]1CCCC[C@H]1C2=CC=CC=C2 MCULE-6329655772 [0,0,1,0,0,0|1,0,2]=4 245 B14R2.24 O=C1CCCC=C1C2=CC=CC=C2 MCULE-7566864552 [0,0,1,0,0,0|2,0,1]=4 246 B14R2.24 O=C1CCCCC1C2=CC=CC=C2 MCULE-1879758913 [0,0,1,0,0,0|2,0,1]=4 247 B14R2.24 O=C1CCCCN1C2=CC=CC=C2 MCULE-3003309389 [0,0,1,0,0,0|3,0,0]=4 248 B14R2.24 O=C1CCNCC1C2=CC=CC=C2 MCULE-5175026393 [0,0,1,0,0,0|1,0,1]=3 249 B14R2.24 O=C1CCNCC1C2=CC=CC=C2 MCULE-9463400822 [0,0,1,0,0,0|1,0,1]=3 250 B14R2.24 O=C1CCOCC1C2=CC=CC=C2 MCULE-7943986328 [0,0,1,0,0,0|2,0,1]=4 251 B14R2.24 OC1=CC=CC=C1C2CCCNC2 MCULE-5380346867 [0,0,1,0,0,0|1,0,2]=4 252 B14R2.24 OC1=CC=CC=C1C2CCCNC2 MCULE-6700150684 [0,0,1,0,0,0|1,0,2]=4 253 B14R2.24 OC1=CC=CC=C1[C@@H]2CNCCN2 MCULE-1396380257 [0,0,1,0,0,0|2,0,1]=4 254 B14R2.24 OC1=CC=CC=C1[C@@H]2CNCCN2 MCULE-8843550682 [0,0,1,0,0,0|2,0,1]=4 255 B14R2.24 OC1=CC=CC=C1[C@H]2CNCCN2 MCULE-5190666150 [0,0,1,0,0,0|2,0,1]=4 256 B14R2.24 OC1=CC=CC=C1[C@H]2CNCCN2 MCULE-7442086257 [0,0,1,0,0,0|2,0,1]=4 257 B14R2.24 OC1CCNCC1C2=CC=CC=C2 MCULE-2175644105 [0,0,1,0,0,0|1,0,2]=4 258 B14R2.24 [C@@H]1(CNCCN1)C2=CC=CC=C2C MCULE-5343961185 [0,0,1,0,0,0|2,0,1]=4 259 B14R2.24 [C@@H]1(CNCCN1)C2=CC=CC=C2C MCULE-7269889388 [0,0,1,0,0,0|2,0,1]=4 260 B14R2.24 [C@@H]1(CNCCN1)C2=CC=CC=C2I MCULE-5855496362 [0,0,1,0,0,0|2,0,1]=4 261 B14R2.24 [C@@H]1(CNCCN1)C2=CC=CC=C2I MCULE-6468419751 [0,0,1,0,0,0|2,0,1]=4 262 B14R2.24 [C@H]1(CNCCN1)C2=CC=CC=C2C MCULE-2155481794 [0,0,1,0,0,0|2,0,1]=4 263 B14R2.24 [C@H]1(CNCCN1)C2=CC=CC=C2C MCULE-9130875717 [0,0,1,0,0,0|2,0,1]=4 264 B14R2.24 [C@H]1(CNCCN1)C2=CC=CC=C2I MCULE-1190756795 [0,0,1,0,0,0|2,0,1]=4 265 B14R2.24 [C@H]1(CNCCN1)C2=CC=CC=C2I MCULE-8431394499 [0,0,1,0,0,0|2,0,1]=4 266 B14R2.44 CCCC1=NC2=CC=CC=C2N1C MCULE-8941372750 [0,0,1,0,0,0|2,0,1]=4 267 B14R2.44 CCCC1=[N+](C2=C(S1)C=CC=C2)C MCULE-5412886430 [0,0,1,0,0,0|3,0,0]=4 268 B14R2.44 CCCC1=[N+](C2=C(S1)C=CC=C2)C MCULE-5487847872 [0,0,1,0,0,0|3,0,0]=4 269 B14R2.44 CN1C(=CC2=CC=CC=C12)CCO MCULE-2235158946 [0,0,1,0,0,0|3,0,0]=4 270 B14R2.44 CN1C(=NC2=C1C=CC=C2)CCCl MCULE-5520857969 [0,0,1,0,0,0|2,0,1]=4 271 B14R2.44 CN1C(=NC2=C1C=CC=C2)CCCl MCULE-6488673462 [0,0,1,0,0,0|2,0,1]=4 272 B14R2.44 CN1C(=NC2=C1C=CC=C2)CCN MCULE-1097735966 [0,0,1,0,0,0|1,0,1]=3 273 B14R2.44 CN1C(=NC2=C1C=CC=C2)CCO MCULE-8687270194 [0,0,1,0,0,0|2,0,1]=4 274 B14R2.44 CN1C(=NC2=C1N=CC=C2)CCN MCULE-5144973547 [0,0,1,0,0,0|2,0,1]=4 275 B14R2.44 CN1C(=NC2=C1N=CC=C2)CCN MCULE-8810655976 [0,0,1,0,0,0|2,0,1]=4 276 B14R2.44 CN1C2=CC=CC=C2N=C1CCN MCULE-3325449707 [0,0,1,0,0,0|1,0,1]=3 277 B14R2.44 CN1C2=CC=CC=C2N=C1CCN MCULE-3605767239 [0,0,1,0,0,0|1,0,1]=3 278 B14R2.44 CNCC1=C(C2=CC=CC=C2N1)C MCULE-1179687391 [0,0,1,0,0,0|2,0,0]=3 279 B14R2.44 CNCC1=C(C2=CC=CC=C2N1)C MCULE-9844726700 [0,0,1,0,0,0|2,0,0]=3 280 B14R2.44 CNCC1=C(C2=CC=CC=C2O1)C MCULE-1126861622 [0,0,1,0,0,0|3,0,0]=4 281 B14R2.44 NCCN1CC2=CC=CC=C2C1=O MCULE-2132500840 [0,0,1,0,0,0|3,0,0]=4 282 B14R2.44 NCCN1CC2=CC=CC=C2C1=O MCULE-4934391049 [0,0,1,0,0,0|3,0,0]=4 283 B14R2.44 NCCN1CC2=CC=CC=C2C1=O MCULE-8630165021 [0,0,1,0,0,0|3,0,0]=4 284 B14R2.67 BrCCCC1=NC2=C(N1)C=CC=C2 MCULE-2798697158 [0,0,1,0,0,0|3,0,0]=4 285 B14R2.67 BrCCCC1=NC2=CC=CC=C2N1 MCULE-3004338350 [0,0,1,0,0,0|3,0,0]=4 286 B14R2.67 CCCCC1=CC2=C(O1)C=CC=C2 MCULE-3407406765 [0,0,1,0,0,0|2,0,0]=3 287 B14R2.67 CCCCC1=CC2=CC=CC=C2C1 MCULE-9229330668 [0,0,1,0,0,0|2,0,0]=3 288 B14R2.67 CCCCC1=NC2=C(S1)C=CC=C2 MCULE-9389314271 [0,0,1,0,0,0|2,0,1]=4 289 B14R2.67 CCCCC1=NC2=CC=CC=C2N1 MCULE-1446161748 [0,0,1,0,0,0|2,0,0]=3 290 B14R2.67 CCCNC1=NC2=CC=CC=C2N1 MCULE-8523014155 [0,0,1,0,0,0|3,0,0]=4 291 B14R2.67 CCCOC1=NC2=CC=CC=C2N1 MCULE-4248181464 [0,0,1,0,0,0|3,0,0]=4 292 B14R2.67 CCCSC1=NC2=C(N1)C=CC=C2 MCULE-7353209442 [0,0,1,0,0,0|3,0,0]=4 293 B14R2.67 CCNCC1=CC2=C(O1)C=CC=C2 MCULE-2413219460 [0,0,1,0,0,0|3,0,0]=4 294 B14R2.67 CCNCC1=CC2=C(O1)C=CC=C2 MCULE-7060756126 [0,0,1,0,0,0|3,0,0]=4 295 B14R2.67 CCNCC1=CC2=CC=CC=C2S1 MCULE-3070900597 [0,0,1,0,0,0|3,0,0]=4 296 B14R2.67 CCNCC1=CC2=CC=CC=C2S1 MCULE-5765444661 [0,0,1,0,0,0|3,0,0]=4 297 B14R2.67 CCSCC1=NC2=C(N1)C=CC=C2 MCULE-9689707532 [0,0,1,0,0,0|3,0,0]=4 298 B14R2.67 CNCCC1=NC2=CC=CC=C2N1 MCULE-6834316505 [0,0,1,0,0,0|1,0,0]=2 299 B14R2.67 CNCCC1=NC2=CC=CC=C2N1 MCULE-9785541364 [0,0,1,0,0,0|1,0,0]=2 300 B14R2.67 COCCC1=NC2=C(N1)C=CC=C2 MCULE-3543511994 [0,0,1,0,0,0|2,0,0]=3 301 B14R2.67 ClCCCC1=NC2=C(N1)C=CC=C2 MCULE-4864635790 [0,0,1,0,0,0|3,0,0]=4 302 B14R2.67 ClCCCC1=NC2=C(N1)C=CC=C2 MCULE-7273570737 [0,0,1,0,0,0|3,0,0]=4 303 B14R2.67 NCCCC1=CC2=C(O1)C=CC=C2 MCULE-6136402505 [0,0,1,0,0,0|3,0,0]=4 304 B14R2.67 NCCCC1=NC2=C(N1)C=CC=C2 MCULE-6689132128 [0,0,1,0,0,0|3,0,0]=4 305 B14R2.67 NCCCC1=NC2=C(N1)C=CC=C2 MCULE-6862216045 [0,0,1,0,0,0|3,0,0]=4 306 B14R2.67 NCCCC1=NC2=CC=CC=C2N1 MCULE-8693404083 [0,0,1,0,0,0|3,0,0]=4 307 B14R2.67 OCCCC1=CC2=C(N1)C=CC=C2 MCULE-8873780691 [0,0,1,0,0,0|2,0,0]=3 308 B14R2.67 OCCCC1=NC2=C(N1)C=CC=C2 MCULE-3069913647 [0,0,1,0,0,0|3,0,0]=4 309 B14R2.67 OCCCC1=NC2=C(N1)C=CC=C2 MCULE-5981833025 [0,0,1,0,0,0|3,0,0]=4 310 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)/C=N/O MCULE-6686562011 [0,0,1,0,0,0|1,0,2]=4 311 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CC#N MCULE-5380835406 [0,0,1,0,0,0|2,0,0]=3 312 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCN MCULE-3061128016 [0,0,1,0,0,0|2,0,0]=3 313 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCN MCULE-5001253895 [0,0,1,0,0,0|2,0,0]=3 314 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCN MCULE-8552900859 [0,0,1,0,0,0|2,0,0]=3 315 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCO MCULE-3951073177 [0,0,1,0,0,0|2,0,0]=3 316 B14R2.517 CC1=C(C2=C(O1)C=CC=C2)CCN MCULE-3395133305 [0,0,1,0,0,0|3,0,0]=4 317 B14R2.517 CC1=C(C2=C(O1)C=CC=C2)CCN MCULE-8844943169 [0,0,1,0,0,0|3,0,0]=4 318 B14R2.517 CC1=C(C2=CC=CC=C2N1)C=NO MCULE-6711281450 [0,0,1,0,0,0|1,0,2]=4 319 B14R2.517 CC1=C(C2=CC=CC=C2N1)CCN MCULE-7938887796 [0,0,1,0,0,0|2,0,0]=3 320 B14R2.517 CC1=C(C2=CC=CN=C2N1)CC#N MCULE-2441941346 [0,0,1,0,0,0|3,0,0]=4 321 B14R2.517 CCCN1C(=O)NC2=CC=CC=C12 MCULE-3910055339 [0,0,1,0,0,0|3,0,0]=4 322 B14R2.517 CCCN1C(=S)NC2=CC=CC=C12 MCULE-9563859994 [0,0,1,0,0,0|3,0,0]=4 323 B14R2.517 CCC[N+]1=C(SC2=CC=CC=C12)C MCULE-4145070803 [0,0,1,0,0,0|3,0,0]=4 324 B14R2.517 CCC[N+]1=C(SC2=CC=CC=C12)C MCULE-6034642723 [0,0,1,0,0,0|3,0,0]=4 325 B14R2.517 CNCC1=C(N=C2N1C=CC=C2)C MCULE-3476212419 [0,0,1,0,0,0|1,0,1]=3 326 B14R2.517 CNCC1=C(N=C2N1C=CC=C2)C MCULE-7205945753 [0,0,1,0,0,0|1,0,1]=3 327 B14R2.517 CNCC1=C(NC2=C1C=CC=C2)C MCULE-3991508517 [0,0,1,0,0,0|0,0,0]=1 328 B14R2.517 CNCC1=C(NC2=CC=CC=C12)Cl MCULE-4048992116 [0,0,1,0,0,0|1,0,0]=2 329 B14R2.517 CNCC1=C(OC2=C1C=CC=C2)C MCULE-3072931276 [0,0,1,0,0,0|1,0,0]=2 330 B14R2.517 CSCN1C(=NC2=C1C=CC=C2)C MCULE-3308292994 [0,0,1,0,0,0|2,0,1]=4 331 B14R2.1129 CCC1=C(C2=C(O1)C=CC=C2)C#N MCULE-4858255197 [0,0,1,0,0,0|1,0,2]=4 332 B14R2.1129 CCC1=C(C2=C(O1)C=CC=C2)C=O MCULE-5345847813 [0,0,1,0,0,0|2,0,1]=4 333 B14R2.1129 CCC1=C(C2=CC=CC=C2S1)C=O MCULE-6672655269 [0,0,1,0,0,0|2,0,1]=4 334 B14R3.49 C1=CC2=C(C=C1)C3=C(C2)N=NN3 MCULE-1895872198 [0,0,0,0,1,0|3,0,0]=4 335 B14R3.49 C1=CC2=C(C=C1)C3=C(N2)CNC3 MCULE-7964694827 [0,0,0,0,1,0|0,0,0]=1 336 B14R3.49 C1=CC2=C(C=C1)C3=C(N2)SN=C3 MCULE-2490936316 [0,0,0,0,1,0|1,0,2]=4 337 B14R3.49 C1=CC2=C(C=C1)C3CCCC3N2 MCULE-9258889806 [0,0,0,0,1,0|0,0,2]=3 338 B14R3.49 C1=CC2=C(C=C1)N3CCCC3=N2 MCULE-8229085841 [0,0,0,0,1,0|1,0,1]=3 339 B14R3.49 C1=CC2=C(C=C1)N3CCN=C3N2 MCULE-7087439747 [0,0,0,0,1,0|2,0,0]=3 340 B14R3.49 C1=CC2=C(C=C1)N3CCSC3=N2 MCULE-5165790646 [0,0,0,0,1,0|2,0,1]=4 341 B14R3.49 C1=CC2=C(C=C1)[N+]3=C(S2)SCC3 MCULE-3576248121 [0,0,0,0,1,0|3,0,0]=4 342 B14R3.49 C1=CC2=C(C=C1)[N+]3=C(S2)SCC3 MCULE-6105828527 [0,0,0,0,1,0|3,0,0]=4 343 B14R3.49 C1=CC=C2C(=C1)NC3=C2CCC3 MCULE-5827398027 [0,0,0,0,1,0|0,0,0]=1 344 B14R3.49 C1=CC=C2C(=C1)NC3=C2CNC3 MCULE-3868380732 [0,0,0,0,1,0|0,0,0]=1 345 B14R3.49 C1=CC=C2C(=C1)SC3=[N+]2CCC3 MCULE-1505575067 [0,0,0,0,1,0|2,0,0]=3 346 B14R3.49 C1=CC=C2C(=C1)SC3=[N+]2CCC3 MCULE-8444669610 [0,0,0,0,1,0|2,0,0]=3 347 B16R3.9 C1=CC2=C(C=C1)C3=C(C=N2)CCCC3 MCULE-2706973479 [0,0,0,0,0,1|1,0,1]=3 348 B16R3.9 C1=CC2=C(C=C1)C3CNCCN3CC2 MCULE-3303137952 [0,0,0,0,0,1|2,0,1]=4 349 B16R3.9 C1=CC2=C(C=C1)C3CNCCN3CC2 MCULE-4486377116 [0,0,0,0,0,1|2,0,1]=4 350 B16R3.9 C1=CC2=C(C=C1)C3CNCCN3CC2 MCULE-7240982225 [0,0,0,0,0,1|2,0,1]=4 351 B16R3.9 C1=CC2=C(C=C1)N3CCCCC3CN2 MCULE-8384352700 [0,0,0,0,0,1|2,0,1]=4 352 B16R3.9 C1=CC2=C(C=C1)[C@@H]3CNCCN3CC2 MCULE-5395180861 [0,0,0,0,0,1|2,0,1]=4 353 B16R3.9 C1=CC2=C(C=C1)[C@@H]3CNCCN3CC2 MCULE-5478425977 [0,0,0,0,0,1|2,0,1]=4 354 B16R3.9 C1=CC=C2C(=C1)CCN3C2CNCC3 MCULE-3741983922 [0,0,0,0,0,1|2,0,1]=4 355 B16R3.9 C1=CC=C2C(=C1)CCN3[C@@H]2CNCC3 MCULE-4268522601 [0,0,0,0,0,1|2,0,1]=4 356 B16R3.9 C1=CC=C2C(=C1)CCN3[C@@H]2CNCC3 MCULE-5733779728 [0,0,0,0,0,1|2,0,1]=4 357 B16R3.9 C1=CC=C2C(=C1)CCN3[C@@H]2CNCC3 MCULE-7541856427 [0,0,0,0,0,1|2,0,1]=4 358 B16R3.9 C1=CC=C2C(=C1)CCN3[C@H]2CNCC3 MCULE-3558061780 [0,0,0,0,0,1|2,0,1]=4 359 B16R3.9 C1=CC=C2C(=C1)CCN3[C@H]2CNCC3 MCULE-9566285926 [0,0,0,0,0,1|2,0,1]=4 360 B16R3.9 C1=CC=C2C(=C1)CN=C3N2CCCC3 MCULE-4473359188 [0,0,0,0,0,1|2,0,1]=4 361 B16R3.9 C1=CC=C2C(=C1)CN=C3N2CCCC3 MCULE-5026748272 [0,0,0,0,0,1|2,0,1]=4 362 B16R3.9 C1=CC=C2C(=C1)OCC3=C2CNNC3 MCULE-4156554566 [0,0,0,0,0,1|2,0,0]=3 363 B16R3.9 [C@@H]12CCCCN1C3=C(C=CC=C3)NC2 MCULE-8638223943 [0,0,0,0,0,1|2,0,1]=4 364 B16R3.9 [C@H]12CCCCN1C3=C(C=CC=C3)NC2 MCULE-9253827666 [0,0,0,0,0,1|2,0,1]=4 365 B16R3.9 [C@H]12CNCCN1CCC3=C2C=CC=C3 MCULE-3047709143 [0,0,0,0,0,1|2,0,1]=4 366 B16R3.9 [C@H]12CNCCN1CCC3=C2C=CC=C3 MCULE-9471987685 [0,0,0,0,0,1|2,0,1]=4 367 B16R3.1720 C1=CC2=C(C=C1)N=C3CCCCC3=N2 MCULE-9162835146 [0,0,0,0,0,1|1,0,1]=3 368 B16R3.1720 C1=CC2=C(C=C1)NC3CCCCC3C2 MCULE-5593553596 [0,0,0,0,0,1|1,0,2]=4 369 B16R3.1720 C1=CC2=C(C=N1)C=C3CNCCC3=N2 MCULE-7993145328 [0,0,0,0,0,1|1,0,1]=3 370 B16R3.1720 C1=CC2=CC3=C(CCCC3)N=C2C=C1 MCULE-9376392408 [0,0,0,0,0,1|1,0,1]=3 371 B16R3.1720 C1=CN=C2N=C3CCNCC3=CC2=C1 MCULE-5971047753 [0,0,0,0,0,1|1,0,1]=3 372 B16R3.1720 C1=CN=C2N=C3CCNCC3=CC2=C1 MCULE-7695396308 [0,0,0,0,0,1|1,0,1]=3 373 B16R3.1720 C1=CN=C2N=C3CCOCC3=CC2=C1 MCULE-1090403238 [0,0,0,0,0,1|2,0,1]=4 374 B16R3.1722 C1=CC2=C(C=C1)C3=C(N2)CCCCC3 MCULE-8668206229 [0,0,0,0,0,1|1,0,0]=2 375 B16R3.1722 C1=CC2=C(C=C1)C3=C(N2)CCCNC3 MCULE-3213454322 [0,0,0,0,0,1|0,0,0]=1 376 B16R3.1722 C1=CC2=C(C=C1)C3=C(N2)CCCNC3 MCULE-4691578843 [0,0,0,0,0,1|0,0,0]=1 377 B16R3.1722 C1=CC2=C(C=C1)C3=C(N2)CCNCC3 MCULE-2272757880 [0,0,0,0,0,1|0,0,0]=1 378 B16R3.1722 C1=CC2=C(C=C1)N3CCCNCC3=C2 MCULE-1813700411 [0,0,0,0,0,1|3,0,0]=4 379 B16R3.1722 C1=CC2=C(C=C1)N3CCCNCC3=C2 MCULE-5717455436 [0,0,0,0,0,1|3,0,0]=4 380 B16R3.1722 C1=CC=C2C(=C1)N=C3N2CCCCN3 MCULE-1050402979 [0,0,0,0,0,1|2,0,1]=4 381 B16R3.1722 C1=CC=C2C(=C1)N=C3N2CCNCC3 MCULE-5371669580 [0,0,0,0,0,1|1,0,1]=3 382 B16R3.1722 C1=CC=C2C(=C1)NC3=C2CCCNC3 MCULE-4752378298 [0,0,0,0,0,1|1,0,0]=2 383 B13R2.1 BrCCC1=CNC2=CC=CC=C12 MCULE-7970040548 [1,0,1,0,0,0|1,0,0]=3 384 B13R2.1 C=CCC1=CNC2=C1C=CC=C2 MCULE-3755785484 [1,0,1,0,0,0|0,0,2]=4 385 B13R2.1 CCCN1C=CC2=C1C=CC=C2 MCULE-1860139388 [1,0,1,0,0,0|2,0,0]=4 386 B13R2.1 CCCN1C=NC2=C1C=CC=C2 MCULE-6531641989 [1,0,1,0,0,0|1,0,1]=4 387 B13R2.1 CCCN1C=NC2=C1C=CC=C2 MCULE-6800421343 [1,0,1,0,0,0|1,0,1]=4 388 B13R2.1 CCCN1C=NC2=CC=CC=C12 MCULE-1523679554 [1,0,1,0,0,0|1,0,1]=4 389 B13R2.1 CCNC1=C2C=CC=CC2=NS1 MCULE-3744782418 [1,0,1,0,0,0|1,0,1]=4 390 B13R2.1 CCNC1=NSC2=C1C=CC=C2 MCULE-9401600778 [1,0,1,0,0,0|2,0,0]=4 391 B13R2.1 CCOC1=NNC2=CC=CC=C12 MCULE-8037093270 [1,0,1,0,0,0|2,0,0]=4 392 B13R2.1 CNCC1=CN=C2N1C=CC=C2 MCULE-1159612009 [1,0,1,0,0,0|1,0,1]=4 393 B13R2.1 CNCC1=CN=C2N1C=CC=C2 MCULE-2872900939 [1,0,1,0,0,0|1,0,1]=4 394 B13R2.1 CNCC1=CNC2=C1C=CC=C2 MCULE-9047737801 [1,0,1,0,0,0|0,0,0]=2 395 B13R2.1 CNCC1=CNC2=NC=CC=C12 MCULE-5684641489 [1,0,1,0,0,0|1,0,0]=3 396 B13R2.1 CNCC1=CNC2=NC=CC=C12 MCULE-6551207812 [1,0,1,0,0,0|1,0,0]=3 397 B13R2.1 CNCC1=COC2=CC=CC=C12 MCULE-6950410380 [1,0,1,0,0,0|1,0,0]=3 398 B13R2.1 CNCC1=COC2=CC=CC=C12 MCULE-9111623154 [1,0,1,0,0,0|1,0,0]=3 399 B13R2.1 CNCC1=CSC2=C1C=CC=C2 MCULE-4376202521 [1,0,1,0,0,0|1,0,0]=3 400 B13R2.1 CNCC1=CSC2=C1C=CC=C2 MCULE-5470793084 [1,0,1,0,0,0|1,0,0]=3 401 B13R2.1 COCC1=CNC2=CC=CC=C12 MCULE-1453715736 [1,0,1,0,0,0|1,0,0]=3 402 B13R2.1 ClCCC1=CNC2=C1C=CC=C2 MCULE-9877505951 [1,0,1,0,0,0|1,0,0]=3 403 B13R2.1 ClCCC1=CNC2=NC=CC=C12 MCULE-3079129470 [1,0,1,0,0,0|2,0,0]=4 404 B13R2.1 N#CCC1=CNC2=C1C=CC=C2 MCULE-6428652739 [1,0,1,0,0,0|1,0,1]=4 405 B13R2.1 NCCC1=CCC2=C1C=CC=C2 MCULE-2661013112 [1,0,1,0,0,0|2,0,0]=4 406 B13R2.1 NCCC1=CCC2=C1C=CC=C2 MCULE-5998677222 [1,0,1,0,0,0|2,0,0]=4 407 B13R2.1 NCCC1=CNC2=C1C=CC=C2 MCULE-6402431765 [1,0,1,0,0,0|1,0,0]=3 408 B13R2.1 NCCC1=CNC2=C1C=CC=N2 MCULE-6871527636 [1,0,1,0,0,0|2,0,0]=4 409 B13R2.1 NCCC1=CNC2=C1C=CN=C2 MCULE-1726648661 [1,0,1,0,0,0|2,0,0]=4 410 B13R2.1 NCCC1=CNC2=C1C=CN=C2 MCULE-7587127908 [1,0,1,0,0,0|2,0,0]=4 411 B13R2.1 NCCC1=CNC2=C1C=NC=C2 MCULE-3986262249 [1,0,1,0,0,0|2,0,0]=4 412 B13R2.1 NCCC1=CNC2=C1C=NC=C2 MCULE-7073983222 [1,0,1,0,0,0|2,0,0]=4 413 B13R2.1 NCCC1=CNC2=C1N=CC=C2 MCULE-5172198608 [1,0,1,0,0,0|2,0,0]=4 414 B13R2.1 NCCC1=CNC2=CC=CN=C12 MCULE-5751228184 [1,0,1,0,0,0|2,0,0]=4 415 B13R2.1 NCCC1=CNC2=NC=CC=C12 MCULE-5729961356 [1,0,1,0,0,0|2,0,0]=4 416 B13R2.1 NCCC1=CNC2=NC=CC=C12 MCULE-9632213722 [1,0,1,0,0,0|2,0,0]=4 417 B13R2.1 NCCC1=COC2=CC=CC=C12 MCULE-7528617628 [1,0,1,0,0,0|2,0,0]=4 418 B13R2.1 NCCC1=COC2=CC=CC=C12 MCULE-7867750419 [1,0,1,0,0,0|2,0,0]=4 419 B13R2.1 NCCC1=CSC2=C1C=CC=C2 MCULE-4237424815 [1,0,1,0,0,0|2,0,0]=4 420 B13R2.1 NCCC1=CSC2=C1C=CC=C2 MCULE-4439041927 [1,0,1,0,0,0|2,0,0]=4 421 B13R2.1 NCCC1=NNC2=C1C=CC=C2 MCULE-1354507733 [1,0,1,0,0,0|2,0,0]=4 422 B13R2.1 NCCC1=NNC2=C1C=CC=C2 MCULE-8325758175 [1,0,1,0,0,0|2,0,0]=4 423 B13R2.1 O=CCC1=CNC2=C1C=CC=C2 MCULE-2893533280 [1,0,1,0,0,0|1,0,1]=4 424 B13R2.1 OCCC1=CNC2=C1C=CC=C2 MCULE-8363712085 [1,0,1,0,0,0|1,0,0]=3 425 B13R2.1 OCCC1=COC2=C1C=CC=C2 MCULE-7695308896 [1,0,1,0,0,0|2,0,0]=4 426 B13R2.1 OCCC1=CSC2=C1C=CC=C2 MCULE-5213360412 [1,0,1,0,0,0|2,0,0]=4 427 B13R2.1 SCCC1=CNC2=C1C=CC=C2 MCULE-4961164716 [1,0,1,0,0,0|1,0,0]=3 428 B13R2.1 [NH3+]CCC1=CNC2=C1C=CC=C2 MCULE-2705006421 [1,0,1,0,0,0|1,0,0]=3 429 B13R2.3 C1=CC(=CC=N1)C2=CCCNC2 MCULE-2540224880 [1,0,1,0,0,0|1,0,0]=3 430 B13R2.3 C1=CC(=CC=N1)C2=CCCNC2 MCULE-4351591225 [1,0,1,0,0,0|1,0,0]=3 431 B13R2.3 C1=CC(=CC=N1)C2=CCCNC2 MCULE-8404080086 [1,0,1,0,0,0|1,0,0]=3 432 B13R2.3 C1=CC(=CN=C1)C2=CCCNC2 MCULE-6429324318 [1,0,1,0,0,0|1,0,0]=3 433 B13R2.3 C1=CC(=CN=C1)C2=CCCNC2 MCULE-8535019586 [1,0,1,0,0,0|1,0,0]=3 434 B13R2.3 C1=CC=C(C=C1)C2=CCCCC2 MCULE-8121072217 [1,0,1,0,0,0|1,0,0]=3 435 B13R2.3 C1=CC=C(C=C1)C2=CCCNC2 MCULE-3312525096 [1,0,1,0,0,0|0,0,0]=2 436 B13R2.3 C1=CC=C(C=C1)C2=CCCNC2 MCULE-9957876928 [1,0,1,0,0,0|0,0,0]=2 437 B13R2.3 C1=CC=C(C=C1)C2=CCNCC2 MCULE-1724533028 [1,0,1,0,0,0|2,0,0]=4 438 B13R2.3 C1=CC=C(C=C1)C2=CCNCC2 MCULE-9917255592 [1,0,1,0,0,0|2,0,0]=4 439 B13R2.3 C1=CC=C(C=C1)C2=CCOCC2 MCULE-9975060872 [1,0,1,0,0,0|2,0,0]=4 440 B13R2.3 C1=CC=C(C=C1)C2CCCNC2 MCULE-1282028108 [1,0,1,0,0,0|0,0,2]=4 441 B13R2.3 C1=CC=C(C=C1)C2CCCNC2 MCULE-4963638365 [1,0,1,0,0,0|0,0,2]=4 442 B13R2.3 C1=CC=C(C=C1)C2CCCNC2 MCULE-5848270063 [1,0,1,0,0,0|0,0,2]=4 443 B13R2.3 C1=CC=C(C=C1)C2CNCCN2 MCULE-5841257922 [1,0,1,0,0,0|1,0,1]=4 444 B13R2.3 C1=CC=C(C=C1)C2CNCCN2 MCULE-5955034006 [1,0,1,0,0,0|1,0,1]=4 445 B13R2.3 C1=CC=C(C=C1)C2CNCCO2 MCULE-2617001808 [1,0,1,0,0,0|1,0,1]=4 446 B13R2.3 C1=CC=C(C=C1)C2CNCCO2 MCULE-7781797135 [1,0,1,0,0,0|1,0,1]=4 447 B13R2.3 C1=CC=C(C=C1)C2CNCCS2 MCULE-1729203355 [1,0,1,0,0,0|1,0,1]=4 448 B13R2.3 C1=CC=C(C=C1)C2CNCCS2 MCULE-8074427790 [1,0,1,0,0,0|1,0,1]=4 449 B13R2.3 C1=CC=C(C=C1)[C@@H]2CCCNC2 MCULE-3853248864 [1,0,1,0,0,0|0,0,2]=4 450 B13R2.3 C1=CC=C(C=C1)[C@@H]2CCCNC2 MCULE-6796720028 [1,0,1,0,0,0|0,0,2]=4 451 B13R2.3 C1=CC=C(C=C1)[C@@H]2CCCNC2 MCULE-7771696030 [1,0,1,0,0,0|0,0,2]=4 452 B13R2.3 C1=CC=C(C=C1)[C@@H]2CNCCN2 MCULE-7207729587 [1,0,1,0,0,0|1,0,1]=4 453 B13R2.3 C1=CC=C(C=C1)[C@@H]2CNCCN2 MCULE-8855176512 [1,0,1,0,0,0|1,0,1]=4 454 B13R2.3 C1=CC=C(C=C1)[C@@H]2CNCCN2 MCULE-9447750095 [1,0,1,0,0,0|1,0,1]=4 455 B13R2.3 C1=CC=C(C=C1)[C@@H]2CNCCO2 MCULE-2265012473 [1,0,1,0,0,0|1,0,1]=4 456 B13R2.3 C1=CC=C(C=C1)[C@@H]2CNCCO2 MCULE-7391020758 [1,0,1,0,0,0|1,0,1]=4 457 B13R2.3 C1=CC=C(C=C1)[C@H]2CCCNC2 MCULE-1634933660 [1,0,1,0,0,0|0,0,2]=4 458 B13R2.3 C1=CC=C(C=C1)[C@H]2CCCNC2 MCULE-6289859716 [1,0,1,0,0,0|0,0,2]=4 459 B13R2.3 C1=CC=C(C=C1)[C@H]2CCCNC2 MCULE-7231470340 [1,0,1,0,0,0|0,0,2]=4 460 B13R2.3 C1=CC=C(C=C1)[C@H]2CCCNC2 MCULE-8317591277 [1,0,1,0,0,0|0,0,2]=4 461 B13R2.3 C1=CC=C(C=C1)[C@H]2CNCCN2 MCULE-2776121567 [1,0,1,0,0,0|1,0,1]=4 462 B13R2.3 C1=CC=C(C=C1)[C@H]2CNCCN2 MCULE-5772913437 [1,0,1,0,0,0|1,0,1]=4 463 B13R2.3 C1=CC=C(C=C1)[C@H]2CNCCN2 MCULE-8884601404 [1,0,1,0,0,0|1,0,1]=4 464 B13R2.3 C1=CC=C(C=C1)[C@H]2CNCCO2 MCULE-3748407618 [1,0,1,0,0,0|1,0,1]=4 465 B13R2.3 C1=CC=C(C=C1)[C@H]2CNCCO2 MCULE-8238981189 [1,0,1,0,0,0|1,0,1]=4 466 B13R2.3 C1=CC=C(C=C1)[C@H]2CNCCO2 MCULE-9727713428 [1,0,1,0,0,0|1,0,1]=4 467 B13R2.3 C1=CC=C(N=C1)C2=CCCCC2 MCULE-4824218022 [1,0,1,0,0,0|2,0,0]=4 468 B13R2.3 C1=CN=C(C=C1)C2=CCCNC2 MCULE-2416979374 [1,0,1,0,0,0|1,0,0]=3 469 B13R2.3 C1=CN=C(C=C1)C2=CCCNC2 MCULE-2499777989 [1,0,1,0,0,0|1,0,0]=3 470 B13R2.3 [C@H]1(CNCCO1)C2=CC=CC=C2 MCULE-3584687549 [1,0,1,0,0,0|1,0,1]=4 471 B13R2.26 BrCCC1=CC2=C(N1)C=CC=C2 MCULE-1192276434 [1,0,1,0,0,0|1,0,0]=3 472 B13R2.26 BrCCC1=NC2=CC=CC=C2N1 MCULE-5262437097 [1,0,1,0,0,0|2,0,0]=4 473 B13R2.26 BrCCC1=NC2=CC=CC=C2N1 MCULE-9203472565 [1,0,1,0,0,0|2,0,0]=4 474 B13R2.26 CCCC1=CC2=C(N1)C=NC=C2 MCULE-6849840925 [1,0,1,0,0,0|1,0,0]=3 475 B13R2.26 CCCC1=CC2=C(O1)C=CC=C2 MCULE-1737708382 [1,0,1,0,0,0|1,0,0]=3 476 B13R2.26 CCCC1=NC2=C(N1)C=CC=C2 MCULE-6935692386 [1,0,1,0,0,0|1,0,0]=3 477 B13R2.26 CCCC1=NC2=CC=CC=C2S1 MCULE-9450311522 [1,0,1,0,0,0|1,0,1]=4 478 B13R2.26 CCNC1=NC2=C(N1)C=CC=C2 MCULE-5451030080 [1,0,1,0,0,0|2,0,0]=4 479 B13R2.26 CCOC1=CC2=C(N1)C=CC=C2 MCULE-7260142994 [1,0,1,0,0,0|1,0,0]=3 480 B13R2.26 CCOC1=NC2=CC=CC=C2N1 MCULE-3177820574 [1,0,1,0,0,0|2,0,0]=4 481 B13R2.26 CCSC1=NC2=C(N1)C=CC=C2 MCULE-2315399484 [1,0,1,0,0,0|2,0,0]=4 482 B13R2.26 CCSC1=NC2=C(N1)C=CC=C2 MCULE-9085682769 [1,0,1,0,0,0|2,0,0]=4 483 B13R2.26 CCSC1=NC2=CC=CC=C2N1 MCULE-3713301622 [1,0,1,0,0,0|2,0,0]=4 484 B13R2.26 CCSC1=[NH+]C2=C(N1)C=CC=C2 MCULE-4433138368 [1,0,1,0,0,0|2,0,0]=4 485 B13R2.26 CNCC1=CC2=C(N1)C=CC=C2 MCULE-4491755513 [1,0,1,0,0,0|0,0,0]=2 486 B13R2.26 CNCC1=CC2=C(O1)C=CC=C2 MCULE-5289666766 [1,0,1,0,0,0|1,0,0]=3 487 B13R2.26 CNCC1=CC2=C(O1)C=CC=C2 MCULE-6763828727 [1,0,1,0,0,0|1,0,0]=3 488 B13R2.26 CNCC1=CC2=C(S1)C=CC=C2 MCULE-6356407325 [1,0,1,0,0,0|1,0,0]=3 489 B13R2.26 CNCC1=CC2=C(S1)C=CC=C2 MCULE-8888993334 [1,0,1,0,0,0|1,0,0]=3 490 B13R2.26 CNCC1=CC2=C(S1)N=CC=C2 MCULE-4462861732 [1,0,1,0,0,0|2,0,0]=4 491 B13R2.26 CNCC1=CN2C=CC=CC2=N1 MCULE-3049668147 [1,0,1,0,0,0|1,0,1]=4 492 B13R2.26 CNCC1=CN2C=CC=CC2=N1 MCULE-8521829727 [1,0,1,0,0,0|1,0,1]=4 493 B13R2.26 CNCC1=NC2=C(O1)C=CC=C2 MCULE-5939856314 [1,0,1,0,0,0|1,0,1]=4 494 B13R2.26 CNCC1=NC2=C(S1)C=CC=C2 MCULE-4913617277 [1,0,1,0,0,0|1,0,1]=4 495 B13R2.26 CNCC1=NC2=CC=CC=C2N1 MCULE-1914783670 [1,0,1,0,0,0|1,0,0]=3 496 B13R2.26 CNCC1=NC2=CC=CC=C2N1 MCULE-4884825644 [1,0,1,0,0,0|1,0,0]=3 497 B13R2.26 CNCC1=NC2=CC=CC=C2N1 MCULE-6691529585 [1,0,1,0,0,0|1,0,0]=3 498 B13R2.26 CNCC1=NC2=CC=CC=C2S1 MCULE-4392154020 [1,0,1,0,0,0|1,0,1]=4 499 B13R2.26 COCC1=NC2=CC=CC=C2N1 MCULE-5879073617 [1,0,1,0,0,0|2,0,0]=4 500 B13R2.26 CSCC1=NC2=CC=CC=C2N1 MCULE-5412187894 [1,0,1,0,0,0|2,0,0]=4 501 B13R2.26 ClCCC1=NC2=CC=CC=C2N1 MCULE-4843037942 [1,0,1,0,0,0|2,0,0]=4 502 B13R2.26 ClCCC1=NC2=CC=CC=C2N1 MCULE-5992484324 [1,0,1,0,0,0|2,0,0]=4 503 B13R2.26 NCCC1=CC2=C(N1)C=CC=C2 MCULE-1362559406 [1,0,1,0,0,0|0,0,0]=2 504 B13R2.26 NCCC1=CC2=C(O1)C=CC=C2 MCULE-4031190601 [1,0,1,0,0,0|1,0,0]=3 505 B13R2.26 NCCC1=CC2=CC=CC=C2N1 MCULE-3712630452 [1,0,1,0,0,0|0,0,0]=2 506 B13R2.26 NCCC1=CC2=CC=CC=C2S1 MCULE-1033321297 [1,0,1,0,0,0|1,0,0]=3 507 B13R2.26 NCCC1=CC2=CC=CC=C2S1 MCULE-8867851840 [1,0,1,0,0,0|1,0,0]=3 508 B13R2.26 NCCC1=CN2C=CC=CC2=N1 MCULE-3805642149 [1,0,1,0,0,0|1,0,1]=4 509 B13R2.26 NCCC1=CN2C=CC=CC2=N1 MCULE-5995680415 [1,0,1,0,0,0|1,0,1]=4 510 B13R2.26 NCCC1=CN2C=CC=CC2=N1 MCULE-9121063263 [1,0,1,0,0,0|1,0,1]=4 511 B13R2.26 NCCC1=NC2=C(N1)C=CC=C2 MCULE-2258663055 [1,0,1,0,0,0|1,0,0]=3 512 B13R2.26 NCCC1=NC2=C(N1)C=CC=C2 MCULE-8423206222 [1,0,1,0,0,0|1,0,0]=3 513 B13R2.26 NCCC1=NC2=C(O1)C=CC=C2 MCULE-5083775059 [1,0,1,0,0,0|1,0,1]=4 514 B13R2.26 NCCC1=NC2=C(S1)C=CC=C2 MCULE-1319205375 [1,0,1,0,0,0|1,0,1]=4 515 B13R2.26 NCCC1=NC2=C(S1)C=CC=C2 MCULE-4088101736 [1,0,1,0,0,0|1,0,1]=4 516 B13R2.26 NCCC1=NC2=CC=CC=C2N1 MCULE-1312071789 [1,0,1,0,0,0|1,0,0]=3 517 B13R2.26 NCCC1=NC2=CC=CC=C2N1 MCULE-8553064400 [1,0,1,0,0,0|1,0,0]=3 518 B13R2.26 NCCC1=NC2=CC=CC=C2O1 MCULE-8545245557 [1,0,1,0,0,0|1,0,1]=4 519 B13R2.26 NCCC1=NC2=CC=CC=C2O1 MCULE-8932280763 [1,0,1,0,0,0|1,0,1]=4 520 B13R2.26 NCCC1=NC2=CC=CC=C2S1 MCULE-4003223417 [1,0,1,0,0,0|1,0,1]=4 521 B13R2.26 NCCC1=NC2=CC=CN=C2N1 MCULE-8409418722 [1,0,1,0,0,0|2,0,0]=4 522 B13R2.26 NCCC1=NC2=CC=CN=C2N1 MCULE-8647388327 [1,0,1,0,0,0|2,0,0]=4 523 B13R2.26 NCCC1=NC2=NC=CC=C2N1 MCULE-3901260045 [1,0,1,0,0,0|2,0,0]=4 524 B13R2.26 NCCN1C=C2C=CC=CC2=N1 MCULE-3556382149 [1,0,1,0,0,0|1,0,1]=4 525 B13R2.26 OCCC1=CC2=C(N1)C=CC=C2 MCULE-9802500182 [1,0,1,0,0,0|1,0,0]=3 526 B13R2.26 OCCC1=CC2=C(O1)C=CC=C2 MCULE-8110301902 [1,0,1,0,0,0|2,0,0]=4 527 B13R2.26 OCCC1=CC2=C(S1)C=CC=C2 MCULE-7321698370 [1,0,1,0,0,0|2,0,0]=4 528 B13R2.26 OCCC1=NC2=CC=CC=C2N1 MCULE-6625237734 [1,0,1,0,0,0|2,0,0]=4 529 B13R2.26 SCCC1=NC2=C(N1)C=CC=C2 MCULE-9663625763 [1,0,1,0,0,0|2,0,0]=4 530 B13R2.45 CC1=C(NC2=CC=CC=C12)C#N MCULE-6053468480 [1,0,1,0,0,0|0,0,2]=4 531 B13R2.45 CC1=C(NC2=CC=CC=C12)C=O MCULE-2212682343 [1,0,1,0,0,0|1,0,1]=4 532 B13R2.45 CC1=C(OC2=C1C=CC=C2)CN MCULE-4002228671 [1,0,1,0,0,0|1,0,0]=3 533 B13R2.45 CC1=C(OC2=C1C=CC=C2)CO MCULE-1181984271 [1,0,1,0,0,0|2,0,0]=4 534 B13R2.45 CC1=C(SC2=C1C=CC=C2)CN MCULE-2420056694 [1,0,1,0,0,0|1,0,0]=3 535 B13R2.45 CCC1=C(C2=C(O1)C=CC=C2)Br MCULE-7587498460 [1,0,1,0,0,0|2,0,0]=4 536 B13R2.45 CCC1=C(C2=CC=CC=C2N1)C MCULE-1580240282 [1,0,1,0,0,0|0,0,0]=2 537 B13R2.45 CCC1=C(C2=CC=CC=C2O1)C MCULE-5809614314 [1,0,1,0,0,0|1,0,0]=3 538 B13R2.45 CCC1=NC2=C(N1N)C=CC=C2 MCULE-3012297232 [1,0,1,0,0,0|1,0,1]=4 539 B13R2.45 CCC1=NC2=CC=CC=C2N1C MCULE-6188194462 [1,0,1,0,0,0|1,0,1]=4 540 B13R2.45 CCC1=[N+](C2=C(S1)C=CC=C2)C MCULE-1895725282 [1,0,1,0,0,0|2,0,0]=4 541 B13R2.45 CCC1=[N+](C2=C(S1)C=CC=C2)C MCULE-2778705269 [1,0,1,0,0,0|2,0,0]=4 542 B13R2.45 CN1C(=CC2=C1C=CC=C2)CN MCULE-7618537155 [1,0,1,0,0,0|2,0,0]=4 543 B13R2.45 CN1C2=CC=CC=C2N=C1CN MCULE-3170752868 [1,0,1,0,0,0|1,0,1]=4 544 B13R2.45 CN1C2=CC=CC=C2N=C1CN MCULE-4894498909 [1,0,1,0,0,0|1,0,1]=4 545 B13R2.45 CN1C2=CC=CC=C2N=C1CN MCULE-9946299629 [1,0,1,0,0,0|1,0,1]=4 546 B13R2.45 N/N=C\1/NC2=C(C1=O)C=CC=C2 MCULE-2986602091 [1,0,1,0,0,0|2,0,0]=4 547 B13R2.45 NCC1=C(C2=C(S1)C=CC=C2)Br MCULE-1001878895 [1,0,1,0,0,0|2,0,0]=4 548 B13R2.45 NCC1=C(C2=C(S1)C=CC=C2)Br MCULE-4546482666 [1,0,1,0,0,0|2,0,0]=4 549 B13R2.45 NCC1=C(C2=CC=CC=C2S1)Cl MCULE-4119116213 [1,0,1,0,0,0|2,0,0]=4 550 B13R2.45 NCC1=C(C2=CC=CC=C2S1)Cl MCULE-7763400245 [1,0,1,0,0,0|2,0,0]=4 551 B13R2.135 CC1=C(C2=C(N1)C=CC=C2)C=O MCULE-4419027969 [1,0,1,0,0,0|1,0,1]=4 552 B13R2.135 CC1=C(C2=C(N1)C=CC=C2)CN MCULE-9130536323 [1,0,1,0,0,0|0,0,0]=2 553 B13R2.135 CC1=C(C2=C(O1)C=CC=C2)CN MCULE-5343919869 [1,0,1,0,0,0|1,0,0]=3 554 B13R2.135 CC1=C(C2=CC=CC=C2N1)C#N MCULE-8041697099 [1,0,1,0,0,0|0,0,2]=4 555 B13R2.135 CC1=C(C2=CC=CC=C2N1)CN MCULE-1868869775 [1,0,1,0,0,0|0,0,0]=2 556 B13R2.135 CC1=C(C2=CC=CC=C2S1)CN MCULE-1629053176 [1,0,1,0,0,0|1,0,0]=3 557 B13R2.135 CC1=C(C2=CC=CC=C2S1)CN MCULE-1979093947 [1,0,1,0,0,0|1,0,0]=3 558 B13R2.135 CC1=C(C2=CC=CC=C2S1)CO MCULE-6883722649 [1,0,1,0,0,0|2,0,0]=4 559 B13R2.135 CC1=C(N2C=CC=CC2=N1)CN MCULE-3251536160 [1,0,1,0,0,0|1,0,1]=4 560 B13R2.135 CC1=C(N2C=CC=CC2=N1)CN MCULE-4011204435 [1,0,1,0,0,0|1,0,1]=4 561 B13R2.135 CCC1=C(NC2=CC=CN=C12)O MCULE-4696564789 [1,0,1,0,0,0|2,0,0]=4 562 B13R2.135 CCC1C(=O)NC2=C1C=CC=C2 MCULE-8023674375 [1,0,1,0,0,0|1,0,1]=4 563 B13R2.135 CCC1C2=C(C=CC=C2)NC1C MCULE-8855109135 [1,0,1,0,0,0|0,0,2]=4 564 B13R2.135 CCN1C(=CC2=C1C=CC=C2)C MCULE-7533444152 [1,0,1,0,0,0|2,0,0]=4 565 B13R2.135 CCN1C(=O)NC2=CC=CC=C12 MCULE-5233670623 [1,0,1,0,0,0|2,0,0]=4 566 B13R2.135 CC[N+]1=C(OC2=CC=CC=C12)C MCULE-2813710424 [1,0,1,0,0,0|2,0,0]=4 567 B13R2.135 CC[N+]1=C(OC2=CC=CC=C12)C MCULE-9353515716 [1,0,1,0,0,0|2,0,0]=4 568 B13R2.135 CC[N+]1=C(SC2=C1C=CC=C2)C MCULE-4421420390 [1,0,1,0,0,0|2,0,0]=4 569 B13R2.135 CC[N+]1=C(SC2=C1C=CC=C2)C MCULE-5201992778 [1,0,1,0,0,0|2,0,0]=4 570 B13R2.135 CC[N+]1=C(SC2=C1C=CC=C2)C MCULE-7678369575 [1,0,1,0,0,0|2,0,0]=4 571 B13R2.135 CC[N+]1=C(SC2=C1C=CC=C2)C MCULE-8091283108 [1,0,1,0,0,0|2,0,0]=4 572 B13R2.135 CC[N+]1=C([Se]C2=C1C=CC=C2)C MCULE-3942609151 [1,0,1,0,0,0|2,0,0]=4 573 B13R2.135 CC[N+]1=C([Se]C2=C1C=CC=C2)C MCULE-3953674709 [1,0,1,0,0,0|2,0,0]=4 574 B13R2.135 CN1N=C2C=CC=CC2=C1CN MCULE-2806629208 [1,0,1,0,0,0|1,0,1]=4 575 B13R2.135 N/N=C/1\C(=O)NC2=CC=CC=C12 MCULE-4198479503 [1,0,1,0,0,0|2,0,0]=4 576 B13R2.135 NCC1=C(OC2=C1C=CC=C2)Cl MCULE-2499750834 [1,0,1,0,0,0|2,0,0]=4 577 B13R2.135 NCC1=C(OC2=C1C=CC=C2)Cl MCULE-3722791573 [1,0,1,0,0,0|2,0,0]=4 578 B13R2.135 NCC1=C(SC2=C1C=CC=C2)Br MCULE-1535715296 [1,0,1,0,0,0|2,0,0]=4 579 B13R2.135 NCC1=C(SC2=C1C=CC=C2)Br MCULE-4096112030 [1,0,1,0,0,0|2,0,0]=4 580 B13R2.135 NCC1C(=O)NC2=CC=CC=C12 MCULE-1847831592 [1,0,1,0,0,0|1,0,1]=4 581 B13R2.135 NCC1C(=O)NC2=CC=CC=C12 MCULE-7410446672 [1,0,1,0,0,0|1,0,1]=4 582 B15R2.4 CCC(N)CC1=CNC2=C1C=CC=C2 MCULE-5651076502 [0,1,1,0,0,0|1,0,0]=3 583 B15R2.4 CCC(N)CC1=CNC2=C1C=CC=C2 MCULE-8710039661 [0,1,1,0,0,0|1,0,0]=3 584 B15R2.4 CCC(N)CC1=CNC2=CC=CC=C12 MCULE-7617108096 [0,1,1,0,0,0|1,0,0]=3 585 B15R2.4 CC[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-2042856337 [0,1,1,0,0,0|1,0,0]=3 586 B15R2.4 CC[C@@H](N)CC1=CNC2=C1C=CC=C2 MCULE-9961177523 [0,1,1,0,0,0|1,0,0]=3 587 B15R2.4 CNC(=O)CC1=CNC2=C1C=CC=C2 MCULE-3992305884 [0,1,1,0,0,0|2,0,0]=4 588 B15R2.4 CNC(C)CC1=CNC2=C1C=CC=C2 MCULE-7812720422 [0,1,1,0,0,0|2,0,0]=4 589 B15R2.4 COC(=O)CC1=CNC2=C1C=CC=C2 MCULE-4496787216 [0,1,1,0,0,0|2,0,0]=4 590 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-4101569242 [0,1,1,0,0,0|2,0,0]=4 591 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-4419819481 [0,1,1,0,0,0|2,0,0]=4 592 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 MCULE-8757853264 [0,1,1,0,0,0|2,0,0]=4 593 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-5057169498 [0,1,1,0,0,0|2,0,0]=4 594 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-6263792283 [0,1,1,0,0,0|2,0,0]=4 595 B15R2.4 N[C@@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-7147570312 [0,1,1,0,0,0|2,0,0]=4 596 B15R2.4 N[C@@H](CO)CC1=CNC2=CC=CC=C12 MCULE-9591598328 [0,1,1,0,0,0|2,0,0]=4 597 B15R2.4 N[C@H](CO)CC1=CNC2=C1C=CC=C2 MCULE-1258780591 [0,1,1,0,0,0|2,0,0]=4 598 B15R2.4 [C@@H](N)(CO)CC1=CNC2=C1C=CC=C2 MCULE-7424777740 [0,1,1,0,0,0|2,0,0]=4 599 B15R2.5 NCCCCC1=CNC2=C1C=CC=C2 MCULE-6711010140 [0,1,1,0,0,0|1,0,0]=3 600 B15R2.5 O=CNCCC1=CNC2=C1C=CC=C2 MCULE-2222832478 [0,1,1,0,0,0|1,0,1]=4 601 B15R2.6 CC(=O)CCC1=CNC2=C1C=CC=C2 MCULE-7392845361 [0,1,1,0,0,0|1,0,1]=4 602 B15R2.6 CN(C)CCC1=CNC2=C1C=CC=C2 MCULE-1451594833 [0,1,1,0,0,0|2,0,0]=4 603 B15R2.65 CC1=C2NC=C(C2=CC=C1)CCCN MCULE-5373656763 [0,1,1,0,0,0|2,0,0]=4 604 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)Br MCULE-7271294699 [0,1,1,0,0,0|2,0,0]=4 605 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)Cl MCULE-5863200997 [0,1,1,0,0,0|2,0,0]=4 606 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)Cl MCULE-7303623768 [0,1,1,0,0,0|2,0,0]=4 607 B15R2.65 NCCCC1=CNC2=C(C=CC=C12)F MCULE-2128097137 [0,1,1,0,0,0|2,0,0]=4 608 B15R2.73 CC(CCO)C1=CNC2=C1C=CC=C2 MCULE-6633467549 [0,1,1,0,0,0|2,0,0]=4 609 B15R2.73 CCCC(=O)C1=CNC2=C1C=CC=C2 MCULE-8914700052 [0,1,1,0,0,0|1,0,1]=4 610 B15R2.73 CCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-5688639569 [0,1,1,0,0,0|1,0,0]=3 611 B15R2.73 CCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-9253056994 [0,1,1,0,0,0|1,0,0]=3 612 B15R2.73 CCC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-4609952049 [0,1,1,0,0,0|2,0,0]=4 613 B15R2.73 CCC[C@@H](N)C1=CSC2=C1C=CC=C2 MCULE-9804155180 [0,1,1,0,0,0|2,0,0]=4 614 B15R2.73 CCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-2511301077 [0,1,1,0,0,0|1,0,0]=3 615 B15R2.73 CCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-3683609765 [0,1,1,0,0,0|1,0,0]=3 616 B15R2.73 CCC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-2582391673 [0,1,1,0,0,0|2,0,0]=4 617 B15R2.73 CCC[C@H](N)C1=CSC2=C1C=CC=C2 MCULE-6102194116 [0,1,1,0,0,0|2,0,0]=4 618 B15R2.73 CCOC(=N)C1=CNC2=C1C=CC=C2 MCULE-7263132116 [0,1,1,0,0,0|1,0,1]=4 619 B15R2.73 CCOC(=O)C1=CNC2=CC=CC=C12 MCULE-5707116390 [0,1,1,0,0,0|1,0,1]=4 620 B15R2.73 CNCC(O)C1=CNC2=CC=CC=C12 MCULE-3654098678 [0,1,1,0,0,0|2,0,0]=4 621 B15R2.73 NCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-7377468942 [0,1,1,0,0,0|2,0,0]=4 622 B15R2.73 NCC[C@@H](N)C1=CNC2=CC=CC=C12 MCULE-7714574859 [0,1,1,0,0,0|2,0,0]=4 623 B15R2.73 NCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-1380158962 [0,1,1,0,0,0|2,0,0]=4 624 B15R2.73 NCC[C@H](N)C1=CNC2=CC=CC=C12 MCULE-2080068518 [0,1,1,0,0,0|2,0,0]=4 625 B15R2.73 N[C@@H](CCF)C1=CNC2=CC=CC=C12 MCULE-1298680018 [0,1,1,0,0,0|2,0,0]=4 626 B15R2.73 N[C@@H](CCF)C1=CNC2=CC=CC=C12 MCULE-6534899465 [0,1,1,0,0,0|2,0,0]=4 627 B15R2.73 N[C@@H](CCO)C1=CNC2=C1C=CC=C2 MCULE-9609971524 [0,1,1,0,0,0|2,0,0]=4 628 B15R2.73 N[C@@H](CCO)C1=CNC2=CC=CC=C12 MCULE-1168622067 [0,1,1,0,0,0|2,0,0]=4 629 B15R2.73 N[C@H](CCF)C1=CNC2=CC=CC=C12 MCULE-2667311895 [0,1,1,0,0,0|2,0,0]=4 630 B15R2.73 N[C@H](CCF)C1=CNC2=CC=CC=C12 MCULE-9166741831 [0,1,1,0,0,0|2,0,0]=4 631 B15R2.73 N[C@H](CCO)C1=CNC2=C1C=CC=C2 MCULE-7580504004 [0,1,1,0,0,0|2,0,0]=4 632 B15R2.73 N[C@H](CCO)C1=CNC2=CC=CC=C12 MCULE-7951381447 [0,1,1,0,0,0|2,0,0]=4 633 B15R2.1385 CC1=CC=C2C(=CNC2=C1)CCCN MCULE-3054127477 [0,1,1,0,0,0|2,0,0]=4 634 B15R2.1385 CCCCC1=NNC2=C1C=CC(=C2)Br MCULE-9085489875 [0,1,1,0,0,0|2,0,0]=4 635 B15R2.1385 CNCCC1=CNC2=C1C=CC(=C2)F MCULE-1164505597 [0,1,1,0,0,0|2,0,0]=4 636 B15R2.1385 NCCCC1=CNC2=CC(=CC=C12)Br MCULE-9688231998 [0,1,1,0,0,0|2,0,0]=4 637 B15R2.1385 NCCCC1=CNC2=CC(=CC=C12)Cl MCULE-4624630045 [0,1,1,0,0,0|2,0,0]=4 638 B15R2.1385 NCCCC1=CNC2=CC(=CC=C12)F MCULE-4098011357 [0,1,1,0,0,0|2,0,0]=4 639 B15R2.1428 CN1C=C(C2=C1C=CC=C2)CCCN MCULE-8434906058 [0,1,1,0,0,0|2,0,0]=4 640 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)CCCN MCULE-4019613679 [0,1,1,0,0,0|2,0,0]=4 641 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)CCCN MCULE-7229320259 [0,1,1,0,0,0|2,0,0]=4 642 B15R2.1435 CCCCN1C(=O)NC2=CC=CC=C12 MCULE-6515463975 [0,1,1,0,0,0|2,0,0]=4 643 B15R2.17667 CC1=C2C(=CNC2=CC=C1)CCCN MCULE-1445788470 [0,1,1,0,0,0|2,0,0]=4 644 B15R2.17667 CNCCC1=CNC2=C1C(=CC=C2)O MCULE-9180683232 [0,1,1,0,0,0|2,0,0]=4 645 B15R2.17667 NCCCC1=CNC2=CC=CC(=C12)Br MCULE-4354390075 [0,1,1,0,0,0|2,0,0]=4 646 B15R2.17667 NCCCC1=CNC2=CC=CC(=C12)Cl MCULE-4816142346 [0,1,1,0,0,0|2,0,0]=4 647 B15R2.17667 NCCCC1=CNC2=CC=CC(=C12)F MCULE-7123316991 [0,1,1,0,0,0|2,0,0]=4 648 B15R2.17719 CC1=CC=C2NC=C(C2=C1)CCCN MCULE-4520003199 [0,1,1,0,0,0|2,0,0]=4 649 B15R2.17719 CCCCC1=NNC2=C1C=C(C=C2)Br MCULE-7097367441 [0,1,1,0,0,0|2,0,0]=4 650 B15R2.17719 CNCCC1=CNC2=C1C=C(C=C2)O MCULE-1823155663 [0,1,1,0,0,0|2,0,0]=4 651 B15R2.17719 CNCCC1=CNC2=C1C=C(C=C2)O MCULE-2918354234 [0,1,1,0,0,0|2,0,0]=4 652 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)Br MCULE-5589265218 [0,1,1,0,0,0|2,0,0]=4 653 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)F MCULE-2533283808 [0,1,1,0,0,0|2,0,0]=4 654 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)F MCULE-9966650311 [0,1,1,0,0,0|2,0,0]=4 655 B15R2.17719 NCCCC1=CNC2=C1C=C(C=C2)I MCULE-4038685690 [0,1,1,0,0,0|2,0,0]=4 656 B15R2.17719 NCCCC1=CNC2=CC=C(C=C12)Br MCULE-9581223794 [0,1,1,0,0,0|2,0,0]=4 657 B15R2.17719 NCCCC1=CNC2=CC=C(C=C12)Cl MCULE-8078485200 [0,1,1,0,0,0|2,0,0]=4 658 B15R2.17719 OCCCC1=CNC2=C1C=C(C=C2)Br MCULE-1084149320 [0,1,1,0,0,0|2,0,0]=4 659 B15R2.17719 OCCCC1=CNC2=C1C=C(C=C2)F MCULE-4395974853 [0,1,1,0,0,0|2,0,0]=4 660 B15R2.17719 OCCCC1=CNC2=CC=C(C=C12)Cl MCULE-2821445160 [0,1,1,0,0,0|2,0,0]=4 661 B15R2.17719 [NH3+]CCCC1=CNC2=C1C=C(C=C2)C MCULE-6315348922 [0,1,1,0,0,0|2,0,0]=4 662 B15R2.17719 [NH3+]CCCC1=CNC2=C1C=C(C=C2)Cl MCULE-8195978965 [0,1,1,0,0,0|2,0,0]=4 663 B15R2.29 BrC1=CC=C(C=C1)NC2CCNCC2 MCULE-2596908542 [0,1,1,0,0,0|0,0,2]=4 664 B15R2.29 CC1=CC=C(C=C1)NC2CCNCC2 MCULE-3874467710 [0,1,1,0,0,0|0,0,2]=4 665 B15R2.29 CN1CCC(CC1)NC2=CC=CC=C2 MCULE-3994456249 [0,1,1,0,0,0|0,0,2]=4 666 B15R2.29 ClC1=CC=C(C=C1)C=C2CCNCC2 MCULE-2412019485 [0,1,1,0,0,0|1,0,1]=4 667 B15R2.29 ClC1=CC=C(C=C1)C=C2CCNCC2 MCULE-8600365863 [0,1,1,0,0,0|1,0,1]=4 668 B15R2.29 ClC1=CC=C(C=C1)NC2CCNCC2 MCULE-5976416114 [0,1,1,0,0,0|0,0,2]=4 669 B15R2.29 FC1=CC=C(C=C1)C=C2CCNCC2 MCULE-1124324785 [0,1,1,0,0,0|1,0,1]=4 670 B15R2.29 FC1=CC=C(C=C1)NC2CCNCC2 MCULE-1198558941 [0,1,1,0,0,0|0,0,2]=4 671 B15R2.29 FC1=CC=C(C=C1)NC2CCNCC2 MCULE-2417511818 [0,1,1,0,0,0|0,0,2]=4 672 B15R2.31 BrC1=CC(=CC=C1)NC2CCNCC2 MCULE-2596068931 [0,1,1,0,0,0|0,0,2]=4 673 B15R2.31 BrC1=CC=CC(=C1)NC2CCNCC2 MCULE-8514037175 [0,1,1,0,0,0|0,0,2]=4 674 B15R2.31 CC1=CC(=CC=C1)NC2CCNCC2 MCULE-9703400487 [0,1,1,0,0,0|0,0,2]=4 675 B15R2.31 FC1=CC(=CC=C1)C=C2CCNCC2 MCULE-1978116510 [0,1,1,0,0,0|1,0,1]=4 676 B15R2.31 FC1=CC(=CC=C1)C=C2CCNCC2 MCULE-6569301355 [0,1,1,0,0,0|1,0,1]=4 677 B15R2.31 FC1=CC(=CC=C1)NC2CCNCC2 MCULE-4998527295 [0,1,1,0,0,0|0,0,2]=4 678 B15R2.31 FC1=CC=CC(=C1)NC2CCNCC2 MCULE-4742484038 [0,1,1,0,0,0|0,0,2]=4 679 B15R2.31 FC1=CC=CC(=C1)NC2CCNCC2 MCULE-5445718961 [0,1,1,0,0,0|0,0,2]=4 680 B15R2.31 O=C1C=C(CCC1)NC2=CC=CC=C2 MCULE-6160051957 [0,1,1,0,0,0|1,0,1]=4 681 B15R2.38 BrC1=C(C=CC=C1)NC2CCNCC2 MCULE-5745092104 [0,1,1,0,0,0|0,0,2]=4 682 B15R2.38 BrC1=CC=CC=C1NC2CCNCC2 MCULE-3957174331 [0,1,1,0,0,0|0,0,2]=4 683 B15R2.38 CC1=C(C=CC=C1)NC2CCNCC2 MCULE-5766125314 [0,1,1,0,0,0|0,0,2]=4 684 B15R2.38 CC1=C(C=CC=C1)NC2CCNCC2 MCULE-9103973201 [0,1,1,0,0,0|0,0,2]=4 685 B15R2.38 ClC1=C(C=CC=C1)NC2CCNCC2 MCULE-7103274192 [0,1,1,0,0,0|0,0,2]=4 686 B15R2.38 ClC1=CC=CC=C1NC2CCNCC2 MCULE-6835929424 [0,1,1,0,0,0|0,0,2]=4 687 B15R2.38 FC1=C(C=CC=C1)C=C2CCNCC2 MCULE-8974545913 [0,1,1,0,0,0|1,0,1]=4 688 B15R2.38 FC1=C(C=CC=C1)C=C2CCNCC2 MCULE-9178469063 [0,1,1,0,0,0|1,0,1]=4 689 B15R2.38 FC1=C(C=CC=C1)NC2CCNCC2 MCULE-1522726085 [0,1,1,0,0,0|0,0,2]=4 690 B15R2.38 FC1=C(C=CC=C1)NC2CCNCC2 MCULE-9303534026 [0,1,1,0,0,0|0,0,2]=4 691 B15R2.38 O=C1CCCCC1=CC2=CC=CC=C2 MCULE-1216184869 [0,1,1,0,0,0|2,0,0]=4 692 B15R2.38 O=C1CCCCC1NC2=CC=CC=C2 MCULE-3744384874 [0,1,1,0,0,0|1,0,1]=4 693 B15R2.38 O=C1CNCCN1CC2=CC=CC=C2 MCULE-6309330618 [0,1,1,0,0,0|2,0,0]=4 694 B15R2.38 O=C1CNCCN1CC2=CC=CC=C2 MCULE-8689511257 [0,1,1,0,0,0|2,0,0]=4 695 B15R2.38 O=C\1CCCC/C1=C\C2=CC=CC=C2 MCULE-7248069865 [0,1,1,0,0,0|2,0,0]=4 696 B15R2.2226 CN(C1=CC=CC=C1)C2CCNCC2 MCULE-1094837646 [0,1,1,0,0,0|0,0,2]=4 697 B15R2.2226 O=C(C1=CC=CC=C1)C2=CCCCC2 MCULE-7862190435 [0,1,1,0,0,0|2,0,0]=4 698 B15R2.21 COC1=CC=CC=C1C2=CCCCC2 MCULE-1417019591 [0,1,1,0,0,0|2,0,0]=4 699 B15R2.33 CN1CCC(=O)C(C1)C2=CC=CC=C2 MCULE-1821811027 [0,1,1,0,0,0|1,0,1]=4 700 B15R2.33 NC1=CC=C(C=C1[C@@H]2CNCCN2)Cl MCULE-5198882469 [0,1,1,0,0,0|1,0,1]=4 701 B15R2.33 NC1=CC=C(C=C1[C@@H]2CNCCN2)Cl MCULE-8333375373 [0,1,1,0,0,0|1,0,1]=4 702 B15R2.33 NC1=CC=C(C=C1[C@H]2CNCCN2)Cl MCULE-6253556259 [0,1,1,0,0,0|1,0,1]=4 703 B15R2.33 NC1=CC=C(C=C1[C@H]2CNCCN2)Cl MCULE-7296398771 [0,1,1,0,0,0|1,0,1]=4 704 B15R2.308 CC1=CC=CC=C1C2=CCC(CC2)C MCULE-6467799612 [0,1,1,0,0,0|2,0,0]=4 705 B15R2.555 NC1=C(C=CC=C1)N2CCCCC2=O MCULE-8041421075 [0,1,1,0,0,0|2,0,0]=4 706 B15R2.89 CC1=C2C=CC=CC2=NN1CCCN MCULE-9304358309 [0,1,1,0,0,0|1,0,1]=4 707 B15R2.89 CN1C(=NC2=C1C=CC=C2)CCCN MCULE-1231183662 [0,1,1,0,0,0|1,0,1]=4 708 B15R2.89 CN1C(=NC2=C1C=CC=C2)CCCN MCULE-2286289485 [0,1,1,0,0,0|1,0,1]=4 709 B15R2.89 CN1C2=CC=CC=C2N=C1CCCN MCULE-7050748658 [0,1,1,0,0,0|1,0,1]=4 710 B15R2.889 CCN1C(=NC2=C1C=CC=C2)CCN MCULE-3875719874 [0,1,1,0,0,0|1,0,1]=4 711 B15R2.889 CCN1C(=NC2=C1C=CC=C2)CCN MCULE-7229652552 [0,1,1,0,0,0|1,0,1]=4 712 B15R2.889 CCN1C2=CC=CC=C2N=C1CCN MCULE-4977131317 [0,1,1,0,0,0|1,0,1]=4 713 B15R2.1592 CC1=C(NC2=C1C=CC=C2)C(=O)CCl MCULE-8362419069 [0,1,1,0,0,0|1,0,1]=4 714 B15R2.4355 CN1C(=NC2=C1C=C(C=C2)F)CCN MCULE-2642637538 [0,1,1,0,0,0|1,0,1]=4 715 B15R2.4355 CN1C(=NC2=C1C=C(C=C2)F)CCN MCULE-4714356468 [0,1,1,0,0,0|1,0,1]=4 716 B15R2.4362 CC1=CC2=C(C=C1)N(C(=C2)CCN)C MCULE-4634525454 [0,1,1,0,0,0|2,0,0]=4 717 B15R2.4362 CC1=CC2=C(C=C1)N(C(=C2)CCN)C MCULE-8318031418 [0,1,1,0,0,0|2,0,0]=4 718 B15R2.4362 CC1=CC2=C(C=C1)N(C(=N2)CCN)C MCULE-5156172579 [0,1,1,0,0,0|1,0,1]=4 719 B15R2.4362 CC1=CC2=C(C=C1)N(C(=N2)CCN)C MCULE-7978360797 [0,1,1,0,0,0|1,0,1]=4 720 B15R2.4362 CN1C(=NC2=C1C=CC(=C2)Cl)CCN MCULE-4217191937 [0,1,1,0,0,0|1,0,1]=4 721 B15R2.4362 CN1C(=NC2=C1C=CC(=C2)F)CCN MCULE-5594751019 [0,1,1,0,0,0|1,0,1]=4 722 B15R2.4362 CN1C(=NC2=C1C=CC(=C2)F)CCN MCULE-7542940802 [0,1,1,0,0,0|1,0,1]=4 723 B15R2.4362 CN1C2=CC=C(C=C2N=C1CCN)Cl MCULE-3653426701 [0,1,1,0,0,0|1,0,1]=4 724 B15R2.9978 CNCC1=C(C2=C(N1C)C=CC=C2)C MCULE-8217585615 [0,1,1,0,0,0|2,0,0]=4 725 B15R2.11629 CN1C(=NC2=C1C=CC=C2F)CCN MCULE-3363034423 [0,1,1,0,0,0|1,0,1]=4 726 B15R2.11629 CN1C(=NC2=C1C=CC=C2F)CCN MCULE-6616974730 [0,1,1,0,0,0|1,0,1]=4 727 B15R2.346 CCCCC1=CC2=CC(=CC=C2O1)N MCULE-8332510555 [0,1,1,0,0,0|2,0,0]=4 728 B15R2.346 CCCCC1=CC2=CC(=CC=C2O1)N MCULE-9360770887 [0,1,1,0,0,0|2,0,0]=4 729 B15R2.346 CCCCC1=NC2=C(N1)C=CC(=C2)N MCULE-2569270313 [0,1,1,0,0,0|2,0,0]=4 730 B15R2.346 CCCCC1=NC2=C(N1)C=CC(=C2)N MCULE-4802378573 [0,1,1,0,0,0|2,0,0]=4 731 B15R2.346 CCCCC1=NC2=CC(=CC=C2N1)Cl MCULE-2205431166 [0,1,1,0,0,0|2,0,0]=4 732 B15R2.346 CNCCC1=NC2=CC(=CC=C2N1)Cl MCULE-6983634477 [0,1,1,0,0,0|1,0,0]=3 733 B15R2.346 CNCCC1=NC2=CC(=CC=C2N1)Cl MCULE-9694746899 [0,1,1,0,0,0|1,0,0]=3 734 B15R2.346 CNCCC1=NC2=CC(=CC=C2N1)F MCULE-4281934211 [0,1,1,0,0,0|1,0,0]=3 735 B15R2.346 CNCCC1=NC2=CC(=CC=C2N1)F MCULE-4721289620 [0,1,1,0,0,0|1,0,0]=3 736 B15R2.351 CCCCC1=CC2=CC=CC(=C2C1)Cl MCULE-8536411467 [0,1,1,0,0,0|2,0,0]=4 737 B15R2.351 CNCCC1=NC2=C(C=CC=C2N1)C MCULE-5045283608 [0,1,1,0,0,0|1,0,0]=3 738 B15R2.351 CNCCC1=NC2=C(C=CC=C2N1)C MCULE-5193390911 [0,1,1,0,0,0|1,0,0]=3 739 B15R2.1356 CCCC(O)C1=NC2=CC=CC=C2N1 MCULE-9363899126 [0,1,1,0,0,0|2,0,0]=4 740 B15R2.1569 CNC(=O)CC1=NC2=C(N1)C=CC=C2 MCULE-2527237861 [0,1,1,0,0,0|1,0,1]=4 741 B15R2.1569 CNC(C)CC1=CC2=C(O1)C=CC=C2 MCULE-3466975757 [0,1,1,0,0,0|1,0,0]=3 742 B15R2.1569 CNC(C)CC1=CC2=C(O1)C=CC=C2 MCULE-4849476591 [0,1,1,0,0,0|1,0,0]=3 743 B15R2.1569 COC(=O)CC1=CC2=CC=CC=C2N1 MCULE-1261520741 [0,1,1,0,0,0|1,0,1]=4 744 B15R2.1569 NNC(=O)CC1=CC2=C(N1)C=CC=C2 MCULE-8119375697 [0,1,1,0,0,0|1,0,1]=4 745 B15R2.1660 CC(=O)CCC1=NC2=C(N1)C=CC=C2 MCULE-8290148913 [0,1,1,0,0,0|2,0,0]=4 746 B15R2.1660 CC(C)NCC1=CC2=C(N1)C=CC=C2 MCULE-9869991021 [0,1,1,0,0,0|2,0,0]=4 747 B15R2.1660 CC(C)NCC1=CC2=C(N1)C=CC=C2 MCULE-9968754653 [0,1,1,0,0,0|2,0,0]=4 748 B15R2.1660 O=C(O)CCC1=CC2=C(N1)C=CC=C2 MCULE-1047547589 [0,1,1,0,0,0|2,0,0]=4 749 B15R2.1660 O=N(=O)CCC1=CC2=C(N1)C=CC=C2 MCULE-6175501043 [0,1,1,0,0,0|1,0,1]=4 750 B15R2.2203 CCCCCC1=NC2=CC=CC=C2N1 MCULE-4483339659 [0,1,1,0,0,0|2,0,0]=4 751 B15R2.2203 CCCCNC1=NC2=C(N1)C=CC=C2 MCULE-7140255405 [0,1,1,0,0,0|2,0,0]=4 752 B15R2.2203 CCCCNC1=NC2=CC=CC=C2N1 MCULE-4539652596 [0,1,1,0,0,0|2,0,0]=4 753 B15R2.2203 CCCCSC1=NC2=C(N1)C=CC=C2 MCULE-5351657922 [0,1,1,0,0,0|2,0,0]=4 754 B15R2.2203 CCCNCC1=CC2=C(O1)C=CC=C2 MCULE-1899301814 [0,1,1,0,0,0|2,0,0]=4 755 B15R2.2203 CCCNCC1=CC2=C(O1)C=CC=C2 MCULE-1932662254 [0,1,1,0,0,0|2,0,0]=4 756 B15R2.2203 CCNCCC1=NC2=CC=CC=C2N1 MCULE-7027261984 [0,1,1,0,0,0|1,0,0]=3 757 B15R2.2203 CCNCCC1=NC2=CC=CC=C2N1 MCULE-9435181543 [0,1,1,0,0,0|1,0,0]=3 758 B15R2.2203 CCOCCC1=NC2=CC=CC=C2N1 MCULE-8946137314 [0,1,1,0,0,0|2,0,0]=4 759 B15R2.2203 CNCCCC1=NC2=C(N1)C=CC=C2 MCULE-1943804995 [0,1,1,0,0,0|1,0,0]=3 760 B15R2.2203 CNCCCC1=NC2=C(O1)C=CC=C2 MCULE-9238253007 [0,1,1,0,0,0|1,0,1]=4 761 B15R2.2203 CNCCCC1=NC2=CC=CC=C2N1 MCULE-9496024889 [0,1,1,0,0,0|1,0,0]=3 762 B15R2.2203 COCCNC1=NC2=C(N1)C=CC=C2 MCULE-9272124800 [0,1,1,0,0,0|2,0,0]=4 763 B15R2.2203 NCCCCC1=NC2=C(N1)C=CC=C2 MCULE-2387236811 [0,1,1,0,0,0|2,0,0]=4 764 B15R2.2203 NCCCCC1=NC2=CC=CC=C2N1 MCULE-5636825469 [0,1,1,0,0,0|2,0,0]=4 765 B15R2.2203 OCCCCC1=NC2=C(N1)C=CC=C2 MCULE-7598326825 [0,1,1,0,0,0|2,0,0]=4 766 B15R2.44 CCC1=C(C2=C(O1)C=CC=C2)CNC MCULE-3769359426 [0,1,1,0,0,0|1,0,0]=3 767 B15R2.44 CCC1=C(C2=C(O1)C=CC=C2)CNC MCULE-8822482948 [0,1,1,0,0,0|1,0,0]=3 768 B15R2.44 CSC1=C(C2=C(N1)C=CC=C2)CC#N MCULE-4616718708 [0,1,1,0,0,0|2,0,0]=4 769 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CC(=O)O MCULE-2477434025 [0,1,1,0,0,0|2,0,0]=4 770 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CN(C)C MCULE-4516162416 [0,1,1,0,0,0|0,0,0]=2 771 B15R2.993 CC1=C(C2=CC=CN=C2N1)CN(C)C MCULE-4456562498 [0,1,1,0,0,0|1,0,0]=3 772 B15R2.993 CN(C)/C=C/1\C(=O)NC2=CC=CC=C12 MCULE-7652735203 [0,1,1,0,0,0|1,0,1]=4 773 B15R2.993 CN(C)/N=C\1/C(=O)NC2=C1C=CC=C2 MCULE-6899132123 [0,1,1,0,0,0|2,0,0]=4 774 B15R2.993 CN(C)C=C1C(=O)NC2=C1C=CC=C2 MCULE-1931770998 [0,1,1,0,0,0|1,0,1]=4 775 B15R2.993 CN(O)C=C1C(=O)NC2=C1C=CC=C2 MCULE-1568649354 [0,1,1,0,0,0|1,0,1]=4 776 B15R2.10698 CC1=C(C2=CC=CC=C2N1C)CCN MCULE-1182662463 [0,1,1,0,0,0|2,0,0]=4 777 B15R2.10698 CC1=C(C2=CC=CC=C2N1C)CCN MCULE-4368174945 [0,1,1,0,0,0|2,0,0]=4 778 B15R2.11812 CC1=C(C2=C(N1)C=C(C=C2)F)CCN MCULE-6555339036 [0,1,1,0,0,0|2,0,0]=4 779 B15R2.11812 CC1=C(C2=C(N1)C=C(C=C2)F)CCN MCULE-9988695244 [0,1,1,0,0,0|2,0,0]=4 780 B15R2.11815 CC1=C(C2=C(N1)C(=CC=C2)Cl)CCN MCULE-5178232273 [0,1,1,0,0,0|2,0,0]=4 781 B15R2.11815 CC1=C(C2=C(N1)C(=CC=C2)Cl)CCN MCULE-9983144925 [0,1,1,0,0,0|2,0,0]=4 782 B15R2.11815 CC1=C(C2=C(N1)C(=CC=C2)F)CCN MCULE-2082396096 [0,1,1,0,0,0|2,0,0]=4 783 B15R2.11815 CC1=C(C2=C(N1)C(=CC=C2)F)CCN MCULE-2352779395 [0,1,1,0,0,0|2,0,0]=4 784 B15R2.11815 CC1=C(C2=C(N1)C(=CC=C2)F)CCN MCULE-6814256679 [0,1,1,0,0,0|2,0,0]=4 785 B15R2.11815 CC1=C(C2=CC=CC(=C2N1)Br)CCN MCULE-2225514084 [0,1,1,0,0,0|2,0,0]=4 786 B15R2.11815 CC1=C(C2=CC=CC(=C2N1)Br)CCN MCULE-8825720151 [0,1,1,0,0,0|2,0,0]=4 787 B15R2.11815 CC1=C(C2=CC=CC(=C2N1)I)CCN MCULE-7328411789 [0,1,1,0,0,0|2,0,0]=4 788 B15R2.11815 CC1=C2NC(=C(C2=CC=C1)CCN)C MCULE-4508243160 [0,1,1,0,0,0|2,0,0]=4 789 B15R2.11815 CC1=CC=CC2=C1NC(=C2CCN)C MCULE-2651324119 [0,1,1,0,0,0|2,0,0]=4 790 B15R2.11815 CC1=CC=CC2=C1NC(=C2CCN)C MCULE-5277502748 [0,1,1,0,0,0|2,0,0]=4 791 B15R2.19393 C=C[C@@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-2758978111 [0,1,1,0,0,0|1,0,1]=4 792 B15R2.19393 C=C[C@@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-6382084124 [0,1,1,0,0,0|1,0,1]=4 793 B15R2.19393 C=C[C@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-3373287632 [0,1,1,0,0,0|1,0,1]=4 794 B15R2.19393 C=C[C@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-5024742459 [0,1,1,0,0,0|1,0,1]=4 795 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CF MCULE-3038871044 [0,1,1,0,0,0|2,0,0]=4 796 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CF MCULE-8268960244 [0,1,1,0,0,0|2,0,0]=4 797 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CN MCULE-3261824694 [0,1,1,0,0,0|2,0,0]=4 798 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CN MCULE-7161887431 [0,1,1,0,0,0|2,0,0]=4 799 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CO MCULE-3522746428 [0,1,1,0,0,0|2,0,0]=4 800 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@@H](N)CO MCULE-5312102122 [0,1,1,0,0,0|2,0,0]=4 801 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CF MCULE-2207988662 [0,1,1,0,0,0|2,0,0]=4 802 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CF MCULE-5816762654 [0,1,1,0,0,0|2,0,0]=4 803 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CN MCULE-4525865143 [0,1,1,0,0,0|2,0,0]=4 804 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CN MCULE-5869269093 [0,1,1,0,0,0|2,0,0]=4 805 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CO MCULE-3238216649 [0,1,1,0,0,0|2,0,0]=4 806 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)[C@H](N)CO MCULE-8042897509 [0,1,1,0,0,0|2,0,0]=4 807 B15R2.19393 CC1=C(C2=CC=CC=C2N1)C(O)CN MCULE-4583584127 [0,1,1,0,0,0|2,0,0]=4 808 B15R2.19393 CCC(=O)C1=C(NC2=C1C=CC=C2)C MCULE-9681026009 [0,1,1,0,0,0|1,0,1]=4 809 B15R2.19393 CC[C@@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-1561343125 [0,1,1,0,0,0|1,0,0]=3 810 B15R2.19393 CC[C@@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-8713516409 [0,1,1,0,0,0|1,0,0]=3 811 B15R2.19393 CC[C@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-2923413013 [0,1,1,0,0,0|1,0,0]=3 812 B15R2.19393 CC[C@H](N)C1=C(NC2=C1C=CC=C2)C MCULE-4518228238 [0,1,1,0,0,0|1,0,0]=3 813 B15R2.19393 COC(=O)C1=C(NC2=C1C=CC=C2)C MCULE-4647229741 [0,1,1,0,0,0|1,0,1]=4 814 B15R2.56716 CC1=CC=CC2=C1C(=C(N2)C)CCN MCULE-4935748335 [0,1,1,0,0,0|2,0,0]=4 815 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)Br)CCN MCULE-4140585219 [0,1,1,0,0,0|2,0,0]=4 816 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)Br)CCN MCULE-5191387381 [0,1,1,0,0,0|2,0,0]=4 817 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)Br)CCN MCULE-8641134779 [0,1,1,0,0,0|2,0,0]=4 818 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)Cl)CCN MCULE-2051495644 [0,1,1,0,0,0|2,0,0]=4 819 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)Cl)CCN MCULE-9388619717 [0,1,1,0,0,0|2,0,0]=4 820 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)I)CCN MCULE-3682761008 [0,1,1,0,0,0|2,0,0]=4 821 B15R2.56717 CC1=C(C2=CC(=CC=C2N1)F)CCN MCULE-3329092347 [0,1,1,0,0,0|2,0,0]=4 822 B15R2.56717 CC1=C(C2=CC(=CC=C2N1)F)CCN MCULE-8424688922 [0,1,1,0,0,0|2,0,0]=4 823 B15R2.56717 CC1=C(C2=CC(=CC=C2N1)F)CCN MCULE-8612943258 [0,1,1,0,0,0|2,0,0]=4 824 B15R2.56717 CC1=C(C2=CC(=CC=C2N1)I)CCN MCULE-2088264755 [0,1,1,0,0,0|2,0,0]=4 825 B15R2.56717 CC1=C(C2=CC(=CC=C2N1)O)CCN MCULE-5329313088 [0,1,1,0,0,0|2,0,0]=4 826 B15R2.56717 CC1=C(C2=CC(=CC=C2N1)O)CCN MCULE-9708660367 [0,1,1,0,0,0|2,0,0]=4 827 B15R2.56717 CC1=C(C2=CC(=CC=C2N1)O)CCN MCULE-9865437359 [0,1,1,0,0,0|2,0,0]=4 828 B15R2.56717 CC1=CC2=C(C=C1)NC(=C2CCN)C MCULE-3374177825 [0,1,1,0,0,0|2,0,0]=4 829 B15R2.56717 CC1=CC=C2NC(=C(C2=C1)CCN)C MCULE-1220780884 [0,1,1,0,0,0|2,0,0]=4 830 B15R2.56717 CC1=CC=C2NC(=C(C2=C1)CCN)C MCULE-7440913280 [0,1,1,0,0,0|2,0,0]=4 831 B15R2.201 CCC1=C(C2=CC=CC=C2N1C)C=O MCULE-8636174384 [0,1,1,0,0,0|1,0,1]=4 832 B15R2.4190 CCC1=C(OC2=C1C=CC=C2)C(C)N MCULE-6569716157 [0,1,1,0,0,0|2,0,0]=4 833 B15R2.4190 CCC1=C(OC2=C1C=CC=C2)C(C)O MCULE-3618962538 [0,1,1,0,0,0|2,0,0]=4 834 B15R3.50 BrC1=CC2=C(C=C1)C3=C(N2)CCC3 MCULE-5452322387 [0,1,0,0,1,0|0,0,0]=2 835 B15R3.50 ClC1=CC=C2C(=C1)N=C3N2CCC3 MCULE-9939638053 [0,1,0,0,1,0|1,0,1]=4 836 B15R3.173 CN1C2=CC=CC=C2N3C1=NCC3 MCULE-2542652823 [0,1,0,0,1,0|2,0,0]=4 837 B15R3.173 CN1C2=CC=CC=C2N3C1=NCC3 MCULE-4642719054 [0,1,0,0,1,0|2,0,0]=4 838 B15R3.562 BrC1=C2NC3=C(C2=CC=C1)CCC3 MCULE-5540672740 [0,1,0,0,1,0|0,0,0]=2 839 B15R3.2009 NC1CC2=C(C1)C3=C(N2)C=CC=C3 MCULE-3220302711 [0,1,0,0,1,0|0,0,0]=2 840 B15R3.2009 O=C1CC2=C(C1)C3=C(N2)C=CC=C3 MCULE-4808786300 [0,1,0,0,1,0|0,0,1]=3 841 B15R3.2249 O=C1CCC2=C1NC3=C2C=CC=C3 MCULE-4237567663 [0,1,0,0,1,0|0,0,1]=3 842 B15R3.10083 O=C1CCC2=C1C3=C(N2)C=CC=C3 MCULE-3321867220 [0,1,0,0,1,0|0,0,1]=3 843 B15R3.10083 O=C1CCC2=C1C3=CC=CC=C3S2 MCULE-6437766518 [0,1,0,0,1,0|1,0,1]=4 844 B15R3.10083 O=C1NCC2=C1C3=C(N2)C=CC=C3 MCULE-9780017048 [0,1,0,0,1,0|0,0,1]=3 845 B15R3.10591 BrC1=CC2=C(C=C1)NC3=C2CCC3 MCULE-1593049899 [0,1,0,0,1,0|0,0,0]=2 846 B15R3.10591 CC1=CC=C2NC3=C(C2=C1)CCC3 MCULE-1478919226 [0,1,0,0,1,0|0,0,0]=2 847 B15R3.10591 ClC1=CC2=C(C=C1)NC3=C2CCC3 MCULE-8979283115 [0,1,0,0,1,0|0,0,0]=2 848 B15R3.10591 FC1=CC=C2NC3=C(C2=C1)CCC3 MCULE-8339309580 [0,1,0,0,1,0|0,0,0]=2 849 B15R3.10591 IC1=CC2=C(C=C1)NC3=C2CCC3 MCULE-6444697367 [0,1,0,0,1,0|0,0,0]=2 850 B15R3.15273 BrC1=CC=CC2=C1C3=C(N2)CCC3 MCULE-1485316082 [0,1,0,0,1,0|0,0,0]=2 851 B17R3.18998 CN1COC2=C(C1)C3=CC=CC=C3C=C2 MCULE-6718681004 [0,1,0,0,0,1|2,0,0]=4 852 B17R3.18998 OC1=CC2=C(C=C1)N=CC3=C2CCCC3 MCULE-6178323851 [0,1,0,0,0,1|1,0,1]=4 853 B17R3.18998 ON1COC2=CC=C3C=CC=CC3=C2C1 MCULE-6174103708 [0,1,0,0,0,1|2,0,0]=4 854 B17R3.54615 O=C1NC2=CC=CC=C2C3=C1CCCC3 MCULE-4838075208 [0,1,0,0,0,1|1,0,0]=3 855 B17R3.54615 O=C1NC2=CC=CC=C2C3=C1CNCC3 MCULE-4189171725 [0,1,0,0,0,1|2,0,0]=4 856 B17R3.54615 S=C1NC2=C(C=CC=C2)C3=C1CCCC3 MCULE-6392737524 [0,1,0,0,0,1|1,0,0]=3 857 B17R3.3205 BrC1=CN=C2N=C3CCNCC3=CC2=C1 MCULE-7480463949 [0,1,0,0,0,1|1,0,1]=4 858 B17R3.3205 BrC1=CN=C2N=C3CCNCC3=CC2=C1 MCULE-9033761915 [0,1,0,0,0,1|1,0,1]=4 859 B17R3.3205 FC1=CC2=C(C=C1)N=C3CCCCC3=N2 MCULE-7765593346 [0,1,0,0,0,1|1,0,1]=4 860 B17R3.35227 BrC1=C2CCCCC2=NC3=CC=CC=C13 MCULE-5625380312 [0,1,0,0,0,1|1,0,1]=4 861 B17R3.35227 CC1=C2C=CC=CC2=NC3=C1CCCC3 MCULE-2546935399 [0,1,0,0,0,1|1,0,1]=4 862 B17R3.35227 ClC1=C2CCCCC2=NC3=C1C=CC=C3 MCULE-8957811182 [0,1,0,0,0,1|1,0,1]=4 863 B17R3.35227 NC1=C2C=CC=CC2=NC3=C1CCCC3 MCULE-3628803328 [0,1,0,0,0,1|1,0,1]=4 864 B17R3.35227 NC1=C2C=CC=CC2=NC3=C1CCCC3 MCULE-4824739637 [0,1,0,0,0,1|1,0,1]=4 865 B17R3.35227 NC1=C2C=CC=CC2=NC3=C1CCCC3 MCULE-6688871242 [0,1,0,0,0,1|1,0,1]=4 866 B17R3.35227 NC1=C2C=CC=CC2=NC3=C1COCC3 MCULE-8899994310 [0,1,0,0,0,1|1,0,1]=4 867 B17R3.35227 NC1=C2CCCCC2=CC3=CC=CC=C13 MCULE-2206793376 [0,1,0,0,0,1|2,0,0]=4 868 B17R3.35227 O=C1C2=C(C=CC=C2)NC3=C1CCCO3 MCULE-7988507370 [0,1,0,0,0,1|2,0,0]=4 869 B17R3.35227 O=C1C2=C(C=CC=C2)NC3=C1CNCC3 MCULE-8559177090 [0,1,0,0,0,1|0,0,0]=2 870 B17R3.35227 O=C1C2=C(CCNC2)N=C3N1C=CC=C3 MCULE-6870437331 [0,1,0,0,0,1|1,0,1]=4 871 B17R3.35227 OC1=C2C=CC=CC2=NC3=C1CCCC3 MCULE-6355371150 [0,1,0,0,0,1|1,0,1]=4 872 B17R3.50126 CC1=CC=CC2=NC3=C(CCCC3)N=C12 MCULE-3121271236 [0,1,0,0,0,1|1,0,1]=4 873 B17R3.50126 O=C1CCCC2=C1SC3=C(N2)C=CC=C3 MCULE-9021609694 [0,1,0,0,0,1|1,0,1]=4 874 B17R3.50126 OC1CCCC2=CC3=CC=CC=C3N=C12 MCULE-7968523424 [0,1,0,0,0,1|1,0,1]=4 875 B17R3.3210 CN1CCC2=C(CC1)C3=CC=CC=C3N2 MCULE-3016982666 [0,1,0,0,0,1|0,0,0]=2 876 B17R3.5121 O=C1C=CC=CC2=C1NC3=C2CCCC3 MCULE-5082020113 [0,1,0,0,0,1|1,0,0]=3 877 B17R3.5121 O=C1CCCCC2=C1NC3=C2C=CC=C3 MCULE-3631162458 [0,1,0,0,0,1|1,0,0]=3 878 B17R3.5121 O=C1NCCCC2=C1NC3=CC=CC=C23 MCULE-6294785752 [0,1,0,0,0,1|1,0,1]=4 879 B17R3.5121 [O-]C1=C2[NH+]=C3CCCCC3=C2C=CC=C1 MCULE-3897226952 [0,1,0,0,0,1|1,0,1]=4 880 B17R3.31653 BrC1=CC2=C(C=C1)NC3=C2CCCCC3 MCULE-7900231456 [0,1,0,0,0,1|1,0,0]=3 881 B17R3.31653 BrC1=CC=C2N=C3CCNCCN3C2=C1 MCULE-5029005333 [0,1,0,0,0,1|1,0,1]=4 882 B17R3.31653 BrC1=CC=C2NC3=C(C2=C1)CCNCC3 MCULE-6285004248 [0,1,0,0,0,1|0,0,0]=2 883 B17R3.31653 CC1=CC2=C(C=C1)NC3=C2CCCCC3 MCULE-9825611384 [0,1,0,0,0,1|1,0,0]=3 884 B17R3.31653 CC1=CC=C2NC3=C(C2=C1)CCNCC3 MCULE-8525438396 [0,1,0,0,0,1|0,0,0]=2 885 B17R3.31653 CC1=CC=C2NC3=C(C2=C1)CCNCC3 MCULE-9045776829 [0,1,0,0,0,1|0,0,0]=2 886 B17R3.31653 FC1=CC2=C(C=C1)NC3=C2CNCCC3 MCULE-5666435748 [0,1,0,0,0,1|0,0,0]=2 887 B17R3.31653 FC1=CC=C2NC3=C(C2=C1)CCCCC3 MCULE-8979835037 [0,1,0,0,0,1|1,0,0]=3 888 B17R3.31653 FC1=CC=C2NC3=C(C2=C1)CNCCC3 MCULE-4885458601 [0,1,0,0,0,1|0,0,0]=2 889 B17R3.31653 IC1=CC2=C(C=C1)NC3=C2CCCCC3 MCULE-5320135611 [0,1,0,0,0,1|1,0,0]=3 890 B17R3.31653 NC1=CC2=C(C=C1)NC3=C2CCCCC3 MCULE-6463738968 [0,1,0,0,0,1|1,0,0]=3 891 B17R3.51118 FC1=C2NC3=C(C2=CC=C1)CCCNC3 MCULE-6052949440 [0,1,0,0,0,1|1,0,0]=3 892 B17R3.275810 BrC1=CC=C2C(=C1)N=C3N2CCNCC3 MCULE-4134211952 [0,1,0,0,0,1|1,0,1]=4 893 B17R3.295117 CN1C2=C(C=CC=C2)C3=C1CCNCC3 MCULE-8362273883 [0,1,0,0,0,1|0,0,0]=2 894 B17R3.295117 CN1C2=C(C=CC=C2)C3=C1CCNCC3 MCULE-9099661994 [0,1,0,0,0,1|0,0,0]=2 895 B17R3.1513 CCN1CCC2=C(C1)C3=C(N2)C=CC=C3 MCULE-8216407393 [0,2,0,0,0,0|0,0,0]=2 896 B17R3.1513 COC1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-5586483608 [0,2,0,0,0,0|1,0,0]=3 897 B17R3.1513 COC1=CC2=C(C=C1)NC3=C2CCNC3 MCULE-4067050427 [0,2,0,0,0,0|2,0,0]=4 898 B17R3.1513 COC1=CC2=C(C=C1)NC3=C2CCNC3 MCULE-7776419556 [0,2,0,0,0,0|2,0,0]=4 899 B17R3.1513 COC1=CC=C2NC3=C(C2=C1)CNCC3 MCULE-3171474171 [0,2,0,0,0,0|0,0,0]=2 900 B17R3.1513 COC1=CC=C2NC3=C(C2=C1)CNCC3 MCULE-7764312699 [0,2,0,0,0,0|0,0,0]=2 901 B17R3.1513 NCC1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-6262939084 [0,2,0,0,0,0|1,0,0]=3 902 B17R3.1513 NCC1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-9887732980 [0,2,0,0,0,0|1,0,0]=3 903 B17R3.1513 OCC1CC2=C(CN1)NC3=C2C=CC=C3 MCULE-2160672557 [0,2,0,0,0,0|2,0,0]=4 904 B17R3.2813 ClC1=CC2=C(C=C1Cl)C3=C(N2)CCCC3 MCULE-7476174223 [0,2,0,0,0,0|1,0,0]=3 905 B17R3.19747 CC1=CC2=C(C=C1)C3=C(N2)CCN(C3)C MCULE-2994748419 [0,2,0,0,0,0|0,0,0]=2 906 B17R3.19747 CC1=CC2=C(C=C1)C3=C(N2)CCN(C3)C MCULE-9696415424 [0,2,0,0,0,0|0,0,0]=2 907 B17R3.19747 CC1=CC2=C(C=C1)NC3=C2CCC(C3)N MCULE-3152013269 [0,2,0,0,0,0|1,0,0]=3 908 B17R3.19747 CC1=CC2=C(C=C1)NC3=C2CCN(C3)C MCULE-8945861219 [0,2,0,0,0,0|2,0,0]=4 909 B17R3.19747 CN1CCC2=C(C1)C3=CC=C(C=C3N2)Cl MCULE-1679645218 [0,2,0,0,0,0|0,0,0]=2 910 B17R3.19747 CN1CCC2NC3=CC(=CC=C3C2C1)Cl MCULE-8262250961 [0,2,0,0,0,0|0,0,2]=4 911 B17R3.19747 NC1CCC2=C(C1)NC3=C2C=C(C=C3)F MCULE-3447275997 [0,2,0,0,0,0|1,0,0]=3 912 B17R3.19747 O=C1CCC2=C(C1)NC3=C2C=C(C=C3)F MCULE-7410192469 [0,2,0,0,0,0|1,0,1]=4 913 B17R3.31626 CC1=CC2=C(C=C1)NC3=C2C(=O)CCC3 MCULE-9373702964 [0,2,0,0,0,0|1,0,1]=4 914 B17R3.31626 O=C1CCCC2=C1C3=C(N2)C=CC(=C3)Cl MCULE-5443321177 [0,2,0,0,0,0|1,0,1]=4 915 B17R3.31626 O=C1CCCC2=C1C3=C(N2)C=CC(=C3)F MCULE-2310701633 [0,2,0,0,0,0|1,0,1]=4 916 B17R3.31627 CC1=CC2=C(C=C1)NC3=C2CC(=O)CC3 MCULE-3124541460 [0,2,0,0,0,0|1,0,0]=3 917 B17R3.31627 CC1=CC2=C(C=C1)NC3=C2CC(CC3)N MCULE-3935824751 [0,2,0,0,0,0|1,0,0]=3 918 B17R3.31627 CC1=CC2=C(C=C1)NC3=C2CN(CC3)C MCULE-2906263037 [0,2,0,0,0,0|0,0,0]=2 919 B17R3.31627 CC1=CC2=C(C=C1)NC3C2CN(CC3)C MCULE-1151227089 [0,2,0,0,0,0|0,0,2]=4 920 B17R3.31627 CC1=CC2=C(C=C1)NC3C2CN(CC3)C MCULE-1924335960 [0,2,0,0,0,0|0,0,2]=4 921 B17R3.31627 CC1=CC2=C(C=C1)NC3C2CN(CC3)C MCULE-5943960847 [0,2,0,0,0,0|0,0,2]=4 922 B17R3.31627 CC1=CC2=C(C=C1)N[C@H]3[C@@H]2CN(CC3)C MCULE-1212855658 [0,2,0,0,0,0|0,0,2]=4 923 B17R3.31627 CC1=CC2=C(C=C1)N[C@H]3[C@@H]2CN(CC3)C MCULE-5310820331 [0,2,0,0,0,0|0,0,2]=4 924 B17R3.31627 CC1=CC2=C(C=C1)N[C@H]3[C@@H]2CN(CC3)C MCULE-5613391546 [0,2,0,0,0,0|0,0,2]=4 925 B17R3.31627 CC1=CC2=C(C=C1)N[C@H]3[C@@H]2CN(CC3)C MCULE-7482799645 [0,2,0,0,0,0|0,0,2]=4 926 B17R3.31627 CC1=CC2=C(C=C1)N[C@H]3[C@H]2CN(CC3)C MCULE-2797021991 [0,2,0,0,0,0|0,0,2]=4 927 B17R3.31627 CN1CCC2=C(C1)C3=C(N2)C=CC(=C3)Br MCULE-5881706995 [0,2,0,0,0,0|0,0,0]=2 928 B17R3.31627 CN1CCC2=C(C1)C3=C(N2)C=CC(=C3)Cl MCULE-7509419058 [0,2,0,0,0,0|0,0,0]=2 929 B17R3.31627 CN1CCC2=C(C1)C3=C(N2)C=CC(=C3)F MCULE-4033844354 [0,2,0,0,0,0|0,0,0]=2 930 B17R3.31627 CN1CCC2=C(C1)C3=C(N2)C=CC(=C3)I MCULE-4068417220 [0,2,0,0,0,0|0,0,0]=2 931 B17R3.31627 CN1CCC2=C(C1)C3=C(N2)C=CC(=C3)O MCULE-7805312412 [0,2,0,0,0,0|0,0,0]=2 932 B17R3.31627 CN1CCC2=C(C1)C3=C(O2)C=CC(=C3)Cl MCULE-5032424685 [0,2,0,0,0,0|1,0,0]=3 933 B17R3.31627 CN1CCC2=C(C1)C3=C(O2)C=CC(=C3)Cl MCULE-9537097616 [0,2,0,0,0,0|1,0,0]=3 934 B17R3.31627 CN1CCC2=C(C1)C3=C(O2)C=CC(=C3)N MCULE-4742457347 [0,2,0,0,0,0|1,0,0]=3 935 B17R3.31627 NC1CCC2=C(C1)C3=C(N2)C=CC(=C3)Cl MCULE-4349793645 [0,2,0,0,0,0|1,0,0]=3 936 B17R3.31627 NC1CCC2=C(C1)C3=C(N2)C=CC(=C3)O MCULE-5556008961 [0,2,0,0,0,0|1,0,0]=3 937 B17R3.31627 O=C1CCC2=C(C1)C3=C(N2)C=CC(=C3)Br MCULE-3206223525 [0,2,0,0,0,0|1,0,0]=3 938 B17R3.31627 OC1CCC2=C(C1)C3=C(N2)C=CC(=C3)Cl MCULE-6044669345 [0,2,0,0,0,0|1,0,0]=3 939 B17R3.31627 [C@@H]12CCN(C[C@H]1C3=CC(=CC=C3N2)C)C MCULE-3304063804 [0,2,0,0,0,0|0,0,2]=4 940 B17R3.31627 [NH+]1(CCC2=C(C1)C3=CC(=CC=C3[NH2+]2)C)C MCULE-4954770378 [0,2,0,0,0,0|0,0,2]=4 941 B17R3.31713 CN1C2=C(C=C(C=C2)O)C3=C1CCCC3 MCULE-8677391747 [0,2,0,0,0,0|1,0,0]=3 942 B17R3.31713 CN1C2=C(C=CC=C2)C3=C1CC[NH+](C3)C MCULE-1822953971 [0,2,0,0,0,0|0,0,1]=3 943 B17R3.31713 CN1C2=CC=C(C=C2C3=C1CCCC3)Br MCULE-6874624962 [0,2,0,0,0,0|1,0,0]=3 944 B17R3.31713 CN1C2=CC=C(C=C2C3=C1CCNC3)Br MCULE-9209256460 [0,2,0,0,0,0|0,0,0]=2 945 B17R3.31713 CN1C2=CC=C(C=C2C3=C1CCNC3)F MCULE-6674344822 [0,2,0,0,0,0|0,0,0]=2 946 B17R3.31713 CN1C2=CC=CC=C2C3=C1CCC(C3)N MCULE-2448077739 [0,2,0,0,0,0|1,0,0]=3 947 B17R3.31713 CN1CCC2=C(C1)C3=C(N2C)C=CC=C3 MCULE-9990623227 [0,2,0,0,0,0|0,0,0]=2 948 B17R3.31713 [C@@H]12CN(CC[C@H]1N(C3=C2C=CC=C3)C)C MCULE-4324565746 [0,2,0,0,0,0|0,0,2]=4 949 B17R3.34483 CC1CC(=O)C2=C(C1)C3=CC=CC=C3N2 MCULE-5802352673 [0,2,0,0,0,0|1,0,1]=4 950 B17R3.34483 CC1CC2=C(NC3=CC=CC=C23)C(N1)C MCULE-3271454297 [0,2,0,0,0,0|2,0,0]=4 951 B17R3.34483 CC1CC2=C(NC3=CC=CC=C23)C(N1)C MCULE-6397872322 [0,2,0,0,0,0|2,0,0]=4 952 B17R3.34483 ClC1=CC(=C2NC3=C(C2=C1)CCCC3)Cl MCULE-4448661148 [0,2,0,0,0,0|1,0,0]=3 953 B17R3.34483 ClC1=CC2=C(NC3=C2CNCC3)C(=C1)Cl MCULE-6886779389 [0,2,0,0,0,0|0,0,0]=2 954 B17R3.34483 ClC1=CC2=C(NC3=C2CNCC3)C(=C1)Cl MCULE-8125641960 [0,2,0,0,0,0|0,0,0]=2 955 B17R3.284867 CC1=CC2=C(C=C1)NC3=C2CCCC3N MCULE-5069546885 [0,2,0,0,0,0|1,0,0]=3 956 B17R3.284867 CC1=CC2=C(C=C1)NC3=C2CCCC3O MCULE-1977019762 [0,2,0,0,0,0|1,0,0]=3 957 B17R3.284867 CC1=CC=C2NC3=C(C2=C1)CCCC3=O MCULE-6788319029 [0,2,0,0,0,0|1,0,1]=4 958 B17R3.284867 CC1=CC=CC2=C1NC3=C2CN(CC3)C MCULE-4747982216 [0,2,0,0,0,0|0,0,0]=2 959 B17R3.284867 CC1=CC=CC2=C1NC3=C2CN(CC3)C MCULE-5972385470 [0,2,0,0,0,0|0,0,0]=2 960 B17R3.284867 CC1CCC2=C(C1)C3=C(N2)C(=CC=C3)Br MCULE-8338747481 [0,2,0,0,0,0|1,0,0]=3 961 B17R3.284867 CN1CCC2=C(C1)C3=C(N2)C(=CC=C3)F MCULE-2824183880 [0,2,0,0,0,0|0,0,0]=2 962 B17R3.284867 CN1CCC2=C(C1)C3=C(N2)C(=CC=C3)F MCULE-8084763489 [0,2,0,0,0,0|0,0,0]=2 963 B17R3.284867 NC1=CC=C2NC3=C(C2=C1)CCCC3=O MCULE-6876600633 [0,2,0,0,0,0|1,0,1]=4 964 B17R3.284867 NC1CCCC2=C1NC3=C2C=C(C=C3)Br MCULE-4161297277 [0,2,0,0,0,0|1,0,0]=3 965 B17R3.284867 NC1CCCC2=C1NC3=C2C=C(C=C3)Cl MCULE-1247300346 [0,2,0,0,0,0|1,0,0]=3 966 B17R3.284867 NC1CCCC2=C1NC3=C2C=C(C=C3)Cl MCULE-3323101224 [0,2,0,0,0,0|1,0,0]=3 967 B17R3.284867 NC1CCCC2=C1NC3=CC=C(C=C23)F MCULE-8497621016 [0,2,0,0,0,0|1,0,0]=3 968 B17R3.284867 O=C1CCCC2=C1NC3=C2C=C(C=C3)Br MCULE-4813662071 [0,2,0,0,0,0|1,0,1]=4 969 B17R3.284867 O=C1CCCC2=C1NC3=C2C=C(C=C3)Cl MCULE-3890355112 [0,2,0,0,0,0|1,0,1]=4 970 B17R3.284867 O=C1CCCC2=C1NC3=C2C=C(C=C3)F MCULE-5148930600 [0,2,0,0,0,0|1,0,1]=4 971 B17R3.284867 OC1CCCC2=C1NC3=C2C=C(C=C3)Br MCULE-7318775878 [0,2,0,0,0,0|1,0,0]=3 972 B17R3.284867 OC1CCCC2=C1NC3=C2C=C(C=C3)Cl MCULE-4561789282 [0,2,0,0,0,0|1,0,0]=3 973 B17R3.284867 [C@H]1(CCCC2=C1NC3=C2C=C(C=C3)C)O MCULE-4713401783 [0,2,0,0,0,0|1,0,0]=3 974 B17R3.1577 COC1=CC2=C(C=C1)C3=C(N2)CCCC3 MCULE-9872404632 [0,2,0,0,0,0|1,0,0]=3 975 B17R3.1577 COC1=CC2=C(C=C1)C3=C(N2)CCNC3 MCULE-6338071905 [0,2,0,0,0,0|0,0,0]=2 976 B17R3.1577 COC1=CC=C2C(=C1)NC3=C2CNCC3 MCULE-7409444907 [0,2,0,0,0,0|0,0,0]=2 977 B17R3.1577 O/N=C\1/CCC2=C(C1)NC3=C2C=CC=C3 MCULE-7541399736 [0,2,0,0,0,0|1,0,1]=4 978 B17R3.1577 ON=C1CCC2=C(C1)NC3=C2C=CC=C3 MCULE-2112787079 [0,2,0,0,0,0|1,0,1]=4 979 B17R3.19746 O=C1CCCC2=C1C3=C(N2)C=C(C=C3)Br MCULE-5523407125 [0,2,0,0,0,0|1,0,1]=4 980 B17R3.30284 CN1CCC2=C(C1)NC3=C2C=CC(=C3)F MCULE-9608301732 [0,2,0,0,0,0|2,0,0]=4 981 B17R3.30495 NC1=CC=C2C(=C1)NC3=C2CCCC3=O MCULE-8110119914 [0,2,0,0,0,0|1,0,1]=4 982 B17R3.30495 O=C1CCCC2=C1NC3=C2C=CC(=C3)Br MCULE-1071852663 [0,2,0,0,0,0|1,0,1]=4 983 B17R3.31811 CC1=C(C2=C(C=C1)C3=C(N2)CCNC3)C MCULE-2816657566 [0,2,0,0,0,0|0,0,0]=2 984 B17R3.31811 CC1=C(C2=C(C=C1)C3=C(N2)CCNC3)C MCULE-7630900824 [0,2,0,0,0,0|0,0,0]=2 985 B17R3.31811 CC1=C(C=CC2=C1NC3=C2CCCC3)Cl MCULE-7050820139 [0,2,0,0,0,0|1,0,0]=3 986 B17R3.34323 CC1=CC2=C(C(=C1)C)C3=C(N2)CCCC3 MCULE-9467933839 [0,2,0,0,0,0|1,0,0]=3 987 B17R3.34323 CC1CC(=O)C2=C(C1)NC3=C2C=CC=C3 MCULE-7929521818 [0,2,0,0,0,0|1,0,1]=4 988 B17R3.633 CCC1NCCC2=C1NC3=C2C=CC=C3 MCULE-2875207063 [0,2,0,0,0,0|2,0,0]=4 989 B17R3.633 COC1=C2NC3=C(C2=CC=C1)CNCC3 MCULE-2260588603 [0,2,0,0,0,0|0,0,0]=2 990 B17R3.633 COC1=C2NC3=C(C2=CC=C1)CNCC3 MCULE-7266027148 [0,2,0,0,0,0|0,0,0]=2 991 B17R3.633 N#CC1=CC=CC2=C1NC3=C2CCCC3 MCULE-3572454145 [0,2,0,0,0,0|1,0,0]=3 992 B17R3.633 N#CC1CCCC2=C1NC3=CC=CC=C23 MCULE-6286558165 [0,2,0,0,0,0|1,0,0]=3 993 B17R3.633 NCC1CCCC2=C1NC3=C2C=CC=C3 MCULE-5156465388 [0,2,0,0,0,0|1,0,0]=3 994 B17R3.633 NCC1CCCC2=C1NC3=C2C=CC=C3 MCULE-5971605757 [0,2,0,0,0,0|1,0,0]=3 995 B17R3.633 ON=C1CCCC2=C1NC3=C2C=CC=C3 MCULE-8659399467 [0,2,0,0,0,0|1,0,1]=4 996 B17R3.51120 CC1=C2NC3=C(C2=CC=C1)CCCC3=O MCULE-8625206108 [0,2,0,0,0,0|1,0,1]=4 997 B17R3.51120 NC1CCCC2=C1NC3=C(C=CC=C23)Cl MCULE-7269574244 [0,2,0,0,0,0|1,0,0]=3 998 B17R3.51120 O=C1CCCC2=C1NC3=C(C=CC=C23)Cl MCULE-3671641571 [0,2,0,0,0,0|1,0,1]=4 999 B17R3.51120 O=C1CCCC2=C1NC3=C2C=CC=C3Br MCULE-2103800773 [0,2,0,0,0,0|1,0,1]=4 1000 B17R3.51174 CN1C2=C(C=CC=C2)C3=C1C(=O)CCC3 MCULE-5123939235 [0,2,0,0,0,0|1,0,1]=4 1001 B17R3.4408 CN1C2=C(C=CC=C2)C3=C1CCCC3=O MCULE-6676569088 [0,2,0,0,0,0|1,0,1]=4 1002 B17R3.4408 CN1C2=C(C=CC=C2)C3=C1CCNC3=O MCULE-1461407084 [0,2,0,0,0,0|0,0,1]=3 1003 B17R3.182920 CCN1C2=CC=CC=C2C3C1CCNC3 MCULE-3323749286 [0,2,0,0,0,0|0,0,2]=4 1004 B17R3.182920 CCN1C2=CC=CC=C2C3C1CCNC3 MCULE-3983282012 [0,2,0,0,0,0|0,0,2]=4 1005 B17R3.83064 O/N=C/1\CCCC2=C1C3=CC=CC=C3N2 MCULE-1166040047 [0,2,0,0,0,0|1,0,1]=4 1006 B17R3.83064 ON=C1CCCC2=C1C3=CC=CC=C3N2 MCULE-3074420954 [0,2,0,0,0,0|1,0,1]=4 1007 B13R1.28 C=CCCNCCC1=CC=CC=C1 MCULE-9178516652 [0,0,2,0,0,0|1,0,1]=4 1008 B13R1.674 NCCNC(=O)C1=C(C=CC=C1)N MCULE-8739271365 [0,0,2,0,0,0|2,0,0]=4 1009 B13R1.44 CNCCC(=O)NC1=CC=CC=C1 MCULE-4339512364 [0,0,2,0,0,0|1,0,0]=3 1010 B13R1.44 CNCCC(=O)NC1=CC=CC=C1 MCULE-4985565690 [0,0,2,0,0,0|1,0,0]=3 1011 B13R1.44 CNCCC(=O)NC1=CC=CN=C1 MCULE-4216790083 [0,0,2,0,0,0|2,0,0]=4 1012 B13R1.44 CNCCC(=O)NC1=CC=CN=C1 MCULE-7668855278 [0,0,2,0,0,0|2,0,0]=4 1013 B13R1.47 CN(C(=O)CCN)C1=CC=CC=C1 MCULE-4599702894 [0,0,2,0,0,0|2,0,0]=4 1014 B13R1.47 CN(C(=O)CCN)C1=CC=CC=C1 MCULE-9924456874 [0,0,2,0,0,0|2,0,0]=4 1015 B15R3.1736 C1=CC2=C(C=C1)C(=CN2)C3CNC3 MCULE-7321182053 [0,0,1,1,0,0|2,0,0]=4 1016 B15R3.1736 C1=CC2=C(C=C1)C(=CN2)C3CNC3 MCULE-7379467677 [0,0,1,1,0,0|2,0,0]=4 1017 B15R3.1736 C1=CC2=C(C=C1)C(=CS2)[C@@H]3CCN3 MCULE-5714844341 [0,0,1,1,0,0|1,0,0]=3 1018 B15R3.1736 C1=CC2=C(C=C1)C(=CS2)[C@@H]3CCN3 MCULE-7573015460 [0,0,1,1,0,0|1,0,0]=3 1019 B15R3.1736 C1=CC2=C(C=C1)C(=CS2)[C@H]3CCN3 MCULE-3262325015 [0,0,1,1,0,0|1,0,0]=3 1020 B15R3.1736 C1=CC2=C(C=C1)C(=CS2)[C@H]3CCN3 MCULE-8966909085 [0,0,1,1,0,0|1,0,0]=3 1021 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@@H]3CCN3 MCULE-3618592433 [0,0,1,1,0,0|0,0,0]=2 1022 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@@H]3CCN3 MCULE-4132878112 [0,0,1,1,0,0|0,0,0]=2 1023 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@H]3CCN3 MCULE-3125843188 [0,0,1,1,0,0|0,0,0]=2 1024 B15R3.1736 C1=CC=C2C(=C1)NC=C2[C@H]3CCN3 MCULE-5348642925 [0,0,1,1,0,0|0,0,0]=2 1025 B15R3.1736 C1=CC=C2C(=C1)NN=C2C3CCC3 MCULE-6508405162 [0,0,1,1,0,0|2,0,0]=4 1026 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)CN2 MCULE-1162706939 [0,0,1,1,0,0|0,0,2]=4 1027 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)CN2 MCULE-9110303447 [0,0,1,1,0,0|0,0,2]=4 1028 B15R3.24790 C1=CC2=C(C=C1)NC(=N2)C3CNC3 MCULE-3357513461 [0,0,1,1,0,0|1,0,0]=3 1029 B15R3.24790 C1=CC2=C(C=C1)SC(=N2)C3CNC3 MCULE-5057914189 [0,0,1,1,0,0|1,0,1]=4 1030 B15R3.24790 C1=CC2=C(N=C1)NC(=C2)C3CCC3 MCULE-3761838891 [0,0,1,1,0,0|2,0,0]=4 1031 B15R3.24790 C1=CC2=C(N=C1)NC(=C2)C3CNC3 MCULE-9348797280 [0,0,1,1,0,0|1,0,0]=3 1032 B15R3.24790 C1=CC=C2NC(=NC2=C1)C3CCC3 MCULE-8108295946 [0,0,1,1,0,0|2,0,0]=4 1033 B15R3.24790 C1=CC=C2OC(=NC2=C1)C3CNC3 MCULE-2364243621 [0,0,1,1,0,0|1,0,1]=4 1034 B15R3.24790 C1=CC=C2SC(=NC2=C1)C3CNC3 MCULE-5598712221 [0,0,1,1,0,0|1,0,1]=4 1035 B15R3.655 O=C1NC2=C(C13CNC3)C=CC=C2 MCULE-3552812555 [0,0,1,1,0,0|1,0,1]=4 1036 B15R3.655 O=C1NC2=C(C13CNC3)C=CC=C2 MCULE-4208350700 [0,0,1,1,0,0|1,0,1]=4 1037 B13R2.64 C1=CC=C(C=C1)C=C2CCCC2 MCULE-1176032575 [0,0,1,0,1,0|1,0,1]=4 1038 B13R2.64 C1=CC=C(C=C1)CC2CCNC2 MCULE-4850260867 [0,0,1,0,1,0|1,0,1]=4 1039 B13R2.64 C1=CC=C(C=C1)CC2CCNC2 MCULE-9430668751 [0,0,1,0,1,0|1,0,1]=4 1040 B13R2.64 C1=CC=C(C=C1)C[C@@H]2CCNC2 MCULE-3370276571 [0,0,1,0,1,0|1,0,1]=4 1041 B13R2.64 C1=CC=C(C=C1)C[C@H]2CCNC2 MCULE-3203008568 [0,0,1,0,1,0|1,0,1]=4 1042 B13R2.64 C1=CC=C(C=C1)NC2=NCCC2 MCULE-2683231905 [0,0,1,0,1,0|1,0,0]=3 1043 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 MCULE-2196574986 [0,0,1,0,1,0|2,0,0]=4 1044 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 MCULE-3861281239 [0,0,1,0,1,0|2,0,0]=4 1045 B13R2.64 C1=CC=C(C=C1)NC2CCCC2 MCULE-6067038447 [0,0,1,0,1,0|0,0,2]=4 1046 B13R2.64 C1=CC=C(C=C1)NC2CCNC2 MCULE-1181042338 [0,0,1,0,1,0|0,0,1]=3 1047 B13R2.64 C1=CC=C(C=C1)NC2CCOC2 MCULE-2218727783 [0,0,1,0,1,0|1,0,1]=4 1048 B13R2.64 C1=CC=C(C=C1)OC2CCNC2 MCULE-4506143623 [0,0,1,0,1,0|1,0,1]=4 1049 B13R2.64 C1=CC=C(C=C1)OC2CCNC2 MCULE-7240123635 [0,0,1,0,1,0|1,0,1]=4 1050 B13R2.64 C1=CC=C(C=C1)O[C@@H]2CCNC2 MCULE-2402583653 [0,0,1,0,1,0|1,0,1]=4 1051 B13R2.64 C1=CC=C(C=C1)O[C@@H]2CCNC2 MCULE-6075919004 [0,0,1,0,1,0|1,0,1]=4 1052 B13R2.64 C1=CC=C(C=C1)O[C@@H]2CCNC2 MCULE-6985686165 [0,0,1,0,1,0|1,0,1]=4 1053 B13R2.64 C1=CC=C(C=C1)O[C@@H]2CCNC2 MCULE-8924927608 [0,0,1,0,1,0|1,0,1]=4 1054 B13R2.64 C1=CC=C(C=C1)O[C@H]2CCNC2 MCULE-1414626211 [0,0,1,0,1,0|1,0,1]=4 1055 B13R2.64 C1=CC=C(C=C1)O[C@H]2CCNC2 MCULE-2857969279 [0,0,1,0,1,0|1,0,1]=4 1056 B13R2.64 C1=CC=C(C=C1)O[C@H]2CCNC2 MCULE-6646695370 [0,0,1,0,1,0|1,0,1]=4 1057 B13R2.64 C1=CC=C(C=C1)O[C@H]2CCNC2 MCULE-7952049053 [0,0,1,0,1,0|1,0,1]=4 1058 B13R2.64 C1=CC=C(N=C1)NC2CCNC2 MCULE-5355956561 [0,0,1,0,1,0|1,0,1]=4 1059 B13R2.64 C1=CC=C(N=C1)NC2CCNC2 MCULE-8299267482 [0,0,1,0,1,0|1,0,1]=4 1060 B13R2.64 C1=CC=C(N=C1)N[C@@H]2CCNC2 MCULE-2437367686 [0,0,1,0,1,0|1,0,1]=4 1061 B13R2.64 C1=CC=C(N=C1)N[C@@H]2CCNC2 MCULE-9578443386 [0,0,1,0,1,0|1,0,1]=4 1062 B13R2.64 C1=CC=C(N=C1)N[C@H]2CCNC2 MCULE-5837973666 [0,0,1,0,1,0|1,0,1]=4 1063 B13R2.64 C1=CN=C(C=C1)NC2CCNC2 MCULE-6727370675 [0,0,1,0,1,0|1,0,1]=4 1064 B13R2.64 C1=CN=C(C=C1)N[C@H]2CCNC2 MCULE-7142090184 [0,0,1,0,1,0|1,0,1]=4 1065 B13R2.15 NC1=C(NN=C1)C2=CC=CC=C2 MCULE-3478991728 [0,0,1,0,1,0|1,0,1]=4 1066 B13R2.15 NC1=NCCN1C2=CC=CC=C2 MCULE-2949711613 [0,0,1,0,1,0|2,0,0]=4 1067 B13R2.15 NC1=NCCN1C2=CC=CC=C2 MCULE-6227050352 [0,0,1,0,1,0|2,0,0]=4 1068 B13R2.15 NC1CCCC1C2=CC=CC=C2 MCULE-4114044855 [0,0,1,0,1,0|0,0,2]=4 1069 B13R2.15 NC1CNCC1C2=CC=CC=C2 MCULE-2254245989 [0,0,1,0,1,0|0,0,2]=4 1070 B13R2.15 NC1CNCC1C2=CC=CC=C2 MCULE-3128577505 [0,0,1,0,1,0|0,0,2]=4 1071 B13R2.15 N[C@@H]1CCC[C@@H]1C2=CC=CC=C2 MCULE-6250965416 [0,0,1,0,1,0|0,0,2]=4 1072 B13R2.15 N[C@@H]1CCC[C@@H]1C2=CC=CC=C2 MCULE-7529249489 [0,0,1,0,1,0|0,0,2]=4 1073 B13R2.15 N[C@@H]1CCC[C@H]1C2=CC=CC=C2 MCULE-1195711967 [0,0,1,0,1,0|0,0,2]=4 1074 B13R2.15 N[C@@H]1CCC[C@H]1C2=CC=CC=C2 MCULE-1361403557 [0,0,1,0,1,0|0,0,2]=4 1075 B13R2.15 N[C@@H]1CCC[C@H]1C2=CC=CC=C2 MCULE-2578322482 [0,0,1,0,1,0|0,0,2]=4 1076 B13R2.15 N[C@@H]1CCC[C@H]1C2=CC=CC=C2 MCULE-8394970332 [0,0,1,0,1,0|0,0,2]=4 1077 B13R2.15 N[C@H]1CCC[C@@H]1C2=CC=CC=C2 MCULE-1636875967 [0,0,1,0,1,0|0,0,2]=4 1078 B13R2.15 N[C@H]1CCC[C@H]1C2=CC=CC=C2 MCULE-5444210199 [0,0,1,0,1,0|0,0,2]=4 1079 B13R2.15 O=C1CCCC1C2=CC=CC=C2 MCULE-9921158660 [0,0,1,0,1,0|1,0,1]=4 1080 B13R2.15 O=C1CCCN1C2=CC=CC=C2 MCULE-8643707124 [0,0,1,0,1,0|2,0,0]=4 1081 B13R2.15 O=C1CCNC1C2=CC=CC=C2 MCULE-2849881178 [0,0,1,0,1,0|1,0,1]=4 1082 B13R2.15 O=C1CCNC1C2=CC=CC=C2 MCULE-4429660373 [0,0,1,0,1,0|1,0,1]=4 1083 B13R2.15 O=C1CCNN1C2=CC=CC=C2 MCULE-9196226367 [0,0,1,0,1,0|2,0,0]=4 1084 B13R2.15 S=C1CCCN1C2=CC=CC=C2 MCULE-6070450178 [0,0,1,0,1,0|2,0,0]=4 1085 B13R2.18 BrC1=CC=CC=C1C2CCNC2 MCULE-5829605595 [0,0,1,0,1,0|1,0,1]=4 1086 B13R2.18 BrC1=CC=CC=C1C2CCNC2 MCULE-8988675588 [0,0,1,0,1,0|1,0,1]=4 1087 B13R2.18 CC1=C(C=CC=C1)C2CCNC2 MCULE-8741341819 [0,0,1,0,1,0|1,0,1]=4 1088 B13R2.18 CC1=C(CNCC1)C2=CC=CO2 MCULE-1381993038 [0,0,1,0,1,0|2,0,0]=4 1089 B13R2.18 CC1=C(CNCC1)C2=CC=CO2 MCULE-5802536653 [0,0,1,0,1,0|2,0,0]=4 1090 B13R2.18 CC1=CC=CC=C1C2CCNC2 MCULE-2581297446 [0,0,1,0,1,0|1,0,1]=4 1091 B13R2.18 ClC1=CC=CC=C1C2=NCCC2 MCULE-3031729590 [0,0,1,0,1,0|2,0,0]=4 1092 B13R2.18 ClC1=CC=CC=C1C2=NCCN2 MCULE-2498957323 [0,0,1,0,1,0|2,0,0]=4 1093 B13R2.18 ClC1=CC=CC=C1C2CCNC2 MCULE-3853811417 [0,0,1,0,1,0|1,0,1]=4 1094 B13R2.18 ClC1=CC=CC=C1C2CCNC2 MCULE-7967998499 [0,0,1,0,1,0|1,0,1]=4 1095 B13R2.18 ClC1=CC=CC=C1C2CCNC2 MCULE-8724722102 [0,0,1,0,1,0|1,0,1]=4 1096 B13R2.18 FC1=C(C=CC=C1)C2=CCNC2 MCULE-1411221017 [0,0,1,0,1,0|1,0,0]=3 1097 B13R2.18 FC1=C(C=CC=C1)C2=CCNC2 MCULE-3037729467 [0,0,1,0,1,0|1,0,0]=3 1098 B13R2.18 FC1=C(C=CC=C1)C2CCNC2 MCULE-7707840949 [0,0,1,0,1,0|1,0,1]=4 1099 B13R2.18 FC1=C(C=CC=C1)C2CCNC2 MCULE-9822637807 [0,0,1,0,1,0|1,0,1]=4 1100 B13R2.18 NC1=C(C=CC=C1)C2=CC=NN2 MCULE-4414023862 [0,0,1,0,1,0|1,0,1]=4 1101 B13R2.18 NC1=C(C=CC=C1)C2=CNN=C2 MCULE-5007406681 [0,0,1,0,1,0|1,0,1]=4 1102 B13R2.18 NC1=C(C=CC=C1)C2=NCCO2 MCULE-9944374168 [0,0,1,0,1,0|1,0,1]=4 1103 B13R2.18 NC1=C(C=CC=C1)N2CCCC2 MCULE-6561961652 [0,0,1,0,1,0|1,0,1]=4 1104 B13R2.18 NC1=CC=CC=C1C2=NCCC2 MCULE-9506917466 [0,0,1,0,1,0|1,0,0]=3 1105 B13R2.18 NC1=CC=CC=C1C2=NCCN2 MCULE-6323057414 [0,0,1,0,1,0|1,0,0]=3 1106 B13R2.18 NC1=CC=CC=C1C2CCCC2 MCULE-4550550221 [0,0,1,0,1,0|0,0,2]=4 1107 B13R2.18 NC1=CC=CC=C1C2CCCN2 MCULE-9074089608 [0,0,1,0,1,0|0,0,2]=4 1108 B13R2.18 NC1=CC=CC=C1N2CCCC2 MCULE-2628155267 [0,0,1,0,1,0|1,0,1]=4 1109 B13R2.18 OC1=C(C=CC=C1)C2=NCCN2 MCULE-4287982613 [0,0,1,0,1,0|2,0,0]=4 1110 B13R2.18 SC1=CC=CC=C1C2=NCCN2 MCULE-3135658309 [0,0,1,0,1,0|2,0,0]=4 1111 B13R2.67 C1=CC2=C(C=C1)CCNCCC2 MCULE-7031061322 [0,0,1,0,1,0|0,0,2]=4 1112 B13R2.67 C1=CC2=C(C=C1)CNCCCC2 MCULE-2426890571 [0,0,1,0,1,0|1,0,1]=4 1113 B13R2.67 C1=CC2=C(C=C1)NCCCCC2 MCULE-2144530534 [0,0,1,0,1,0|0,0,2]=4 1114 B13R2.67 C1=CC2=C(C=C1)NCCCCC2 MCULE-2774855003 [0,0,1,0,1,0|0,0,2]=4 1115 B13R2.67 C1=CC=C2NCCCCNC2=C1 MCULE-5051837857 [0,0,1,0,1,0|1,0,1]=4 1116 B13R2.67 C1=CC=C2NCCCNCC2=C1 MCULE-3429050045 [0,0,1,0,1,0|0,0,1]=3 1117 B15R2.352 CCCCC1=CC=C2C=CC=CC2=C1 MCULE-5002783646 [0,0,1,0,0,1|2,0,0]=4 1118 B15R2.352 CCNCC1=CC2=C(C=CC=C2)C=C1 MCULE-3237873752 [0,0,1,0,0,1|1,0,0]=3 1119 B15R2.352 CCNCC1=NC2=C(C=CC=C2)C=C1 MCULE-7432320356 [0,0,1,0,0,1|1,0,0]=3 1120 B15R2.352 CCNCC1=NC2=C(C=CC=C2)C=C1 MCULE-7627189949 [0,0,1,0,0,1|1,0,0]=3 1121 B15R2.352 CCSCC1=CC=C2C=CC=CC2=C1 MCULE-5022913542 [0,0,1,0,0,1|2,0,0]=4 1122 B15R2.18471 CCCCC1=C2C=CC=CC2=CC=C1 MCULE-8903925113 [0,0,1,0,0,1|2,0,0]=4 1123 B15R2.18471 CCNCC1=C2C=CC=CC2=NC=C1 MCULE-7603868814 [0,0,1,0,0,1|0,0,1]=3 1124 B15R2.18471 CCNCC1=CC=CC2=CC=CC=C12 MCULE-5153411131 [0,0,1,0,0,1|1,0,0]=3 1125 B15R2.18471 CCNCC1=CC=CC2=CC=CC=C12 MCULE-8657771152 [0,0,1,0,0,1|1,0,0]=3 1126 B15R2.2167 C1=CC=C(C=C1)NC2=NCCCCC2 MCULE-2334956208 [0,0,1,0,0,1|1,0,1]=4 1127 B15R2.2167 C1=CC=C(C=C1)NC2=NCCCCC2 MCULE-5545053937 [0,0,1,0,0,1|1,0,1]=4 1128 B15R2.2167 C1=CC=C(C=C1)NC2CCCNCC2 MCULE-3774784413 [0,0,1,0,0,1|0,0,2]=4 1129 B15R2.2167 C1=CC=C(C=C1)NC2CCCNCC2 MCULE-9365384008 [0,0,1,0,0,1|0,0,2]=4 1130 B15R2.2195 C1=CC=C(C=C1)CNC2CCNCC2 MCULE-3523928625 [0,0,1,0,0,1|0,0,2]=4 1131 B15R2.2195 C1=CC=C(C=C1)CNC2CCNCC2 MCULE-4853963653 [0,0,1,0,0,1|0,0,2]=4 1132 B15R2.2195 C1=CC=C(C=C1)NCC2CCNCC2 MCULE-1321317058 [0,0,1,0,0,1|0,0,2]=4 1133 B15R2.2195 C1=CC=C(C=C1)NN=C2CCCCC2 MCULE-5488387949 [0,0,1,0,0,1|1,0,1]=4 1134 B15R2.886 CC1=C2C=CC=CC2=NC(=C1)CCN MCULE-4853906587 [0,0,1,0,0,1|0,0,1]=3 1135 B15R2.886 CC1=CC(=NC2=CC=CC=C12)CCN MCULE-2643542100 [0,0,1,0,0,1|0,0,1]=3 1136 B15R2.886 CCCC1=CC(=O)C2=C(N1)C=CC=C2 MCULE-9033111852 [0,0,1,0,0,1|2,0,0]=4 1137 B15R2.886 NCCC1=NC2=C(C=CC=C2)C(=O)N1 MCULE-8978649275 [0,0,1,0,0,1|1,0,1]=4 1138 B15R2.886 NCCC1=NC2=CC=CC=C2C(=O)N1 MCULE-5911802386 [0,0,1,0,0,1|1,0,1]=4 1139 B15R2.888 CCCC1=NC2=CC=CC=C2N=C1C MCULE-6691113515 [0,0,1,0,0,1|1,0,1]=4 1140 B15R2.888 NCCC1=CC2=CC=CC=C2NC1=O MCULE-3200195926 [0,0,1,0,0,1|2,0,0]=4 1141 B15R2.888 NCCC1=CC2=CC=CC=C2NC1=O MCULE-8556751423 [0,0,1,0,0,1|2,0,0]=4 1142 B15R2.4392 CC1=CC(=C2C=CC=CC2=N1)CNN MCULE-1483284212 [0,0,1,0,0,1|1,0,1]=4 1143 B15R2.4392 CC1=NC2=C(C=CC=C2)C(=C1)CNN MCULE-2651741411 [0,0,1,0,0,1|1,0,1]=4 1144 B15R2.4392 CNCC1=CC(=O)NC2=CC=CC=C12 MCULE-5443710055 [0,0,1,0,0,1|1,0,0]=3 1145 B15R2.117 CCC1=NC2=C(C=CC=C2)N=C1CC MCULE-4213280179 [0,0,1,0,0,1|1,0,1]=4 1146 B15R2.117 COC1=C(C=C2C=CC=CC2=C1)CN MCULE-2207336154 [0,0,1,0,0,1|2,0,0]=4 1147 B15R2.117 COC1=NC2=CC=CC=C2C=C1CN MCULE-3385983611 [0,0,1,0,0,1|1,0,1]=4 1148 B15R2.117 COC1=NC2=CC=CC=C2C=C1CN MCULE-4514249093 [0,0,1,0,0,1|1,0,1]=4 1149 B15R2.1851 COC1=NC2=C(C=CC=C2)C(=C1)CN MCULE-2562471678 [0,0,1,0,0,1|1,0,1]=4 1150 B15R2.2115 CCC1=C(C2=C(C=CC=C2)C=C1)CCl MCULE-1988043778 [0,0,1,0,0,1|2,0,0]=4 1151 B15R2.2115 CCC1=C(C2=C(C=CC=C2)C=C1)CN MCULE-2287473338 [0,0,1,0,0,1|1,0,0]=3 1152 B15R2.2115 CCC1=C(C2=C(C=CC=C2)C=C1)CN MCULE-7985869383 [0,0,1,0,0,1|1,0,0]=3 1153 B15R2.2115 CCC1=C(C2=C(C=CC=C2)C=N1)CC MCULE-1689614010 [0,0,1,0,0,1|1,0,1]=4 1154 B15R2.2115 COC1=C(C2=CC=CC=C2C=C1)CN MCULE-4169824117 [0,0,1,0,0,1|2,0,0]=4 1155 B15R2.2115 COC1=C(C2=CC=CC=C2C=C1)CN MCULE-7242718916 [0,0,1,0,0,1|2,0,0]=4 1156 B17R3.1829 C1=CC2=CC3=C(CCCCC3)N=C2C=C1 MCULE-8486569540 [0,0,0,0,0,2|1,0,1]=4 1157 B17R3.9117 C1=CC2=C(C=C1)C3=C(N2)CCCCCC3 MCULE-7485034523 [0,0,0,0,0,2|1,0,0]=3 1158 B17R3.9117 C1=CC=C2C(=C1)N=C3N2CCNCCO3 MCULE-4504867087 [0,0,0,0,0,2|1,0,1]=4