0 B13R1.643 C=C(C)CCC1=CC=CC(=C1)C#N MCULE-8966223638 [0,0,0,0,0,0|2,0,2]=4 1 B13R1.643 C=C(C)CCC1=CC=CC(=C1)OC MCULE-7183131245 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.643 C=C(C)COC1=CC(=CC=C1)CO MCULE-4343139473 [0,0,0,0,0,0|4,0,0]=4 3 B13R1.643 CC(=N)NCC1=CC=CC(=C1)CN MCULE-5423476220 [0,0,0,0,0,0|0,0,0]=0 4 B13R1.643 CC(=N)NCC1=CC=CC(=C1)CN MCULE-8301654792 [0,0,0,0,0,0|0,0,0]=0 5 B13R1.643 CC(=O)NCC1=CC(=CC=C1)CN MCULE-3057798950 [0,0,0,0,0,0|1,0,0]=1 6 B13R1.643 CC(=O)NCC1=CC(=CC=C1)CN MCULE-7923538512 [0,0,0,0,0,0|1,0,0]=1 7 B13R1.643 CC(=O)NCC1=CC=CC(=C1)CO MCULE-8970553252 [0,0,0,0,0,0|2,0,0]=2 8 B13R1.643 CC(=O)OCC1=CC(=CC=C1)C#N MCULE-8035369869 [0,0,0,0,0,0|2,0,2]=4 9 B13R1.643 CC(C)CCC1=CC(=CC=C1)CO MCULE-2282302809 [0,0,0,0,0,0|3,0,1]=4 10 B13R1.643 CC(C)COC1=CC(=CC=C1)CN MCULE-1352519729 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.643 CC(C)COC1=CC(=CC=C1)CN MCULE-5012198283 [0,0,0,0,0,0|3,0,1]=4 12 B13R1.643 CC(C)NCC1=CC(=CC=C1)C#N MCULE-5742634583 [0,0,0,0,0,0|1,0,3]=4 13 B13R1.643 CCC1=CC(=CC=C1)CCC(=O)O MCULE-6324109477 [0,0,0,0,0,0|4,0,0]=4 14 B13R1.643 COC1=CC(=CC=C1)CNC(=O)N MCULE-7818870187 [0,0,0,0,0,0|3,0,1]=4 15 B13R1.643 COC1=CC(=CC=C1)CNC(=S)N MCULE-5488826174 [0,0,0,0,0,0|3,0,1]=4 16 B13R1.643 COC1=CC(=CC=C1)CSC(=N)N MCULE-3718688774 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.643 COC1=CC(=CC=C1)CSC(=N)N MCULE-6228716189 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.643 COC1=CC=CC(=C1)CCC(=O)C MCULE-7078246852 [0,0,0,0,0,0|4,0,0]=4 19 B13R1.643 COC1=CC=CC(=C1)CNC(C)C MCULE-3897035939 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.643 COC1=CC=CC(=C1)CNC(C)C MCULE-4558247966 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.643 CSC1=CC=CC(=C1)CNC(C)C MCULE-4408439308 [0,0,0,0,0,0|3,0,1]=4 22 B13R1.643 N#CC1=CC(=CC=C1)CSC(=N)N MCULE-3121275441 [0,0,0,0,0,0|2,0,2]=4 23 B13R1.643 N#CC1=CC(=CC=C1)CSC(=N)N MCULE-4935001501 [0,0,0,0,0,0|2,0,2]=4 24 B13R1.643 NCC1=CC(=CC=C1)CCC(=O)O MCULE-5955967575 [0,0,0,0,0,0|3,0,0]=3 25 B13R1.643 NCC1=CC(=CC=C1)CCC(=O)O MCULE-7118837178 [0,0,0,0,0,0|3,0,0]=3 26 B13R1.643 NCC1=CC(=CC=C1)OCC(=O)O MCULE-3155213807 [0,0,0,0,0,0|4,0,0]=4 27 B13R1.643 NCC1=CC(=CC=C1)OCC(=O)O MCULE-8291236293 [0,0,0,0,0,0|4,0,0]=4 28 B12R1.226 C=C(Br)CCC1=CC=CC(=C1)C MCULE-9352855416 [1,0,0,0,0,0|2,0,1]=4 29 B12R1.226 C=C(C)CCC1=CC=CC(=C1)Br MCULE-8291028195 [1,0,0,0,0,0|3,0,0]=4 30 B12R1.226 C=C(C)CCC1=CC=CC(=C1)C MCULE-8368790541 [1,0,0,0,0,0|2,0,0]=3 31 B12R1.226 C=C(C)CCC1=CC=CC(=C1)Cl MCULE-4308144438 [1,0,0,0,0,0|3,0,0]=4 32 B12R1.226 C=C(C)CCC1=CC=CC(=C1)F MCULE-6908507987 [1,0,0,0,0,0|3,0,0]=4 33 B12R1.226 C=C(C)COC1=CC(=CC=C1)N MCULE-3041221264 [1,0,0,0,0,0|3,0,0]=4 34 B12R1.226 C=C(C)COC1=CC=CC(=C1)N MCULE-7218831611 [1,0,0,0,0,0|3,0,0]=4 35 B12R1.226 C=C(Cl)CCC1=CC=CC(=C1)C MCULE-5044258761 [1,0,0,0,0,0|2,0,1]=4 36 B12R1.226 CC(=O)CCC1=CC(=CC=C1)Br MCULE-6542929800 [1,0,0,0,0,0|3,0,0]=4 37 B12R1.226 CC(=O)CCC1=CC(=CC=C1)C MCULE-3521864248 [1,0,0,0,0,0|2,0,0]=3 38 B12R1.226 CC(=O)CCC1=CC(=CC=C1)Cl MCULE-2707623461 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.226 CC(=O)CCC1=CC(=CC=C1)F MCULE-5772196572 [1,0,0,0,0,0|3,0,0]=4 40 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Br MCULE-1264689257 [1,0,0,0,0,0|2,0,0]=3 41 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Cl MCULE-7152116575 [1,0,0,0,0,0|2,0,0]=3 42 B12R1.226 CC(=O)NCC1=CC(=CC=C1)N MCULE-6571557011 [1,0,0,0,0,0|1,0,0]=2 43 B12R1.226 CC(=O)NCC1=NC(=CC=C1)N MCULE-9117403159 [1,0,0,0,0,0|2,0,0]=3 44 B12R1.226 CC(=O)NCC1=NC=CC(=C1)Br MCULE-1734458635 [1,0,0,0,0,0|3,0,0]=4 45 B12R1.226 CC(=O)OCC1=CC(=CC=C1)Br MCULE-4822291356 [1,0,0,0,0,0|3,0,0]=4 46 B12R1.226 CC(=O)OCC1=CC(=CC=C1)F MCULE-7638715445 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.226 CC(=O)SCC1=CC=CC(=C1)I MCULE-7492884889 [1,0,0,0,0,0|3,0,0]=4 48 B12R1.226 CC(C)CCC1=CC(=CC=C1)N MCULE-8693406640 [1,0,0,0,0,0|2,0,1]=4 49 B12R1.226 CC(C)NCC1=CC(=CC=C1)Br MCULE-6876419451 [1,0,0,0,0,0|2,0,1]=4 50 B12R1.226 CC(C)NCC1=CC(=CC=C1)Cl MCULE-5524232417 [1,0,0,0,0,0|2,0,1]=4 51 B12R1.226 CC(C)NCC1=CC(=CC=C1)F MCULE-6140975776 [1,0,0,0,0,0|2,0,1]=4 52 B12R1.226 CC(C)NCC1=CC(=CC=C1)F MCULE-7325443144 [1,0,0,0,0,0|2,0,1]=4 53 B12R1.226 CC(C)NCC1=CC(=CC=C1)O MCULE-3763350606 [1,0,0,0,0,0|2,0,1]=4 54 B12R1.226 CC(C)NCC1=CC(=CC=C1)O MCULE-9243955667 [1,0,0,0,0,0|2,0,1]=4 55 B12R1.226 CC(C)NCC1=CC=CC(=C1)Br MCULE-8766997229 [1,0,0,0,0,0|2,0,1]=4 56 B12R1.226 CC(C)NCC1=CC=CC(=C1)Cl MCULE-4754736207 [1,0,0,0,0,0|2,0,1]=4 57 B12R1.226 CC(C)NCC1=CC=CC(=C1)I MCULE-6282760068 [1,0,0,0,0,0|2,0,1]=4 58 B12R1.226 CC(C)OCC1=CC(=CC=C1)N MCULE-7677950932 [1,0,0,0,0,0|2,0,1]=4 59 B12R1.226 CC(C)SCC1=CC(=CC=C1)N MCULE-8949290010 [1,0,0,0,0,0|2,0,1]=4 60 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O MCULE-1135918013 [1,0,0,0,0,0|3,0,0]=4 61 B12R1.226 CC1=CC(=CC=C1)CCC(C)N MCULE-3060384855 [1,0,0,0,0,0|1,0,2]=4 62 B12R1.226 CC1=CC(=CC=C1)CSC(=N)N MCULE-9109950641 [1,0,0,0,0,0|2,0,0]=3 63 B12R1.226 CC1=CC(=CC=C1)NN=C(C)C MCULE-4702312964 [1,0,0,0,0,0|2,0,1]=4 64 B12R1.226 CC1=CC(=CC=C1)OCC(=N)N MCULE-9587229759 [1,0,0,0,0,0|3,0,0]=4 65 B12R1.226 CC1=CC=CC(=C1)CNC(=N)N MCULE-4884472042 [1,0,0,0,0,0|1,0,0]=2 66 B12R1.226 CC1=CC=CC(=C1)CNC(C)C MCULE-7661493081 [1,0,0,0,0,0|1,0,1]=3 67 B12R1.226 CC1=CC=CC(=C1)CNC(C)C MCULE-7700392957 [1,0,0,0,0,0|1,0,1]=3 68 B12R1.226 CC1=CC=CC(=C1)CSC(=N)N MCULE-4629257197 [1,0,0,0,0,0|2,0,0]=3 69 B12R1.226 CC1=CC=CC(=C1)NNC(=S)N MCULE-5147785379 [1,0,0,0,0,0|2,0,1]=4 70 B12R1.226 CC1=CC=CC(=C1)OCC(=N)N MCULE-7408542799 [1,0,0,0,0,0|3,0,0]=4 71 B12R1.226 N=C(N)NCC1=CC(=CC=C1)F MCULE-9527255219 [1,0,0,0,0,0|2,0,0]=3 72 B12R1.226 N=C(N)NCC1=CC(=CC=C1)I MCULE-2764127049 [1,0,0,0,0,0|2,0,0]=3 73 B12R1.226 N=C(N)NCC1=CC=CC(=C1)Br MCULE-1738489546 [1,0,0,0,0,0|2,0,0]=3 74 B12R1.226 N=C(N)NCC1=CC=CC(=C1)Br MCULE-2881494925 [1,0,0,0,0,0|2,0,0]=3 75 B12R1.226 N=C(N)NCC1=CC=CC(=C1)I MCULE-8285531114 [1,0,0,0,0,0|2,0,0]=3 76 B12R1.226 N=C(N)NCC1=CC=CC(=C1)I MCULE-8345247175 [1,0,0,0,0,0|2,0,0]=3 77 B12R1.226 N=C(N)SCC1=CC(=CC=C1)Cl MCULE-9529929643 [1,0,0,0,0,0|3,0,0]=4 78 B12R1.226 N=C(N)SCC1=CC(=CC=C1)F MCULE-4384572264 [1,0,0,0,0,0|3,0,0]=4 79 B12R1.226 N=C(N)SCC1=CC=CC(=C1)Br MCULE-2758351641 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.226 N=C(N)SCC1=CC=CC(=C1)Br MCULE-7905235745 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.226 N=C(N)SCC1=CC=CC(=C1)Cl MCULE-3174856313 [1,0,0,0,0,0|3,0,0]=4 82 B12R1.226 N=C(N)SCC1=CC=CC(=C1)F MCULE-6305355709 [1,0,0,0,0,0|3,0,0]=4 83 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F MCULE-1971307249 [1,0,0,0,0,0|2,0,1]=4 84 B12R1.226 NC(=O)NCC1=CC=CC(=C1)Br MCULE-1774177997 [1,0,0,0,0,0|2,0,1]=4 85 B12R1.226 NC(=O)NCC1=CC=CC(=C1)Cl MCULE-6966740480 [1,0,0,0,0,0|2,0,1]=4 86 B12R1.226 NC(=O)NCC1=CC=CC(=C1)I MCULE-7873410427 [1,0,0,0,0,0|2,0,1]=4 87 B12R1.226 NC1=CC(=CC=C1)CCC(=O)O MCULE-7356050025 [1,0,0,0,0,0|3,0,0]=4 88 B12R1.226 NC1=CC=CC(=C1)CCC(=O)O MCULE-4812854870 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.226 NC1=CC=CC(=C1)CCC(=O)[O-] MCULE-7775985988 [1,0,0,0,0,0|3,0,0]=4 90 B12R1.382 CCCOC1=CC(=CC=C1)CN MCULE-3860265109 [1,0,0,0,0,0|2,0,1]=4 91 B12R1.382 CCCOC1=CC(=CC=C1)CN MCULE-3934610973 [1,0,0,0,0,0|2,0,1]=4 92 B12R1.382 CCNCC1=CC(=CC=C1)C#N MCULE-7166083323 [1,0,0,0,0,0|0,0,3]=4 93 B12R1.382 CCNCC1=CC(=CC=C1)OC MCULE-2616901963 [1,0,0,0,0,0|2,0,1]=4 94 B12R1.382 CCNCC1=CC=CC(=C1)OC MCULE-2802262221 [1,0,0,0,0,0|2,0,1]=4 95 B12R1.382 CCOCC1=CC(=CC=C1)CN MCULE-2703004289 [1,0,0,0,0,0|1,0,1]=3 96 B12R1.382 CCOCC1=CC(=CC=C1)CN MCULE-6474457953 [1,0,0,0,0,0|1,0,1]=3 97 B12R1.382 COCCC1=CC(=CC=C1)CN MCULE-8209666714 [1,0,0,0,0,0|2,0,0]=3 98 B14R1.74 CC(C)NC(=O)C1=CC(=CC=C1)CN MCULE-5563751855 [0,1,0,0,0,0|1,0,2]=4 99 B14R1.75 CC(C)N(C)CC1=CC(=CC=C1)CN MCULE-2634192601 [0,1,0,0,0,0|1,0,1]=3 100 B14R1.75 CC(C)N(C)CC1=CC(=CC=C1)CN MCULE-8793196454 [0,1,0,0,0,0|1,0,1]=3 101 B14R1.75 COC1=CC=CC(=C1)CN(C)C(=N)N MCULE-2733827220 [0,1,0,0,0,0|3,0,0]=4 102 B14R1.75 COC1=CC=CC(=C1)CN(C)C(=N)N MCULE-7403278699 [0,1,0,0,0,0|3,0,0]=4 103 B14R1.75 NCC1=CC(=CC=C1)CC(N)C(=O)O MCULE-7324682378 [0,1,0,0,0,0|3,0,0]=4 104 B14R1.75 NCC1=CC(=CC=C1)C[C@@H](N)C(=O)O MCULE-7251583706 [0,1,0,0,0,0|3,0,0]=4 105 B14R1.75 NCC1=CC(=CC=C1)C[C@@H](N)C(=O)O MCULE-9051060471 [0,1,0,0,0,0|3,0,0]=4 106 B14R1.75 NCC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-2600156569 [0,1,0,0,0,0|3,0,0]=4 107 B14R1.75 NCC1=CC(=CC=C1)C[C@H](N)C(=O)O MCULE-6774442569 [0,1,0,0,0,0|3,0,0]=4 108 B14R1.77 CCC1=CC(=CC=C1)CNC(=O)CCl MCULE-1253650451 [0,1,0,0,0,0|2,0,0]=3 109 B14R1.77 CNC(=O)COC1=CC(=CC=C1)CN MCULE-3463570509 [0,1,0,0,0,0|3,0,0]=4 110 B14R1.77 CNC(=O)COC1=CC(=CC=C1)CN MCULE-9819289360 [0,1,0,0,0,0|3,0,0]=4 111 B14R1.77 CNC(=O)NCC1=CC=CC(=C1)OC MCULE-5169851267 [0,1,0,0,0,0|3,0,0]=4 112 B14R1.77 COC(=O)CCC1=CC(=CC=C1)CN MCULE-7711657694 [0,1,0,0,0,0|2,0,0]=3 113 B14R1.77 COC(=O)CCC1=CC=CC(=C1)CN MCULE-9033804343 [0,1,0,0,0,0|2,0,0]=3 114 B14R1.77 COC(=O)COC1=CC(=CC=C1)CN MCULE-2548767539 [0,1,0,0,0,0|3,0,0]=4 115 B14R1.77 COC(=O)COC1=CC(=CC=C1)CN MCULE-7885068602 [0,1,0,0,0,0|3,0,0]=4 116 B14R1.77 COC1=CC(=CC=C1)CNC(=O)CCl MCULE-5918322648 [0,1,0,0,0,0|3,0,0]=4 117 B14R1.77 COC1=CC(=CC=C1)CNC(=O)CN MCULE-8109759695 [0,1,0,0,0,0|3,0,0]=4 118 B14R1.77 COC1=CC=CC(=C1)CNC(=O)CBr MCULE-7882574362 [0,1,0,0,0,0|3,0,0]=4 119 B14R1.77 N#CC1=CC(=CC=C1)CNC(=O)CN MCULE-7750723328 [0,1,0,0,0,0|1,0,2]=4 120 B14R1.77 N#CC1=CC=CC(=C1)CNC(=O)CCl MCULE-2816649147 [0,1,0,0,0,0|1,0,2]=4 121 B14R1.468 CCOC1=CC=CC(=C1)CNC(=O)C MCULE-9122465586 [0,1,0,0,0,0|2,0,0]=3 122 B14R1.468 NCCC1=CC(=CC=C1)CCC(=O)O MCULE-5807019191 [0,1,0,0,0,0|3,0,0]=4 123 B14R1.468 NCCC1=CC(=CC=C1)CCC(=O)O MCULE-7446389654 [0,1,0,0,0,0|3,0,0]=4 124 B14R1.2162 CC(C)(C)OCC1=CC(=CC=C1)CN MCULE-1372433532 [0,1,0,0,0,0|2,0,1]=4 125 B14R1.6355 C=C(C)CCC1=CC(=CC=C1)C(C)C MCULE-8225948059 [0,1,0,0,0,0|3,0,0]=4 126 B14R1.6355 CC(=O)NCC1=CC(=CC=C1)C(=O)O MCULE-5493978766 [0,1,0,0,0,0|2,0,1]=4 127 B14R1.6355 CC(=O)NCC1=CC=CC(=C1)B(O)O MCULE-4579200139 [0,1,0,0,0,0|3,0,0]=4 128 B14R1.6355 CC(=O)OCC1=CC(=CC=C1)C(=S)N MCULE-3282892034 [0,1,0,0,0,0|2,0,1]=4 129 B14R2.130 COC1=CC=CC(=C1)C2CC(=O)N2 MCULE-1470754833 [0,0,0,1,0,0|3,0,0]=4 130 B14R2.2332 CC1=CC2=C(C=N1)C=C(C=C2)CN MCULE-5520315817 [0,0,0,1,0,0|1,0,2]=4 131 B14R2.2332 CC1=CC=C2C=C(C=CC2=N1)CO MCULE-8801085064 [0,0,0,1,0,0|2,0,1]=4 132 B14R2.2332 CC1=NC2=CC=C(C=C2C=C1)CBr MCULE-4268117307 [0,0,0,1,0,0|2,0,1]=4 133 B14R2.2332 NCC1=CC2=C(C=C1)NC(=O)CC2 MCULE-4247655650 [0,0,0,1,0,0|2,0,1]=4 134 B14R2.2332 NCC1=CC2=C(C=C1)NC(=O)CC2 MCULE-7980899518 [0,0,0,1,0,0|2,0,1]=4 135 B14R2.11684 CC1=CC2=C(C=CC=C2CN)C=N1 MCULE-9117354232 [0,0,0,1,0,0|1,0,2]=4 136 B12R1.59 CC(=O)NCC1=NC(=CS1)CN MCULE-2107430387 [0,0,0,0,1,0|3,0,0]=4 137 B12R1.59 CC(=O)NCC1=NC(=CS1)CN MCULE-9161761853 [0,0,0,0,1,0|3,0,0]=4 138 B12R1.438 C#CC1=CC=CC(=C1)NC(=O)C MCULE-8588871021 [0,0,0,0,1,0|2,0,1]=4 139 B12R1.438 C=C(Br)CC1=CC(=CC=C1)CC MCULE-8520402197 [0,0,0,0,1,0|2,0,1]=4 140 B12R1.438 C=C(C)CC1=CC(=CC=C1)C#N MCULE-5980114545 [0,0,0,0,1,0|1,0,2]=4 141 B12R1.438 C=C(C)CC1=CC(=CC=C1)CC MCULE-4595941488 [0,0,0,0,1,0|2,0,0]=3 142 B12R1.438 C=C(C)CC1=CC(=CC=C1)OC MCULE-2249754688 [0,0,0,0,1,0|3,0,0]=4 143 B12R1.438 C=C(C)CC1=CC(=CC=C1)SC MCULE-4535558417 [0,0,0,0,1,0|3,0,0]=4 144 B12R1.438 C=C(Cl)CC1=CC(=CC=C1)CC MCULE-1547514247 [0,0,0,0,1,0|2,0,1]=4 145 B12R1.438 C=CC1=CC=CC(=C1)CC(=C)C MCULE-7506115233 [0,0,0,0,1,0|2,0,1]=4 146 B12R1.438 CC(=O)CC1=CC(=CC=C1)C#N MCULE-4974644822 [0,0,0,0,1,0|1,0,2]=4 147 B12R1.438 CC(=O)NC1=CC(=CC=C1)C#N MCULE-4479364334 [0,0,0,0,1,0|1,0,2]=4 148 B12R1.438 CC(=O)NC1=CC(=CC=C1)C=O MCULE-5838466127 [0,0,0,0,1,0|2,0,1]=4 149 B12R1.438 CC(=O)NC1=CC(=CC=C1)CCl MCULE-1283547575 [0,0,0,0,1,0|2,0,0]=3 150 B12R1.438 CC(=O)NC1=CC(=CC=C1)CN MCULE-5796312335 [0,0,0,0,1,0|1,0,0]=2 151 B12R1.438 CC(=O)NC1=CC(=CC=C1)CN MCULE-7139736297 [0,0,0,0,1,0|1,0,0]=2 152 B12R1.438 CC(=O)NC1=CC(=CC=C1)CO MCULE-7756321779 [0,0,0,0,1,0|2,0,0]=3 153 B12R1.438 CC(=O)NC1=CC(=CC=C1)NN MCULE-2871336794 [0,0,0,0,1,0|2,0,0]=3 154 B12R1.438 CC(=O)NC1=CC(=NC=C1)CN MCULE-4961579107 [0,0,0,0,1,0|2,0,0]=3 155 B12R1.438 CC(=O)NC1=CC(=NC=C1)CN MCULE-5518290564 [0,0,0,0,1,0|2,0,0]=3 156 B12R1.438 CC(=O)NC1=CC(=NC=C1)CO MCULE-4625047614 [0,0,0,0,1,0|3,0,0]=4 157 B12R1.438 CC(=O)NC1=CC=CC(=C1)CBr MCULE-7715535055 [0,0,0,0,1,0|2,0,0]=3 158 B12R1.438 CC(=O)OC1=CC=CC(=C1)CBr MCULE-7328864207 [0,0,0,0,1,0|3,0,0]=4 159 B12R1.438 CC(=O)OC1=CC=CC(=C1)CO MCULE-3615755460 [0,0,0,0,1,0|3,0,0]=4 160 B12R1.438 CC(C)NC1=CC(=CC=C1)CN MCULE-8455485346 [0,0,0,0,1,0|1,0,1]=3 161 B12R1.438 CC(C)OC1=CC(=CC=C1)CN MCULE-7191188053 [0,0,0,0,1,0|2,0,1]=4 162 B12R1.438 CC(C)OC1=CC(=CC=C1)CN MCULE-8688216147 [0,0,0,0,1,0|2,0,1]=4 163 B12R1.438 CCC1=CC(=CC=C1)CC(=O)O MCULE-6076835455 [0,0,0,0,1,0|3,0,0]=4 164 B12R1.438 CCC1=CC(=CC=C1)CC(C)O MCULE-2429623104 [0,0,0,0,1,0|2,0,1]=4 165 B12R1.438 CCC1=CC(=CC=C1)NC(=O)N MCULE-2919771053 [0,0,0,0,1,0|2,0,1]=4 166 B12R1.438 CCC1=CC(=CC=C1)NC(=S)N MCULE-4459957711 [0,0,0,0,1,0|2,0,1]=4 167 B12R1.438 CCC1=CC=CC(=C1)OC(=O)C MCULE-8951467214 [0,0,0,0,1,0|3,0,0]=4 168 B12R1.438 CN(C)CC1=CC(=CC=C1)CN MCULE-4405934095 [0,0,0,0,1,0|2,0,0]=3 169 B12R1.438 CN(C)CC1=CC(=CC=C1)CN MCULE-9907166705 [0,0,0,0,1,0|2,0,0]=3 170 B12R1.438 CN(C)CC1=CC(=CC=C1)CO MCULE-9617749110 [0,0,0,0,1,0|3,0,0]=4 171 B12R1.438 CNC1=CC(=CC=C1)NC(=O)C MCULE-7478816791 [0,0,0,0,1,0|3,0,0]=4 172 B12R1.438 COC1=CC(=CC=C1)CC(=N)N MCULE-6797013534 [0,0,0,0,1,0|3,0,0]=4 173 B12R1.438 COC1=CC(=CC=C1)CC(=N)N MCULE-7896944498 [0,0,0,0,1,0|3,0,0]=4 174 B12R1.438 COC1=CC(=CC=C1)CC(=O)C MCULE-7274935203 [0,0,0,0,1,0|3,0,0]=4 175 B12R1.438 COC1=CC(=CC=C1)NC(=N)N MCULE-9853033607 [0,0,0,0,1,0|3,0,0]=4 176 B12R1.438 COC1=CC=CC(=C1)NC(=N)N MCULE-6122343122 [0,0,0,0,1,0|3,0,0]=4 177 B12R1.438 COC1=CC=CC(=C1)NC(=O)C MCULE-5524716683 [0,0,0,0,1,0|3,0,0]=4 178 B12R1.438 CSC1=CC(=CC=C1)NC(=O)C MCULE-6542128302 [0,0,0,0,1,0|3,0,0]=4 179 B12R1.438 CSC1=CC=CC(=C1)NC(=N)N MCULE-3972018602 [0,0,0,0,1,0|3,0,0]=4 180 B12R1.438 NCC1=CC(=CC=C1)CC(=O)O MCULE-8193798874 [0,0,0,0,1,0|2,0,0]=3 181 B12R1.438 NCC1=CC(=CC=C1)NC(=O)N MCULE-4651018823 [0,0,0,0,1,0|1,0,1]=3 182 B12R1.438 NCC1=CC=CC(=C1)CC(=O)O MCULE-2513434329 [0,0,0,0,1,0|2,0,0]=3 183 B12R1.438 O=C(O)CC1=CC(=CC=C1)CBr MCULE-9868120323 [0,0,0,0,1,0|3,0,0]=4 184 B12R1.438 O=C(O)CC1=CC(=CC=C1)CCl MCULE-9774444761 [0,0,0,0,1,0|3,0,0]=4 185 B14R1.76 CN(C)CCOC1=CC(=CC=C1)CN MCULE-1849974835 [0,0,0,0,0,1|3,0,0]=4 186 B14R1.76 COC1=CC(=CC=C1)CCNC(=O)C MCULE-5044102726 [0,0,0,0,0,1|3,0,0]=4 187 B11R1.24 C=CCCC1=CC=CC(=C1)C MCULE-5479621493 [2,0,0,0,0,0|1,0,1]=4 188 B11R1.24 CC1=CC=CC(=C1)CCC=O MCULE-8922394552 [2,0,0,0,0,0|2,0,0]=4 189 B11R1.24 CCCCC1=CC=CC(=C1)N MCULE-2806575789 [2,0,0,0,0,0|1,0,1]=4 190 B11R1.24 CCNCC1=CC(=CC=C1)C MCULE-2389664437 [2,0,0,0,0,0|0,0,1]=3 191 B11R1.24 CCNCC1=CC(=CC=C1)Cl MCULE-1532638455 [2,0,0,0,0,0|1,0,1]=4 192 B11R1.24 CCNCC1=CC=CC(=C1)Br MCULE-4664241869 [2,0,0,0,0,0|1,0,1]=4 193 B11R1.24 CCNCC1=CC=CC(=C1)Br MCULE-6286118772 [2,0,0,0,0,0|1,0,1]=4 194 B11R1.24 CCNCC1=CC=CC(=C1)Cl MCULE-1252806540 [2,0,0,0,0,0|1,0,1]=4 195 B11R1.24 CCNCC1=CC=CC(=C1)F MCULE-7196118434 [2,0,0,0,0,0|1,0,1]=4 196 B11R1.24 CCNCC1=CC=CC(=C1)I MCULE-6592755559 [2,0,0,0,0,0|1,0,1]=4 197 B11R1.24 CCNCC1=CC=CC(=C1)O MCULE-3020598815 [2,0,0,0,0,0|1,0,1]=4 198 B11R1.24 CCOCC1=CC(=CC=C1)N MCULE-1929471930 [2,0,0,0,0,0|1,0,1]=4 199 B11R1.24 CCSCC1=CC(=CC=C1)N MCULE-9195132216 [2,0,0,0,0,0|1,0,1]=4 200 B11R1.24 CNCCC1=CC(=CC=C1)C MCULE-7781855969 [2,0,0,0,0,0|2,0,0]=4 201 B11R1.24 CONCC1=CC=CC(=C1)F MCULE-8521419054 [2,0,0,0,0,0|2,0,0]=4 202 B11R1.24 O=CNCC1=CC=CC(=C1)Cl MCULE-1813958022 [2,0,0,0,0,0|2,0,0]=4 203 B11R1.24 O=CNCC1=CC=CC(=C1)F MCULE-3090239638 [2,0,0,0,0,0|2,0,0]=4 204 B11R1.91 C=C(C)CCC1=CC=CC=C1 MCULE-2990252396 [2,0,0,0,0,0|2,0,0]=4 205 B11R1.91 C=C(C)OCC1=CC=CC=C1 MCULE-9253229966 [2,0,0,0,0,0|2,0,0]=4 206 B11R1.91 CC(=CCC1=CC=CC=C1)C MCULE-6894689571 [2,0,0,0,0,0|2,0,0]=4 207 B11R1.91 CC(=N)NCC1=CC=CC=C1 MCULE-1620218963 [2,0,0,0,0,0|0,0,0]=2 208 B11R1.91 CC(=N)NCC1=CC=CC=C1 MCULE-8833975625 [2,0,0,0,0,0|0,0,0]=2 209 B11R1.91 CC(=N)SCC1=CC=CC=C1 MCULE-2830681415 [2,0,0,0,0,0|1,0,0]=3 210 B11R1.91 CC(=N)SCC1=CC=CC=C1 MCULE-3429191250 [2,0,0,0,0,0|1,0,0]=3 211 B11R1.91 CC(=O)CCC1=CC=CC=C1 MCULE-1136231603 [2,0,0,0,0,0|2,0,0]=4 212 B11R1.91 CC(=O)NCC1=CC=CC=C1 MCULE-2051924381 [2,0,0,0,0,0|1,0,0]=3 213 B11R1.91 CC(=O)NCC1=CC=NC=C1 MCULE-8645049472 [2,0,0,0,0,0|2,0,0]=4 214 B11R1.91 CC(=O)NCC1=CN=CC=C1 MCULE-8882042703 [2,0,0,0,0,0|2,0,0]=4 215 B11R1.91 CC(=O)NCC1=NC=CC=C1 MCULE-3133975600 [2,0,0,0,0,0|2,0,0]=4 216 B11R1.91 CC(=O)NCC1=NC=CC=C1 MCULE-5622133685 [2,0,0,0,0,0|2,0,0]=4 217 B11R1.91 CC(=O)NNC1=CC=CC=C1 MCULE-5989143063 [2,0,0,0,0,0|2,0,0]=4 218 B11R1.91 CC(=O)OCC1=CC=CC=C1 MCULE-7952998506 [2,0,0,0,0,0|2,0,0]=4 219 B11R1.91 CC(=S)NCC1=CC=CC=C1 MCULE-3109655156 [2,0,0,0,0,0|1,0,0]=3 220 B11R1.91 CC(C)NCC1=CC=CC=C1 MCULE-3535531096 [2,0,0,0,0,0|1,0,1]=4 221 B11R1.91 CC(C)NCC1=CC=CC=C1 MCULE-4035303181 [2,0,0,0,0,0|1,0,1]=4 222 B11R1.91 CN(C)NCC1=CC=CC=C1 MCULE-3955095931 [2,0,0,0,0,0|2,0,0]=4 223 B11R1.91 CN(C)NCC1=CC=CC=C1 MCULE-6031251263 [2,0,0,0,0,0|2,0,0]=4 224 B11R1.91 N=C(N)CCC1=CC=CC=C1 MCULE-3670139370 [2,0,0,0,0,0|2,0,0]=4 225 B11R1.91 N=C(N)CCC1=CC=CC=C1 MCULE-9569405514 [2,0,0,0,0,0|2,0,0]=4 226 B11R1.91 N=C(N)NCC1=CC=CC=C1 MCULE-1999057378 [2,0,0,0,0,0|1,0,0]=3 227 B11R1.91 N=C(N)NCC1=CC=CC=C1 MCULE-7043542693 [2,0,0,0,0,0|1,0,0]=3 228 B11R1.91 N=C(N)NCC1=CC=CC=C1 MCULE-8415890377 [2,0,0,0,0,0|1,0,0]=3 229 B11R1.91 N=C(N)NCC1=CC=CN=C1 MCULE-3177900373 [2,0,0,0,0,0|2,0,0]=4 230 B11R1.91 N=C(N)NCC1=CC=CN=C1 MCULE-7145756176 [2,0,0,0,0,0|2,0,0]=4 231 B11R1.91 N=C(N)NCC1=CC=NC=C1 MCULE-2808988134 [2,0,0,0,0,0|2,0,0]=4 232 B11R1.91 N=C(N)NCC1=CC=NC=C1 MCULE-6303598609 [2,0,0,0,0,0|2,0,0]=4 233 B11R1.91 N=C(N)NCC1=CC=NC=C1 MCULE-7298802406 [2,0,0,0,0,0|2,0,0]=4 234 B11R1.91 N=C(N)NCC1=CN=CC=C1 MCULE-3308204444 [2,0,0,0,0,0|2,0,0]=4 235 B11R1.91 N=C(N)NCC1=NC=CC=C1 MCULE-1744935022 [2,0,0,0,0,0|2,0,0]=4 236 B11R1.91 N=C(N)OCC1=CC=CC=C1 MCULE-9880051094 [2,0,0,0,0,0|2,0,0]=4 237 B11R1.91 N=C(N)SCC1=CC=CC=C1 MCULE-2727300494 [2,0,0,0,0,0|2,0,0]=4 238 B11R1.91 N=C(N)SCC1=CC=CC=C1 MCULE-9265876579 [2,0,0,0,0,0|2,0,0]=4 239 B11R1.91 N=C(N)SCC1=CC=CC=C1 MCULE-9966047767 [2,0,0,0,0,0|2,0,0]=4 240 B11R1.91 NC(=O)NCC1=CC=CC=C1 MCULE-8856820054 [2,0,0,0,0,0|1,0,1]=4 241 B11R1.91 NC(=S)NCC1=CC=CC=C1 MCULE-3106139297 [2,0,0,0,0,0|1,0,1]=4 242 B11R1.91 S=C(S)NCC1=CC=CC=C1 MCULE-7358133493 [2,0,0,0,0,0|2,0,0]=4 243 B11R1.91 S=C([S-])NCC1=CC=CC=C1 MCULE-9039728767 [2,0,0,0,0,0|2,0,0]=4 244 B11R1.189 C=CCC1=CC(=CC=C1)CN MCULE-1329623127 [2,0,0,0,0,0|0,0,1]=3 245 B11R1.189 C=CCC1=CC(=CC=C1)CN MCULE-5743597290 [2,0,0,0,0,0|0,0,1]=3 246 B11R1.189 C=CCC1=CC(=CC=C1)CO MCULE-2074830518 [2,0,0,0,0,0|1,0,1]=4 247 B11R1.189 C=CCC1=CC=CC(=C1)CBr MCULE-2409773034 [2,0,0,0,0,0|1,0,1]=4 248 B11R1.189 C=CCC1=CC=CC(=C1)CC MCULE-3509933583 [2,0,0,0,0,0|1,0,1]=4 249 B11R1.189 CCNC1=CC(=CC=C1)CO MCULE-2536406633 [2,0,0,0,0,0|1,0,1]=4 250 B11R1.189 CCNC1=CC=CC(=C1)CC MCULE-4717072640 [2,0,0,0,0,0|1,0,1]=4 251 B11R1.189 CCNC1=NC=CC(=C1)CN MCULE-5094200091 [2,0,0,0,0,0|1,0,1]=4 252 B11R1.189 CCOC1=CC(=CC=C1)CN MCULE-9688535042 [2,0,0,0,0,0|1,0,1]=4 253 B11R1.189 CCSC1=CC(=CC=C1)CN MCULE-8917368614 [2,0,0,0,0,0|1,0,1]=4 254 B11R1.189 CNCC1=CC(=CC=C1)C#N MCULE-3422362757 [2,0,0,0,0,0|0,0,2]=4 255 B11R1.189 CNCC1=CC(=CC=C1)OC MCULE-5111951645 [2,0,0,0,0,0|2,0,0]=4 256 B11R1.189 CNCC1=CC(=CC=C1)OC MCULE-7869674203 [2,0,0,0,0,0|2,0,0]=4 257 B11R1.189 CNCC1=CC(=CC=C1)SC MCULE-1645629268 [2,0,0,0,0,0|2,0,0]=4 258 B11R1.189 CNCC1=CC=CC(=C1)CN MCULE-9811906152 [2,0,0,0,0,0|0,0,0]=2 259 B11R1.189 COCC1=CC(=CC=C1)CBr MCULE-2674169090 [2,0,0,0,0,0|2,0,0]=4 260 B11R1.189 COCC1=CC(=CC=C1)CN MCULE-2750586958 [2,0,0,0,0,0|1,0,0]=3 261 B11R1.189 COCC1=CC(=CC=C1)CO MCULE-2638645297 [2,0,0,0,0,0|2,0,0]=4 262 B11R1.189 CSCC1=CC(=CC=C1)CN MCULE-4131821410 [2,0,0,0,0,0|1,0,0]=3 263 B11R1.189 N#CCC1=CC=CC(=C1)CN MCULE-1763052157 [2,0,0,0,0,0|0,0,2]=4 264 B11R1.189 N#CCC1=CC=CC(=C1)CN MCULE-5738336344 [2,0,0,0,0,0|0,0,2]=4 265 B11R1.189 NCC1=CC(=CC=C1)CCO MCULE-8070981181 [2,0,0,0,0,0|1,0,1]=4 266 B13R1.15 CC1=CC(=CC=C1)CNC(=O)CCl MCULE-1300615382 [1,1,0,0,0,0|1,0,0]=3 267 B13R1.15 CC1=CC(=CC=C1)CNC(=O)CN MCULE-4462181609 [1,1,0,0,0,0|1,0,0]=3 268 B13R1.15 CCC(=O)NCC1=CC(=CC=C1)Br MCULE-6056277368 [1,1,0,0,0,0|2,0,0]=4 269 B13R1.15 CCC(C)NCC1=CC(=CC=C1)C MCULE-3316898237 [1,1,0,0,0,0|1,0,1]=4 270 B13R1.15 CCC(C)NCC1=CC(=CC=C1)C MCULE-7424787756 [1,1,0,0,0,0|1,0,1]=4 271 B13R1.15 CNC(=O)CCC1=CC(=CC=C1)N MCULE-6849669748 [1,1,0,0,0,0|2,0,0]=4 272 B13R1.15 CNC(=O)CCC1=CC(=CC=C1)N MCULE-6888056048 [1,1,0,0,0,0|2,0,0]=4 273 B13R1.15 CNC(=O)CCC1=CC(=CC=C1)N MCULE-9127316030 [1,1,0,0,0,0|2,0,0]=4 274 B13R1.15 CNC(=O)NCC1=CC(=CC=C1)Cl MCULE-7509104237 [1,1,0,0,0,0|2,0,0]=4 275 B13R1.15 COC(=O)CCC1=CC(=CC=C1)N MCULE-1101018183 [1,1,0,0,0,0|2,0,0]=4 276 B13R1.15 COC(=O)CCC1=CC(=CC=C1)N MCULE-4722502923 [1,1,0,0,0,0|2,0,0]=4 277 B13R1.15 COC(=O)NCC1=CC(=CC=C1)Br MCULE-3263245880 [1,1,0,0,0,0|2,0,0]=4 278 B13R1.15 NCC(=O)NCC1=CC=CC(=C1)Br MCULE-4326091634 [1,1,0,0,0,0|2,0,0]=4 279 B13R1.15 NCC(=O)NCC1=CC=CC(=C1)Cl MCULE-2545968265 [1,1,0,0,0,0|2,0,0]=4 280 B13R1.15 NCC(=O)NCC1=CC=CC(=C1)F MCULE-2415058893 [1,1,0,0,0,0|2,0,0]=4 281 B13R1.15 O=C(CBr)NCC1=CC=CC(=C1)Cl MCULE-2149634393 [1,1,0,0,0,0|2,0,0]=4 282 B13R1.15 O=C(CCl)NCC1=CC(=CC=C1)Cl MCULE-3522483381 [1,1,0,0,0,0|2,0,0]=4 283 B13R1.15 O=C(CCl)NCC1=CC=CC(=C1)Br MCULE-2024992844 [1,1,0,0,0,0|2,0,0]=4 284 B13R1.147 C=C(C)C[C@@H](N)C1=CC=CC(=C1)C MCULE-5067783747 [1,1,0,0,0,0|2,0,0]=4 285 B13R1.147 C=C(C)C[C@@H](N)C1=CC=CC(=C1)C MCULE-8784832356 [1,1,0,0,0,0|2,0,0]=4 286 B13R1.147 C=C(C)C[C@H](N)C1=CC=CC(=C1)C MCULE-6873246398 [1,1,0,0,0,0|2,0,0]=4 287 B13R1.147 C=C(C)C[C@H](N)C1=CC=CC(=C1)C MCULE-9314481838 [1,1,0,0,0,0|2,0,0]=4 288 B13R1.147 CC(=O)NC(C)C1=CC=CC(=C1)N MCULE-8776654413 [1,1,0,0,0,0|1,0,0]=3 289 B13R1.147 CC(=O)NC(C)C1=CC=CC(=C1)N MCULE-9316188587 [1,1,0,0,0,0|1,0,0]=3 290 B13R1.147 CC(=O)NC(C)C1=CC=CC(=C1)N MCULE-9886650009 [1,1,0,0,0,0|1,0,0]=3 291 B13R1.148 CC(=O)N(C)CC1=CC(=CC=C1)N MCULE-8260789099 [1,1,0,0,0,0|1,0,0]=3 292 B13R1.148 CC(C)N(C)CC1=CC=CC(=C1)N MCULE-6376945719 [1,1,0,0,0,0|1,0,1]=4 293 B13R1.148 CC1=CC=CC(=C1)CN(C)C(=N)N MCULE-5438319608 [1,1,0,0,0,0|1,0,0]=3 294 B13R1.148 CC1=CC=CC(=C1)CN(C)C(=N)N MCULE-9044724748 [1,1,0,0,0,0|1,0,0]=3 295 B13R1.148 CN(CC1=CC(=CC=C1)Cl)C(=N)N MCULE-5674001200 [1,1,0,0,0,0|2,0,0]=4 296 B13R1.148 CN(CC1=CC(=CC=C1)Cl)C(=N)N MCULE-8617163569 [1,1,0,0,0,0|2,0,0]=4 297 B13R1.148 CN(CC1=CC(=CC=C1)F)C(=N)N MCULE-2060779448 [1,1,0,0,0,0|2,0,0]=4 298 B13R1.148 CN(CC1=CC(=CC=C1)F)C(=N)N MCULE-3297632197 [1,1,0,0,0,0|2,0,0]=4 299 B13R1.150 C=C(C)CCC1=CC=CC(=C1F)C MCULE-5983760946 [1,1,0,0,0,0|2,0,0]=4 300 B13R1.150 CC1=C(C(=CC=C1)CNC(C)C)F MCULE-8542942435 [1,1,0,0,0,0|1,0,1]=4 301 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)C)C MCULE-9757583794 [1,1,0,0,0,0|2,0,0]=4 302 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)Cl)C MCULE-6628857640 [1,1,0,0,0,0|2,0,0]=4 303 B13R1.511 C=C(C)CCC1=CC(=C(C=C1)F)C MCULE-9478434242 [1,1,0,0,0,0|2,0,0]=4 304 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)C)N MCULE-4932959317 [1,1,0,0,0,0|2,0,0]=4 305 B13R1.511 CC(=O)NCC1=CC(=C(C=C1)Cl)Cl MCULE-2010730263 [1,1,0,0,0,0|2,0,0]=4 306 B13R1.511 CC(=O)NCC1=CC=C(C(=C1)C)I MCULE-7713399596 [1,1,0,0,0,0|1,0,0]=3 307 B13R1.511 CC(=O)NCC1=CC=C(C(=C1)Cl)N MCULE-9661147475 [1,1,0,0,0,0|2,0,0]=4 308 B13R1.511 CC1=C(C=C(C=C1)CNC(=N)N)C MCULE-3275347369 [1,1,0,0,0,0|1,0,0]=3 309 B13R1.511 CC1=C(C=CC(=C1)CNC(C)C)I MCULE-4156141847 [1,1,0,0,0,0|1,0,1]=4 310 B13R1.511 CC1=CC(=CC=C1Br)CNC(=O)N MCULE-8749221615 [1,1,0,0,0,0|1,0,1]=4 311 B13R1.511 CC1=CC=C(C=C1N)CNC(C)C MCULE-7275529410 [1,1,0,0,0,0|1,0,1]=4 312 B13R1.511 N=C(N)NCC1=CC(=C(C=C1)Cl)Cl MCULE-5226901046 [1,1,0,0,0,0|2,0,0]=4 313 B13R1.838 CC1=CC=CC(=C1)CNS(=O)(=O)C MCULE-5312494472 [1,1,0,0,0,0|2,0,0]=4 314 B13R1.838 CS(=O)(=O)NCC1=CC(=CC=C1)N MCULE-9105395792 [1,1,0,0,0,0|2,0,0]=4 315 B13R1.893 C=C(C)CCC1=C(C=CC(=C1)C)C MCULE-2791559278 [1,1,0,0,0,0|2,0,0]=4 316 B13R1.893 CC(=O)NCC1=C(C=CC(=C1)C)C MCULE-4813342148 [1,1,0,0,0,0|1,0,0]=3 317 B13R1.893 CC1=CC(=C(C=C1)C)CNC(C)C MCULE-7080069977 [1,1,0,0,0,0|1,0,1]=4 318 B13R1.893 CC1=CC=C(C(=C1)CNC(C)C)Cl MCULE-9552534820 [1,1,0,0,0,0|1,0,1]=4 319 B13R1.893 CC1=CC=C(C(=C1)CNC(C)C)F MCULE-9378240642 [1,1,0,0,0,0|1,0,1]=4 320 B13R1.3420 C=C(C)CCC1=CC(=CC(=C1)C)C MCULE-2240313936 [1,1,0,0,0,0|2,0,0]=4 321 B13R1.3420 CC1=CC(=CC(=C1)CNC(C)C)Br MCULE-6588950423 [1,1,0,0,0,0|1,0,1]=4 322 B13R1.3420 CC1=CC(=CC(=C1)CNC(C)C)F MCULE-2509971459 [1,1,0,0,0,0|1,0,1]=4 323 B13R1.3420 N=C(N)NCC1=CC(=CC(=C1)F)F MCULE-7322976761 [1,1,0,0,0,0|2,0,0]=4 324 B13R1.81 CCN(C)CC1=CC(=CC=C1)CN MCULE-2966846261 [1,1,0,0,0,0|0,0,1]=3 325 B13R1.81 COC(=O)CC1=CC=CC(=C1)CN MCULE-3779211859 [1,1,0,0,0,0|2,0,0]=4 326 B13R1.81 COC(=O)CC1=CC=CC(=C1)CN MCULE-6969230520 [1,1,0,0,0,0|2,0,0]=4 327 B13R1.460 CCNC(=O)C1=CC(=CC=C1)CN MCULE-6018433459 [1,1,0,0,0,0|0,0,2]=4 328 B13R1.460 CCNC(=O)C1=CC(=CC=C1)CN MCULE-9646658123 [1,1,0,0,0,0|0,0,2]=4 329 B13R1.567 CCNCC1=CC(=CC=C1)OCC MCULE-3301884693 [1,1,0,0,0,0|1,0,1]=4 330 B13R1.567 CCNCC1=CC(=CC=C1)OCC MCULE-9792291165 [1,1,0,0,0,0|1,0,1]=4 331 B13R1.569 CCCCC1=CC=CC(=C1Cl)CN MCULE-6545239803 [1,1,0,0,0,0|1,0,1]=4 332 B13R1.666 CCCCOC1=CC(=CC=C1)CN MCULE-5271307986 [1,1,0,0,0,0|1,0,1]=4 333 B13R1.666 CCCCOC1=CC(=CC=C1)CN MCULE-8589956730 [1,1,0,0,0,0|1,0,1]=4 334 B13R1.666 COCCOC1=CC(=CC=C1)CN MCULE-8796887463 [1,1,0,0,0,0|2,0,0]=4 335 B13R1.56 CCC1=CC(=CC(=C1)NC(=O)C)Br MCULE-3259596394 [0,1,0,0,1,0|2,0,0]=4 336 B13R1.80 CS(=O)(=O)CC1=CC(=CC=C1)CN MCULE-4452674651 [0,1,0,0,1,0|2,0,0]=4 337 B13R1.80 CS(=O)(=O)NC1=CC(=CC=C1)CN MCULE-2846836552 [0,1,0,0,1,0|2,0,0]=4 338 B13R1.80 CS(=O)(=O)NC1=CC(=CC=C1)CN MCULE-6253823331 [0,1,0,0,1,0|2,0,0]=4 339 B13R1.97 CN(C)CC1=C(C=CC(=C1)CN)O MCULE-7556155914 [0,1,0,0,1,0|2,0,0]=4 340 B13R1.97 CN(C)CC1=C(C=CC(=C1)CN)O MCULE-8590576375 [0,1,0,0,1,0|2,0,0]=4 341 B13R1.373 C=C(C)CC1=CC(=CC=C1)OCC MCULE-9845923139 [0,1,0,0,1,0|2,0,0]=4 342 B13R1.373 CC(=O)CC1=CC(=CC=C1)CC#N MCULE-9447008304 [0,1,0,0,1,0|1,0,1]=4 343 B13R1.373 CCNC1=CC=CC(=C1)NC(=O)C MCULE-2889826436 [0,1,0,0,1,0|2,0,0]=4 344 B13R1.373 CCOC1=CC(=CC=C1)NC(=O)C MCULE-7490549482 [0,1,0,0,1,0|2,0,0]=4 345 B13R1.373 CN(C)CC1=CC(=CC=C1)CCN MCULE-6155518197 [0,1,0,0,1,0|2,0,0]=4 346 B13R1.373 CN(C)CC1=CC(=CC=C1)CCN MCULE-6388970982 [0,1,0,0,1,0|2,0,0]=4 347 B13R1.373 CNCC1=CC=CC(=C1)CN(C)C MCULE-9200052207 [0,1,0,0,1,0|2,0,0]=4 348 B13R1.373 CNCC1=CC=CC(=C1)CN(C)C MCULE-9487029349 [0,1,0,0,1,0|2,0,0]=4 349 B13R1.587 C=C(C)CC1=CC(=CC=C1)C(C)C MCULE-6311855733 [0,1,0,0,1,0|2,0,0]=4 350 B13R1.587 CC(=O)NC1=CC(=CC=C1)C(=S)N MCULE-8314671045 [0,1,0,0,1,0|1,0,1]=4 351 B13R1.587 CC(=O)NC1=CC(=CC=C1)C(C)O MCULE-4000734974 [0,1,0,0,1,0|2,0,0]=4 352 B13R1.587 CC(=O)NC1=CC=CC(=C1)C(C)N MCULE-7878560094 [0,1,0,0,1,0|1,0,0]=3 353 B13R1.587 CC(=O)OC1=CC(=CC=C1)[C@@H](C)N MCULE-3835008932 [0,1,0,0,1,0|2,0,0]=4 354 B13R1.587 CC(=O)OC1=CC(=CC=C1)[C@@H](C)N MCULE-8962725465 [0,1,0,0,1,0|2,0,0]=4 355 B13R1.587 CC(=O)OC1=CC(=CC=C1)[C@H](C)N MCULE-1198553073 [0,1,0,0,1,0|2,0,0]=4 356 B13R1.587 CC(=O)OC1=CC(=CC=C1)[C@H](C)N MCULE-8993862996 [0,1,0,0,1,0|2,0,0]=4 357 B13R1.642 CC(=O)N(C)C1=CC(=CC=C1)CN MCULE-2366060480 [0,1,0,0,1,0|1,0,0]=3 358 B13R1.642 CC(=O)N(C)C1=CC(=CC=C1)CN MCULE-3916765664 [0,1,0,0,1,0|1,0,0]=3 359 B15R1.63 CCC1=CC(=CC=C1)CN(C)C(=O)CCl MCULE-7243378705 [0,2,0,0,0,0|2,0,0]=4 360 B15R1.569 CCOC1=CC(=CC=C1)CNC(=O)CCl MCULE-9725673965 [0,2,0,0,0,0|2,0,0]=4 361 B15R1.569 CCOC1=CC=CC(=C1)CNC(=O)CC MCULE-1323862328 [0,2,0,0,0,0|2,0,0]=4 362 B15R1.569 COCC1=CC(=CC=C1)CNC(=O)CCl MCULE-8104035608 [0,2,0,0,0,0|2,0,0]=4 363 B15R1.1106 CC(C)C1=CC(=CC=C1)CNC(=O)CCl MCULE-2846304778 [0,2,0,0,0,0|2,0,0]=4 364 B15R1.10389 CCOC(=O)CCC1=CC=CC(=C1)CN MCULE-2507601784 [0,2,0,0,0,0|2,0,0]=4 365 B15R1.8935 CC(=O)NCC1=CC=CC(=C1)C(F)(F)F MCULE-4534133116 [0,2,0,0,0,0|2,0,0]=4 366 B15R1.8935 N=C(N)NCC1=CC(=CC=C1)C(F)(F)F MCULE-9331887919 [0,2,0,0,0,0|2,0,0]=4 367 B13R2.151 CC1=CC(=CC=C1)C2CC(=O)C2 MCULE-5385069823 [1,0,0,1,0,0|2,0,0]=4 368 B13R2.151 O=C1CC(N1)C2=CC=CC(=C2)Br MCULE-6665742958 [1,0,0,1,0,0|2,0,0]=4 369 B13R2.162 CC1=CC=CC2=C1CC(=O)CC2 MCULE-8228174055 [1,0,0,1,0,0|2,0,0]=4 370 B13R2.162 CC1=CC=CC2=C1N=C(C=C2)C MCULE-1703801542 [1,0,0,1,0,0|1,0,1]=4 371 B13R2.162 CC1=CN=C2C=CC=C(C2=N1)N MCULE-7990735840 [1,0,0,1,0,0|2,0,0]=4 372 B13R2.162 CC1=NC2=C(C=CC=C2C=C1)C MCULE-2533300368 [1,0,0,1,0,0|1,0,1]=4 373 B13R2.162 CC1=NC2=C(C=CC=C2C=C1)N MCULE-1814309915 [1,0,0,1,0,0|1,0,1]=4 374 B13R2.162 CC1CC2=C(C=CC=C2N)CN1 MCULE-6198911644 [1,0,0,1,0,0|1,0,1]=4 375 B13R2.162 NC1=CC=CC2=C1CC(=O)CC2 MCULE-2017130114 [1,0,0,1,0,0|2,0,0]=4 376 B13R2.162 NC1=CC=CC2=C1CC(=O)NC2 MCULE-2328257953 [1,0,0,1,0,0|1,0,0]=3 377 B13R2.162 NC1=CC=CC2=C1NC(=O)NC2 MCULE-5409903214 [1,0,0,1,0,0|1,0,1]=4 378 B13R2.162 O=C1CC2=C(C=CC=C2CN1)Br MCULE-1994294016 [1,0,0,1,0,0|2,0,0]=4 379 B13R2.162 O=C1CC2=C(C=CC=C2CN1)F MCULE-6706712873 [1,0,0,1,0,0|2,0,0]=4 380 B13R2.3683 CC1=CC2=C(C=C1)CC(=O)CC2 MCULE-7277910374 [1,0,0,1,0,0|2,0,0]=4 381 B13R2.3683 CC1=CC2=C(C=C1)N=C(C=C2)C MCULE-3519758935 [1,0,0,1,0,0|1,0,1]=4 382 B13R2.3683 CC1=NC2=C(C=C1)C=C(C=C2)N MCULE-4971169357 [1,0,0,1,0,0|1,0,1]=4 383 B13R2.3683 CC1=NC=C2C=C(C=CC2=N1)N MCULE-4584157293 [1,0,0,1,0,0|0,0,2]=4 384 B13R2.3683 NC1=CC2=C(C=C1)CC(=O)NC2 MCULE-1831651909 [1,0,0,1,0,0|1,0,0]=3 385 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)NC2 MCULE-9261095989 [1,0,0,1,0,0|1,0,1]=4 386 B13R2.3683 O=C1CC2=C(C=C(C=C2)O)CN1 MCULE-2690679179 [1,0,0,1,0,0|2,0,0]=4 387 B13R2.3683 O=C1CC2=CC=C(C=C2CN1)Br MCULE-5642780784 [1,0,0,1,0,0|2,0,0]=4 388 B13R2.3683 O=C1CC2=CC=C(C=C2CN1)F MCULE-4497563659 [1,0,0,1,0,0|2,0,0]=4 389 B13R2.5331 CC1=CC(=CC=C1)CNC2CC2 MCULE-1346342587 [1,0,0,1,0,0|1,0,1]=4 390 B13R2.5331 CC1=CC=CC(=C1)CNC2CC2 MCULE-8337615416 [1,0,0,1,0,0|1,0,1]=4 391 B13R2.57 CCC1=CC2=C(C=C1)CCNC2 MCULE-9244779323 [1,0,0,1,0,0|1,0,1]=4 392 B13R2.57 NCC1=CC2=C(C=C1)CCCC2 MCULE-8385691331 [1,0,0,1,0,0|1,0,1]=4 393 B13R2.57 NCC1=CC2=C(C=C1)CCOC2 MCULE-6566964632 [1,0,0,1,0,0|1,0,1]=4 394 B13R2.57 NCC1=CC2=C(C=C1)COCC2 MCULE-1352091437 [1,0,0,1,0,0|2,0,0]=4 395 B13R2.57 NCC1=CC2=CC=CN=C2C=C1 MCULE-1455479995 [1,0,0,1,0,0|1,0,1]=4 396 B13R2.57 NCC1=CC2=CC=CN=C2C=C1 MCULE-2681768775 [1,0,0,1,0,0|1,0,1]=4 397 B13R2.57 NCC1=CC2=CN=CN=C2C=C1 MCULE-5083741380 [1,0,0,1,0,0|0,0,2]=4 398 B13R2.57 NCC1=CC=C2N=CC=CC2=C1 MCULE-1117467955 [1,0,0,1,0,0|1,0,1]=4 399 B13R2.57 NCC1=CC=C2N=CC=NC2=C1 MCULE-3613790839 [1,0,0,1,0,0|2,0,0]=4 400 B13R2.57 NCC1=CC=C2N=CC=NC2=C1 MCULE-3632775120 [1,0,0,1,0,0|2,0,0]=4 401 B13R2.57 OCC1=CC2=C(C=C1)CCNC2 MCULE-2407503999 [1,0,0,1,0,0|1,0,1]=4 402 B13R2.57 OCC1=CC2=C(C=C1)CCNC2 MCULE-5652517430 [1,0,0,1,0,0|1,0,1]=4 403 B13R2.582 NCC1=CC=CC2=C1C(=O)NC2 MCULE-2210780191 [1,0,0,1,0,0|1,0,0]=3 404 B13R2.582 O=C1NCC2=C1C(=CC=C2)CO MCULE-6098871208 [1,0,0,1,0,0|2,0,0]=4 405 B13R2.1613 CCC1=C2CCNCC2=CC=C1 MCULE-6530160954 [1,0,0,1,0,0|1,0,1]=4 406 B13R2.1613 NCC1=C2CCNCC2=CC=C1 MCULE-2421983462 [1,0,0,1,0,0|0,0,1]=3 407 B13R2.1613 NCC1=C2CCNCC2=CC=C1 MCULE-3599679508 [1,0,0,1,0,0|0,0,1]=3 408 B13R2.1613 NCC1=C2CCOCC2=CC=C1 MCULE-6988629814 [1,0,0,1,0,0|1,0,1]=4 409 B13R2.1613 NCC1=C2N=CC=CC2=CC=C1 MCULE-4059421518 [1,0,0,1,0,0|1,0,1]=4 410 B13R2.1613 NCC1=C2N=CC=CC2=CC=C1 MCULE-5353272039 [1,0,0,1,0,0|1,0,1]=4 411 B13R2.1613 NCC1=C2N=CC=NC2=CC=C1 MCULE-7855854286 [1,0,0,1,0,0|2,0,0]=4 412 B13R2.2130 CN1CCC2=C1C=CC(=C2)CN MCULE-1904931747 [1,0,0,1,0,0|2,0,0]=4 413 B13R2.2130 NCC1=CC2=C(C=C1)C(=O)NC2 MCULE-2595438030 [1,0,0,1,0,0|1,0,0]=3 414 B13R2.2130 NCC1=CC2=C(C=C1)C(=O)NC2 MCULE-4336022740 [1,0,0,1,0,0|1,0,0]=3 415 B13R2.2130 O=C1NCC2=C1C=CC(=C2)CO MCULE-5839706038 [1,0,0,1,0,0|2,0,0]=4 416 B13R2.581 CC1=CC2=C(C=CN=C2N1)CN MCULE-7848475694 [0,0,0,1,1,0|2,0,0]=4 417 B13R2.581 CC1=CC2=C(N1)C=CC=C2CN MCULE-4859119572 [0,0,0,1,1,0|1,0,0]=3 418 B13R2.581 CC1=NC2=C(C=CC=C2N1)CO MCULE-5067154574 [0,0,0,1,1,0|1,0,0]=3 419 B13R2.581 CC1=NC2=C(C=CC=C2O1)CO MCULE-3137368097 [0,0,0,1,1,0|2,0,0]=4 420 B13R2.581 CC1=NC2=C(N1)C=CC=C2C#N MCULE-7492969009 [0,0,0,1,1,0|0,0,2]=4 421 B13R2.581 CC1=NC2=CC=CC(=C2N1)CN MCULE-5891620576 [0,0,0,1,1,0|0,0,2]=4 422 B13R2.581 CC1=NC2=CC=CC(=C2N1)CN MCULE-9488689833 [0,0,0,1,1,0|0,0,2]=4 423 B13R2.581 CN1C=C2C=CC=C(C2=N1)CN MCULE-3678174733 [0,0,0,1,1,0|1,0,1]=4 424 B13R2.581 CN1C=C2C=CC=C(C2=N1)CN MCULE-9706989405 [0,0,0,1,1,0|1,0,1]=4 425 B13R2.581 NCC1=C2CC(=O)NC2=NC=C1 MCULE-2358427838 [0,0,0,1,1,0|2,0,0]=4 426 B13R2.581 NCC1=C2NC(=O)CC2=CC=C1 MCULE-1093545813 [0,0,0,1,1,0|1,0,1]=4 427 B13R2.581 NCC1=CC=NC2=C1CC(=O)N2 MCULE-1279133677 [0,0,0,1,1,0|2,0,0]=4 428 B13R2.2121 CC1=CC2=C(N1)C=CC(=C2)CN MCULE-7036886288 [0,0,0,1,1,0|0,0,2]=4 429 B13R2.2121 CC1=CC2=C(N1)C=CC(=C2)CN MCULE-7882751305 [0,0,0,1,1,0|0,0,2]=4 430 B13R2.2121 CC1=NC2=C(O1)C=CC(=C2)CN MCULE-7363021884 [0,0,0,1,1,0|1,0,1]=4 431 B13R2.2121 CC1=NC2=C(O1)C=CC(=C2)CN MCULE-9669242282 [0,0,0,1,1,0|1,0,1]=4 432 B13R2.2121 CC1=NC2=C(S1)C=C(C=C2)CO MCULE-5502729057 [0,0,0,1,1,0|2,0,0]=4 433 B13R2.2121 CC1=NC2=C(S1)C=C(C=C2)NN MCULE-6503648447 [0,0,0,1,1,0|2,0,0]=4 434 B13R2.2121 CC1=NC2=CC=C(C=C2N1)CN MCULE-2207407155 [0,0,0,1,1,0|0,0,0]=2 435 B13R2.2121 CC1=NC2=CC=C(C=C2N1)CN MCULE-9112645314 [0,0,0,1,1,0|0,0,0]=2 436 B13R2.2121 CC1=NC2=CC=C(C=C2O1)CN MCULE-5591204149 [0,0,0,1,1,0|1,0,0]=3 437 B13R2.2121 CC1=NC2=CC=C(C=C2O1)CO MCULE-3476819500 [0,0,0,1,1,0|2,0,0]=4 438 B13R2.2121 CC1=NC2=CC=C(C=C2S1)CCl MCULE-8756486350 [0,0,0,1,1,0|2,0,0]=4 439 B13R2.2121 CC1=NC2=CC=C(C=C2S1)NN MCULE-1983234222 [0,0,0,1,1,0|2,0,0]=4 440 B13R2.2121 CC1CC2=C(O1)C=CC(=C2)CN MCULE-6387191671 [0,0,0,1,1,0|1,0,1]=4 441 B13R2.2121 CCC1=CC=C2N=C(NC2=C1)N MCULE-3121594948 [0,0,0,1,1,0|2,0,0]=4 442 B13R2.2121 CN1C=C2C=C(C=CC2=N1)CN MCULE-1705332548 [0,0,0,1,1,0|1,0,1]=4 443 B13R2.2121 CN1C=C2C=C(C=CC2=N1)CN MCULE-5145423409 [0,0,0,1,1,0|1,0,1]=4 444 B13R2.2121 CN1C=C2C=C(C=CC2=N1)CN MCULE-8849292795 [0,0,0,1,1,0|1,0,1]=4 445 B13R2.2121 COC1=CC2=C(C=C1)N=C(N2)C MCULE-4178809010 [0,0,0,1,1,0|2,0,0]=4 446 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)C2 MCULE-1841168574 [0,0,0,1,1,0|1,0,1]=4 447 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)C2 MCULE-6617993124 [0,0,0,1,1,0|1,0,1]=4 448 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)N2 MCULE-2833196246 [0,0,0,1,1,0|1,0,1]=4 449 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)N2 MCULE-8020489235 [0,0,0,1,1,0|1,0,1]=4 450 B13R2.2121 NCC1=CC2=C(C=C1)OC(=O)N2 MCULE-6838903718 [0,0,0,1,1,0|2,0,0]=4 451 B13R2.2121 NCC1=CC2=C(C=C1)OC(=O)N2 MCULE-8027327502 [0,0,0,1,1,0|2,0,0]=4 452 B15R2.18 CC1=CSC(=N1)C2=CC(=CC=C2)CN MCULE-1705880900 [0,0,0,1,0,1|1,0,1]=4 453 B15R2.18 CC1=CSC(=N1)C2=CC(=CC=C2)CN MCULE-6438220742 [0,0,0,1,0,1|1,0,1]=4 454 B15R2.18 CC1=CSC(=N1)C2=CC(=CC=C2)CN MCULE-6761511501 [0,0,0,1,0,1|1,0,1]=4 455 B15R2.18 CC1=NC(=CS1)C2=CC(=CC=C2)CN MCULE-4426339437 [0,0,0,1,0,1|1,0,1]=4 456 B15R2.18 CC1=NC(=CS1)C2=CC(=CC=C2)CN MCULE-4784916186 [0,0,0,1,0,1|1,0,1]=4 457 B15R2.7688 CC(=O)NCC1=CC2=C(C=C1)CNC2 MCULE-2828362014 [0,1,0,1,0,0|1,0,0]=3 458 B15R2.7688 CC(=O)NCC1=CC2=C(C=C1)CNC2 MCULE-4035931056 [0,1,0,1,0,0|1,0,0]=3 459 B15R2.7688 CC(=O)NCC1=CC=C2OCOC2=C1 MCULE-7575232678 [0,1,0,1,0,0|2,0,0]=4 460 B15R2.7688 N=C(N)NCC1=CC2=C(C=C1)OCO2 MCULE-6105116361 [0,1,0,1,0,0|2,0,0]=4 461 B15R2.7688 N=C(N)NCC1=CC=C2OCOC2=C1 MCULE-1423059096 [0,1,0,1,0,0|2,0,0]=4 462 B15R2.7688 N=C(N)NCC1=CC=C2OCOC2=C1 MCULE-6055402045 [0,1,0,1,0,0|2,0,0]=4 463 B15R2.21329 CC1=NC2=C(C=C(C=C2)CBr)C(=O)N1 MCULE-8842777902 [0,1,0,1,0,0|1,0,1]=4 464 B11R1.75 CC1=CC=C(O1)CNC(=N)N MCULE-5500504056 [1,0,0,0,1,0|2,0,0]=4 465 B11R1.75 CC1=CC=C(O1)CNC(=N)N MCULE-8817441575 [1,0,0,0,1,0|2,0,0]=4 466 B11R1.157 C=C(Br)CC1=CC(=CC=C1)C MCULE-8012176156 [1,0,0,0,1,0|1,0,1]=4 467 B11R1.157 C=C(C)CC1=CC(=CC=C1)Br MCULE-9186287037 [1,0,0,0,1,0|2,0,0]=4 468 B11R1.157 C=C(C)CC1=CC(=CC=C1)C MCULE-8515928932 [1,0,0,0,1,0|1,0,0]=3 469 B11R1.157 C=C(C)CC1=CC(=CC=C1)Cl MCULE-7443393021 [1,0,0,0,1,0|2,0,0]=4 470 B11R1.157 C=C(C)CC1=CC(=CC=C1)F MCULE-6994581804 [1,0,0,0,1,0|2,0,0]=4 471 B11R1.157 C=C(C)CC1=CC(=CC=C1)O MCULE-1563941729 [1,0,0,0,1,0|2,0,0]=4 472 B11R1.157 C=C(C)CC1=CC(=CC=N1)C MCULE-7144121884 [1,0,0,0,1,0|2,0,0]=4 473 B11R1.157 C=C(C)CC1=CC=CC(=N1)C MCULE-1016409950 [1,0,0,0,1,0|2,0,0]=4 474 B11R1.157 C=C(Cl)CC1=CC(=CC=C1)C MCULE-4343331169 [1,0,0,0,1,0|1,0,1]=4 475 B11R1.157 CC(=N)NC1=CC=CC(=C1)Cl MCULE-3885035069 [1,0,0,0,1,0|1,0,0]=3 476 B11R1.157 CC(=N)NC1=CC=CC(=C1)Cl MCULE-5539809206 [1,0,0,0,1,0|1,0,0]=3 477 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br MCULE-6613122699 [1,0,0,0,1,0|2,0,0]=4 478 B11R1.157 CC(=O)CC1=CC(=CC=C1)C MCULE-9504071522 [1,0,0,0,1,0|1,0,0]=3 479 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl MCULE-5254937937 [1,0,0,0,1,0|2,0,0]=4 480 B11R1.157 CC(=O)CC1=CC(=CC=C1)F MCULE-5565162161 [1,0,0,0,1,0|2,0,0]=4 481 B11R1.157 CC(=O)CC1=CC(=CC=N1)C MCULE-2913684470 [1,0,0,0,1,0|2,0,0]=4 482 B11R1.157 CC(=O)CC1=NC(=CC=C1)C MCULE-7423504135 [1,0,0,0,1,0|2,0,0]=4 483 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br MCULE-3401615240 [1,0,0,0,1,0|2,0,0]=4 484 B11R1.157 CC(=O)NC1=CC(=CC=C1)Cl MCULE-2601514546 [1,0,0,0,1,0|2,0,0]=4 485 B11R1.157 CC(=O)NC1=CC(=CC=C1)F MCULE-1851935542 [1,0,0,0,1,0|2,0,0]=4 486 B11R1.157 CC(=O)NC1=CC(=CC=C1)I MCULE-5402592699 [1,0,0,0,1,0|2,0,0]=4 487 B11R1.157 CC(=O)NC1=CC(=CN=C1)N MCULE-4938504605 [1,0,0,0,1,0|2,0,0]=4 488 B11R1.157 CC(=O)NC1=CC(=NC=C1)C MCULE-2594550348 [1,0,0,0,1,0|2,0,0]=4 489 B11R1.157 CC(=O)NC1=CC(=NC=C1)N MCULE-5684893517 [1,0,0,0,1,0|2,0,0]=4 490 B11R1.157 CC(=O)NC1=CC=CC(=C1)C MCULE-5690701833 [1,0,0,0,1,0|1,0,0]=3 491 B11R1.157 CC(=O)NC1=CC=CC(=C1)N MCULE-2104045922 [1,0,0,0,1,0|1,0,0]=3 492 B11R1.157 CC(=O)NC1=CC=CC(=C1)N MCULE-5722441261 [1,0,0,0,1,0|1,0,0]=3 493 B11R1.157 CC(=O)NC1=CC=CC(=C1)O MCULE-1526482888 [1,0,0,0,1,0|2,0,0]=4 494 B11R1.157 CC(=O)NC1=CC=CC(=C1)S MCULE-9562836416 [1,0,0,0,1,0|2,0,0]=4 495 B11R1.157 CC(=O)NC1=CC=CC(=N1)N MCULE-8149399493 [1,0,0,0,1,0|2,0,0]=4 496 B11R1.157 CC(=O)NC1=NC(=CC=C1)C MCULE-7901457206 [1,0,0,0,1,0|2,0,0]=4 497 B11R1.157 CC(=O)NC1=NC=CC(=C1)C MCULE-3334625511 [1,0,0,0,1,0|2,0,0]=4 498 B11R1.157 CC(=O)NC1=NC=CC(=C1)N MCULE-4989112425 [1,0,0,0,1,0|2,0,0]=4 499 B11R1.157 CC(=O)OC1=CC=CC(=C1)C MCULE-6903728300 [1,0,0,0,1,0|2,0,0]=4 500 B11R1.157 CC(C)CC1=CC=CC(=C1)N MCULE-5307341136 [1,0,0,0,1,0|1,0,1]=4 501 B11R1.157 CC1=CC(=CC=C1)CC(=N)N MCULE-4936582931 [1,0,0,0,1,0|1,0,0]=3 502 B11R1.157 CC1=CC(=CC=C1)CC(=N)N MCULE-9809860738 [1,0,0,0,1,0|1,0,0]=3 503 B11R1.157 CC1=CC(=CC=C1)CC(=O)Cl MCULE-3451207056 [1,0,0,0,1,0|2,0,0]=4 504 B11R1.157 CC1=CC(=CC=C1)CC(=O)O MCULE-8658748020 [1,0,0,0,1,0|2,0,0]=4 505 B11R1.157 CC1=CC(=CC=C1)CC(=S)N MCULE-1644127041 [1,0,0,0,1,0|1,0,1]=4 506 B11R1.157 CC1=CC(=CC=C1)NC(=N)N MCULE-4043901139 [1,0,0,0,1,0|1,0,0]=3 507 B11R1.157 CC1=CC(=CC=C1)NC(=O)N MCULE-9290593954 [1,0,0,0,1,0|1,0,1]=4 508 B11R1.157 CC1=CC(=CC=C1)NC(=S)N MCULE-6069853101 [1,0,0,0,1,0|1,0,1]=4 509 B11R1.157 CC1=CC(=CC=C1)NC(=S)S MCULE-4456315769 [1,0,0,0,1,0|2,0,0]=4 510 B11R1.157 CC1=CC(=CC=C1)NC(=S)[S-] MCULE-4518482334 [1,0,0,0,1,0|2,0,0]=4 511 B11R1.157 CC1=CC=CC(=C1)CC(C)N MCULE-2117652896 [1,0,0,0,1,0|0,0,2]=4 512 B11R1.157 CC1=CC=CC(=C1)NC(C)C MCULE-7004696031 [1,0,0,0,1,0|1,0,1]=4 513 B11R1.157 CN(C)CC1=CC(=CC=C1)N MCULE-7523055207 [1,0,0,0,1,0|2,0,0]=4 514 B11R1.157 CN(C)CC1=CC=CC(=C1)N MCULE-5592271988 [1,0,0,0,1,0|2,0,0]=4 515 B11R1.157 CS(=O)CC1=CC(=CC=C1)N MCULE-5776527295 [1,0,0,0,1,0|2,0,0]=4 516 B11R1.157 N=C(N)CC1=CC(=CC=C1)Cl MCULE-7009206964 [1,0,0,0,1,0|2,0,0]=4 517 B11R1.157 N=C(N)CC1=CC(=CC=C1)F MCULE-3192482392 [1,0,0,0,1,0|2,0,0]=4 518 B11R1.157 N=C(N)CC1=CC(=CC=C1)F MCULE-8773497113 [1,0,0,0,1,0|2,0,0]=4 519 B11R1.157 N=C(N)CC1=CC=CC(=C1)Cl MCULE-5333589422 [1,0,0,0,1,0|2,0,0]=4 520 B11R1.157 N=C(N)NC1=CC(=CC=C1)Br MCULE-2531809299 [1,0,0,0,1,0|2,0,0]=4 521 B11R1.157 N=C(N)NC1=CC=CC(=C1)Cl MCULE-2184979093 [1,0,0,0,1,0|2,0,0]=4 522 B11R1.157 N=C(N)NC1=CC=CC(=C1)F MCULE-9516171216 [1,0,0,0,1,0|2,0,0]=4 523 B11R1.157 NC(=O)CC1=CC=CC(=C1)N MCULE-4682437122 [1,0,0,0,1,0|1,0,1]=4 524 B11R1.157 NC(=O)CC1=CC=CC(=C1)N MCULE-9653593508 [1,0,0,0,1,0|1,0,1]=4 525 B11R1.157 NC(=O)NC1=CC(=CC=C1)N MCULE-1072163895 [1,0,0,0,1,0|1,0,1]=4 526 B11R1.157 NC(=O)NC1=CC(=CC=C1)N MCULE-1849400608 [1,0,0,0,1,0|1,0,1]=4 527 B11R1.157 NC1=CC(=CC=C1)CC(=O)O MCULE-5352536107 [1,0,0,0,1,0|2,0,0]=4 528 B11R1.157 NC1=CC(=CC=C1)CC(=O)O MCULE-9819576026 [1,0,0,0,1,0|2,0,0]=4 529 B11R1.266 CC(=O)C1=CC(=CC=C1)CBr MCULE-8780050842 [0,0,0,0,2,0|2,0,0]=4 530 B11R1.266 CC(=O)C1=CC(=CC=C1)CN MCULE-2711970348 [0,0,0,0,2,0|1,0,0]=3 531 B11R1.266 CC(=O)C1=CC(=CC=C1)CN MCULE-8060543774 [0,0,0,0,2,0|1,0,0]=3 532 B11R1.266 CC(=O)C1=CC(=CC=C1)CO MCULE-8300717837 [0,0,0,0,2,0|2,0,0]=4 533 B11R1.266 CC(=O)C1=CC=CC(=C1)CCl MCULE-4047358796 [0,0,0,0,2,0|2,0,0]=4 534 B11R1.266 CC(C)C1=CC(=CC=C1)CN MCULE-1043688588 [0,0,0,0,2,0|1,0,1]=4 535 B11R1.266 CCC1=CC=CC(=C1)C(=O)C MCULE-3215324240 [0,0,0,0,2,0|2,0,0]=4 536 B11R1.266 CN(C)C1=CC(=CC=C1)CN MCULE-6535455791 [0,0,0,0,2,0|2,0,0]=4 537 B11R1.266 CN(C)C1=CC=CC(=C1)CN MCULE-7268477339 [0,0,0,0,2,0|2,0,0]=4 538 B11R1.266 N=C(N)C1=CC=CC(=C1)CN MCULE-3126959974 [0,0,0,0,2,0|1,0,0]=3 539 B11R1.266 N=C(N)C1=CC=CC(=C1)CN MCULE-5113268429 [0,0,0,0,2,0|1,0,0]=3 540 B11R1.266 NCC1=CC(=CC=C1)C(=O)N MCULE-4472435830 [0,0,0,0,2,0|1,0,1]=4 541 B11R1.266 NCC1=CC(=CC=C1)C(=O)N MCULE-7158363603 [0,0,0,0,2,0|1,0,1]=4 542 B11R1.266 NCC1=CC(=CC=C1)C(=O)O MCULE-3333725886 [0,0,0,0,2,0|2,0,0]=4 543 B11R1.266 NCC1=CC=CC(=C1)C(=O)O MCULE-3770537157 [0,0,0,0,2,0|2,0,0]=4 544 B13R1.149 C=C(C)CCCC1=CC(=CC=C1)C MCULE-1077134614 [1,0,0,0,0,1|2,0,0]=4 545 B13R1.149 CC(=O)NCCC1=CC=CC(=C1)F MCULE-8308690306 [1,0,0,0,0,1|2,0,0]=4 546 B13R1.149 CC(=O)NCCC1=CC=CC(=C1)O MCULE-3678621841 [1,0,0,0,0,1|2,0,0]=4 547 B13R1.149 CC(=O)OCCC1=CC(=CC=C1)C MCULE-5192471480 [1,0,0,0,0,1|2,0,0]=4 548 B13R1.149 CC(=O)OCCC1=CC(=CC=C1)N MCULE-1745434310 [1,0,0,0,0,1|2,0,0]=4 549 B13R1.149 CC1=CC(=CC=C1)CNCC(=O)O MCULE-3306898022 [1,0,0,0,0,1|2,0,0]=4 550 B13R1.149 CC1=CC(=CC=C1)CNCC(=O)O MCULE-9278241705 [1,0,0,0,0,1|2,0,0]=4 551 B13R1.149 CC1=CC=CC(=C1)CNCC(C)C MCULE-1614397385 [1,0,0,0,0,1|1,0,1]=4 552 B13R1.149 CC1=CC=CC(=C1)CNCC(C)C MCULE-3053487288 [1,0,0,0,0,1|1,0,1]=4 553 B13R1.3 CC(=O)NCC1=CC=C(C=C1)CCl MCULE-4577805547 [0,0,0,0,1,1|2,0,0]=4 554 B13R1.3 CC(=O)NCC1=CC=C(C=C1)CN MCULE-3064536101 [0,0,0,0,1,1|1,0,0]=3 555 B13R1.3 CCC1=CC=C(C=C1)CNC(=N)N MCULE-5487691063 [0,0,0,0,1,1|2,0,0]=4