0 B15R2.1154 CC1=CC(=C(C=C1)/N=C\2/NCCS2)C MCULE-6282004029 [0,0,0,0,0,0|2,0,1]=3 1 B15R2.1154 CC1=CC(=C(C=C1)NC2=NCCN2)Cl MCULE-6459811464 [0,0,0,0,0,0|0,0,0]=0 2 B15R2.1154 CC1=CC(=CC=C1NC2=NCCS2)F MCULE-4533698966 [0,0,0,0,0,0|3,0,0]=3 3 B15R2.1154 CC1=CC=C(C(=C1)C)NC2=NN=NS2 MCULE-2974961104 [0,0,0,0,0,0|4,0,0]=4 4 B15R2.1154 CC1=CC=C(C(=C1)I)NC2CCCC2 MCULE-3425721383 [0,0,0,0,0,0|2,1,1]=4 5 B15R2.1154 ClC1=C(C=CC(=C1)I)NC2CCCC2 MCULE-5890868146 [0,0,0,0,0,0|3,0,1]=4 6 B15R2.1154 ClC1=CC(=C(C=C1)NC2=NC=NN2)Cl MCULE-7532657739 [0,0,0,0,0,0|2,0,1]=3 7 B15R2.1154 ClC1=CC(=C(C=C1)NC2=NCCS2)Cl MCULE-6686516710 [0,0,0,0,0,0|2,0,0]=2 8 B15R2.1154 ClC1=CC(=CC=C1NC2=NCCS2)Br MCULE-9132859233 [0,0,0,0,0,0|2,0,0]=2 9 B14R2.50 CC1=C(C=CC=C1)NC2=NCCS2 MCULE-8540817027 [1,0,0,0,0,0|2,0,0]=3 10 B14R2.50 ClC1=C(C=CC=C1)CC2=NCCN2 MCULE-3850240814 [1,0,0,0,0,0|1,0,0]=2 11 B14R2.50 ClC1=C(C=CC=C1)CC2CCCN2 MCULE-4724136482 [1,0,0,0,0,0|2,0,1]=4 12 B14R2.50 ClC1=C(C=CC=C1)CC2CCCN2 MCULE-5633665370 [1,0,0,0,0,0|2,0,1]=4 13 B14R2.50 ClC1=C(C=CC=C1)N=C2SCCS2 MCULE-7621614349 [1,0,0,0,0,0|2,0,1]=4 14 B14R2.50 ClC1=C(C=CC=C1)NC2=NC=CS2 MCULE-9187450739 [1,0,0,0,0,0|1,0,2]=4 15 B14R2.72 BrC1=CC=C(C=C1)NC2=NCCC2 MCULE-6197046542 [1,0,0,0,0,0|2,0,0]=3 16 B14R2.72 CC1=CC=C(C=C1)/N=C/2\CCCN2 MCULE-9686734123 [1,0,0,0,0,0|1,0,1]=3 17 B14R2.72 CC1=CC=C(C=C1)CC2CCCN2 MCULE-1402614454 [1,0,0,0,0,0|2,0,1]=4 18 B14R2.72 CC1=CC=C(C=C1)NC2=NCCS2 MCULE-2957764760 [1,0,0,0,0,0|1,0,0]=2 19 B14R2.72 CC1=CC=C(C=C1)NC2=NN=NS2 MCULE-3594003191 [1,0,0,0,0,0|3,0,0]=4 20 B14R2.72 CC1=CC=C(C=C1)OC2=NN=NN2 MCULE-4708822689 [1,0,0,0,0,0|3,0,0]=4 21 B14R2.72 CC1=CC=C(C=C1)SC2=NN=NN2 MCULE-3084851061 [1,0,0,0,0,0|3,0,0]=4 22 B14R2.72 ClC1=CC=C(C=C1)NC2=NCCS2 MCULE-5724738405 [1,0,0,0,0,0|2,0,0]=3 23 B14R2.72 FC1=CC=C(C=C1)NC2=NCCC2 MCULE-8228522527 [1,0,0,0,0,0|2,0,0]=3 24 B16R2.316 CC1=CC(=C(C=C1)NC2=NC(CS2)C)C MCULE-6811953956 [0,1,0,0,0,0|2,0,0]=3 25 B16R2.316 CC1=CC(=CC=C1NC2=NCC(S2)C)Cl MCULE-5296476787 [0,1,0,0,0,0|3,0,0]=4 26 B16R2.316 CC1=CC=C(C(=C1)C)NC2=NCC(S2)C MCULE-9626246797 [0,1,0,0,0,0|2,0,0]=3 27 B16R2.316 CC1CN=C(S1)NC2=C(C=C(C=C2)F)F MCULE-8078829129 [0,1,0,0,0,0|2,1,0]=4 28 B16R2.6175 CC1=CC(=C(C(=C1)C)CC2=NCCN2)C MCULE-3851451102 [0,1,0,0,0,0|2,0,0]=3 29 B16R2.6175 CC1=CC(=C(C(=C1)C)NC2=NCCS2)C MCULE-4664617580 [0,1,0,0,0,0|2,0,0]=3 30 B16R2.6175 ClC1=CC(=CC(=C1N=C2NCCN2)Cl)I MCULE-7771230346 [0,1,0,0,0,0|1,0,2]=4 31 B16R2.6175 ClC1=CC(=CC(=C1N=C2NCCN2)Cl)I MCULE-8997645777 [0,1,0,0,0,0|1,0,2]=4 32 B16R2.6175 NC1=CC(=C(C(=C1)Cl)NC2=NCCN2)Cl MCULE-6259215099 [0,1,0,0,0,0|1,0,0]=2 33 B16R2.6175 NC1=CC(=C(C(=C1)Cl)NC2=NCCN2)Cl MCULE-7993920296 [0,1,0,0,0,0|1,0,0]=2 34 B16R2.6175 OC1=CC(=C(C(=C1)Cl)NC2=NCCN2)Cl MCULE-5144662218 [0,1,0,0,0,0|1,0,0]=2 35 B16R2.6175 OC1=CC(=C(C(=C1)Cl)NC2=NCC[NH2+]2)Cl MCULE-5648908255 [0,1,0,0,0,0|1,0,1]=3 36 B16R2.6917 COC1=CC(=CC=C1NC2=NCCC2)Cl MCULE-6337818517 [0,1,0,0,0,0|3,0,0]=4 37 B16R2.12287 ClC1=CC=C(C(=C1Cl)Cl)/N=C\2/NCCS2 MCULE-9490272822 [0,1,0,0,0,0|2,0,1]=4 38 B16R2.12609 CC1=CC(=C(C=C1)N=C2SCCN2C)C MCULE-1968361117 [0,1,0,0,0,0|2,0,1]=4 39 B16R2.12609 CC1=CC(=C(C=C1)N=C2SCCN2C)C MCULE-9184776081 [0,1,0,0,0,0|2,0,1]=4 40 B14R1.6823 CC1=CC(=C(C=C1)NC(=O)CCN)Cl MCULE-3156636955 [0,0,1,0,0,0|3,0,0]=4 41 B14R1.6823 CC1=CC(=C(C=C1)NC(=O)CCN)Cl MCULE-7340888526 [0,0,1,0,0,0|3,0,0]=4 42 B14R1.6823 CCCC(=O)NC1=C(C=C(C=C1)Br)Cl MCULE-9116558694 [0,0,1,0,0,0|3,0,0]=4 43 B14R1.6823 CCCC(=O)NC1=C(C=C(C=C1)I)Cl MCULE-9631000375 [0,0,1,0,0,0|3,0,0]=4 44 B14R1.6823 CCCC(=O)NC1=C(C=C(C=C1)N)Cl MCULE-7211069291 [0,0,1,0,0,0|3,0,0]=4 45 B14R1.6823 CCCC(=O)NC1=CC=C(C=C1Br)C MCULE-8835665391 [0,0,1,0,0,0|2,1,0]=4 46 B14R1.6823 CCCC(=O)NC1=CC=C(C=C1C)C MCULE-5845981504 [0,0,1,0,0,0|3,0,0]=4 47 B14R1.6823 CCCC(=O)NC1=CC=C(C=C1Cl)Cl MCULE-6779946491 [0,0,1,0,0,0|3,0,0]=4 48 B14R1.6823 CCCC(=O)NC1=CC=C(C=C1N)C MCULE-5079281952 [0,0,1,0,0,0|3,0,0]=4 49 B14R1.6823 CCNC(=O)NC1=C(C=C(C=N1)Cl)Cl MCULE-6163262358 [0,0,1,0,0,0|3,0,0]=4 50 B14R1.6823 CCNC(=S)NC1=C(C=C(C=C1)Br)F MCULE-2337446592 [0,0,1,0,0,0|2,1,0]=4 51 B14R1.6823 CCNC(=S)NC1=C(C=C(C=C1)C)O MCULE-2115762678 [0,0,1,0,0,0|2,0,0]=3 52 B14R1.6823 CCNC(=S)NC1=C(C=C(C=C1)Cl)Cl MCULE-2127268654 [0,0,1,0,0,0|2,0,0]=3 53 B14R1.6823 CCNC(=S)NC1=C(C=C(C=C1)O)C MCULE-2165207588 [0,0,1,0,0,0|3,0,0]=4 54 B14R1.6823 CCNC(=S)NC1=CC=C(C=C1Br)Br MCULE-1571078005 [0,0,1,0,0,0|2,1,0]=4 55 B14R1.6823 CCNC(=S)NC1=CC=C(C=C1C)C MCULE-7221072027 [0,0,1,0,0,0|2,0,0]=3 56 B14R1.6823 CCNC(=S)NC1=CC=C(C=C1C)Cl MCULE-7845137480 [0,0,1,0,0,0|3,0,0]=4 57 B14R1.6823 CCOC(=N)CC1=CC=C(C=C1Cl)Cl MCULE-2280230956 [0,0,1,0,0,0|3,0,0]=4 58 B14R1.6823 CCOC(=N)CC1=CC=C(C=C1Cl)Cl MCULE-4578515055 [0,0,1,0,0,0|3,0,0]=4 59 B14R1.6823 CCOC(=O)NC1=C(C=C(C=C1)C)C MCULE-9559914129 [0,0,1,0,0,0|3,0,0]=4 60 B14R1.6823 CCOC(=O)NC1=CC=C(C=C1Br)C MCULE-6719513308 [0,0,1,0,0,0|2,1,0]=4 61 B14R1.6823 CCOC(=O)NC1=CC=C(C=C1Cl)Cl MCULE-1415002259 [0,0,1,0,0,0|3,0,0]=4 62 B14R1.6932 C/N=C(/NC1=CC=C(C=C1C)C)\SC MCULE-3658072712 [0,0,1,0,0,0|2,0,0]=3 63 B14R1.6932 C/N=C(/NC1=CC=C(C=C1C)C)\SC MCULE-6056367439 [0,0,1,0,0,0|2,0,0]=3 64 B16R3.10840 CC1=CC=C2N=C3NCCC3=CC2=C1 MCULE-2640765196 [0,0,0,1,0,0|2,0,1]=4 65 B14R2.739 CC1=CC(=C(C=C1)C2CCCN2)C MCULE-4566149676 [0,0,0,0,1,0|2,0,1]=4 66 B14R2.739 CC1=CC(=C(C=C1)[C@@H]2CCCN2)C MCULE-2758987367 [0,0,0,0,1,0|2,0,1]=4 67 B14R2.739 CC1=CC(=C(C=C1)[C@@H]2CCCN2)C MCULE-8537186293 [0,0,0,0,1,0|2,0,1]=4 68 B14R2.739 CC1=CC(=C(C=C1)[C@@H]2CCCN2)F MCULE-2646348011 [0,0,0,0,1,0|1,1,1]=4 69 B14R2.739 CC1=CC(=C(C=C1)[C@@H]2CCCN2)O MCULE-5938857756 [0,0,0,0,1,0|2,0,1]=4 70 B14R2.739 CC1=CC(=C(C=C1)[C@@H]2CCCN2)O MCULE-9911319164 [0,0,0,0,1,0|2,0,1]=4 71 B14R2.739 CC1=CC(=C(C=C1)[C@H]2CCCN2)C MCULE-4267873751 [0,0,0,0,1,0|2,0,1]=4 72 B14R2.739 CC1=CC(=C(C=C1)[C@H]2CCCN2)C MCULE-7364645309 [0,0,0,0,1,0|2,0,1]=4 73 B14R2.739 CC1=CC(=C(C=C1)[C@H]2CCCN2)F MCULE-8330074713 [0,0,0,0,1,0|1,1,1]=4 74 B14R2.739 CC1=CC(=C(C=C1)[C@H]2CCCN2)O MCULE-1167158597 [0,0,0,0,1,0|2,0,1]=4 75 B14R2.739 CC1=CC(=C(C=C1)[C@H]2CCCN2)O MCULE-5046397943 [0,0,0,0,1,0|2,0,1]=4 76 B14R2.739 CC1=CC=C(C(=C1)Br)C2=NN=NN2 MCULE-9509340595 [0,0,0,0,1,0|2,1,0]=4 77 B14R2.739 CC1=CC=C(C(=C1)Br)[C@@H]2CCCN2 MCULE-4455318177 [0,0,0,0,1,0|1,1,1]=4 78 B14R2.739 CC1=CC=C(C(=C1)Br)[C@@H]2CCCN2 MCULE-4722159009 [0,0,0,0,1,0|1,1,1]=4 79 B14R2.739 CC1=CC=C(C(=C1)Br)[C@H]2CCCN2 MCULE-2328338181 [0,0,0,0,1,0|1,1,1]=4 80 B14R2.739 CC1=CC=C(C(=C1)Br)[C@H]2CCCN2 MCULE-2760802823 [0,0,0,0,1,0|1,1,1]=4 81 B14R2.739 CC1=CC=C(C(=C1)Cl)[C@H]2CCCN2 MCULE-2490322659 [0,0,0,0,1,0|1,0,1]=3 82 B14R2.739 CC1=CC=C(C(=C1)Cl)[C@H]2CCCN2 MCULE-3650806995 [0,0,0,0,1,0|1,0,1]=3 83 B14R2.739 CC1=CC=C(C(=C1)Cl)[C@H]2CCCN2 MCULE-9202282924 [0,0,0,0,1,0|1,0,1]=3 84 B14R2.739 CC1=CC=C(C(=C1)Cl)[C@H]2CCCN2 MCULE-9688698935 [0,0,0,0,1,0|1,0,1]=3 85 B14R2.739 CC1=CC=C(C(=C1)F)[C@@H]2CCCN2 MCULE-9637495125 [0,0,0,0,1,0|1,1,1]=4 86 B14R2.739 CC1=CC=C(C(=C1)F)[C@H]2CCCN2 MCULE-6513630153 [0,0,0,0,1,0|1,1,1]=4 87 B14R2.739 CC1=CC=C(C(=C1)O)C2=NCCN2 MCULE-3227973301 [0,0,0,0,1,0|1,0,0]=2 88 B14R2.739 ClC1=C(C=CC(=C1)Br)C2CCCN2 MCULE-6811552328 [0,0,0,0,1,0|2,0,1]=4 89 B14R2.739 ClC1=C(C=CC(=C1)Br)C2CCCN2 MCULE-8293068512 [0,0,0,0,1,0|2,0,1]=4 90 B14R2.739 ClC1=CC(=C(C=C1)C2CCCN2)Cl MCULE-2853463001 [0,0,0,0,1,0|2,0,1]=4 91 B14R2.739 ClC1=CC(=C(C=C1)C2CCCN2)Cl MCULE-4635859614 [0,0,0,0,1,0|2,0,1]=4 92 B14R2.739 ClC1=CC(=C(C=C1)[C@@H]2CCCN2)Cl MCULE-1201871665 [0,0,0,0,1,0|2,0,1]=4 93 B14R2.739 ClC1=CC(=C(C=C1)[C@@H]2CCCN2)Cl MCULE-1426863004 [0,0,0,0,1,0|2,0,1]=4 94 B14R2.739 ClC1=CC(=C(C=C1)[C@@H]2CCCN2)Cl MCULE-9187893094 [0,0,0,0,1,0|2,0,1]=4 95 B14R2.739 ClC1=CC(=C(C=C1)[C@H]2CCCN2)Cl MCULE-7015323820 [0,0,0,0,1,0|2,0,1]=4 96 B14R2.739 ClC1=CC(=C(C=C1)[C@H]2CCCN2)Cl MCULE-8289692547 [0,0,0,0,1,0|2,0,1]=4 97 B14R2.739 ClC1=CC(=C(C=C1)[C@H]2CCCN2)Cl MCULE-8574074464 [0,0,0,0,1,0|2,0,1]=4 98 B14R2.739 ClC1=CC(=CC=C1[C@@H]2CCCN2)Br MCULE-5361368691 [0,0,0,0,1,0|2,0,1]=4 99 B14R2.739 ClC1=CC(=CC=C1[C@@H]2CCCN2)Br MCULE-8824227919 [0,0,0,0,1,0|2,0,1]=4 100 B14R2.739 ClC1=CC(=CC=C1[C@H]2CCCN2)Br MCULE-2273762931 [0,0,0,0,1,0|2,0,1]=4 101 B14R2.739 ClC1=CC(=CC=C1[C@H]2CCCN2)Br MCULE-5335477031 [0,0,0,0,1,0|2,0,1]=4 102 B14R2.739 ClC1=CC=C(C(=C1)Cl)C2=NC=CN2 MCULE-3271826607 [0,0,0,0,1,0|1,0,2]=4 103 B14R2.739 ClC1=CC=C(C(=C1)Cl)C2=NN=NN2 MCULE-2653780355 [0,0,0,0,1,0|3,0,0]=4 104 B14R2.739 ClC1=CC=C(C(=C1)Cl)C2NCCS2 MCULE-9208153931 [0,0,0,0,1,0|2,0,1]=4 105 B14R2.739 ClC1=NC=C(C(=N1)Cl)C2=NCCN2 MCULE-3520764124 [0,0,0,0,1,0|3,0,0]=4 106 B14R2.739 FC1=CC(=C(C=C1)[C@@H]2CCCN2)Cl MCULE-6603954632 [0,0,0,0,1,0|2,0,1]=4 107 B14R2.739 FC1=CC(=C(C=C1)[C@H]2CCCN2)Cl MCULE-4950235113 [0,0,0,0,1,0|2,0,1]=4 108 B14R2.739 FC1=CC=C(C(=C1)Cl)[C@@H]2CCCN2 MCULE-9682969658 [0,0,0,0,1,0|2,0,1]=4 109 B14R2.739 FC1=CC=C(C(=C1)Cl)[C@H]2CCCN2 MCULE-1106227011 [0,0,0,0,1,0|2,0,1]=4 110 B14R2.739 FC1=CC=C(C(=C1)Cl)[C@H]2CCCN2 MCULE-4217960373 [0,0,0,0,1,0|2,0,1]=4 111 B14R2.739 FC1=CC=C(C(=C1)Cl)[C@H]2CCCN2 MCULE-6617247576 [0,0,0,0,1,0|2,0,1]=4 112 B14R2.739 NC1=C(C=CC(=C1)Br)C2=NCCO2 MCULE-6585721048 [0,0,0,0,1,0|3,0,0]=4 113 B14R2.739 NC1=CC(=CC=C1C2=NCCN2)Cl MCULE-6934681728 [0,0,0,0,1,0|2,0,0]=3 114 B14R2.30090 CC1=CC(=C(C=C1)NC2CCC2)Br MCULE-1947324137 [0,0,0,0,1,0|1,1,1]=4 115 B14R2.30090 CC1=CC=C(C(=C1)I)NC2CCC2 MCULE-7720977903 [0,0,0,0,1,0|1,1,1]=4 116 B14R2.30090 ClC1=C(C=CC(=C1)Br)NC2CCC2 MCULE-8288902993 [0,0,0,0,1,0|2,0,1]=4 117 B14R2.30090 ClC1=CC(=CC=C1NC2CCC2)I MCULE-3449756892 [0,0,0,0,1,0|2,0,1]=4 118 B16R2.312 CC1=CC(=C(C=C1)OC2CCCNC2)Cl MCULE-8833458526 [0,0,0,0,0,1|2,0,1]=4 119 B16R2.312 CC1=CC=C(C(=C1)C)NC2=NCCCS2 MCULE-2060371538 [0,0,0,0,0,1|2,0,0]=3 120 B16R2.312 CC1=CC=C(C(=C1)Cl)OC2CCCNC2 MCULE-2447683414 [0,0,0,0,0,1|2,0,1]=4 121 B16R2.3000 CC1=CC(=C(C=C1)NCC2CCCN2)Br MCULE-1272537378 [0,0,0,0,0,1|1,1,1]=4 122 B16R2.3000 CC1=CC(=C(C=C1)NCC2CCCN2)Br MCULE-7478210669 [0,0,0,0,0,1|1,1,1]=4 123 B16R2.3000 CC1=CC(=C(C=C1)NCC2CCCN2)C MCULE-8871225034 [0,0,0,0,0,1|2,0,1]=4 124 B16R2.3000 CC1=CC(=C(C=C1)NCC2CCCN2)C MCULE-9331439881 [0,0,0,0,0,1|2,0,1]=4 125 B16R2.3000 ClC1=CC(=C(C=C1)CSC2=NCCS2)Cl MCULE-1557850443 [0,0,0,0,0,1|3,0,0]=4 126 B16R2.3000 ClC1=CC(=C(C=C1)NCC2CCCN2)Cl MCULE-1792546969 [0,0,0,0,0,1|2,0,1]=4 127 B16R2.3000 ClC1=CC(=C(C=C1)NCC2CCCN2)Cl MCULE-5202970764 [0,0,0,0,0,1|2,0,1]=4 128 B16R2.3000 ClC1=CC=C(C(=C1)Cl)CNC2=NC=NN2 MCULE-1397995098 [0,0,0,0,0,1|2,0,1]=4 129 B16R2.3000 ClC1=CC=C(C(=C1)Cl)CSC2=NCCN2 MCULE-2943858059 [0,0,0,0,0,1|2,0,0]=3 130 B16R2.3000 ClC1=CC=C(C(=C1)Cl)CSC2=NCCN2 MCULE-8506256702 [0,0,0,0,0,1|2,0,0]=3 131 B16R2.3000 FC1=CC=C(C(=C1)F)CNC2=NCCN2 MCULE-5034835939 [0,0,0,0,0,1|1,1,0]=3 132 B13R1.19 CCCC(=O)NC1=CC=C(C=C1)C MCULE-2570138353 [1,0,1,0,0,0|2,0,0]=4 133 B13R1.19 CCNC(=O)CC1=CC=C(C=C1)C MCULE-3017151568 [1,0,1,0,0,0|2,0,0]=4 134 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)Br MCULE-9035153738 [1,0,1,0,0,0|2,0,0]=4 135 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)C MCULE-7907642319 [1,0,1,0,0,0|1,0,0]=3 136 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)I MCULE-9415666245 [1,0,1,0,0,0|2,0,0]=4 137 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)N MCULE-7866771736 [1,0,1,0,0,0|2,0,0]=4 138 B13R1.19 CCNC(=O)NC1=CC=C(C=C1)O MCULE-6608720826 [1,0,1,0,0,0|2,0,0]=4 139 B13R1.19 CCNC(=O)OC1=CC=C(C=C1)C MCULE-3414253151 [1,0,1,0,0,0|2,0,0]=4 140 B13R1.19 CCNC(=S)NC1=CC=C(C=C1)Br MCULE-1750369242 [1,0,1,0,0,0|2,0,0]=4 141 B13R1.19 CCNC(=S)NC1=CC=C(C=C1)C MCULE-6344166496 [1,0,1,0,0,0|1,0,0]=3 142 B13R1.19 CCNC(=S)NC1=CC=C(C=C1)Cl MCULE-4208246380 [1,0,1,0,0,0|2,0,0]=4 143 B13R1.19 CCNC(=S)NC1=CC=C(C=C1)F MCULE-7738149278 [1,0,1,0,0,0|2,0,0]=4 144 B13R1.19 CCNC(=S)NC1=CC=C(C=C1)I MCULE-8329608743 [1,0,1,0,0,0|2,0,0]=4 145 B13R1.19 CCNC(=S)NC1=CC=C(C=C1)S MCULE-5394027361 [1,0,1,0,0,0|2,0,0]=4 146 B13R1.19 CCOC(=N)CC1=CC=C(C=C1)C MCULE-4745731072 [1,0,1,0,0,0|2,0,0]=4 147 B13R1.19 CCOC(=N)CC1=CC=C(C=C1)C MCULE-5336568213 [1,0,1,0,0,0|2,0,0]=4 148 B13R1.19 CCOC(=O)NC1=CC=C(C=C1)C MCULE-5153870310 [1,0,1,0,0,0|2,0,0]=4 149 B13R1.19 CCOC(=S)NC1=CC=C(C=C1)C MCULE-3244518689 [1,0,1,0,0,0|2,0,0]=4 150 B13R1.19 CCSC(=N)NC1=CC=C(C=C1)O MCULE-6923583458 [1,0,1,0,0,0|2,0,0]=4 151 B13R1.19 CCSC(=N)NC1=CC=C(C=C1)O MCULE-9507709655 [1,0,1,0,0,0|2,0,0]=4 152 B13R1.470 CCCC(=O)NC1=CC=CC=C1Cl MCULE-5861170772 [1,0,1,0,0,0|2,0,0]=4 153 B13R1.470 CCNC(=O)NC1=CC=CC=C1S MCULE-5359744823 [1,0,1,0,0,0|2,0,0]=4 154 B13R1.470 CCNC(=S)NC1=C(C=CC=C1)Cl MCULE-2426293957 [1,0,1,0,0,0|1,0,0]=3 155 B13R1.470 CCNC(=S)NC1=C(C=CC=C1)F MCULE-8867316191 [1,0,1,0,0,0|1,1,0]=4 156 B13R1.470 CCNC(=S)NC1=C(C=CC=C1)N MCULE-2899549204 [1,0,1,0,0,0|2,0,0]=4 157 B13R1.470 CCNC(=S)NC1=CC=CC=C1Br MCULE-9759155954 [1,0,1,0,0,0|1,1,0]=4 158 B13R1.470 CCNC(=S)NC1=CC=CC=C1C MCULE-7066210812 [1,0,1,0,0,0|2,0,0]=4 159 B13R1.470 CCOC(=N)CC1=C(C=CC=C1)Cl MCULE-8432075846 [1,0,1,0,0,0|2,0,0]=4 160 B13R1.470 CCOC(=N)CC1=CC=CC=C1Cl MCULE-5389626807 [1,0,1,0,0,0|2,0,0]=4 161 B13R1.470 CCOC(=O)NC1=CC=CC=C1Cl MCULE-6804122956 [1,0,1,0,0,0|2,0,0]=4 162 B13R1.2679 CC1=CC(=C(C=C1)NC(=O)CN)Cl MCULE-5320588243 [1,0,1,0,0,0|2,0,0]=4 163 B13R1.2679 CC1=CC(=C(C=C1)NC(=O)CN)Cl MCULE-8913793739 [1,0,1,0,0,0|2,0,0]=4 164 B13R1.2679 CC1=CC(=C(C=C1)NC(=O)CO)Cl MCULE-9655240751 [1,0,1,0,0,0|2,0,0]=4 165 B13R1.2679 CC1=CC(=C(C=C1)NC(=O)NN)Cl MCULE-5015670432 [1,0,1,0,0,0|2,0,0]=4 166 B13R1.2679 CC1=CC=C(C(=C1)Cl)NC(=O)CBr MCULE-8344205458 [1,0,1,0,0,0|2,0,0]=4 167 B13R1.2679 CC1=CC=C(C(=C1)Cl)NC(=O)CCl MCULE-3191016817 [1,0,1,0,0,0|2,0,0]=4 168 B13R1.2679 CC1=CC=C(C(=C1)Cl)NC(=S)NN MCULE-6675383996 [1,0,1,0,0,0|2,0,0]=4 169 B13R1.2679 CCC(=O)NC1=C(C=C(C=C1)C)C MCULE-3026969722 [1,0,1,0,0,0|2,0,0]=4 170 B13R1.2679 CCC(=O)NC1=C(C=C(C=C1)Cl)Cl MCULE-2595523890 [1,0,1,0,0,0|2,0,0]=4 171 B13R1.2679 CCC(=O)NC1=C(C=C(C=C1)I)Cl MCULE-3325640936 [1,0,1,0,0,0|2,0,0]=4 172 B13R1.2679 CCC(=O)NC1=C(C=C(C=C1)N)Cl MCULE-7339020474 [1,0,1,0,0,0|2,0,0]=4 173 B13R1.2679 CCC(=O)NC1=CC=C(C=C1Br)C MCULE-2455954387 [1,0,1,0,0,0|1,1,0]=4 174 B13R1.2679 CCC(=O)NC1=CC=C(C=C1N)C MCULE-8082223717 [1,0,1,0,0,0|2,0,0]=4 175 B13R1.2679 CNC(=O)NC1=C(C=C(C=C1)F)Cl MCULE-3729008286 [1,0,1,0,0,0|2,0,0]=4 176 B13R1.2679 CNC(=S)NC1=CC=C(C=C1C)C MCULE-1793113903 [1,0,1,0,0,0|2,0,0]=4 177 B13R1.2679 CNC(=S)NC1=CC=C(C=C1Cl)Br MCULE-8840022479 [1,0,1,0,0,0|2,0,0]=4 178 B13R1.2679 CNC(=S)NC1=CC=C(C=C1Cl)Cl MCULE-9013170665 [1,0,1,0,0,0|2,0,0]=4 179 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 MCULE-5694308124 [2,0,0,0,0,0|1,0,0]=3 180 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 MCULE-8393678793 [2,0,0,0,0,0|1,0,0]=3 181 B13R2.64 C1=CC=C(C=C1)N=C2NCCN2 MCULE-9797207863 [2,0,0,0,0,0|0,0,2]=4 182 B13R2.64 C1=CC=C(C=C1)NC2=NC=NN2 MCULE-5005365444 [2,0,0,0,0,0|1,0,1]=4 183 B13R2.64 C1=CC=C(C=C1)NC2=NCCC2 MCULE-2683231905 [2,0,0,0,0,0|1,0,0]=3 184 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 MCULE-2196574986 [2,0,0,0,0,0|1,0,0]=3 185 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 MCULE-3861281239 [2,0,0,0,0,0|1,0,0]=3 186 B13R2.64 C1=CN=C(C=N1)NC2=NCCN2 MCULE-1693334469 [2,0,0,0,0,0|2,0,0]=4 187 B15R1.5927 CC1=CC(=C(C=C1)NC(=O)NCCCl)C MCULE-5555139421 [0,1,1,0,0,0|2,0,0]=4 188 B15R1.5927 CC1=CC(=C(C=C1)NC(=S)NCCO)C MCULE-1782700558 [0,1,1,0,0,0|2,0,0]=4 189 B15R1.5927 CCCNC(=S)NC1=C(C=C(C=C1)C)C MCULE-1488191616 [0,1,1,0,0,0|2,0,0]=4 190 B15R1.5927 CCCNC(=S)NC1=C(C=C(C=C1)Cl)Cl MCULE-7860217200 [0,1,1,0,0,0|2,0,0]=4 191 B15R1.5927 OCCNC(=S)NC1=CC=C(C=C1Cl)Cl MCULE-2839685253 [0,1,1,0,0,0|2,0,0]=4 192 B15R1.5927 S=C(NCCBr)NC1=CC=C(C=C1Cl)Cl MCULE-2719896398 [0,1,1,0,0,0|2,0,0]=4 193 B15R1.8426 CC(C)NC(=O)NC1=C(C=C(C=C1)Br)Cl MCULE-8662276035 [0,1,1,0,0,0|2,0,0]=4 194 B15R1.37637 CCNC(=S)NC1=C(C=C(C=C1C)C)C MCULE-7074060593 [0,1,1,0,0,0|2,0,0]=4 195 B15R1.37637 CCOC(=O)NC1=C(C=C(C=C1Cl)C)C MCULE-9260537937 [0,1,1,0,0,0|2,0,0]=4 196 B15R1.30756 C/N=C(/NC1=C(C=C(C(=C1)C)C)C)\SC MCULE-4202773981 [0,1,1,0,0,0|2,0,0]=4 197 B15R1.30756 C/N=C(/NC1=C(C=C(C(=C1)C)C)C)\SC MCULE-6052611398 [0,1,1,0,0,0|2,0,0]=4 198 B15R1.30756 C/N=C(\NN)/NC1=CC(=C(C=C1C)C)C MCULE-6721556227 [0,1,1,0,0,0|2,0,0]=4 199 B15R1.30756 C/N=C(\NN)/NC1=CC(=C(C=C1C)C)C MCULE-6781209771 [0,1,1,0,0,0|2,0,0]=4 200 B15R2.123 COC1=C(C=CC=C1)NC2=NCCS2 MCULE-2389957159 [1,1,0,0,0,0|2,0,0]=4 201 B15R2.305 CC1=CC=CC=C1NC2=NCC(S2)C MCULE-5317462462 [1,1,0,0,0,0|2,0,0]=4 202 B15R2.305 CC1CN=C(S1)NC2=CC=CC=C2F MCULE-6154991103 [1,1,0,0,0,0|1,1,0]=4 203 B15R2.305 CC1CN=C(S1)NC2=CC=CC=C2N MCULE-5625485910 [1,1,0,0,0,0|2,0,0]=4 204 B15R2.1109 CC1=C(C=CC=C1Cl)NC2=NCCS2 MCULE-5296629079 [1,1,0,0,0,0|2,0,0]=4 205 B15R2.1109 ClC1=C(C(=CC=C1)NC2=NCCS2)Cl MCULE-6058429443 [1,1,0,0,0,0|1,0,0]=3 206 B15R2.7567 CC1=C(C=C(C=C1)F)NC2=NCCN2 MCULE-9903645250 [1,1,0,0,0,0|1,0,0]=3 207 B15R2.7567 CC1=CC=C(C(=C1)NC2=NCCS2)C MCULE-3040953042 [1,1,0,0,0,0|2,0,0]=4 208 B15R2.15371 CC1=CC=CC(=C1NC2=NCCN2)C MCULE-8658291527 [1,1,0,0,0,0|1,0,0]=3 209 B15R2.15371 CC1=CC=CC(=C1NC2=NCCS2)C MCULE-3990484846 [1,1,0,0,0,0|2,0,0]=4 210 B15R2.15371 ClC1=CC=CC(=C1/N=C/2\CCCN2)Cl MCULE-2738885996 [1,1,0,0,0,0|1,0,1]=4 211 B15R2.15371 ClC1=CC=CC(=C1/N=C\2/NCCS2)Cl MCULE-9783526202 [1,1,0,0,0,0|1,0,1]=4 212 B15R2.15371 ClC1=CC=CC(=C1NC2=NCCN2)Cl MCULE-5017779690 [1,1,0,0,0,0|0,0,0]=2 213 B15R2.15371 ClC1=CC=CC(=C1NC2=NCCN2)Cl MCULE-6555265624 [1,1,0,0,0,0|0,0,0]=2 214 B15R2.15371 ClC1=CC=CC(=C1NC2=NCCN2)Cl MCULE-9274594116 [1,1,0,0,0,0|0,0,0]=2 215 B15R2.15371 FC1=C(C(=CC=C1)Br)NC2=NCCN2 MCULE-3049261530 [1,1,0,0,0,0|0,1,0]=3 216 B15R2.15371 FC1=C(C(=CC=C1)Br)NC2=NCCN2 MCULE-7640826371 [1,1,0,0,0,0|0,1,0]=3 217 B15R2.34 COC1=CC=C(C=C1)CC2=NCCN2 MCULE-4904609239 [1,1,0,0,0,0|1,0,0]=3 218 B15R2.34 COC1=CC=C(C=C1)NC2=NCCC2 MCULE-3281274661 [1,1,0,0,0,0|1,0,0]=3 219 B15R2.34 COC1=CC=C(C=C1)NC2=NCCS2 MCULE-2671042292 [1,1,0,0,0,0|1,0,0]=3 220 B15R2.92 CC1=C(C=C(C=C1)/N=C/2\NCCS2)Cl MCULE-6960040652 [1,1,0,0,0,0|1,0,1]=4 221 B15R2.92 CC1=C(C=C(C=C1)/N=C\2/NCCS2)C MCULE-8142794178 [1,1,0,0,0,0|1,0,1]=4 222 B15R2.92 CC1=C(C=C(C=C1)/N=C\2/NCCS2)F MCULE-6473135796 [1,1,0,0,0,0|1,0,1]=4 223 B15R2.92 CC1=CC=C(C=C1Cl)NC2=NCCC2 MCULE-9433801209 [1,1,0,0,0,0|1,0,0]=3 224 B15R2.92 ClC1=C(C=C(C=C1)NC2=NCCC2)Cl MCULE-9071412928 [1,1,0,0,0,0|2,0,0]=4 225 B15R2.92 ClC1=C(C=C(C=C1)NC2=NCCS2)Cl MCULE-3163217433 [1,1,0,0,0,0|2,0,0]=4 226 B15R2.92 FC1=C(C=C(C=C1)NC2=NCCS2)Cl MCULE-8175077678 [1,1,0,0,0,0|2,0,0]=4 227 B15R2.98 CC1=CC=C(C=C1)NC2=NC(=O)CS2 MCULE-2865982597 [1,1,0,0,0,0|1,0,1]=4 228 B15R2.98 CC1=CC=C(C=C1)NC2=NCC(S2)C MCULE-1303150634 [1,1,0,0,0,0|1,0,0]=3 229 B15R2.98 CC1CN=C(S1)NC2=CC=C(C=C2)Cl MCULE-5992946380 [1,1,0,0,0,0|2,0,0]=4 230 B15R2.98 CC1CN=C(S1)NC2=CC=C(C=C2)O MCULE-8164174697 [1,1,0,0,0,0|2,0,0]=4 231 B15R2.15650 CC1=CC(=C(C=C1)NC2CCC2O)Cl MCULE-8166906538 [0,1,0,0,1,0|1,0,1]=4 232 B17R2.2360 CC1=CC(=C(C(=C1)C)NC2=NCCCS2)C MCULE-4633899564 [0,1,0,0,0,1|2,0,0]=4 233 B17R2.2360 CC1=CC(=C(C(=C1)C)NC2=NCCCS2)C MCULE-9564025630 [0,1,0,0,0,1|2,0,0]=4 234 B17R2.3478 CC1=CC(=C(C=C1)C(=O)NC2=NCCS2)Cl MCULE-2346506404 [0,1,0,0,0,1|1,0,0]=3 235 B17R2.3478 CC1=CC=C(C(=C1)Cl)C(=O)NC2=NN=CN2 MCULE-9130366694 [0,1,0,0,0,1|1,0,1]=4 236 B17R2.3478 O=C(NC1=NCCS1)C2=CC=C(C=C2Cl)F MCULE-3190110516 [0,1,0,0,0,1|2,0,0]=4 237 B17R2.5361 CC1=CC(=C(C=C1)NC(=O)C2CCCN2)Cl MCULE-3472359718 [0,1,0,0,0,1|1,0,1]=4 238 B17R2.5361 CC1=CC=C(C(=C1)C)NC(=O)C2=NCCN2 MCULE-3633399317 [0,1,0,0,0,1|1,0,0]=3 239 B17R2.5412 COC1=C(C(=NC(=N1)C)Cl)NC2=NCCN2 MCULE-2966988794 [0,2,0,0,0,0|2,0,0]=4 240 B15R2.346 CC1=CC2=C(C=C1)NC(=N2)CCCN MCULE-8971714240 [0,0,1,1,0,0|2,0,0]=4 241 B15R2.346 CC1=CC2=C(C=C1)NC(=N2)NCCCl MCULE-1304832773 [0,0,1,1,0,0|2,0,0]=4 242 B15R2.346 CC1=CC2=C(C=C1)NC(=N2)NCCO MCULE-6613138947 [0,0,1,1,0,0|2,0,0]=4 243 B15R2.346 CC1=CC=C2NC(=NC2=C1)CCCN MCULE-6001302140 [0,0,1,1,0,0|2,0,0]=4 244 B15R2.346 CC1=CC=C2NC(=NC2=C1)NCCCl MCULE-6799707323 [0,0,1,1,0,0|2,0,0]=4 245 B15R2.10368 CC1=CC2=C(NC=C2CCN)C(=C1)Br MCULE-1116509647 [0,0,1,1,0,0|1,1,0]=4 246 B15R2.10368 CC1=CC2=C(NC=C2CCN)C(=C1)Br MCULE-2148236912 [0,0,1,1,0,0|1,1,0]=4 247 B15R2.10368 NCCC1=CNC2=C1C=C(C=C2Cl)Cl MCULE-2589956192 [0,0,1,1,0,0|2,0,0]=4 248 B15R2.10368 NCCC1=CNC2=C1C=C(C=C2Cl)Cl MCULE-4157329268 [0,0,1,1,0,0|2,0,0]=4 249 B15R2.6580 CCN1C(=N)SC2=C1C=C(C=C2C)C MCULE-5633546640 [0,0,1,1,0,0|2,0,0]=4 250 B15R2.6580 CCN1C(=N)SC2=C1C=C(C=C2C)C MCULE-9250151341 [0,0,1,1,0,0|2,0,0]=4 251 B15R3.10591 CC1=CC=C2NC3=C(C2=C1)CCC3 MCULE-1478919226 [1,0,0,1,0,0|2,0,0]=4 252 B15R3.10591 NC1=CC=C2SC3=NCCN3C2=C1 MCULE-5308285072 [1,0,0,1,0,0|2,0,0]=4 253 B15R3.10591 OC1=CC=C2SC3=NCCN3C2=C1 MCULE-6549369568 [1,0,0,1,0,0|2,0,0]=4 254 B15R3.10591 OC1=CC=C2SC3=NCCN3C2=C1 MCULE-8058871284 [1,0,0,1,0,0|2,0,0]=4 255 B13R1.1511 CCCC(=O)C1=CC=C(C=C1Cl)C MCULE-2132967033 [0,0,1,0,1,0|2,0,0]=4 256 B13R1.1511 CCCC(N)C1=CC=C(C=C1Cl)C MCULE-2512395503 [0,0,1,0,1,0|1,0,1]=4 257 B13R1.1511 CCCC(N)C1=CC=C(C=C1Cl)C MCULE-3253638657 [0,0,1,0,1,0|1,0,1]=4 258 B13R1.1511 CCNC(=O)C1=C(C=C(C=C1)Br)Cl MCULE-6957176662 [0,0,1,0,1,0|2,0,0]=4 259 B13R1.1511 CCNC(=O)C1=C(C=C(C=C1)C)C MCULE-6596162938 [0,0,1,0,1,0|2,0,0]=4 260 B13R1.1511 CCNC(=O)C1=C(C=C(C=C1)C)Cl MCULE-9047342060 [0,0,1,0,1,0|1,0,0]=3 261 B13R1.1511 CCNC(=O)C1=C(C=C(C=C1)Cl)Cl MCULE-4126184344 [0,0,1,0,1,0|2,0,0]=4 262 B13R1.1511 CCNC(=O)C1=C(C=C(C=C1)N)Cl MCULE-7994143764 [0,0,1,0,1,0|2,0,0]=4 263 B13R1.1511 CCNC(=O)C1=C(C=C(C=C1)N)Cl MCULE-9340272401 [0,0,1,0,1,0|2,0,0]=4 264 B13R1.1511 CCNC(=O)C1=CC=C(C=C1Cl)F MCULE-6858549710 [0,0,1,0,1,0|2,0,0]=4 265 B13R1.1511 CCOC(=O)C1=CC=C(C=C1Cl)C MCULE-8146662617 [0,0,1,0,1,0|2,0,0]=4 266 B13R2.18 ClC1=C(C=CC=C1)C2=NC=CN2 MCULE-1835797277 [1,0,0,0,1,0|0,0,2]=4 267 B13R2.18 ClC1=C(C=CC=C1)C2=NC=NN2 MCULE-6790188009 [1,0,0,0,1,0|1,0,1]=4 268 B13R2.18 ClC1=C(C=CC=C1)C2CCCN2 MCULE-3724263411 [1,0,0,0,1,0|1,0,1]=4 269 B13R2.18 ClC1=C(C=CC=C1)C2CCCN2 MCULE-6584975327 [1,0,0,0,1,0|1,0,1]=4 270 B13R2.18 ClC1=C(C=CC=C1)C2NCCS2 MCULE-4650449561 [1,0,0,0,1,0|1,0,1]=4 271 B13R2.18 ClC1=C(C=CC=C1)[C@@H]2CCCN2 MCULE-2979993370 [1,0,0,0,1,0|1,0,1]=4 272 B13R2.18 ClC1=C(C=CC=C1)[C@@H]2CCCN2 MCULE-6723968682 [1,0,0,0,1,0|1,0,1]=4 273 B13R2.18 ClC1=C(C=CC=C1)[C@H]2CCCN2 MCULE-3589668454 [1,0,0,0,1,0|1,0,1]=4 274 B13R2.18 ClC1=C(C=CC=C1)[C@H]2CCCN2 MCULE-3662820025 [1,0,0,0,1,0|1,0,1]=4 275 B13R2.18 ClC1=CC=CC=C1C2=NCCC2 MCULE-3031729590 [1,0,0,0,1,0|1,0,0]=3 276 B13R2.18 ClC1=CC=CC=C1C2=NCCN2 MCULE-2498957323 [1,0,0,0,1,0|0,0,0]=2 277 B13R2.18 ClC1=CC=CC=C1C2=NN=NN2 MCULE-4562921829 [1,0,0,0,1,0|2,0,0]=4 278 B13R2.18 ClC1=CC=CC=C1C2CCCN2 MCULE-2272753492 [1,0,0,0,1,0|1,0,1]=4 279 B13R2.18 ClC1=CC=CC=C1C2CCCN2 MCULE-6920081444 [1,0,0,0,1,0|1,0,1]=4 280 B13R2.18 ClC1=CC=CC=C1[C@@H]2CCCN2 MCULE-2597349134 [1,0,0,0,1,0|1,0,1]=4 281 B13R2.18 ClC1=CC=CC=C1[C@@H]2CCCN2 MCULE-4660036755 [1,0,0,0,1,0|1,0,1]=4 282 B13R2.18 ClC1=CC=CC=C1[C@H]2CCCN2 MCULE-5250799839 [1,0,0,0,1,0|1,0,1]=4 283 B13R2.18 ClC1=CC=CC=C1[C@H]2CCCN2 MCULE-6878375839 [1,0,0,0,1,0|1,0,1]=4 284 B13R2.18 NC1=C(C=CC=C1)C2=NCCO2 MCULE-9944374168 [1,0,0,0,1,0|2,0,0]=4 285 B13R2.18 NC1=CC=CC=C1C2=NCCC2 MCULE-9506917466 [1,0,0,0,1,0|2,0,0]=4 286 B13R2.18 NC1=CC=CC=C1C2=NCCN2 MCULE-6323057414 [1,0,0,0,1,0|1,0,0]=3 287 B13R2.18 OC1=C(C=CC=C1)C2=NCCN2 MCULE-4287982613 [1,0,0,0,1,0|1,0,0]=3 288 B13R2.18 OC1=C(C=CC=C1)C2=NCCO2 MCULE-6985220561 [1,0,0,0,1,0|2,0,0]=4 289 B13R2.18 SC1=CC=CC=C1C2=NCCN2 MCULE-3135658309 [1,0,0,0,1,0|1,0,0]=3 290 B13R2.18 [NH2+]1CCN=C1C2=C(C=CC=C2)O MCULE-2889400573 [1,0,0,0,1,0|1,0,1]=4 291 B13R2.12 BrC1=CC=C(C=C1)C2=NCCC2 MCULE-1031914668 [1,0,0,0,1,0|2,0,0]=4 292 B13R2.12 BrC1=CC=C(C=C1)C2=NCCN2 MCULE-4303404374 [1,0,0,0,1,0|1,0,0]=3 293 B13R2.12 BrC1=CC=C(C=C1)C2=NCCN2 MCULE-9992700560 [1,0,0,0,1,0|1,0,0]=3 294 B13R2.12 BrC1=CC=C(C=C1)C2=NCCO2 MCULE-4379947855 [1,0,0,0,1,0|2,0,0]=4 295 B13R2.12 BrC1=CC=C(C=C1)C2=NCCS2 MCULE-5025873078 [1,0,0,0,1,0|2,0,0]=4 296 B13R2.12 CC1=CC=C(C=C1)C2=NC=CN2 MCULE-5507938532 [1,0,0,0,1,0|0,0,2]=4 297 B13R2.12 CC1=CC=C(C=C1)C2=NCCN2 MCULE-6075044609 [1,0,0,0,1,0|0,0,0]=2 298 B13R2.12 CC1=CC=C(C=C1)C2CCCN2 MCULE-1715719526 [1,0,0,0,1,0|1,0,1]=4 299 B13R2.12 CC1=CC=C(C=C1)C2CCCN2 MCULE-7209063506 [1,0,0,0,1,0|1,0,1]=4 300 B13R2.12 CC1=CC=C(C=C1)C2NCCS2 MCULE-5037622156 [1,0,0,0,1,0|1,0,1]=4 301 B13R2.12 CC1=CC=C(C=C1)[C@@H]2CCCN2 MCULE-2593412596 [1,0,0,0,1,0|1,0,1]=4 302 B13R2.12 CC1=CC=C(C=C1)[C@@H]2CCCN2 MCULE-6349655025 [1,0,0,0,1,0|1,0,1]=4 303 B13R2.12 CC1=CC=C(C=C1)[C@@H]2CCCN2 MCULE-8176220491 [1,0,0,0,1,0|1,0,1]=4 304 B13R2.12 CC1=CC=C(C=C1)[C@H]2CCCN2 MCULE-5415253490 [1,0,0,0,1,0|1,0,1]=4 305 B13R2.12 CC1=CC=C(C=C1)[C@H]2CCCN2 MCULE-8111596248 [1,0,0,0,1,0|1,0,1]=4 306 B13R2.12 ClC1=CC=C(C=C1)C2=NCCC2 MCULE-6657392532 [1,0,0,0,1,0|2,0,0]=4 307 B13R2.12 ClC1=CC=C(C=C1)C2=NCCN2 MCULE-1202342608 [1,0,0,0,1,0|1,0,0]=3 308 B13R2.12 ClC1=CC=C(C=C1)C2=NCCN2 MCULE-4125153952 [1,0,0,0,1,0|1,0,0]=3 309 B13R2.12 ClC1=CC=C(C=C1)C2=NCCS2 MCULE-2744743584 [1,0,0,0,1,0|2,0,0]=4 310 B13R2.12 FC1=CC=C(C=C1)C2=NCCO2 MCULE-8576418838 [1,0,0,0,1,0|2,0,0]=4 311 B13R2.12 IC1=CC=C(C=C1)C2=NCCC2 MCULE-6626426641 [1,0,0,0,1,0|2,0,0]=4 312 B13R2.12 NC1=CC=C(C=C1)C2=NCCN2 MCULE-4590215545 [1,0,0,0,1,0|1,0,0]=3 313 B13R2.12 NC1=CC=C(C=C1)C2=NCCN2 MCULE-8705106547 [1,0,0,0,1,0|1,0,0]=3 314 B13R2.12 NC1=CC=C(C=C1)C2=NCCO2 MCULE-3394434784 [1,0,0,0,1,0|2,0,0]=4 315 B13R2.12 NC1=CC=C(C=N1)C2=NCCN2 MCULE-9994839493 [1,0,0,0,1,0|2,0,0]=4 316 B13R2.12 OC1=CC=C(C=C1)C2=NCCN2 MCULE-2464626340 [1,0,0,0,1,0|1,0,0]=3 317 B13R2.12 OC1=CC=C(C=C1)C2=NCCO2 MCULE-9900422941 [1,0,0,0,1,0|2,0,0]=4 318 B13R2.12 OC1=CC=C(C=C1)C2=NCCS2 MCULE-4762432716 [1,0,0,0,1,0|2,0,0]=4 319 B13R2.1069 CC1=CC=C(C=C1)NC2CCC2 MCULE-8955577470 [1,0,0,0,1,0|1,0,1]=4 320 B13R2.13518 CC1=CC(=C(C=C1)[C@@H]2CCN2)C MCULE-4927441233 [0,0,0,0,2,0|1,0,1]=4 321 B13R2.13518 CC1=CC(=C(C=C1)[C@@H]2CCN2)C MCULE-6143518632 [0,0,0,0,2,0|1,0,1]=4 322 B13R2.13518 CC1=CC(=C(C=C1)[C@@H]2CCN2)F MCULE-1159813633 [0,0,0,0,2,0|0,1,1]=4 323 B13R2.13518 CC1=CC(=C(C=C1)[C@@H]2CCN2)F MCULE-9499093305 [0,0,0,0,2,0|0,1,1]=4 324 B13R2.13518 CC1=CC(=C(C=C1)[C@@H]2CCN2)O MCULE-2614427749 [0,0,0,0,2,0|1,0,1]=4 325 B13R2.13518 CC1=CC(=C(C=C1)[C@@H]2CCN2)O MCULE-6471128159 [0,0,0,0,2,0|1,0,1]=4 326 B13R2.13518 CC1=CC(=C(C=C1)[C@H]2CCN2)C MCULE-1543535052 [0,0,0,0,2,0|1,0,1]=4 327 B13R2.13518 CC1=CC(=C(C=C1)[C@H]2CCN2)C MCULE-4897407280 [0,0,0,0,2,0|1,0,1]=4 328 B13R2.13518 CC1=CC(=C(C=C1)[C@H]2CCN2)F MCULE-3265894086 [0,0,0,0,2,0|0,1,1]=4 329 B13R2.13518 CC1=CC(=C(C=C1)[C@H]2CCN2)F MCULE-4218115011 [0,0,0,0,2,0|0,1,1]=4 330 B13R2.13518 CC1=CC(=C(C=C1)[C@H]2CCN2)O MCULE-1924547709 [0,0,0,0,2,0|1,0,1]=4 331 B13R2.13518 CC1=CC(=C(C=C1)[C@H]2CCN2)O MCULE-4632761646 [0,0,0,0,2,0|1,0,1]=4 332 B13R2.13518 CC1=CC=C(C(=C1)Br)[C@@H]2CCN2 MCULE-6943811367 [0,0,0,0,2,0|0,1,1]=4 333 B13R2.13518 CC1=CC=C(C(=C1)Br)[C@@H]2CCN2 MCULE-8589526668 [0,0,0,0,2,0|0,1,1]=4 334 B13R2.13518 CC1=CC=C(C(=C1)Br)[C@H]2CCN2 MCULE-3021394760 [0,0,0,0,2,0|0,1,1]=4 335 B13R2.13518 CC1=CC=C(C(=C1)Br)[C@H]2CCN2 MCULE-6842603153 [0,0,0,0,2,0|0,1,1]=4 336 B13R2.13518 ClC1=CC(=C(C=C1)[C@@H]2CCN2)Cl MCULE-3943115731 [0,0,0,0,2,0|1,0,1]=4 337 B13R2.13518 ClC1=CC(=C(C=C1)[C@@H]2CCN2)Cl MCULE-9653660668 [0,0,0,0,2,0|1,0,1]=4 338 B13R2.13518 ClC1=CC(=C(C=C1)[C@H]2CCN2)Cl MCULE-5422205649 [0,0,0,0,2,0|1,0,1]=4 339 B13R2.13518 ClC1=CC(=C(C=C1)[C@H]2CCN2)Cl MCULE-5502312984 [0,0,0,0,2,0|1,0,1]=4 340 B13R2.13518 ClC1=CC(=CC=C1[C@@H]2CCN2)Br MCULE-2523996730 [0,0,0,0,2,0|1,0,1]=4 341 B13R2.13518 ClC1=CC(=CC=C1[C@@H]2CCN2)Br MCULE-4504528459 [0,0,0,0,2,0|1,0,1]=4 342 B13R2.13518 ClC1=CC(=CC=C1[C@H]2CCN2)Br MCULE-5221542232 [0,0,0,0,2,0|1,0,1]=4 343 B13R2.13518 ClC1=CC(=CC=C1[C@H]2CCN2)Br MCULE-9999005278 [0,0,0,0,2,0|1,0,1]=4 344 B13R2.13518 FC1=CC(=C(C=C1)[C@@H]2CCN2)Cl MCULE-2245681882 [0,0,0,0,2,0|1,0,1]=4 345 B13R2.13518 FC1=CC(=C(C=C1)[C@@H]2CCN2)Cl MCULE-6198817902 [0,0,0,0,2,0|1,0,1]=4 346 B13R2.13518 FC1=CC(=C(C=C1)[C@H]2CCN2)Cl MCULE-5324428560 [0,0,0,0,2,0|1,0,1]=4 347 B13R2.13518 FC1=CC(=C(C=C1)[C@H]2CCN2)Cl MCULE-9277798479 [0,0,0,0,2,0|1,0,1]=4 348 B13R2.5400 ClC1=C(C=CC(=C1)Br)NC2CC2 MCULE-3421921775 [0,0,0,0,2,0|1,0,1]=4 349 B15R2.38 CC1=C(C=CC=C1)NC2=NCCCS2 MCULE-2197863694 [1,0,0,0,0,1|2,0,0]=4 350 B15R2.38 ClC1=C(C=CC=C1)NC2=NCCCS2 MCULE-6718923178 [1,0,0,0,0,1|1,0,0]=3 351 B15R2.562 CC1=C(C=CC=C1)CNC2=NCCN2 MCULE-8927749570 [1,0,0,0,0,1|1,0,0]=3 352 B15R2.562 CC1=CC=CC=C1CSC2=NCCN2 MCULE-5766686216 [1,0,0,0,0,1|2,0,0]=4 353 B15R2.562 CC1=CC=CC=C1CSC2=NCCN2 MCULE-8775671014 [1,0,0,0,0,1|2,0,0]=4 354 B15R2.562 ClC1=C(C=CC=C1)NCC2CCCN2 MCULE-1924036913 [1,0,0,0,0,1|1,0,1]=4 355 B15R2.562 ClC1=C(C=CC=C1)NCC2CCCN2 MCULE-5919788376 [1,0,0,0,0,1|1,0,1]=4 356 B15R2.562 ClC1=CC=CC=C1CNC2=NN=NN2 MCULE-5861403696 [1,0,0,0,0,1|2,0,0]=4 357 B15R2.562 ClC1=CC=CC=C1CSC2=NCCN2 MCULE-3747440636 [1,0,0,0,0,1|1,0,0]=3 358 B15R2.562 ClC1=CC=CC=C1CSC2=NCCN2 MCULE-9369927761 [1,0,0,0,0,1|1,0,0]=3 359 B15R2.562 FC1=CC=CC=C1CSC2=NCCN2 MCULE-2487862158 [1,0,0,0,0,1|1,1,0]=4 360 B15R2.562 FC1=CC=CC=C1CSC2=NCCN2 MCULE-9353594850 [1,0,0,0,0,1|1,1,0]=4 361 B15R2.29 CC1=CC=C(C=C1)NC2=NCCCS2 MCULE-6441595068 [1,0,0,0,0,1|1,0,0]=3 362 B15R2.29 CC1=CC=C(C=C1)NC2=NCCOC2 MCULE-7109606821 [1,0,0,0,0,1|1,0,0]=3 363 B15R2.29 CC1=CC=C(C=C1)NC2=NCCOC2 MCULE-9628111289 [1,0,0,0,0,1|1,0,0]=3 364 B15R2.29 ClC1=CC=C(C=C1)NC2=NCCCS2 MCULE-2965961562 [1,0,0,0,0,1|2,0,0]=4 365 B15R2.29 FC1=CC=C(C=C1)NC2=NCCCS2 MCULE-7400641385 [1,0,0,0,0,1|2,0,0]=4 366 B15R2.29 OC1=CC=C(C=C1)NC2=NCCCS2 MCULE-1500206741 [1,0,0,0,0,1|2,0,0]=4 367 B15R2.100 BrC1=CC=C(C=C1)CSC2=NCCN2 MCULE-6191050244 [1,0,0,0,0,1|2,0,0]=4 368 B15R2.100 BrC1=CC=C(C=C1)CSC2=NCCN2 MCULE-6274602546 [1,0,0,0,0,1|2,0,0]=4 369 B15R2.100 CC1=CC=C(C=C1)CNC2=NCCS2 MCULE-7568258193 [1,0,0,0,0,1|1,0,0]=3 370 B15R2.100 CC1=CC=C(C=C1)CSC2=NCCN2 MCULE-1798337064 [1,0,0,0,0,1|1,0,0]=3 371 B15R2.100 CC1=CC=C(C=C1)CSC2=NCCN2 MCULE-2569007524 [1,0,0,0,0,1|1,0,0]=3 372 B15R2.100 CC1=CC=C(C=C1)CSC2=NCCS2 MCULE-1856916144 [1,0,0,0,0,1|2,0,0]=4 373 B15R2.100 CC1=CC=C(C=C1)NCC2CCCN2 MCULE-7016511801 [1,0,0,0,0,1|1,0,1]=4 374 B15R2.100 CC1=CC=C(C=C1)NCC2CCCN2 MCULE-9831771836 [1,0,0,0,0,1|1,0,1]=4 375 B15R2.100 ClC1=CC=C(C=C1)CSC2=NCCN2 MCULE-4409872969 [1,0,0,0,0,1|2,0,0]=4 376 B15R2.100 ClC1=CC=C(C=C1)CSC2=NCCN2 MCULE-9183926659 [1,0,0,0,0,1|2,0,0]=4 377 B15R2.100 FC1=CC=C(C=C1)CNC2=NCCS2 MCULE-4401375828 [1,0,0,0,0,1|2,0,0]=4 378 B15R2.100 FC1=CC=C(C=C1)CSC2=NCCN2 MCULE-7157070321 [1,0,0,0,0,1|2,0,0]=4 379 B15R2.100 FC1=CC=C(C=C1)CSC2=NCCN2 MCULE-8449073451 [1,0,0,0,0,1|2,0,0]=4 380 B15R2.6880 CC1=CC(=NC(=N1)NC2=NCCN2)C MCULE-2783699860 [0,0,0,0,1,1|2,0,0]=4