0 B5R0.5 CC(C)S(N)=O O29745 [0,0,0,0,0,0|3,1,0]=4 1 B5R0.5 CC(Cl)C(=N)N L21176 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.5 CC(N)C(C)O P38125 [0,0,0,0,0,0|1,1,0]=2 3 B5R0.5 CC(N)C(F)F H-8439 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.5 CC(N)C(F)F H-8440 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.5 CC(N)C(N)=O P37963 [0,0,0,0,0,0|2,1,1]=4 6 B5R0.5 CC(O)C(N)=O P39940 [0,0,0,0,0,0|1,2,1]=4 7 B5R0.5 C[C@@H](O)C(=N)N P38252 [0,0,0,0,0,0|2,1,1]=4 8 B5R0.5 C[C@@H](O)C(N)=O P37171 [0,0,0,0,0,0|1,2,1]=4 9 B5R0.5 C[C@H](O)C(=N)N P41718 [0,0,0,0,0,0|2,1,1]=4 10 B4R0.1 C#CC(C)N P51445 [1,0,0,0,0,0|1,0,2]=4 11 B4R0.1 C#C[C@@H](C)N Q52993 [1,0,0,0,0,0|1,0,2]=4 12 B4R0.1 C#C[C@H](C)O Q52831 [1,0,0,0,0,0|0,1,2]=4 13 B4R0.1 C=C(C)CN P39039 [1,0,0,0,0,0|2,0,1]=4 14 B4R0.1 CC(=O)CN P45193 [1,0,0,0,0,0|1,1,1]=4 15 B4R0.1 CC(Br)CO O34000 [1,0,0,0,0,0|1,1,0]=3 16 B4R0.1 CC(C)NO O30196 [1,0,0,0,0,0|2,1,0]=4 17 B4R0.1 CC(N)CS L19436 [1,0,0,0,0,0|1,0,0]=2 18 B4R0.1 CC(S)CN L19389 [1,0,0,0,0,0|1,0,0]=2 19 B4R0.1 C[C@@H](Cl)CO 10058 [1,0,0,0,0,0|1,1,0]=3 20 B6R0.3 CC(C)C(C)NN P42479 [0,1,0,0,0,0|2,0,0]=3 21 B6R0.3 CC(C)C(O)CN P40479 [0,1,0,0,0,0|1,1,0]=3 22 B6R0.3 CC(C)[C@@H](N)CO L13788 [0,1,0,0,0,0|2,0,0]=3 23 B6R0.3 CCC(C)C(C)N O31127 [0,1,0,0,0,0|2,0,0]=3 24 B6R0.3 CCC(N)C(C)O L20519 [0,1,0,0,0,0|1,1,0]=3 25 B6R0.3 CNC(=O)C(C)N P38407 [0,1,0,0,0,0|1,1,1]=4 26 B6R0.3 CNC(=O)[C@@H](C)N P37080 [0,1,0,0,0,0|1,1,1]=4 27 B6R0.3 CNC(=O)[C@H](C)N P37082 [0,1,0,0,0,0|1,1,1]=4 28 B6R0.7 CC(C)C(C)(C)N O32138 [0,1,0,0,0,0|2,0,0]=3 29 B6R0.7 CC(N)C(F)(F)F 10701 [0,1,0,0,0,0|3,0,0]=4 30 B6R0.7 CC(O)C(F)(F)F P38470 [0,1,0,0,0,0|2,1,0]=4 31 B6R0.7 C[C@@H](N)C(F)(F)F F-4128 [0,1,0,0,0,0|3,0,0]=4 32 B6R1.4 CC1CCC1=O P47956 [0,0,0,1,0,0|1,1,1]=4 33 B6R1.4 CC1CCC1N P44937 [0,0,0,1,0,0|2,0,0]=3 34 B6R1.4 CC1CCC1N P47065 [0,0,0,1,0,0|2,0,0]=3 35 B6R1.4 CC1CCC1O L20058 [0,0,0,1,0,0|1,1,0]=3 36 B6R1.4 CC1CNC1C P45190 [0,0,0,1,0,0|2,0,0]=3 37 B6R1.4 CC1CNC1C P46961 [0,0,0,1,0,0|2,0,0]=3 38 B6R1.4 CC1NCC1F P47439 [0,0,0,1,0,0|2,0,0]=3 39 B6R1.4 CC1NCC1F P47451 [0,0,0,1,0,0|2,0,0]=3 40 B6R1.4 CC1NCC1O P44849 [0,0,0,1,0,0|1,1,0]=3 41 B6R1.4 CC1NCC1O P44851 [0,0,0,1,0,0|1,1,0]=3 42 B6R1.4 CC1OCC1=O L18036 [0,0,0,1,0,0|0,2,1]=4 43 B6R1.4 CC1OCC1Br Q56171 [0,0,0,1,0,0|1,1,0]=3 44 B6R1.4 CC1OCC1I Q56172 [0,0,0,1,0,0|1,1,0]=3 45 B6R1.4 CC1OCC1N Q56170 [0,0,0,1,0,0|1,1,0]=3 46 B6R1.4 CC1OCC1O L18037 [0,0,0,1,0,0|0,2,0]=3 47 B6R1.4 C[C@@H]1NCC1F P50109 [0,0,0,1,0,0|2,0,0]=3 48 B6R1.4 C[C@@H]1NCC1O P47321 [0,0,0,1,0,0|1,1,0]=3 49 B6R1.4 C[C@@H]1NC[C@@H]1F P50877 [0,0,0,1,0,0|2,0,0]=3 50 B6R1.4 C[C@@H]1NC[C@@H]1F P50878 [0,0,0,1,0,0|2,0,0]=3 51 B6R1.4 C[C@@H]1NC[C@@H]1O P46638 [0,0,0,1,0,0|1,1,0]=3 52 B6R1.4 C[C@@H]1NC[C@@H]1O P48644 [0,0,0,1,0,0|1,1,0]=3 53 B6R1.4 C[C@@H]1NC[C@@H]1O P48652 [0,0,0,1,0,0|1,1,0]=3 54 B6R1.4 C[C@@H]1NC[C@@H]1O P50879 [0,0,0,1,0,0|1,1,0]=3 55 B6R1.4 C[C@@H]1NC[C@H]1F P50880 [0,0,0,1,0,0|2,0,0]=3 56 B6R1.4 C[C@@H]1NC[C@H]1F P50881 [0,0,0,1,0,0|2,0,0]=3 57 B6R1.4 C[C@@H]1NC[C@H]1O P46945 [0,0,0,1,0,0|1,1,0]=3 58 B6R1.4 C[C@@H]1NC[C@H]1O P48643 [0,0,0,1,0,0|1,1,0]=3 59 B6R1.4 C[C@@H]1NC[C@H]1O P48651 [0,0,0,1,0,0|1,1,0]=3 60 B6R1.4 C[C@@H]1OC[C@H]1O Q56119 [0,0,0,1,0,0|0,2,0]=3 61 B6R1.4 C[C@H]1NCC1F P50084 [0,0,0,1,0,0|2,0,0]=3 62 B6R1.4 C[C@H]1NCC1O P50087 [0,0,0,1,0,0|1,1,0]=3 63 B6R1.4 C[C@H]1NC[C@@H]1F P50079 [0,0,0,1,0,0|2,0,0]=3 64 B6R1.4 C[C@H]1NC[C@@H]1O P50080 [0,0,0,1,0,0|1,1,0]=3 65 B6R1.4 C[C@H]1NC[C@H]1F P50081 [0,0,0,1,0,0|2,0,0]=3 66 B6R1.4 C[C@H]1NC[C@H]1O P50082 [0,0,0,1,0,0|1,1,0]=3 67 B6R1.4 C[C@H]1NC[C@H]1O P50119 [0,0,0,1,0,0|1,1,0]=3 68 B6R1.4 C[C@H]1OC[C@H]1O Q56118 [0,0,0,1,0,0|0,2,0]=3 69 B6R1.4 NC1CCC1F P47239 [0,0,0,1,0,0|2,0,0]=3 70 B6R1.4 NC1CCC1F Q56123 [0,0,0,1,0,0|2,0,0]=3 71 B6R1.4 NC1CCC1O P45290 [0,0,0,1,0,0|1,1,0]=3 72 B6R1.4 NC1CCC1O P48134 [0,0,0,1,0,0|1,1,0]=3 73 B6R1.4 N[C@@H]1CC[C@@H]1O P43811 [0,0,0,1,0,0|1,1,0]=3 74 B6R1.4 N[C@@H]1CC[C@@H]1O P45279 [0,0,0,1,0,0|1,1,0]=3 75 B6R1.4 N[C@@H]1CC[C@@H]1O P45323 [0,0,0,1,0,0|1,1,0]=3 76 B6R1.4 N[C@@H]1CC[C@H]1O P45283 [0,0,0,1,0,0|1,1,0]=3 77 B6R1.4 N[C@@H]1CC[C@H]1O P46699 [0,0,0,1,0,0|1,1,0]=3 78 B6R1.4 N[C@@H]1CC[C@H]1O P46700 [0,0,0,1,0,0|1,1,0]=3 79 B6R1.4 N[C@@H]1CC[C@H]1O P47798 [0,0,0,1,0,0|1,1,0]=3 80 B6R1.4 N[C@H]1CC[C@@H]1O O33030 [0,0,0,1,0,0|1,1,0]=3 81 B6R1.4 N[C@H]1CC[C@@H]1O P46969 [0,0,0,1,0,0|1,1,0]=3 82 B6R1.4 N[C@H]1CC[C@H]1O P45237 [0,0,0,1,0,0|1,1,0]=3 83 B6R1.4 N[C@H]1CC[C@H]1O P46397 [0,0,0,1,0,0|1,1,0]=3 84 B6R1.4 O=C1CCC1Br P49445 [0,0,0,1,0,0|1,1,1]=4 85 B6R1.4 O=C1CCC1O P47312 [0,0,0,1,0,0|0,2,1]=4 86 B6R1.4 OC1CCC1F P46352 [0,0,0,1,0,0|1,1,0]=3 87 B6R1.4 OC1CCC1O P50009 [0,0,0,1,0,0|0,2,0]=3 88 B6R1.4 O[C@@H]1CC[C@H]1O P45708 [0,0,0,1,0,0|0,2,0]=3 89 B6R1.4 O[C@H]1CC[C@H]1O P45709 [0,0,0,1,0,0|0,2,0]=3 90 B6R1.9 CC1(C)CC1Br O33124 [0,0,0,1,0,0|2,0,0]=3 91 B6R1.9 FC1(F)CC1Br L14733 [0,0,0,1,0,0|3,0,0]=4 92 B6R1.9 NC1CC1(F)F L14110 [0,0,0,1,0,0|3,0,0]=4 93 B6R1.11 CC(N)C1CC1 A-640 [0,0,0,1,0,0|2,0,0]=3 94 B6R1.11 CC(N)C1CC1 A-640-HCL [0,0,0,1,0,0|2,0,0]=3 95 B6R1.11 C[C@@H](N)C1CC1 P46530 [0,0,0,1,0,0|2,0,0]=3 96 B6R1.11 C[C@H](N)C1CC1 L14639 [0,0,0,1,0,0|2,0,0]=3 97 B6R1.11 C[C@H](O)C1CC1 K13410 [0,0,0,1,0,0|1,1,0]=3 98 B6R0.2 CC(=O)NC(C)C P50955 [0,0,0,0,0,1|1,1,1]=4 99 B6R0.2 CC(C)C[C@@H](C)O Q70085 [0,0,0,0,0,1|1,1,0]=3 100 B6R0.2 CC(N)CN(C)C P42731 [0,0,0,0,0,1|3,0,0]=4 101 B6R0.2 C[C@@H](N)CN(C)C P38236 [0,0,0,0,0,1|3,0,0]=4 102 B6R0.2 C[C@H](N)CN(C)C P35926 [0,0,0,0,0,1|3,0,0]=4 103 B3R0.1 CCNN H-8579 [2,0,0,0,0,0|2,0,0]=4 104 B3R0.1 CCNN O31940 [2,0,0,0,0,0|2,0,0]=4 105 B3R0.2 C[PH](C)=O O30537 [2,0,0,0,0,0|1,1,0]=4 106 B5R0.1 CC(N)CCO P39048 [1,1,0,0,0,0|1,0,0]=3 107 B5R0.1 CC(O)CCN M22972 [1,1,0,0,0,0|0,1,0]=3 108 B5R0.1 CC(O)CON M15150 [1,1,0,0,0,0|0,2,0]=4 109 B5R0.1 CCC[C@H](C)N I-9318 [1,1,0,0,0,0|1,0,0]=3 110 B5R0.1 CNCC(C)O P40721 [1,1,0,0,0,0|0,1,0]=3 111 B5R0.1 CNCC(F)F P41399 [1,1,0,0,0,0|2,0,0]=4 112 B5R0.1 CNC[C@@H](C)O P41738 [1,1,0,0,0,0|0,1,0]=3 113 B5R0.1 CNC[C@H](C)O P36531 [1,1,0,0,0,0|0,1,0]=3 114 B5R0.1 COCC(C)Br O32164 [1,1,0,0,0,0|1,0,0]=3 115 B5R0.1 C[C@@H](N)CCO F-4752 [1,1,0,0,0,0|1,0,0]=3 116 B5R0.1 C[C@H](N)CC#N Q66038 [1,1,0,0,0,0|1,0,1]=4 117 B5R0.1 C[C@H](N)CCO F-4570 [1,1,0,0,0,0|1,0,0]=3 118 B5R0.1 OCCC(F)F P45589 [1,1,0,0,0,0|2,0,0]=4 119 B5R0.3 C#CC(O)CC P38163 [1,1,0,0,0,0|0,1,1]=4 120 B5R0.3 CC(CBr)CBr O34172 [1,1,0,0,0,0|2,0,0]=4 121 B5R0.3 CC(CN)CO O30604 [1,1,0,0,0,0|1,1,0]=4 122 B5R0.3 CCC(C)NN O30637 [1,1,0,0,0,0|1,0,0]=3 123 B5R0.3 CNC(C)CO M23268 [1,1,0,0,0,0|1,1,0]=4 124 B5R0.3 CN[C@@H](C)CO P38191 [1,1,0,0,0,0|1,1,0]=4 125 B5R0.3 CN[C@H](C)CO P41018 [1,1,0,0,0,0|1,1,0]=4 126 B5R0.3 COC(C)CN P36510 [1,1,0,0,0,0|1,1,0]=4 127 B5R0.3 NCC(O)CF M23924 [1,1,0,0,0,0|1,1,0]=4 128 B5R0.3 NC[C@@H](F)CO L22313 [1,1,0,0,0,0|1,1,0]=4 129 B5R0.3 NC[C@@H](O)CCl Q69638 [1,1,0,0,0,0|1,1,0]=4 130 B5R0.3 NC[C@H](F)CO O33576 [1,1,0,0,0,0|1,1,0]=4 131 B5R0.4 CC(C)(C)CBr P36951 [1,1,0,0,0,0|2,0,0]=4 132 B5R0.4 CC(C)(F)CO P45778 [1,1,0,0,0,0|1,1,0]=4 133 B5R0.4 CC(C)(O)CN G-7049 [1,1,0,0,0,0|1,1,0]=4 134 B5R0.4 CC(F)(F)CN M15293 [1,1,0,0,0,0|2,0,0]=4 135 B7R0.5 CC(C)[C@H](N)CCO Q69023 [0,2,0,0,0,0|2,0,0]=4 136 B7R0.5 CCCC(C)C(C)N L19280 [0,2,0,0,0,0|2,0,0]=4 137 B7R0.14 CC(C)(C)C(N)CO P38365 [0,2,0,0,0,0|2,0,0]=4 138 B7R0.14 CC(C)(C)[C@@H](N)CO H-8828 [0,2,0,0,0,0|2,0,0]=4 139 B7R0.14 CC(C)(C)[C@H](N)CO P42613 [0,2,0,0,0,0|2,0,0]=4 140 B7R0.14 CC(C)(O)[C@@H](F)CN P50799 [0,2,0,0,0,0|1,1,0]=4 141 B7R0.15 CCC(CO)C(C)C K16110 [0,2,0,0,0,0|1,1,0]=4 142 B5R1.2 BrC1CNC1 D-2507 [1,0,0,1,0,0|2,0,0]=4 143 B5R1.2 BrC1CNC1 P39525 [1,0,0,1,0,0|2,0,0]=4 144 B5R1.2 BrC1COC1 C-2448 [1,0,0,1,0,0|1,1,0]=4 145 B5R1.2 C=C1CCC1 P49771 [1,0,0,1,0,0|1,0,1]=4 146 B5R1.2 CC1CCN1 M22690 [1,0,0,1,0,0|1,0,0]=3 147 B5R1.2 CC1CCN1 P44577 [1,0,0,1,0,0|1,0,0]=3 148 B5R1.2 CC1CCO1 Q53239 [1,0,0,1,0,0|0,1,0]=3 149 B5R1.2 CC1CNC1 C-2879 [1,0,0,1,0,0|2,0,0]=4 150 B5R1.2 C[C@@H]1CCN1 P45172 [1,0,0,1,0,0|1,0,0]=3 151 B5R1.2 C[C@@H]1CCO1 Q53238 [1,0,0,1,0,0|0,1,0]=3 152 B5R1.2 C[C@H]1CCN1 P44797 [1,0,0,1,0,0|1,0,0]=3 153 B5R1.2 C[C@H]1CCO1 Q53237 [1,0,0,1,0,0|0,1,0]=3 154 B5R1.2 ClC1CNC1 G-7722 [1,0,0,1,0,0|2,0,0]=4 155 B5R1.2 ClC1COC1 L21610 [1,0,0,1,0,0|1,1,0]=4 156 B5R1.2 FC1CNC1 A-433 [1,0,0,1,0,0|2,0,0]=4 157 B5R1.2 FC1CNC1 P45315 [1,0,0,1,0,0|2,0,0]=4 158 B5R1.2 IC1CCC1 L21363 [1,0,0,1,0,0|1,0,0]=3 159 B5R1.2 IC1CNC1 F-4497 [1,0,0,1,0,0|2,0,0]=4 160 B5R1.2 IC1COC1 C-2449 [1,0,0,1,0,0|1,1,0]=4 161 B5R1.2 NC1CCC1 P45382 [1,0,0,1,0,0|1,0,0]=3 162 B5R1.2 NC1CNC1 L13523 [1,0,0,1,0,0|2,0,0]=4 163 B5R1.2 NC1COC1 C-2472 [1,0,0,1,0,0|1,1,0]=4 164 B5R1.2 NC1COC1 O31926 [1,0,0,1,0,0|1,1,0]=4 165 B5R1.2 NC1CSC1 G-6637 [1,0,0,1,0,0|1,0,0]=3 166 B5R1.2 NC1CSC1 Q58806 [1,0,0,1,0,0|1,0,0]=3 167 B5R1.2 NC1CSC1 S72763 [1,0,0,1,0,0|1,0,0]=3 168 B5R1.2 O=C1CSC1 A-895 [1,0,0,1,0,0|0,1,1]=4 169 B5R1.2 OC1CNC1 A-407 [1,0,0,1,0,0|1,1,0]=4 170 B5R1.2 OC1CNC1 O28030 [1,0,0,1,0,0|1,1,0]=4 171 B5R1.2 OC1COC1 B-1102 [1,0,0,1,0,0|0,2,0]=4 172 B5R1.2 OC1CSC1 L21497 [1,0,0,1,0,0|0,1,0]=3 173 B5R1.2 SC1CNC1 G-7240 [1,0,0,1,0,0|1,0,0]=3 174 B5R1.2 SC1COC1 G-6845 [1,0,0,1,0,0|0,1,0]=3 175 B5R1.3 CNC1CC1 G-6453 [1,0,0,1,0,0|2,0,0]=4 176 B5R1.3 ClCC1CS1 H-8564 [1,0,0,1,0,0|1,0,0]=3 177 B5R1.3 ICC1CC1 P38738 [1,0,0,1,0,0|2,0,0]=4 178 B5R1.3 SCC1CC1 F-4776 [1,0,0,1,0,0|1,0,0]=3 179 B5R1.4 NC1CC1F O33119 [1,0,0,1,0,0|2,0,0]=4 180 B5R1.4 N[C@@H]1C[C@H]1N Q54346 [1,0,0,1,0,0|2,0,0]=4 181 B5R1.4 N[C@H]1C[C@@H]1F Q52395 [1,0,0,1,0,0|2,0,0]=4 182 B5R1.5 CC1(Br)CC1 L14741 [1,0,0,1,0,0|1,0,0]=3 183 B5R1.5 CC1(N)CC1 F-4521 [1,0,0,1,0,0|1,0,0]=3 184 B5R1.5 CC1(O)CC1 F-4583 [1,0,0,1,0,0|0,1,0]=3 185 B7R1.2 CC1CC(O)CN1 Q59204 [0,0,0,1,0,1|1,1,0]=4 186 B7R1.2 CC1CC(O)CN1 Q59205 [0,0,0,1,0,1|1,1,0]=4 187 B7R1.2 CC1CCC(N)C1 Q56970 [0,0,0,1,0,1|2,0,0]=4 188 B7R1.2 C[C@@H]1CC[C@@H](C)N1 O32970 [0,0,0,1,0,1|2,0,0]=4 189 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Q61707 [0,0,0,1,0,1|2,0,0]=4 190 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Q61742 [0,0,0,1,0,1|2,0,0]=4 191 B7R1.2 C[C@@H]1CN[C@@H](C)C1 Q61627 [0,0,0,1,0,1|2,0,0]=4 192 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Q56025 [0,0,0,1,0,1|1,1,0]=4 193 B7R1.2 C[C@@H]1C[C@H](F)CN1 Q54433 [0,0,0,1,0,1|2,0,0]=4 194 B7R1.2 C[C@@H]1C[C@H](O)CN1 L14502 [0,0,0,1,0,1|1,1,0]=4 195 B7R1.2 C[C@H]1CC[C@@H](C)N1 O32965 [0,0,0,1,0,1|2,0,0]=4 196 B7R1.2 C[C@H]1CC[C@@H](C)N1 Q61708 [0,0,0,1,0,1|2,0,0]=4 197 B7R1.2 C[C@H]1C[C@@H](O)CN1 Q56026 [0,0,0,1,0,1|1,1,0]=4 198 B7R1.2 C[C@H]1C[C@H](O)CN1 L13861 [0,0,0,1,0,1|1,1,0]=4 199 B7R1.2 NC1CCC(F)C1 Q54470 [0,0,0,1,0,1|2,0,0]=4 200 B7R1.2 NC1CCC(F)C1 Q54471 [0,0,0,1,0,1|2,0,0]=4 201 B7R1.2 NC1CCC(O)C1 G-5810 [0,0,0,1,0,1|1,1,0]=4 202 B7R1.2 N[C@@H]1CC[C@@H](F)C1 Q56999 [0,0,0,1,0,1|2,0,0]=4 203 B7R1.2 N[C@@H]1CC[C@@H](F)C1 Q57000 [0,0,0,1,0,1|2,0,0]=4 204 B7R1.2 N[C@@H]1CC[C@@H](F)C1 Q57004 [0,0,0,1,0,1|2,0,0]=4 205 B7R1.2 N[C@@H]1CC[C@@H](O)C1 G-6580 [0,0,0,1,0,1|1,1,0]=4 206 B7R1.2 N[C@@H]1CC[C@@H](O)C1 L13346 [0,0,0,1,0,1|1,1,0]=4 207 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Q57092 [0,0,0,1,0,1|1,1,0]=4 208 B7R1.2 N[C@@H]1CC[C@H](F)C1 Q57002 [0,0,0,1,0,1|2,0,0]=4 209 B7R1.2 N[C@@H]1CC[C@H](O)C1 L13208 [0,0,0,1,0,1|1,1,0]=4 210 B7R1.2 N[C@@H]1CC[C@H](O)C1 Q57094 [0,0,0,1,0,1|1,1,0]=4 211 B7R1.2 N[C@H]1CC[C@@H](F)C1 O33077 [0,0,0,1,0,1|2,0,0]=4 212 B7R1.2 N[C@H]1CC[C@@H](F)C1 Q56998 [0,0,0,1,0,1|2,0,0]=4 213 B7R1.2 N[C@H]1CC[C@@H](F)C1 Q57001 [0,0,0,1,0,1|2,0,0]=4 214 B7R1.2 N[C@H]1CC[C@@H](O)C1 G-6579 [0,0,0,1,0,1|1,1,0]=4 215 B7R1.2 N[C@H]1CC[C@@H](O)C1 K10902 [0,0,0,1,0,1|1,1,0]=4 216 B7R1.2 N[C@H]1CC[C@@H](O)C1 L21276 [0,0,0,1,0,1|1,1,0]=4 217 B7R1.2 N[C@H]1CC[C@H](F)C1 Q57003 [0,0,0,1,0,1|2,0,0]=4 218 B7R1.2 N[C@H]1CC[C@H](O)C1 I-9981 [0,0,0,1,0,1|1,1,0]=4 219 B7R1.2 N[C@H]1CC[C@H](O)C1 Q57093 [0,0,0,1,0,1|1,1,0]=4 220 B7R1.2 OC1CCC(F)C1 Q55723 [0,0,0,1,0,1|1,1,0]=4 221 B7R1.2 OC1CCC(O)C1 L14091 [0,0,0,1,0,1|0,2,0]=4 222 B7R1.2 O[C@@H]1CC[C@@H](O)C1 O33251 [0,0,0,1,0,1|0,2,0]=4 223 B7R1.2 O[C@H]1CC[C@@H](O)C1 L14976 [0,0,0,1,0,1|0,2,0]=4 224 B7R1.2 O[C@H]1CC[C@H](O)C1 Q57036 [0,0,0,1,0,1|0,2,0]=4 225 B7R1.16 CC1(C)CC(Br)C1 P45628 [0,0,0,1,0,1|2,0,0]=4 226 B7R1.16 CC1(C)CC(N)C1 L21546 [0,0,0,1,0,1|2,0,0]=4 227 B7R1.16 CC1(C)CC(N)C1 P44151 [0,0,0,1,0,1|2,0,0]=4 228 B7R1.16 CC1(C)CC(O)C1 L21464 [0,0,0,1,0,1|1,1,0]=4 229 B7R1.16 CC1(F)CC(N)C1 L13396 [0,0,0,1,0,1|2,0,0]=4 230 B7R1.16 CC1(F)CC(N)C1 P48242 [0,0,0,1,0,1|2,0,0]=4 231 B7R1.16 CC1(N)CC(F)C1 P47217 [0,0,0,1,0,1|2,0,0]=4 232 B7R1.16 CC1(N)CC(O)C1 G-7345 [0,0,0,1,0,1|1,1,0]=4 233 B7R1.16 CC1(O)CC(N)C1 P46958 [0,0,0,1,0,1|1,1,0]=4 234 B7R1.16 CC1(O)CC(N)C1 P47986 [0,0,0,1,0,1|1,1,0]=4 235 B7R1.16 CC1CC(C)(C)N1 P45491 [0,0,0,1,0,1|2,0,0]=4 236 B7R1.16 CC1CC(C)(C)N1 P49429 [0,0,0,1,0,1|2,0,0]=4 237 B7R1.16 C[C@]1(F)C[C@@H](N)C1 P46979 [0,0,0,1,0,1|2,0,0]=4 238 B7R1.16 C[C@]1(F)C[C@H](N)C1 P46980 [0,0,0,1,0,1|2,0,0]=4 239 B7R1.16 C[C@]1(N)C[C@@H](N)C1 P50500 [0,0,0,1,0,1|2,0,0]=4 240 B7R1.16 C[C@]1(N)C[C@H](O)C1 G-7346 [0,0,0,1,0,1|1,1,0]=4 241 B7R1.16 C[C@]1(N)C[C@H](O)C1 G-7347 [0,0,0,1,0,1|1,1,0]=4 242 B7R1.16 C[C@]1(O)C[C@@H](N)C1 G-6305 [0,0,0,1,0,1|1,1,0]=4 243 B7R1.16 C[C@]1(O)C[C@@H](N)C1 G-6305-01 [0,0,0,1,0,1|1,1,0]=4 244 B7R1.16 C[C@]1(O)C[C@H](N)C1 G-6304 [0,0,0,1,0,1|1,1,0]=4 245 B7R1.16 C[C@]1(O)C[C@H](N)C1 P43966 [0,0,0,1,0,1|1,1,0]=4 246 B7R1.20 CC(C)NC1CC1 M23094 [0,0,0,1,0,1|2,0,0]=4 247 B7R1.20 CC(O)CC1CC1 O29763 [0,0,0,1,0,1|1,1,0]=4 248 B7R1.4 CC1CCNC1C Q61659 [0,1,0,1,0,0|2,0,0]=4 249 B7R1.4 CC1CNCC1C O33388 [0,1,0,1,0,0|2,0,0]=4 250 B7R1.4 CC1CNCC1F Q54416 [0,1,0,1,0,0|2,0,0]=4 251 B7R1.4 CC1CNCC1O Q59312 [0,1,0,1,0,0|1,1,0]=4 252 B7R1.4 C[C@@H]1CCC[C@@H]1N Q53279 [0,1,0,1,0,0|2,0,0]=4 253 B7R1.4 C[C@@H]1CCC[C@@H]1N Q53280 [0,1,0,1,0,0|2,0,0]=4 254 B7R1.4 C[C@@H]1CNC[C@@H]1F Q56053 [0,1,0,1,0,0|2,0,0]=4 255 B7R1.4 C[C@@H]1CNC[C@@H]1F Q56054 [0,1,0,1,0,0|2,0,0]=4 256 B7R1.4 C[C@@H]1CNC[C@@H]1N Q61701 [0,1,0,1,0,0|2,0,0]=4 257 B7R1.4 C[C@@H]1CNC[C@@H]1N Q61702 [0,1,0,1,0,0|2,0,0]=4 258 B7R1.4 C[C@@H]1CNC[C@@H]1O L22286 [0,1,0,1,0,0|1,1,0]=4 259 B7R1.4 C[C@@H]1CNC[C@@H]1O Q55495 [0,1,0,1,0,0|1,1,0]=4 260 B7R1.4 C[C@@H]1CNC[C@H]1O L22285 [0,1,0,1,0,0|1,1,0]=4 261 B7R1.4 C[C@@H]1CNC[C@H]1O Q55494 [0,1,0,1,0,0|1,1,0]=4 262 B7R1.4 C[C@@H]1COC[C@H]1N F-4262 [0,1,0,1,0,0|1,1,0]=4 263 B7R1.4 C[C@@H]1NCC[C@@H]1O Q64145 [0,1,0,1,0,0|1,1,0]=4 264 B7R1.4 C[C@@H]1NCC[C@H]1O Q64143 [0,1,0,1,0,0|1,1,0]=4 265 B7R1.4 C[C@H]1CCC[C@@H]1N Q53277 [0,1,0,1,0,0|2,0,0]=4 266 B7R1.4 C[C@H]1CCC[C@@H]1N Q53278 [0,1,0,1,0,0|2,0,0]=4 267 B7R1.4 C[C@H]1COC[C@@H]1N L13875 [0,1,0,1,0,0|1,1,0]=4 268 B7R1.4 C[C@H]1NCC[C@@H]1O Q64142 [0,1,0,1,0,0|1,1,0]=4 269 B7R1.4 C[C@H]1NCC[C@H]1O Q64144 [0,1,0,1,0,0|1,1,0]=4 270 B7R1.4 FC1CNCC1F Q57411 [0,1,0,1,0,0|2,0,0]=4 271 B7R1.4 F[C@@H]1CNC[C@H]1F Q63594 [0,1,0,1,0,0|2,0,0]=4 272 B7R1.4 F[C@H]1CNC[C@@H]1F K12040 [0,1,0,1,0,0|2,0,0]=4 273 B7R1.4 F[C@H]1CNC[C@@H]1F Q56486 [0,1,0,1,0,0|2,0,0]=4 274 B7R1.4 F[C@H]1CNC[C@H]1F G-6496 [0,1,0,1,0,0|2,0,0]=4 275 B7R1.4 NC1CCCC1Cl Q54474 [0,1,0,1,0,0|2,0,0]=4 276 B7R1.4 NC1CCCC1F Q54472 [0,1,0,1,0,0|2,0,0]=4 277 B7R1.4 NC1CCCC1F Q54473 [0,1,0,1,0,0|2,0,0]=4 278 B7R1.4 NC1CCCC1O F-4442 [0,1,0,1,0,0|1,1,0]=4 279 B7R1.4 N[C@@H]1CCC[C@@H]1F Q61724 [0,1,0,1,0,0|2,0,0]=4 280 B7R1.4 N[C@@H]1CCC[C@@H]1F Q61725 [0,1,0,1,0,0|2,0,0]=4 281 B7R1.4 N[C@@H]1CCC[C@@H]1O F-4443 [0,1,0,1,0,0|1,1,0]=4 282 B7R1.4 N[C@@H]1CCC[C@@H]1O F-4445 [0,1,0,1,0,0|1,1,0]=4 283 B7R1.4 N[C@@H]1CCC[C@H]1F O32983 [0,1,0,1,0,0|2,0,0]=4 284 B7R1.4 N[C@@H]1CCC[C@H]1F Q61721 [0,1,0,1,0,0|2,0,0]=4 285 B7R1.4 N[C@@H]1CCC[C@H]1F Q61728 [0,1,0,1,0,0|2,0,0]=4 286 B7R1.4 N[C@@H]1CCC[C@H]1N L21303 [0,1,0,1,0,0|2,0,0]=4 287 B7R1.4 N[C@@H]1CCC[C@H]1N Q61965 [0,1,0,1,0,0|2,0,0]=4 288 B7R1.4 N[C@@H]1CCC[C@H]1O F-4450 [0,1,0,1,0,0|1,1,0]=4 289 B7R1.4 N[C@@H]1CCC[C@H]1O I-9382 [0,1,0,1,0,0|1,1,0]=4 290 B7R1.4 N[C@@H]1COC[C@@H]1N G-7625 [0,1,0,1,0,0|2,0,0]=4 291 B7R1.4 N[C@@H]1COC[C@@H]1N L14037 [0,1,0,1,0,0|2,0,0]=4 292 B7R1.4 N[C@@H]1COC[C@H]1N G-7624 [0,1,0,1,0,0|2,0,0]=4 293 B7R1.4 N[C@@H]1COC[C@H]1O H-8080 [0,1,0,1,0,0|1,1,0]=4 294 B7R1.4 N[C@H]1CCC[C@@H]1F Q61723 [0,1,0,1,0,0|2,0,0]=4 295 B7R1.4 N[C@H]1CCC[C@@H]1O F-4444 [0,1,0,1,0,0|1,1,0]=4 296 B7R1.4 N[C@H]1CCC[C@@H]1O F-4447 [0,1,0,1,0,0|1,1,0]=4 297 B7R1.4 N[C@H]1CCC[C@@H]1O F-4448 [0,1,0,1,0,0|1,1,0]=4 298 B7R1.4 N[C@H]1CCC[C@H]1F Q61722 [0,1,0,1,0,0|2,0,0]=4 299 B7R1.4 N[C@H]1CCC[C@H]1F Q61726 [0,1,0,1,0,0|2,0,0]=4 300 B7R1.4 N[C@H]1CCC[C@H]1F Q61727 [0,1,0,1,0,0|2,0,0]=4 301 B7R1.4 N[C@H]1CCC[C@H]1N O33475 [0,1,0,1,0,0|2,0,0]=4 302 B7R1.4 N[C@H]1CCC[C@H]1O F-4446 [0,1,0,1,0,0|1,1,0]=4 303 B7R1.4 N[C@H]1CCC[C@H]1O F-4449 [0,1,0,1,0,0|1,1,0]=4 304 B7R1.4 N[C@H]1CCC[C@H]1O Q52258 [0,1,0,1,0,0|1,1,0]=4 305 B7R1.4 N[C@H]1COC[C@@H]1N G-6892 [0,1,0,1,0,0|2,0,0]=4 306 B7R1.4 N[C@H]1COC[C@@H]1N G-7623 [0,1,0,1,0,0|2,0,0]=4 307 B7R1.4 N[C@H]1COC[C@@H]1O F-4615 [0,1,0,1,0,0|1,1,0]=4 308 B7R1.4 N[C@H]1COC[C@@H]1O H-8081 [0,1,0,1,0,0|1,1,0]=4 309 B7R1.4 N[C@H]1COC[C@H]1O L22268 [0,1,0,1,0,0|1,1,0]=4 310 B7R1.4 N[C@H]1COC[C@H]1O P45710 [0,1,0,1,0,0|1,1,0]=4 311 B7R1.4 OC1CCCC1F L19027 [0,1,0,1,0,0|1,1,0]=4 312 B7R1.4 O[C@@H]1CCC[C@H]1F Q62078 [0,1,0,1,0,0|1,1,0]=4 313 B7R1.4 O[C@@H]1CNC[C@@H]1F P47689 [0,1,0,1,0,0|1,1,0]=4 314 B7R1.4 O[C@@H]1CNC[C@H]1F L22087 [0,1,0,1,0,0|1,1,0]=4 315 B7R1.4 O[C@@H]1CNC[C@H]1O I-9041 [0,1,0,1,0,0|0,2,0]=4 316 B7R1.4 O[C@H]1CCC[C@@H]1O Q61543 [0,1,0,1,0,0|0,2,0]=4 317 B7R1.4 O[C@H]1CNC[C@@H]1F G-6498 [0,1,0,1,0,0|1,1,0]=4 318 B7R1.4 O[C@H]1CNC[C@@H]1F L18425 [0,1,0,1,0,0|1,1,0]=4 319 B7R1.4 O[C@H]1CNC[C@@H]1O G-7319 [0,1,0,1,0,0|0,2,0]=4 320 B7R1.4 O[C@H]1CNC[C@@H]1O I-9326 [0,1,0,1,0,0|0,2,0]=4 321 B7R1.4 O[C@H]1CNC[C@@H]1O O33609 [0,1,0,1,0,0|0,2,0]=4 322 B7R1.4 O[C@H]1CNC[C@H]1F L14907 [0,1,0,1,0,0|1,1,0]=4 323 B7R1.4 O[C@H]1CNC[C@H]1F Q64937 [0,1,0,1,0,0|1,1,0]=4 324 B7R1.4 O[C@H]1CNC[C@H]1O G-6497 [0,1,0,1,0,0|0,2,0]=4 325 B7R1.4 O[C@H]1CNC[C@H]1O H-8791 [0,1,0,1,0,0|0,2,0]=4 326 B7R1.4 O[C@H]1COC[C@H]1O G-7040 [0,1,0,1,0,0|0,2,0]=4 327 B7R1.8 CC1CCC1CO P48346 [0,1,0,1,0,0|1,1,0]=4 328 B7R1.8 CC1NCC1C#N P50215 [0,1,0,1,0,0|2,0,0]=4 329 B7R1.8 CC1OCC1CO Q56093 [0,1,0,1,0,0|0,2,0]=4 330 B7R1.8 CO[C@@H]1CC[C@@H]1N P50889 [0,1,0,1,0,0|1,1,0]=4 331 B7R1.8 CO[C@@H]1CC[C@@H]1N P50890 [0,1,0,1,0,0|1,1,0]=4 332 B7R1.8 CO[C@@H]1CC[C@H]1N P46967 [0,1,0,1,0,0|1,1,0]=4 333 B7R1.8 CO[C@@H]1CC[C@H]1N P50886 [0,1,0,1,0,0|1,1,0]=4 334 B7R1.8 CO[C@H]1CC[C@@H]1N P50517 [0,1,0,1,0,0|1,1,0]=4 335 B7R1.8 CO[C@H]1CC[C@H]1N P50488 [0,1,0,1,0,0|1,1,0]=4 336 B7R1.8 NCC1CCC1F P47834 [0,1,0,1,0,0|2,0,0]=4 337 B7R1.8 NCC1CCC1F P50566 [0,1,0,1,0,0|2,0,0]=4 338 B7R1.8 OCC1CCC1F P47249 [0,1,0,1,0,0|1,1,0]=4 339 B7R1.8 OCC1CCC1O P50851 [0,1,0,1,0,0|0,2,0]=4 340 B7R1.8 OC[C@@H]1CC[C@H]1O P50820 [0,1,0,1,0,0|0,2,0]=4 341 B7R1.8 OC[C@H]1CC[C@H]1O P48230 [0,1,0,1,0,0|0,2,0]=4 342 B7R1.17 CC1(C)CCC1O O32944 [0,1,0,1,0,0|1,1,0]=4 343 B7R1.17 CC1(C)NCC1N P44080 [0,1,0,1,0,0|2,0,0]=4 344 B7R1.17 CC1(C)NCC1N P48748 [0,1,0,1,0,0|2,0,0]=4 345 B7R1.17 CC1(C)NCC1O K13397 [0,1,0,1,0,0|1,1,0]=4 346 B7R1.17 CC1(C)NCC1O P47335 [0,1,0,1,0,0|1,1,0]=4 347 B7R1.17 CC1(C)OCC1Br Q52792 [0,1,0,1,0,0|1,1,0]=4 348 B7R1.17 CC1(C)OCC1I Q52793 [0,1,0,1,0,0|1,1,0]=4 349 B7R1.17 CC1(C)OCC1N Q52791 [0,1,0,1,0,0|1,1,0]=4 350 B7R1.17 CC1(C)OCC1O Q52790 [0,1,0,1,0,0|0,2,0]=4 351 B7R1.17 CC1(C)SCC1N Q58807 [0,1,0,1,0,0|1,0,0]=3 352 B7R1.17 CC1(C)SCC1N Q58808 [0,1,0,1,0,0|1,0,0]=3 353 B7R1.17 CC1(C)SC[C@H]1N Q58818 [0,1,0,1,0,0|1,0,0]=3 354 B7R1.17 CC1NCC1(F)F P47446 [0,1,0,1,0,0|2,0,0]=4 355 B7R1.17 C[C@@H]1NCC1(F)F P50108 [0,1,0,1,0,0|2,0,0]=4 356 B7R1.17 C[C@H]1NCC1(F)F P50083 [0,1,0,1,0,0|2,0,0]=4 357 B7R1.17 NC1CCC1(F)F F-4874 [0,1,0,1,0,0|2,0,0]=4 358 B7R1.17 NC1CCC1(F)F P49059 [0,1,0,1,0,0|2,0,0]=4 359 B7R1.17 OC1CCC1(F)F P46292 [0,1,0,1,0,0|1,1,0]=4 360 B7R1.18 CC(C)C1CCN1 P45191 [0,1,0,1,0,0|2,0,0]=4 361 B7R1.18 CC(C)C1CCN1 P48185 [0,1,0,1,0,0|2,0,0]=4 362 B7R1.18 CC(C)C1CNC1 P48267 [0,1,0,1,0,0|2,0,0]=4 363 B7R1.18 CC(C)C1CNC1 P48289 [0,1,0,1,0,0|2,0,0]=4 364 B7R1.18 CC(F)C1CNC1 P47135 [0,1,0,1,0,0|2,0,0]=4 365 B7R1.18 CC(N)C1CCC1 L22474 [0,1,0,1,0,0|2,0,0]=4 366 B7R1.18 CC(N)C1CCC1 P45412 [0,1,0,1,0,0|2,0,0]=4 367 B7R1.18 CC(N)C1COC1 L21399 [0,1,0,1,0,0|1,1,0]=4 368 B7R1.18 CC(N)C1COC1 Q52428 [0,1,0,1,0,0|1,1,0]=4 369 B7R1.18 CC(O)C1CCC1 P45236 [0,1,0,1,0,0|1,1,0]=4 370 B7R1.18 CC(O)C1CNC1 L18023 [0,1,0,1,0,0|1,1,0]=4 371 B7R1.18 CC(O)C1CNC1 P43762 [0,1,0,1,0,0|1,1,0]=4 372 B7R1.18 CC(O)C1COC1 P47968 [0,1,0,1,0,0|0,2,0]=4 373 B7R1.18 C[C@@H](N)C1CCC1 P45187 [0,1,0,1,0,0|2,0,0]=4 374 B7R1.18 C[C@@H](N)C1CCC1 P45332 [0,1,0,1,0,0|2,0,0]=4 375 B7R1.18 C[C@@H](O)C1COC1 Q53307 [0,1,0,1,0,0|0,2,0]=4 376 B7R1.18 C[C@H](N)C1CCC1 P48628 [0,1,0,1,0,0|2,0,0]=4 377 B7R1.18 C[C@H](O)C1CCC1 P47847 [0,1,0,1,0,0|1,1,0]=4 378 B7R1.18 C[C@H](O)C1COC1 Q53308 [0,1,0,1,0,0|0,2,0]=4 379 B7R1.19 CC(C)C1(O)CC1 L22368 [0,1,0,1,0,0|1,1,0]=4 380 B7R1.22 CCC(N)C1CC1 L14734 [0,1,0,1,0,0|2,0,0]=4 381 B7R1.22 CCC(O)C1CC1 L14172 [0,1,0,1,0,0|1,1,0]=4 382 B7R1.22 CNC(C)C1CC1 P42683 [0,1,0,1,0,0|2,0,0]=4 383 B7R1.22 NC(CO)C1CC1 P36106 [0,1,0,1,0,0|2,0,0]=4 384 B7R1.22 NCC(O)C1CC1 P37544 [0,1,0,1,0,0|1,1,0]=4 385 B7R1.22 N[C@@H](CO)C1CC1 P41862 [0,1,0,1,0,0|2,0,0]=4 386 B7R1.22 N[C@H](CO)C1CC1 P42349 [0,1,0,1,0,0|2,0,0]=4 387 B7R1.23 CC1(C)CC1CO P35038 [0,1,0,1,0,0|1,1,0]=4 388 B7R1.26 CC(C)(N)C1CC1 O30329 [0,1,0,1,0,0|2,0,0]=4 389 B7R1.26 CC(C)(O)C1CC1 P43176 [0,1,0,1,0,0|1,1,0]=4 390 B7R2.8 NC1C2CC1C2 P45329 [0,0,0,2,0,0|2,0,0]=4 391 B7R2.8 OC1C2CC1C2 Q61085 [0,0,0,2,0,0|1,1,0]=4 392 B7R2.3 BrC1CC12CC2 Q52700 [0,0,0,2,0,0|2,0,0]=4