0 B11R1.53 CC(C)C1=C(C=CC=C1)C=O Z1171158413 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.53 CC(C)C1=C(C=CC=N1)C=O Z1255398088 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.53 CC(C)C1=C(N=CC=C1)CN Z4927326966 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.53 CCC1=C(N=CC=N1)C(=O)O Z1551935457 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.53 CN(C)C1=C(C=CC=N1)C#N Z86242586 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.53 CN(C)C1=C(C=CC=N1)C=O Z1201624113 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.53 CN(C)C1=C(N=CC=C1)C#N Z1255491406 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.53 CNC1=C(C=CC=C1)C(C)C Z335263032 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.53 CNC1=C(N=CC=C1)N(C)C Z1082871914 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.53 COC1=C(C=CC=C1)C(C)N Z57057709 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.53 COC1=C(C=CC=C1)[C@@H](C)O Z360055200 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.53 COC1=C(C=CC=C1)[C@H](C)O Z360055194 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.53 COC1=C(C=CC=N1)B(O)O Z1741962386 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.53 COC1=C(C=CC=N1)C(=O)N Z300502574 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.53 COC1=C(C=CC=N1)C(=O)O Z71179597 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.53 COC1=C(C=CC=N1)C(=S)N Z295390708 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.53 COC1=C(C=CN=C1)C(C)N Z1216820428 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.53 COC1=C(N=CC=C1)C(=O)O Z808643216 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.53 COC1=C(N=CC=N1)C(=N)N Z3810710763 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.53 CSC1=C(C=CC=C1)C(C)O Z1157829809 [0,0,0,0,0,0|3,1,0]=4 20 B11R1.53 CSC1=C(C=CC=C1)[C@@H](C)N Z1993522688 [0,0,0,0,0,0|3,1,0]=4 21 B11R1.53 CSC1=C(N=CC=N1)C(=O)O Z995154340 [0,0,0,0,0,0|2,1,1]=4 22 B10R1.20 CCC1=C(C=CC=C1)NC Z335279298 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.20 CCC1=C(C=CC=N1)C=O Z3241890674 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.20 CCC1=C(N=CC=C1)C#N Z1198166295 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.20 CCC1=C(N=CC=C1)C=O Z1255375872 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.20 CNC1=C(C=CC=N1)CN Z4763824006 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.20 CNC1=C(N=CC=C1)OC Z1082871982 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.20 CNC1=C(N=CC=N1)C#N Z995018658 [1,0,0,0,0,0|2,0,1]=4 29 B10R1.20 COC1=C(C=CC=C1)CN Z57102476 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.20 COC1=C(C=CC=C1)CO Z104479146 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.20 COC1=C(C=CC=C1)OC Z53833941 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.20 COC1=C(C=CC=N1)C#N Z31131631 [1,0,0,0,0,0|2,0,1]=4 33 B10R1.20 COC1=C(C=CC=N1)C=O Z1079442776 [1,0,0,0,0,0|2,0,1]=4 34 B10R1.20 COC1=C(C=CC=N1)CO Z800297974 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.20 COC1=C(N=CC=C1)C=O Z1198165843 [1,0,0,0,0,0|2,0,1]=4 36 B10R1.20 COC1=C(N=CC=N1)C=O Z1198266659 [1,0,0,0,0,0|1,0,1]=3 37 B10R1.20 COC1=C(N=CC=N1)CO Z1661095795 [1,0,0,0,0,0|1,0,0]=2 38 B10R1.20 CSC1=C(C=CC=N1)CO Z1198184816 [1,0,0,0,0,0|2,1,0]=4 39 B10R1.20 CSC1=C(N=CC=N1)C#N Z995023946 [1,0,0,0,0,0|1,1,1]=4 40 B10R1.61 CC(=O)C1=C(C=CC=N1)O Z1198175942 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.61 CC(=O)C1=C(N=CC=N1)Cl Z1198277886 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.61 CC(C)C1=C(C=CC=C1)Br Z1201618204 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.61 CC(C)C1=C(C=CC=C1)N Z104475672 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.61 CC(C)C1=C(C=CC=C1)O Z104485440 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.61 CC(C)C1=C(C=CC=N1)N Z1416177001 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.61 CC(C)C1=C(C=CN=C1)O Z1255421924 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.61 CC(C)C1=C(C=NC=N1)N Z3303296144 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.61 CC(C)C1=C(C=NC=N1)O Z1618037650 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.61 CC(C)C1=C(N=CC=C1)N Z1192017957 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.61 CC(C)C1=C(N=CC=N1)Cl Z1255497724 [1,0,0,0,0,0|1,0,0]=2 51 B10R1.61 CC(C)C1=C(N=CN=C1)N Z1203583456 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.61 CC(C)C1=NC=CNC1=O Z1203732938 [1,0,0,0,0,0|0,0,2]=3 53 B10R1.61 CC(N)C1=C(C=CC=C1)O Z234895795 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.61 CC(N)C1=C(C=CC=N1)Br Z3925841137 [1,0,0,0,0,0|3,0,0]=4 55 B10R1.61 CC(N)C1=C(C=CC=N1)F Z2284396256 [1,0,0,0,0,0|3,0,0]=4 56 B10R1.61 CC1=C(C=CC=C1)C(C)O Z335245068 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.61 CC1=C(C=CC=C1)[C@@H](C)O Z360055768 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.61 CC1=C(C=CC=N1)C(C)N Z4511547602 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.61 CC1=C(C=CC=N1)C(C)O Z1766930129 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.61 CC1=C(N=CC=N1)C(=O)O Z1205494130 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.61 CN(C)C1=C(C=CC=C1)O Z2681253687 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.61 CN(C)C1=C(N=CC=C1)N Z1203587145 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.61 C[C@H](N)C1=C(C=CC=N1)F Z1924739255 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.61 FC(F)C1=C(N=CC=N1)Cl Z1813160247 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.61 NC(=O)C1=C(N=CC=N1)O Z1201619905 [1,0,0,0,0,0|2,0,1]=4 66 B12R1.46 COC1=C(C=C(C=C1)C)C(C)N Z94601375 [0,1,0,0,0,0|3,0,0]=4 67 B12R1.46 COC1=C(C=C(C=C1)C)[C@@H](C)O Z360056216 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.46 COC1=C(C=C(C=C1)C)[C@H](C)O Z360056212 [0,1,0,0,0,0|3,0,0]=4 69 B12R1.46 COC1=C(C=C(C=C1)F)C(C)N Z332383672 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.46 COC1=C(C=C(C=C1)N)C(C)C Z3244866812 [0,1,0,0,0,0|2,0,0]=3 71 B12R1.57 CC(C)C1=C(N=C(C=C1)Cl)C#N Z2732565766 [0,1,0,0,0,0|3,0,0]=4 72 B12R1.57 COC1=C(C=CC(=C1)C)[C@@H](C)O Z1127664493 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.76 COC1=C(C=CC=C1)C(C)(C)N Z449374472 [0,1,0,0,0,0|2,0,0]=3 74 B12R1.76 COC1=C(C=CC=C1)C(C)(C)O Z449374410 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.76 COC1=C(N=CC=N1)S(=O)(=O)F Z2755014271 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.77 CCC(N)C1=C(C=CC=C1)OC Z234894889 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.77 CNC(=O)C1=C(N=CC=C1)OC Z300243570 [0,1,0,0,0,0|2,0,1]=4 78 B12R1.77 CNC(C)C1=C(C=CC=C1)OC Z140561750 [0,1,0,0,0,0|2,0,0]=3 79 B12R1.77 COC(=O)C1=C(N=CC=C1)OC Z307842984 [0,1,0,0,0,0|2,0,1]=4 80 B12R1.77 COC1=C(C=CC=C1)C(C)C=O Z1255384224 [0,1,0,0,0,0|2,0,1]=4 81 B12R1.77 COC1=C(C=CC=C1)C(C)CN Z415655038 [0,1,0,0,0,0|2,0,0]=3 82 B12R1.77 COC1=C(C=CC=C1)C(N)CN Z425861114 [0,1,0,0,0,0|3,0,0]=4 83 B12R1.77 COC1=C(C=CC=C1)C(O)CN Z336086524 [0,1,0,0,0,0|3,0,0]=4 84 B12R1.77 COC1=C(N=CC=C1)C(O)CN Z3601606840 [0,1,0,0,0,0|2,0,0]=3 85 B12R1.261 CC(C)C1=C(C=CC=N1)B(O)O Z4435822732 [0,1,0,0,0,0|3,0,0]=4 86 B12R1.283 CCOC1=C(C=CC=C1)C(C)N Z239627262 [0,1,0,0,0,0|3,0,0]=4 87 B12R1.283 CCOC1=C(C=CC=C1)C(C)O Z228586324 [0,1,0,0,0,0|3,0,0]=4 88 B12R1.283 CCOC1=C(C=CC=C1)[C@@H](C)N Z360055960 [0,1,0,0,0,0|3,0,0]=4 89 B12R1.283 CCOC1=C(C=CC=C1)[C@@H](C)O Z360055958 [0,1,0,0,0,0|3,0,0]=4 90 B12R1.283 CCOC1=C(C=CC=C1)[C@H](C)O Z360055954 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.283 CN(C)C1=C(C=CC=N1)CCN Z3379430785 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.283 CNCC1=C(C=CC=C1)C(C)C Z3847495068 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.437 COC1=C(C(=CC=C1)F)C(C)N Z332383676 [0,1,0,0,0,0|3,0,0]=4 94 B12R2.1081 CC1CCNC2=C1C=CC=C2 Z382691338 [0,0,0,1,0,0|3,0,0]=4 95 B12R2.1081 CN1CCNC2=C1N=CC=C2 Z1198175997 [0,0,0,1,0,0|3,0,0]=4 96 B12R2.1081 NC1CCOC2=C1C=CC=C2 Z85923435 [0,0,0,1,0,0|3,0,0]=4 97 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 Z1442208747 [0,0,0,1,0,0|3,0,0]=4 98 B12R2.1081 O=C1CCOC2=C1C=CC=N2 Z1198233082 [0,0,0,1,0,0|2,0,1]=4 99 B12R2.1081 OC1CCCC2=C1C=CC=N2 Z1198156585 [0,0,0,1,0,0|3,0,0]=4 100 B12R2.1081 OC1CCOC2=C1C=CC=C2 Z335244980 [0,0,0,1,0,0|3,0,0]=4 101 B12R2.1081 O[C@@H]1CCCC2=C1N=CC=C2 Z1255505566 [0,0,0,1,0,0|3,0,0]=4 102 B12R2.1081 O[C@@H]1CCOC2=C1C=CC=C2 Z959151866 [0,0,0,1,0,0|3,0,0]=4 103 B12R2.1081 O[C@H]1CCCC2=C1N=CC=C2 Z1216847007 [0,0,0,1,0,0|3,0,0]=4 104 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 Z959151868 [0,0,0,1,0,0|3,0,0]=4 105 B12R2.2048 COC1=C(C=CC=C1)[C@@H]2CO2 Z1574937225 [0,0,0,1,0,0|3,0,0]=4 106 B12R2.2048 N#CC1=C(N=CC=C1)C2CC2 Z1255402420 [0,0,0,1,0,0|3,0,0]=4 107 B12R2.2403 CC1(CNC2=C1C=CC=C2)C Z1413780522 [0,0,0,1,0,0|3,0,0]=4 108 B12R2.2403 CC1(CNC2=C1N=CC=C2)C Z1861999568 [0,0,0,1,0,0|2,0,0]=3 109 B12R2.2403 CC1(COC2=C1C=CC=C2)N Z5094222723 [0,0,0,1,0,0|3,0,0]=4 110 B10R1.39 CC(C)C1=C(N=CO1)CN Z2310723118 [0,0,0,0,1,0|3,0,0]=4 111 B10R1.39 CC(C)C1=C(OC=C1)C#N Z2026106811 [0,0,0,0,1,0|3,0,0]=4 112 B10R1.39 CC(C)C1=CON=C1C=O Z2732450042 [0,0,0,0,1,0|3,0,0]=4 113 B10R1.39 CC(C)C1=NOC=C1C=O Z2732450056 [0,0,0,0,1,0|3,0,0]=4 114 B10R1.39 CC(C)N1C=CN=C1C=O Z1198173197 [0,0,0,0,1,0|3,0,0]=4 115 B10R1.39 CC(C)N1C=CN=C1CO Z566199922 [0,0,0,0,1,0|3,0,0]=4 116 B10R1.39 CC(C)N1N=CC=C1C=O Z1198161629 [0,0,0,0,1,0|3,0,0]=4 117 B10R1.39 CC(C)N1N=CN=C1C=O Z1504682912 [0,0,0,0,1,0|3,0,0]=4 118 B10R1.39 CC(C)N1N=CN=C1CN Z1945984213 [0,0,0,0,1,0|3,0,0]=4 119 B10R1.39 CCN1C=CN=C1C(C)N Z2235409223 [0,0,0,0,1,0|3,0,0]=4 120 B10R1.39 CNC1=CC=NN1C(C)C Z1082871154 [0,0,0,0,1,0|2,0,0]=3 121 B10R1.39 COC1=C(SC=C1)C(=O)C Z1255500699 [0,0,0,0,1,0|2,0,1]=4 122 B10R1.39 COC1=NSC=C1C(=O)C Z3024184412 [0,0,0,0,1,0|2,0,1]=4 123 B10R1.39 CSC1=NN=CN1C(C)C Z16606776 [0,0,0,0,1,0|2,1,0]=4 124 B12R1.75 CC(C)NC1=C(C=CC=N1)C#N Z31191155 [0,0,0,0,0,1|3,0,0]=4 125 B12R1.75 CC(C)OC1=C(C=CC=N1)C#N Z295203628 [0,0,0,0,0,1|3,0,0]=4 126 B12R1.75 COC1=C(C=CC=C1)CC(C)O Z445987128 [0,0,0,0,0,1|3,0,0]=4 127 B12R1.75 COC1=C(C=CC=C1)NC(C)C Z267171966 [0,0,0,0,0,1|2,0,0]=3 128 B9R1.15 CC1=C(N=CC=C1)CO Z976637084 [2,0,0,0,0,0|2,0,0]=4 129 B9R1.15 CC1=C(N=CC=N1)C#N Z1198181979 [2,0,0,0,0,0|1,0,1]=4 130 B9R1.15 CC1=C(N=CC=N1)C=O Z1198233269 [2,0,0,0,0,0|1,0,1]=4 131 B9R1.15 CC1=C(N=CC=N1)CN Z3671696702 [2,0,0,0,0,0|1,0,0]=3 132 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [2,0,0,0,0,0|2,0,0]=4 133 B9R1.15 CCC1=C(C=NC=N1)O Z1618133826 [2,0,0,0,0,0|2,0,0]=4 134 B9R1.15 CCC1=C(N=CC=C1)N Z1192017773 [2,0,0,0,0,0|2,0,0]=4 135 B9R1.15 CCC1=C(N=CC=C1)O Z1198266674 [2,0,0,0,0,0|1,0,0]=3 136 B9R1.15 CCC1=C(N=CC=N1)Cl Z1198149374 [2,0,0,0,0,0|1,0,0]=3 137 B9R1.15 CCC1=C(N=CC=N1)N Z1203580180 [2,0,0,0,0,0|1,0,0]=3 138 B9R1.15 CCC1=NC=CNC1=O Z3274889193 [2,0,0,0,0,0|0,0,2]=4 139 B9R1.15 CCC1=NNC=NC1=O Z1201628993 [2,0,0,0,0,0|1,0,1]=4 140 B9R1.15 CNC1=C(C=CC=N1)C Z968907582 [2,0,0,0,0,0|2,0,0]=4 141 B9R1.15 CNC1=C(N=CC=C1)C Z1295808975 [2,0,0,0,0,0|2,0,0]=4 142 B9R1.15 CNC1=C(N=CC=N1)C Z2768516750 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.15 COC1=C(C=CC=N1)N Z240084308 [2,0,0,0,0,0|2,0,0]=4 144 B9R1.15 COC1=C(C=CC=N1)O Z1255423921 [2,0,0,0,0,0|2,0,0]=4 145 B9R1.15 COC1=C(N=CC=C1)C Z1198150814 [2,0,0,0,0,0|1,0,0]=3 146 B9R1.15 COC1=C(N=CC=C1)N Z362783902 [2,0,0,0,0,0|2,0,0]=4 147 B9R1.15 COC1=C(N=CC=N1)N Z1198166025 [2,0,0,0,0,0|1,0,0]=3 148 B9R1.15 ClCC1=C(N=CC=N1)Cl Z934373154 [2,0,0,0,0,0|2,0,0]=4 149 B9R1.15 N#CC1=C(N=CC=N1)O Z995023286 [2,0,0,0,0,0|1,0,1]=4 150 B9R1.15 NC1=C(N=CC=N1)CO Z1198237691 [2,0,0,0,0,0|2,0,0]=4 151 B9R1.15 NCC1=C(C=CC=N1)O Z1198156472 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.15 NCC1=C(N=CC=N1)Cl Z2472857434 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.6 CC(=O)C1=NC=CN=C1 Z513735920 [2,0,0,0,0,0|1,0,1]=4 154 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [2,0,0,0,0,0|1,0,0]=3 155 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [2,0,0,0,0,0|2,0,0]=4 159 B9R1.6 CC(O)C1=NC=CN=C1 Z513751834 [2,0,0,0,0,0|1,0,0]=3 160 B9R1.6 CN(C)C1=CN=CC=C1 Z1201619922 [2,0,0,0,0,0|2,0,0]=4 161 B11R1.37 CCC1=C(C=C(C=C1)N)OC Z1255492864 [1,1,0,0,0,0|2,0,0]=4 162 B11R1.37 CCC1=C(N=C(N=N1)Cl)CC Z1761595443 [1,1,0,0,0,0|2,0,0]=4 163 B11R1.37 CCC1=C(N=C(N=N1)N)CC Z1262632570 [1,1,0,0,0,0|2,0,0]=4 164 B11R1.37 COC1=C(C=C(C=N1)Br)CO Z905191750 [1,1,0,0,0,0|2,0,0]=4 165 B11R1.37 COC1=C(C=C(C=N1)N)CO Z3675090866 [1,1,0,0,0,0|2,0,0]=4 166 B11R1.37 COC1=C(C=CC(=N1)C)CN Z803153228 [1,1,0,0,0,0|2,0,0]=4 167 B11R1.37 COC1=C(N=C(C=C1)C)CN Z3486438235 [1,1,0,0,0,0|2,0,0]=4 168 B11R1.37 COC1=C(N=CC(=C1)I)OC Z1269199963 [1,1,0,0,0,0|2,0,0]=4 169 B11R1.37 COC1=C(N=CC(=C1)N)OC Z1262665453 [1,1,0,0,0,0|2,0,0]=4 170 B11R1.41 CCOC1=C(C=CC=N1)CN Z240084032 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.41 CCSC1=C(N=CC=N1)C#N Z995023798 [1,1,0,0,0,0|2,0,0]=4 172 B11R1.41 CNCC1=C(C=CC=C1)OC Z56944118 [1,1,0,0,0,0|2,0,0]=4 173 B11R1.41 COC1=C(C=CC=C1)CCN Z104493472 [1,1,0,0,0,0|2,0,0]=4 174 B11R1.41 COC1=C(C=CC=N1)CCO Z1504674309 [1,1,0,0,0,0|1,0,0]=3 175 B11R1.87 CC(C)(C)C1=C(C=CC=C1)O Z104485444 [1,1,0,0,0,0|2,0,0]=4 176 B11R1.87 CC(C)(C)C1=C(C=CC=N1)O Z1198153185 [1,1,0,0,0,0|1,0,0]=3 177 B11R1.87 CC(C)(C)C1=C(N=CC=C1)N Z1192017799 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.87 CC(C)(C)C1=NC=CNC1=O Z1606819839 [1,1,0,0,0,0|0,0,2]=4 179 B11R1.87 CC1=C(C=CC=C1)C(C)(C)O Z449373950 [1,1,0,0,0,0|2,0,0]=4 180 B11R1.159 CC1=C(C=CC=C1N)C(C)C Z2740750367 [1,1,0,0,0,0|2,0,0]=4 181 B11R1.166 CC1=C(C=CC(=C1)Br)C(C)C Z1861997013 [1,1,0,0,0,0|2,0,0]=4 182 B11R1.166 CC1=C(C=CC(=C1)O)C(C)C Z104476618 [1,1,0,0,0,0|2,0,0]=4 183 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O Z57127464 [1,1,0,0,0,0|2,0,0]=4 184 B11R1.167 CC(C)C1=C(C=CC(=C1)Br)O Z1269143433 [1,1,0,0,0,0|2,0,0]=4 185 B11R1.167 CC(C)C1=C(C=CC(=C1)N)O Z1255375171 [1,1,0,0,0,0|2,0,0]=4 186 B11R1.167 CC(C)C1=C(N=CC(=C1)Cl)N Z1197892620 [1,1,0,0,0,0|2,0,0]=4 187 B11R1.222 CNC(C)C1=C(C=CC=C1)C Z159528196 [1,1,0,0,0,0|2,0,0]=4 188 B11R1.222 CNC(C)C1=C(C=CC=C1)O Z316170358 [1,1,0,0,0,0|2,0,0]=4 189 B11R1.49 COC1=CN(N=C1C(C)N)C Z2932146567 [0,1,0,0,1,0|2,0,0]=4 190 B11R1.193 CC(C)C1=NC=CN1CCN Z2902091492 [0,1,0,0,1,0|2,0,0]=4 191 B13R1.89 COC1=C(C=CC=N1)C(=O)N(C)C Z300800902 [0,1,0,0,0,1|2,0,0]=4 192 B13R1.91 CNC(C)CC1=C(C=CC=C1)OC Z1691545280 [0,1,0,0,0,1|2,0,0]=4 193 B13R1.622 COC1=C(C=CC=C1)CC(C)(C)N Z839115174 [0,1,0,0,0,1|2,0,0]=4 194 B13R1.3089 COC1=C(C=C(C=C1)N)OC(C)C Z1675167202 [0,1,0,0,0,1|2,0,0]=4 195 B13R1.2430 COC1=C(C=C(C=C1)C=O)C(C)C Z1198168466 [0,2,0,0,0,0|2,0,0]=4 196 B13R1.2430 COC1=C(C=C(C=C1)CN)C(C)C Z4768873205 [0,2,0,0,0,0|2,0,0]=4 197 B13R1.2430 COC1=C(C=C(C=C1)CO)C(C)C Z1255452413 [0,2,0,0,0,0|2,0,0]=4 198 B13R1.3090 COC1=C(C=C(C=C1)Cl)C(C)(C)O Z1020762406 [0,2,0,0,0,0|2,0,0]=4 199 B13R1.3090 COC1=C(C=C(C=C1)O)C(C)(C)C Z1198149489 [0,2,0,0,0,0|2,0,0]=4 200 B13R1.53 COC1=C(C=CC(=C1)Cl)C(C)(C)N Z4655970823 [0,2,0,0,0,0|2,0,0]=4 201 B13R1.381 CCOC1=C(C=CC=C1)C(C)(C)O Z1020790680 [0,2,0,0,0,0|2,0,0]=4 202 B13R1.2129 COC1=C(C=CC=C1)C(C)(C)C#N Z725146236 [0,2,0,0,0,0|2,0,0]=4 203 B13R1.2129 COC1=C(C=CC=C1)C(C)(C)CN Z725146544 [0,2,0,0,0,0|2,0,0]=4 204 B13R1.572 CC(C)C1=C(C=CC=C1)OCCN Z1266933918 [0,2,0,0,0,0|2,0,0]=4 205 B11R1.89 CC(C)C(=O)C1=NC=CN1C Z86499931 [0,0,1,1,0,0|2,0,0]=4 206 B11R2.1 CC1CNC2=C1N=CC=C2 Z3464420345 [1,0,0,1,0,0|2,0,0]=4 207 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [1,0,0,1,0,0|2,0,0]=4 208 B11R2.20 C1=CC2=C(CCCC2)N=C1 Z1201617100 [1,0,0,1,0,0|2,0,0]=4 209 B11R2.20 C1=CC2=C(CCCN2)N=C1 Z212053854 [1,0,0,1,0,0|2,0,0]=4 210 B11R2.20 C1=CC2=C(N=C1)NCCC2 Z1198176448 [1,0,0,1,0,0|2,0,0]=4 211 B11R2.20 C1=CC2=C(N=C1)OCCN2 Z1201624799 [1,0,0,1,0,0|2,0,0]=4 212 B11R2.20 C1=NC2=C(CNCC2)N=C1 Z5626910804 [1,0,0,1,0,0|2,0,0]=4 213 B11R2.55 NC1=C(C=CC=N1)C2CC2 Z4496948738 [1,0,0,1,0,0|2,0,0]=4 214 B11R2.55 NC1=C(N=CC=C1)C2CC2 Z1521319401 [1,0,0,1,0,0|2,0,0]=4 215 B11R2.55 NC1=C(N=CC=N1)C2CC2 Z1203653375 [1,0,0,1,0,0|1,0,0]=3 216 B13R2.222 CC1(CNC2=C(C1)C=CC=N2)C Z4449638275 [0,0,0,1,0,1|2,0,0]=4 217 B13R2.222 CC1(CNC2=C(O1)C=CC=N2)C Z1255421457 [0,0,0,1,0,1|2,0,0]=4 218 B13R2.3791 CC1(COC2=C1C=C(C=C2)Br)C Z1269161489 [0,1,0,1,0,0|2,0,0]=4 219 B13R2.3791 CC1(COC2=C1C=C(C=C2)O)C Z1513829476 [0,1,0,1,0,0|2,0,0]=4 220 B13R2.5179 ClC1=NC2=C(N=C1)C(CCC2)Cl Z3277528199 [0,1,0,1,0,0|2,0,0]=4 221 B13R2.91 COC1=C(C=CC=C1)C2(CC2)N Z2429425696 [0,1,0,1,0,0|2,0,0]=4 222 B13R2.3122 CC1(CCOC2=C1C=CC=C2)C Z1255441405 [0,1,0,1,0,0|2,0,0]=4 223 B13R2.3122 CC1(CCOC2=C1C=CC=C2)N Z2896336823 [0,1,0,1,0,0|2,0,0]=4 224 B13R2.1613 NCC1CCOC2=C1C=CC=C2 Z415655034 [0,1,0,1,0,0|2,0,0]=4 225 B13R2.1613 OCC1CCCC2=C1N=CC=C2 Z1216823106 [0,1,0,1,0,0|2,0,0]=4 226 B13R2.2531 CC1(COC2=C1C=CC=C2)CN Z5185116445 [0,1,0,1,0,0|2,0,0]=4 227 B9R1.41 CC(C)C1=C(C=CS1)N Z4702454044 [1,0,0,0,1,0|2,0,0]=4 228 B9R1.41 CC(C)C1=C(N=CS1)N Z2146513878 [1,0,0,0,1,0|2,0,0]=4 229 B9R1.41 CC(C)C1=CNN=C1N Z1198316279 [1,0,0,0,1,0|2,0,0]=4 230 B9R1.41 CC(C)C1=CON=C1N Z1707473656 [1,0,0,0,1,0|2,0,0]=4 231 B9R1.41 CC(C)C1=NC=CN1C Z1198309810 [1,0,0,0,1,0|1,0,0]=3 232 B9R1.41 CC(C)C1=NN=CN1C Z992282676 [1,0,0,0,1,0|2,0,0]=4 233 B9R1.41 CC(C)C1=NNC=C1N Z2734283894 [1,0,0,0,1,0|2,0,0]=4 234 B9R1.41 CC(C)C1=NON=C1N Z359374182 [1,0,0,0,1,0|2,0,0]=4 235 B9R1.41 CC(C)N1C=CN=C1S Z220434798 [1,0,0,0,1,0|1,1,0]=4 236 B9R1.41 CC(C)N1N=CC=C1N Z55928891 [1,0,0,0,1,0|2,0,0]=4 237 B9R1.41 CC(C)N1N=CN=C1N Z995040876 [1,0,0,0,1,0|2,0,0]=4 238 B9R1.41 CC(N)C1=NC=CN1C Z2581825158 [1,0,0,0,1,0|2,0,0]=4 239 B9R1.41 CC(N)C1=NC=NN1C Z1824511251 [1,0,0,0,1,0|2,0,0]=4 240 B9R1.41 CC(O)C1=NC=CN1C Z1183454575 [1,0,0,0,1,0|2,0,0]=4 241 B9R1.41 CC(O)C1=NC=NN1C Z2043691446 [1,0,0,0,1,0|2,0,0]=4 242 B9R1.41 CC1=C(SC=C1)C(C)O Z837065414 [1,0,0,0,1,0|2,0,0]=4 243 B9R1.41 CC1=C(SC=N1)C(C)N Z414834562 [1,0,0,0,1,0|2,0,0]=4