0 B9R1.6 C=C(F)C1=CC=CC=C1 CS3204 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.6 CN(N)C1=CC=CN=C1 D74848 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 CN(N)C1=NC=CC=C1 D86030 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 C[C@H](N)C1=CN=CN=C1 P12431 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.6 C[C@H](N)C1=CN=CN=C1 P12500 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 C[C@H](N)C1=CN=NC=C1 P18973 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 C[C@H](O)C1=CN=CN=C1 P11936 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 C[C@H](O)C1=NN=CC=C1 P14065 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 C[P@H](=O)C1=CC=CC=C1 O11981 [0,0,0,0,0,0|1,0,1]=2 9 B9R1.6 OB(O)C1=NN=CC=C1 D75475 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.2 CCC1=NC=CC=N1 D86044 [1,0,0,0,0,0|2,0,0]=3 11 B8R1.2 C[13CH2]C1=CC=CC=C1 D98792 [1,0,0,0,0,0|0,0,0]=1 12 B8R1.2 NCC1=CN=NC=C1 F10917 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.13 CC(C)C1=CN=C(N)N=C1 FD7250 [0,1,0,0,0,0|3,0,0]=4 14 B10R1.13 CC1=CC=C([C@H](C)N)N=N1 56579 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.13 CC1=CC=C([C@H](C)N)N=N1 56581 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 C91123 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 C92102 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.13 CC1=CN=C([C@H](C)N)C=N1 D96435 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.13 CC1=NC=C([C@H](C)N)C=C1 D96383 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 56587 [0,1,0,0,0,0|3,0,0]=4 21 B10R1.13 CC1=NC=C([C@H](C)N)C=N1 56589 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 90823 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 90824 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.13 C[C@H](N)C1=CN=C(Cl)C=C1 D96354 [0,1,0,0,0,0|2,0,0]=3 25 B10R1.13 C[C@H](N)C1=CN=C(F)C=C1 AC7189 [0,1,0,0,0,0|2,0,0]=3 26 B10R1.13 C[C@H](O)C1=NC=C(F)C=C1 AT10692 [0,1,0,0,0,0|1,0,0]=2 27 B10R1.13 C[C@H](O)C1=NC=C(F)C=C1 AT10693 [0,1,0,0,0,0|1,0,0]=2 28 B10R1.13 C[C@H](O)C1=NC=C(O)C=N1 72720 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 F50249 [0,1,0,0,0,0|1,0,1]=3 30 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 F50317 [0,1,0,0,0,0|1,0,1]=3 31 B10R1.13 C[S@](=O)C1=CN=C(Br)C=C1 22983 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.13 O=C(F)C1=CC=C(F)C=C1 AT22483 [0,1,0,0,0,0|1,0,2]=4 33 B10R1.13 OC1=CC=C(C(F)F)C=C1 78024 [0,1,0,0,0,0|2,0,0]=3 34 B10R1.15 C#C[C@@H](C)C1=CC=CC=C1 C12342 [0,1,0,0,0,0|1,0,0]=2 35 B10R1.15 CC[C@H](N)C1=NC=CC=N1 C90664 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.15 CN[C@@H](C)C1=CC=NC=C1 AT18142 [0,1,0,0,0,0|2,0,0]=3 37 B10R1.15 C[C@@H](CO)C1=NC=CC=C1 AT23842 [0,1,0,0,0,0|1,0,0]=2 38 B10R1.15 C[C@H](ON)C1=CC=CC=C1 D74249 [0,1,0,0,0,0|0,0,0]=1 39 B10R1.15 NC[C@H](F)C1=CC=CC=C1 E72838 [0,1,0,0,0,0|1,0,0]=2 40 B10R1.15 N[C@@H](CF)C1=CC=CC=C1 72623 [0,1,0,0,0,0|1,0,0]=2 41 B10R1.15 N[C@@H](CF)C1=CC=CC=C1 AC4819 [0,1,0,0,0,0|1,0,0]=2 42 B10R1.15 N[C@@H](CF)C1=CC=CC=C1 W11733 [0,1,0,0,0,0|1,0,0]=2 43 B10R1.15 N[C@@H](CF)C1=CC=CC=C1 W11734 [0,1,0,0,0,0|1,0,0]=2 44 B10R1.15 N[C@@H](CO)C1=NC=CC=C1 N14219 [0,1,0,0,0,0|2,0,0]=3 45 B10R1.15 N[C@@H](CO)C1=NC=CN=C1 AT24480 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.15 N[C@@H](CO)C1=NC=CN=C1 AT24481 [0,1,0,0,0,0|3,0,0]=4 47 B10R1.28 [2H]C([2H])(N)C1=CC=CC=C1 D99382 [0,1,0,0,0,0|2,0,0]=3 48 B10R1.28 [2H]C([2H])([2H])C1=CC=CN=C1 D98305 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.61 CN(C)C1=C(O)C=CC=C1 AT26775 [0,1,0,0,0,0|2,0,0]=3 50 B10R1.61 CN(C)C1=C(O)C=NC=C1 AT23568 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.61 C[C@H](N)C1=CC=CN=C1F AC8220 [0,1,0,0,0,0|2,0,0]=3 52 B10R1.61 C[C@H](O)C1=C(F)C=CN=C1 AT10684 [0,1,0,0,0,0|1,0,0]=2 53 B10R1.61 C[C@H](O)C1=C(N)C=CC=C1 D75506 [0,1,0,0,0,0|0,0,0]=1 54 B10R1.61 C[C@H](O)C1=CC=CN=C1F AT10061 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.61 O=C(O)C1=C(S)C=CN=C1 AT16203 [0,1,0,0,0,0|2,0,1]=4 56 B10R1.61 OB(O)C1=C(F)C=CC=N1 C14125 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.61 OC1=C(C(F)F)C=CC=C1 AT20035 [0,1,0,0,0,0|2,0,0]=3 58 B10R1.113 CC(C)C1=CN=CC(Cl)=N1 AT19946 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.113 CC1=CC=CC([C@H](C)N)=N1 D75135 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.113 CC1=CC=CC([S@](=O)[O-])=C1 C14953 [0,1,0,0,0,0|2,0,1]=4 61 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 D96342 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.113 C[C@H](N)C1=CC(O)=NC=C1 N13197 [0,1,0,0,0,0|2,0,0]=3 63 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 D96341 [0,1,0,0,0,0|2,0,0]=3 64 B10R1.113 C[C@H](N)C1=CC=CC(N)=N1 D96323 [0,1,0,0,0,0|2,0,0]=3 65 B10R1.113 C[C@H](O)C1=CC(F)=NC=C1 AT10688 [0,1,0,0,0,0|1,0,0]=2 66 B10R1.113 C[C@H](O)C1=CC=NC(Cl)=N1 E70226 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.113 NC1=CC(C(F)F)=CN=C1 E72812 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.113 NC1=NC=CC(B(O)O)=C1 36649 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.113 OB(O)C1=NC=CC(F)=C1 D76942 [0,1,0,0,0,0|3,0,0]=4 70 B10R1.113 OC1=CC(C(F)F)=CN=C1 AT26720 [0,1,0,0,0,0|3,0,0]=4 71 B10R2.6 C1=CC=C(C2CC2)C=C1 W16080 [0,0,0,1,0,0|1,0,0]=2 72 B10R2.6 C1=CC=C([C@@H]2CN2)C=C1 89380 [0,0,0,1,0,0|1,0,0]=2 73 B10R2.6 C1=CC=C([C@@H]2CN2)C=C1 89381 [0,0,0,1,0,0|1,0,0]=2 74 B8R1.7 C[C@H](N)C1=CC=NS1 AT21225 [0,0,0,0,1,0|3,0,0]=4 75 B8R1.7 C[C@H](N)C1=CN=CN1 F13260 [0,0,0,0,1,0|3,0,0]=4 76 B8R1.7 C[C@H](N)C1=CN=CO1 AT18689 [0,0,0,0,1,0|3,0,0]=4 77 B8R1.7 C[C@H](N)C1=CN=CO1 AT18691 [0,0,0,0,1,0|3,0,0]=4 78 B8R1.7 C[C@H](N)C1=CNC=N1 C91192 [0,0,0,0,1,0|3,0,0]=4 79 B8R1.7 C[C@H](N)C1=CNC=N1 C91193 [0,0,0,0,1,0|3,0,0]=4 80 B8R1.7 C[C@H](N)C1=COC=C1 N16719 [0,0,0,0,1,0|2,0,0]=3 81 B8R1.7 C[C@H](N)C1=COC=N1 AT12536 [0,0,0,0,1,0|3,0,0]=4 82 B8R1.7 C[C@H](N)C1=CSC=C1 AT23262 [0,0,0,0,1,0|2,0,0]=3 83 B8R1.7 C[C@H](N)C1=CSC=C1 AT23264 [0,0,0,0,1,0|2,0,0]=3 84 B8R1.7 C[C@H](N)C1=CSN=C1 AT21218 [0,0,0,0,1,0|3,0,0]=4 85 B8R1.7 C[C@H](N)C1=NNC=C1 32103 [0,0,0,0,1,0|3,0,0]=4 86 B8R1.7 C[C@H](N)C1=NOC=C1 33764 [0,0,0,0,1,0|3,0,0]=4 87 B8R1.7 C[C@H](O)C1=CC=NS1 AT21152 [0,0,0,0,1,0|2,0,0]=3 88 B8R1.7 C[C@H](O)C1=NOC=C1 AT21815 [0,0,0,0,1,0|2,0,0]=3 89 B8R1.7 OB(O)N1C=CC=C1 AT22888 [0,0,0,0,1,0|3,0,0]=4 90 B10R1.18 CC(C)NC1=NC=CC=C1 D86001 [0,0,0,0,0,1|2,0,0]=3 91 B10R1.18 O=C(Cl)NC1=CC=CC=C1 D86031 [0,0,0,0,0,1|1,0,2]=4 92 B10R1.18 O=C(O)CC1=CC=CC=C1 AT24078 [0,0,0,0,0,1|1,0,1]=3 93 B7R1.3 SC1=CN=CC=C1 AT26584 [2,0,0,0,0,0|1,1,0]=4 94 B9R1.1 CC1=CN=C(CBr)C=C1 AC9707 [1,1,0,0,0,0|2,0,0]=4 95 B9R1.1 CCC1=CC=C(N)N=N1 AT21731 [1,1,0,0,0,0|2,0,0]=4 96 B9R1.1 CCC1=NC=C(O)C=C1 D76529 [1,1,0,0,0,0|1,0,0]=3 97 B9R1.1 NC1=CN=C(CO)C=C1 D77165 [1,1,0,0,0,0|1,0,0]=3 98 B9R1.1 OCC1=CN=C(Br)N=C1 D76260 [1,1,0,0,0,0|2,0,0]=4 99 B9R1.2 BrCC1=NC=CC(Br)=C1 AT15450 [1,1,0,0,0,0|2,0,0]=4 100 B9R1.2 CC1=CC(CBr)=NC=C1 AC9733 [1,1,0,0,0,0|2,0,0]=4 101 B9R1.2 CCC1=CN=NC(N)=C1 S11510 [1,1,0,0,0,0|2,0,0]=4 102 B9R1.2 ClCC1=CC(Cl)=CN=C1 H10969 [1,1,0,0,0,0|2,0,0]=4 103 B9R1.2 FC1=CC(CBr)=NC=C1 AC8274 [1,1,0,0,0,0|2,0,0]=4 104 B9R1.2 NCC1=NC=CC(F)=C1 N13372 [1,1,0,0,0,0|2,0,0]=4 105 B9R1.2 NCC1=NC=CC(O)=C1 79355 [1,1,0,0,0,0|2,0,0]=4 106 B9R1.2 O=C1C=CN=C(CO)N1 AT21628 [1,1,0,0,0,0|2,0,0]=4 107 B9R1.2 OCC1=NC=CC(Cl)=N1 AT21631 [1,1,0,0,0,0|2,0,0]=4 108 B9R1.8 CCNC1=CN=NC=C1 D86255 [1,1,0,0,0,0|2,0,0]=4 109 B9R1.8 CCOC1=CN=CC=C1 F31361 [1,1,0,0,0,0|1,0,0]=3 110 B9R1.8 CNCC1=CN=NC=C1 P12145 [1,1,0,0,0,0|2,0,0]=4 111 B9R1.8 ClCCC1=CN=CC=C1 D87792 [1,1,0,0,0,0|1,0,0]=3 112 B9R1.8 I\C=C/C1=CC=CC=C1 AT23642 [1,1,0,0,0,0|0,0,2]=4 113 B9R1.8 OCCC1=NC=NC=C1 20262 [1,1,0,0,0,0|2,0,0]=4 114 B9R1.8 SCCC1=CN=CC=C1 F18092 [1,1,0,0,0,0|1,0,0]=3 115 B9R1.15 CC1=C(CO)C=NN=C1 F30427 [1,1,0,0,0,0|2,0,0]=4 116 B9R1.15 CC1=CC=NN=C1CO F50171 [1,1,0,0,0,0|2,0,0]=4 117 B9R1.15 CC1=[13C](C=O)C=CC=C1 D98794 [1,1,0,0,0,0|0,0,2]=4 118 B9R1.15 NCC1=C(F)C=CN=C1 C90217 [1,1,0,0,0,0|2,0,0]=4 119 B9R1.15 NCC1=CC=CNC1=O D76881 [1,1,0,0,0,0|2,0,0]=4 120 B9R1.35 CC1=CC([C@H](C)O)=NO1 AT19829 [0,1,0,0,1,0|2,0,0]=4 121 B9R1.35 CC1=CC=C([C@H](C)N)O1 D96335 [0,1,0,0,1,0|2,0,0]=4 122 B9R1.35 CC1=CC=C([C@H](C)N)O1 D96391 [0,1,0,0,1,0|2,0,0]=4 123 B9R1.35 CC1=CC=C([C@H](C)N)O1 Y12181 [0,1,0,0,1,0|2,0,0]=4 124 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 E72737 [0,1,0,0,1,0|2,0,0]=4 125 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 Y11514 [0,1,0,0,1,0|2,0,0]=4 126 B9R1.35 C[C@H](N)C1=CC=C(Br)O1 Y11522 [0,1,0,0,1,0|2,0,0]=4 127 B9R1.35 C[C@H](O)C1=CC(Br)=NO1 AT19716 [0,1,0,0,1,0|2,0,0]=4 128 B9R1.35 C[C@H](O)C1=CN(C)C=N1 P12387 [0,1,0,0,1,0|2,0,0]=4 129 B9R1.35 C[C@H](O)C1=NN(C)C=C1 AT14456 [0,1,0,0,1,0|2,0,0]=4 130 B9R1.41 CC(C)C1=C(Br)SC=C1 D76982 [0,1,0,0,1,0|2,0,0]=4 131 B11R1.20 C[C@H](N)CC1=CC=C(I)C=C1 A10374 [0,1,0,0,0,1|1,0,0]=3 132 B11R1.36 CC(C)[C@H](C)C1=CC=CC=C1 T70930 [0,1,0,0,0,1|1,0,0]=3 133 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 N15520 [0,1,0,0,0,1|0,0,0]=2 134 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21494 [0,1,0,0,0,1|2,0,0]=4 135 B11R1.36 O[C@H](C1=CC=CC=C1)C(F)F AT21495 [0,1,0,0,0,1|2,0,0]=4 136 B11R1.40 CNC(=O)NC1=CC=CC=C1 D77088 [0,1,0,0,0,1|0,0,2]=4 137 B11R1.40 COC(=N)CC1=CC=CC=C1 C10559 [0,1,0,0,0,1|1,0,1]=4 138 B11R1.40 N#C[C@@H](N)CC1=CC=CC=C1 D76472 [0,1,0,0,0,1|1,0,1]=4 139 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 AC6790 [0,1,0,0,0,1|1,0,0]=3 140 B11R1.40 N[C@H](CF)CC1=CC=CC=C1 AC6791 [0,1,0,0,0,1|1,0,0]=3 141 B11R1.157 CC(=O)CC1=CC(N)=CC=C1 D75584 [0,1,0,0,0,1|0,0,2]=4 142 B11R1.157 C[C@H](N)CC1=CC=CC(Cl)=C1 D96441 [0,1,0,0,0,1|1,0,0]=3 143 B11R1.497 CC(C)C1=CC(=O)C=CC=C1 D72296 [0,1,0,0,0,1|1,0,0]=3 144 B11R1.3 COC1=CN=C([C@H](C)N)C=C1 N14204 [0,2,0,0,0,0|2,0,0]=4 145 B11R1.3 COC1=CN=C([C@H](C)O)N=C1 AT23879 [0,2,0,0,0,0|2,0,0]=4 146 B11R1.3 C[C@H](N)C1=CN=C(C#N)C=C1 P19331 [0,2,0,0,0,0|2,0,0]=4 147 B11R1.3 C[C@H](O)C1=CC=C(C=O)C=C1 D74867 [0,2,0,0,0,0|0,0,0]=2 148 B11R1.3 O=C(O)C1=CC=C(CF)C=C1 E72963 [0,2,0,0,0,0|1,0,1]=4 149 B11R1.19 CC(C)(Br)C1=CC=C(Br)C=C1 AC9251 [0,2,0,0,0,0|1,0,0]=3 150 B11R1.19 CC(C)(F)C1=CC=C(N)C=C1 AT21859 [0,2,0,0,0,0|1,0,0]=3 151 B11R1.19 CC(C)(F)C1=CC=C(O)C=C1 AC6205 [0,2,0,0,0,0|1,0,0]=3 152 B11R1.19 CC(C)(O)C1=NC=C(N)N=C1 AT20018 [0,2,0,0,0,0|2,0,0]=4 153 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 AT11670 [0,2,0,0,0,0|2,0,0]=4 154 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W15910 [0,2,0,0,0,0|2,0,0]=4 155 B11R1.19 CP(C)(=O)C1=CC=C(Br)C=C1 D73584 [0,2,0,0,0,0|1,0,1]=4 156 B11R1.19 C[S@](=N)(=O)C1=CC=C(N)C=C1 AT25737 [0,2,0,0,0,0|1,0,1]=4 157 B11R1.19 O=P(O)(O)C1=CC=C(Br)C=C1 T70400 [0,2,0,0,0,0|2,0,0]=4 158 B11R1.19 [2H]C([2H])([2H])C1=CC=C(N)C=C1 D98170 [0,2,0,0,0,0|2,0,0]=4 159 B11R1.19 [2H]C([2H])([2H])C1=CC=C(O)C=C1 D99239 [0,2,0,0,0,0|2,0,0]=4 160 B11R1.19 [2H]C1=CC=C(S(C)(=O)=O)C=C1 AC5556 [0,2,0,0,0,0|1,0,1]=4 161 B11R1.21 CC1=C(S)C=C(C(=O)O)C=C1 D74668 [0,2,0,0,0,0|1,0,1]=4 162 B11R1.21 CC1=CC(C(C)C)=CN=C1N AT11127 [0,2,0,0,0,0|2,0,0]=4 163 B11R1.21 CC1=CC(C(C)C)=NC=C1N AT11119 [0,2,0,0,0,0|2,0,0]=4 164 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 AT24134 [0,2,0,0,0,0|1,0,0]=3 165 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 AT24137 [0,2,0,0,0,0|1,0,0]=3 166 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 D76436 [0,2,0,0,0,0|1,0,0]=3 167 B11R1.21 NC1=C(Br)C=C(C(F)F)C=C1 AT21955 [0,2,0,0,0,0|2,0,0]=4 168 B11R1.21 NC1=C(Cl)C=CC(C(F)F)=C1 AT22855 [0,2,0,0,0,0|2,0,0]=4 169 B11R1.21 OC1=C(F)C=CC(C(F)F)=C1 D76518 [0,2,0,0,0,0|2,0,0]=4 170 B11R1.22 CNC(=S)C1=CC=C(Br)C=C1 AC9075 [0,2,0,0,0,0|0,1,1]=4 171 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 AT17335 [0,2,0,0,0,0|0,0,0]=2 172 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 AT17408 [0,2,0,0,0,0|0,0,0]=2 173 B11R1.166 CC(=O)C1=C(F)C=C(N)C=C1 AT16600 [0,2,0,0,0,0|0,0,2]=4 174 B11R1.166 CC(C)C1=C(F)C=C(N)C=C1 AT16598 [0,2,0,0,0,0|1,0,0]=3 175 B11R1.166 CC(C)C1=C(N)N=C(Br)C=C1 AT12665 [0,2,0,0,0,0|2,0,0]=4 176 B11R1.166 CC1=CC(Br)=C([C@H](C)N)C=C1 C92023 [0,2,0,0,0,0|1,0,0]=3 177 B11R1.166 CC1=CC(Br)=C([C@H](C)N)C=C1 C92046 [0,2,0,0,0,0|1,0,0]=3 178 B11R1.166 CC1=CC(Cl)=C([C@H](C)Br)C=C1 AT15344 [0,2,0,0,0,0|1,0,0]=3 179 B11R1.166 CC1=CC(Cl)=C([C@H](C)N)C=C1 D96376 [0,2,0,0,0,0|1,0,0]=3 180 B11R1.166 C[C@H](N)C1=C(Br)C=C(Cl)C=C1 C91974 [0,2,0,0,0,0|1,0,0]=3 181 B11R1.166 C[C@H](N)C1=C(Br)C=C(Cl)C=C1 C91977 [0,2,0,0,0,0|1,0,0]=3 182 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 C92027 [0,2,0,0,0,0|1,0,0]=3 183 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 C92048 [0,2,0,0,0,0|1,0,0]=3 184 B11R1.166 C[C@H](N)C1=C(Cl)C=C(Br)C=C1 D96375 [0,2,0,0,0,0|1,0,0]=3 185 B11R1.166 NC1=CC(S)=C(C(=O)O)C=C1 AT21193 [0,2,0,0,0,0|1,0,1]=4 186 B11R1.166 [2H]C1=C(N(C)C)C=CC(Cl)=C1 AC5651 [0,2,0,0,0,0|2,0,0]=4 187 B11R1.166 [2H]C1=C(N(C)C)C=CC(F)=C1 AC5650 [0,2,0,0,0,0|2,0,0]=4 188 B11R1.12 N#C[C@@H](CO)C1=CC=CC=C1 F11744 [0,2,0,0,0,0|0,0,1]=3 189 B11R1.12 NC\C(=C\Cl)C1=CC=CC=C1 42349 [0,2,0,0,0,0|1,0,1]=4 190 B11R1.16 NCCC(=O)C1=CC=CC=C1 AC9010 [0,2,0,0,0,0|0,0,2]=4 191 B11R1.16 NCCC(=O)C1=CC=CC=C1 D76552 [0,2,0,0,0,0|0,0,2]=4 192 B11R1.16 OCC[C@H](O)C1=CC=NC=C1 D76515 [0,2,0,0,0,0|1,0,0]=3 193 B11R1.23 CC[C@H](C)C1=CC=CC(N)=N1 AT24915 [0,2,0,0,0,0|2,0,0]=4 194 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 F13059 [0,2,0,0,0,0|1,0,0]=3 195 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 F13081 [0,2,0,0,0,0|1,0,0]=3 196 B11R1.23 CN[C@@H](C)C1=CC(C)=CC=C1 E72733 [0,2,0,0,0,0|1,0,0]=3 197 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 E72741 [0,2,0,0,0,0|1,0,0]=3 198 B11R1.23 CN[C@@H](C)C1=CC=CC(F)=C1 E72742 [0,2,0,0,0,0|1,0,0]=3 199 B11R1.23 C[C@H](C#N)C1=CC=CC(Br)=C1 AT16528 [0,2,0,0,0,0|1,0,0]=3 200 B11R1.23 NC[C@H](O)C1=CC=CC(Cl)=C1 Y10333 [0,2,0,0,0,0|0,0,0]=2 201 B11R1.23 N[C@@H](CF)C1=CC=CC(Cl)=C1 N14612 [0,2,0,0,0,0|1,0,0]=3 202 B11R1.23 N[C@@H](CO)C1=CC=CC(I)=C1 P12330 [0,2,0,0,0,0|1,0,0]=3 203 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 F16868 [0,2,0,0,0,0|1,0,0]=3 204 B11R1.23 O[C@@H](CF)C1=CC=CC(Cl)=C1 AT24264 [0,2,0,0,0,0|0,0,0]=2 205 B11R1.222 CC[C@H](O)C1=C(F)C=CC=C1 AT26732 [0,2,0,0,0,0|0,0,0]=2 206 B11R1.222 N#C[C@@H](F)C1=C(Cl)C=CC=C1 AC8978 [0,2,0,0,0,0|1,0,1]=4 207 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13417 [0,2,0,0,0,0|1,0,0]=3 208 B11R1.222 NC[C@H](N)C1=C(Br)C=CC=C1 N13440 [0,2,0,0,0,0|1,0,0]=3 209 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 AT24988 [0,2,0,0,0,0|2,0,0]=4 210 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 N14405 [0,2,0,0,0,0|2,0,0]=4 211 B11R1.222 O=C(NO)C1=C(Br)C=CC=C1 D76830 [0,2,0,0,0,0|1,0,1]=4 212 B11R1.222 O[C@@H](CF)C1=CC=CN=C1F AT10159 [0,2,0,0,0,0|1,0,0]=3 213 B11R1.87 CC(C)(C)C1=C(Br)C=CC=N1 AT10672 [0,2,0,0,0,0|2,0,0]=4 214 B11R1.87 CC(C)(C)C1=C(Cl)C=CC=N1 68805 [0,2,0,0,0,0|2,0,0]=4 215 B11R1.87 CC(C)(N)C1=C(N)C=CC=C1 D86445 [0,2,0,0,0,0|1,0,0]=3 216 B11R1.87 CC(C)(O)C1=NC=CC=C1N AT11529 [0,2,0,0,0,0|1,0,0]=3 217 B11R1.87 CP(C)(=O)C1=C(I)C=CC=C1 AT11111 [0,2,0,0,0,0|1,0,1]=4 218 B11R1.87 [2H]C([2H])([2H])C1=C(Br)C=CC=C1 AT21395 [0,2,0,0,0,0|2,0,0]=4 219 B11R1.87 [2H]C([2H])([2H])C1=C(O)C=CC=C1 D98895 [0,2,0,0,0,0|2,0,0]=4 220 B11R1.155 CC(C)(C)C1=CN=CC(N)=C1 F51180 [0,2,0,0,0,0|2,0,0]=4 221 B11R1.155 CC(C)(N)C1=CC(F)=CN=C1 AT26869 [0,2,0,0,0,0|2,0,0]=4 222 B11R1.155 CC(C)(O)C1=CC(F)=CN=C1 AT26870 [0,2,0,0,0,0|1,0,0]=3 223 B11R1.155 CC(F)(F)C1=NC=CC(Br)=C1 AT14848 [0,2,0,0,0,0|2,0,0]=4 224 B11R1.155 CC(F)(F)C1=NC=CC(Cl)=C1 86999 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.155 CC(F)(F)C1=NC=CC(N)=C1 C91252 [0,2,0,0,0,0|2,0,0]=4 226 B11R1.155 [2H]C([2H])([2H])C1=CC=CC(O)=C1 D98620 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.53 CC(C)C1=CC=CN=C1C=O AT24574 [0,2,0,0,0,0|2,0,0]=4 228 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 N14391 [0,2,0,0,0,0|1,0,0]=3 229 B11R1.53 C[C@H](N)C1=C(CO)C=CC=C1 Y12531 [0,2,0,0,0,0|1,0,0]=3 230 B11R1.156 CC(C)C1=C(F)C=CC=C1O AT20215 [0,2,0,0,0,0|1,0,0]=3 231 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl C92035 [0,2,0,0,0,0|1,0,0]=3 232 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1Cl C92044 [0,2,0,0,0,0|1,0,0]=3 233 B11R1.156 C[C@H](N)C1=C(Br)C=CC=C1F C92042 [0,2,0,0,0,0|1,0,0]=3 234 B11R1.156 C[C@H](O)C1=C(Cl)C=CN=C1Cl AT13837 [0,2,0,0,0,0|1,0,0]=3 235 B11R1.159 CC(C)C1=C(N)C(Cl)=NC=C1 AT11113 [0,2,0,0,0,0|2,0,0]=4 236 B11R1.159 CC(C)C1=CC=CC(F)=C1O AT20236 [0,2,0,0,0,0|1,0,0]=3 237 B11R1.159 CC1=CN=CC(C(C)C)=C1N AT11103 [0,2,0,0,0,0|2,0,0]=4 238 B11R1.159 CC1=NC=CC(C(C)C)=C1N AT11125 [0,2,0,0,0,0|2,0,0]=4 239 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Br C92031 [0,2,0,0,0,0|1,0,0]=3 240 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Br C92054 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Br C92033 [0,2,0,0,0,0|1,0,0]=3 242 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Br C92052 [0,2,0,0,0,0|1,0,0]=3 243 B11R1.159 C[C@H](N)C1=NC=CC(Cl)=C1F AT25603 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.159 C[C@H](N)C1=NC=CC(Cl)=C1F AT25605 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.159 C[C@H](N)C1=NC=CC(Cl)=C1F AT25606 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.159 C[C@H](O)C1=CC=CC(F)=C1F AT11383 [0,2,0,0,0,0|0,0,0]=2 247 B11R1.159 C[C@H](O)C1=CC=CC(F)=C1F AT11384 [0,2,0,0,0,0|0,0,0]=2 248 B11R1.159 C[C@H](O)C1=CC=CC(F)=C1O AT22639 [0,2,0,0,0,0|0,0,0]=2 249 B11R1.167 CC(=O)C1=C(Br)C=CC(N)=C1 O10299 [0,2,0,0,0,0|0,0,2]=4 250 B11R1.167 CC(C)C1=C(Br)C=CC(N)=N1 AT24913 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.167 CC1=CC(C(C)C)=C(N)C=C1 F52420 [0,2,0,0,0,0|1,0,0]=3 252 B11R1.167 CC1=CC([C@H](C)N)=C(Br)C=C1 C92014 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.167 CC1=CC([C@H](C)N)=C(Br)C=C1 C92021 [0,2,0,0,0,0|1,0,0]=3 254 B11R1.167 CC1=CN=C(N)C(C(C)C)=C1 AT11126 [0,2,0,0,0,0|2,0,0]=4 255 B11R1.167 C[C@H](N)C1=C(Br)C=CC(Cl)=C1 C91966 [0,2,0,0,0,0|1,0,0]=3 256 B11R1.167 C[C@H](N)C1=C(Br)C=CC(Cl)=C1 C91970 [0,2,0,0,0,0|1,0,0]=3 257 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24142 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.167 C[C@H](N)C1=C(F)C=CC(Br)=C1 AT24143 [0,2,0,0,0,0|1,0,0]=3 259 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 N13234 [0,2,0,0,0,0|1,0,0]=3 260 B11R1.167 C[C@H](N)C1=C(O)C=CC(Cl)=C1 50793 [0,2,0,0,0,0|1,0,0]=3 261 B11R1.167 C[C@H](N)C1=CC(Br)=NC=C1F AT14347 [0,2,0,0,0,0|2,0,0]=4 262 B11R1.167 C[C@H](N)C1=CC(Br)=NC=C1F AT14350 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.167 C[C@H](O)C1=CC(F)=CN=C1Cl D79304 [0,2,0,0,0,0|1,0,0]=3 264 B11R1.167 C[C@H](O)C1=CC(F)=CN=C1F AT10059 [0,2,0,0,0,0|1,0,0]=3 265 B11R1.167 C[C@H](O)C1=CC(F)=CN=C1F AT10060 [0,2,0,0,0,0|1,0,0]=3 266 B11R1.167 NC1=C(C(F)F)C=C(Br)C=C1 AT22859 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.167 NC1=CC(C(F)F)=C(Br)C=C1 AT22857 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.167 NC1=CC(C(F)F)=C(O)C=C1 AT26539 [0,2,0,0,0,0|2,0,0]=4 269 B11R1.167 OC1=C(C(F)F)C=C(F)C=C1 79333 [0,2,0,0,0,0|2,0,0]=4 270 B11R1.74 CC(C)C1=CC(Cl)=CC(N)=C1 AT26935 [0,2,0,0,0,0|1,0,0]=3 271 B11R1.74 CC1=CC(Cl)=CC([C@H](C)N)=N1 AT14054 [0,2,0,0,0,0|2,0,0]=4 272 B11R1.74 CC1=CC(N)=NC(C(C)C)=C1 AT11133 [0,2,0,0,0,0|2,0,0]=4 273 B11R1.74 FC1=CC(C(F)F)=CC(S)=C1 97707 [0,2,0,0,0,0|2,0,0]=4 274 B11R1.74 NC1=CC(C(F)F)=CC(Br)=C1 AT22858 [0,2,0,0,0,0|2,0,0]=4 275 B11R1.74 [2H]C1=CC([2H])=CC(C(=O)O)=C1 D99631 [0,2,0,0,0,0|1,0,1]=4 276 B11R1.266 CC(C)C1=CC(C#N)=NC=C1 AT26688 [0,2,0,0,0,0|2,0,0]=4 277 B11R1.266 CNC1=CC=CC(B(O)O)=C1 D74781 [0,2,0,0,0,0|2,0,0]=4 278 B11R1.266 COC1=CC([C@H](C)N)=NC=C1 90527 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.266 COC1=CN=CC([C@H](C)N)=C1 Y13929 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.266 COC1=NC([C@H](C)N)=CC=C1 Y12186 [0,2,0,0,0,0|2,0,0]=4 281 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 P15599 [0,0,0,1,0,1|1,0,0]=3 282 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 P19381 [0,0,0,1,0,1|1,0,0]=3 283 B11R2.10 IC1CC2=C(C=CC=C2)C1 H10270 [0,0,0,1,0,1|1,0,0]=3 284 B11R2.10 N[C@H]1CC2=CC=CN=C2C1 AT25949 [0,0,0,1,0,1|2,0,0]=4 285 B11R2.34 FC1=CC=C(C2CC2)C=C1 AC9033 [0,1,0,1,0,0|1,0,0]=3 286 B11R2.34 FC1=CN=C(C2CC2)C=C1 AC8048 [0,1,0,1,0,0|2,0,0]=4 287 B11R2.34 OC1=CN=C(C2CC2)C=C1 D76530 [0,1,0,1,0,0|2,0,0]=4 288 B11R2.1 BrC1=NOC2=C1C=CC=C2 D77128 [0,1,0,1,0,0|1,0,1]=4 289 B11R2.1 C[C@@H]1NCC2=C1C=CC=C2 E73009 [0,1,0,1,0,0|1,0,0]=3 290 B11R2.1 C[C@H]1CNC2=NC=CC=C21 93644 [0,1,0,1,0,0|2,0,0]=4 291 B11R2.1 NC1=C2C=CC=CC2=NO1 AC2203 [0,1,0,1,0,0|1,0,1]=4 292 B11R2.1 N[C@H]1CCC2=NC=CC=C21 C15938 [0,1,0,1,0,0|2,0,0]=4 293 B11R2.1 N[C@H]1COC2=C1C=CC=C2 F16957 [0,1,0,1,0,0|1,0,0]=3 294 B11R2.1 OB1OCC2=C1C=NC=C2 AT12854 [0,1,0,1,0,0|2,0,0]=4 295 B11R2.40 NC1(C2=CC=NC=C2)CC1 AC2827 [0,1,0,1,0,0|2,0,0]=4 296 B11R2.40 OC1(C2=CC=CC=C2)CC1 D72927 [0,1,0,1,0,0|0,0,0]=2 297 B11R2.40 OC1(C2=NC=CC=C2)CC1 AC9082 [0,1,0,1,0,0|1,0,0]=3 298 B11R2.239 C1=CN=CC(C2CNC2)=C1 AT10105 [0,1,0,1,0,0|2,0,0]=4 299 B11R2.55 BrC1=C(C2CC2)C=NC=C1 AT10334 [0,1,0,1,0,0|2,0,0]=4 300 B11R2.55 IC1=C(C2CC2)C=CN=C1 AT16335 [0,1,0,1,0,0|2,0,0]=4 301 B11R2.55 NC1=C(C2CC2)C=NC=C1 O10997 [0,1,0,1,0,0|2,0,0]=4 302 B11R2.468 O=C1CC2=CC=CC(Br)=C12 AT20401 [0,1,0,1,0,0|0,0,2]=4 303 B11R2.35 ClC1=NC(C2CC2)=CC=C1 AT12437 [0,1,0,1,0,0|2,0,0]=4 304 B11R2.35 FC1=CC(C2CC2)=NC=C1 AT11496 [0,1,0,1,0,0|2,0,0]=4 305 B11R2.117 N[C@H]1CC2=C1C=C(F)C=C2 AT11821 [0,1,0,1,0,0|1,0,0]=3 306 B7R1.1 CCC1=NNC=C1 D77034 [1,0,0,0,1,0|2,0,0]=4 307 B11R1.91 C[C@H](O)CCC1=CC=NC=C1 AT24513 [0,0,0,0,0,2|1,0,0]=3