0 B12R1.652 CC1=C(C(=C(C=N1)CO)C=O)O Z56922082 [0,0,0,0,0,0|0,0,2]=2 1 B12R1.652 CC1=C(C(=C(C=N1)CO)CO)O Z382721012 [0,0,0,0,0,0|0,0,0]=0 2 B11R1.37 NC1=CC(=C(C=C1)CO)CO Z2522353605 [1,0,0,0,0,0|2,0,0]=3 3 B11R1.37 OCC1=C(C=C(C=C1)Br)CO Z1269113456 [1,0,0,0,0,0|2,0,0]=3 4 B11R1.37 OCC1=C(C=C(C=C1)I)CO Z4527381308 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.72 CC1=C(C(=C(C=C1)C)C=O)O Z1198163822 [1,0,0,0,0,0|1,0,2]=4 6 B11R1.72 CC1=C(C(=C(C=C1)Cl)CO)N Z3074473359 [1,0,0,0,0,0|3,0,0]=4 7 B11R1.72 CC1=C(C(=C(N=N1)O)CN)C Z1266854888 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.72 CC1=C(C(=C(N=N1)O)CO)C Z1897140740 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.278 CC1=C(C(=C(N=C1)CO)C)N Z1827563591 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.278 CC1=C(C=CC(=C1Cl)Cl)CO Z2307001332 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.278 NCC1=C(C(=C(C=C1)O)O)O Z4780998599 [1,0,0,0,0,0|3,0,0]=4 12 B13R2.3790 CC1=C(C2=C(C=C1)CCC2O)C Z4883452164 [0,0,0,1,0,0|3,0,0]=4 13 B10R1.20 COC1=C(C=NC=C1)CO Z1198311138 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.20 NCC1=C(C=CC=C1)CO Z336080860 [2,0,0,0,0,0|2,0,0]=4 15 B10R1.25 CC1=C(C=CC(=C1)Br)CO Z444299166 [2,0,0,0,0,0|2,0,0]=4 16 B10R1.25 CC1=C(C=CC(=C1)F)CO Z959356974 [2,0,0,0,0,0|2,0,0]=4 17 B10R1.25 CC1=CC(=C(C=C1)CN)C Z239626330 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.25 CC1=CC(=C(C=C1)CN)O Z4525848236 [2,0,0,0,0,0|2,0,0]=4 19 B10R1.25 CC1=CC(=C(C=C1)CO)C Z335244716 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.25 CC1=CC(=C(C=C1)CO)Cl Z1255382519 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.25 CC1=CC(=C(C=C1)CO)N Z1198176996 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.25 CC1=CC(=NC=C1CN)C Z2255111767 [2,0,0,0,0,0|1,0,0]=3 23 B10R1.25 CC1=NC(=C(C=N1)CO)N Z1198155379 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.25 CCC1=C(C=C(C=C1)C)O Z1198181015 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.25 CCC1=C(C=C(N=C1)C)N Z1198157196 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.30 CC1=C(C=C(C=C1)Br)CO Z1259109160 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.30 CC1=C(C=C(C=C1)N)CO Z1203578809 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.30 CC1=CC(=C(C=C1)Br)CO Z1269153193 [2,0,0,0,0,0|2,0,0]=4 29 B10R1.30 CC1=CC(=C(C=C1)F)CO Z992343034 [2,0,0,0,0,0|2,0,0]=4 30 B10R1.30 CC1=CC(=C(C=C1)I)CO Z1269210139 [2,0,0,0,0,0|2,0,0]=4 31 B10R1.30 CC1=CC(=C(C=C1)N)CO Z1203578305 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.30 CC1=NC(=C(C=C1)O)CO Z1104852895 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.30 CC1=NN=C(C(=C1)CO)C Z1504687332 [2,0,0,0,0,0|1,0,0]=3 34 B10R1.30 OCC1=C(C=CC(=C1)Br)O Z56969308 [2,0,0,0,0,0|2,0,0]=4 35 B10R1.2 CC1=C(C(=CC=C1)CN)O Z2568737629 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.2 CC1=C(C(=CC=C1)CO)Br Z1269244302 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.2 CC1=C(C(=CC=C1)CO)I Z1269243400 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.2 CC1=C(C(=NC=N1)CO)C Z3337288172 [2,0,0,0,0,0|2,0,0]=4 39 B10R1.2 CC1=C(C=CC=C1Br)CO Z1263881346 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.2 CC1=C(C=CC=C1Cl)CO Z1198223504 [2,0,0,0,0,0|2,0,0]=4 41 B10R1.2 CC1=C(C=CC=C1I)CO Z1269226759 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.2 CC1=C(C=CC=C1N)CO Z425792776 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.2 CC1=C(C=CC=C1O)CN Z4452492342 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.2 CCC1=C(C(=CC=C1)O)C Z1255437459 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.2 NCC1=C(C(=CC=C1)O)O Z2755766575 [2,0,0,0,0,0|2,0,0]=4 46 B10R1.119 CC1=C(C(=C(C=C1)C)O)C Z104479158 [2,0,0,0,0,0|1,0,0]=3 47 B10R1.119 CC1=C(C(=C(C=C1)C)O)O Z1513803660 [2,0,0,0,0,0|1,0,0]=3 48 B10R1.119 CC1=C(C(=C(C=C1)N)C)O Z352249250 [2,0,0,0,0,0|2,0,0]=4 49 B10R1.119 CC1=C(C(=C(C=C1)O)O)C Z1513805453 [2,0,0,0,0,0|2,0,0]=4 50 B10R1.119 CC1=C(C(=C(C=N1)N)C)Br Z1269222208 [2,0,0,0,0,0|2,0,0]=4 51 B10R1.119 CC1=C(C(=C(N=C1)C)C)N Z2310717132 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.119 CC1=C(C(=C(N=C1)C)O)C Z4984123266 [2,0,0,0,0,0|0,0,0]=2 53 B10R1.245 CC1=C(C(=CC=C1)Br)CO Z1269136839 [2,0,0,0,0,0|2,0,0]=4 54 B10R1.245 CC1=C(C(=CC=C1)Cl)CO Z1198166613 [2,0,0,0,0,0|2,0,0]=4 55 B10R1.245 NCC1=C(C=CC=C1O)O Z2906109104 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.245 OCC1=C(C=NC=C1F)F Z1255362916 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.176 CC1=C(C=C(C=C1)CN)O Z3951014909 [2,0,0,0,0,0|2,0,0]=4 58 B10R1.176 CC1=C(C=C(C=C1)CO)Br Z1269190523 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.176 CC1=C(C=C(C=C1)CO)I Z1269159118 [2,0,0,0,0,0|2,0,0]=4 60 B10R1.176 CC1=C(C=C(C=C1)CO)N Z1203578220 [2,0,0,0,0,0|2,0,0]=4 61 B10R1.176 CC1=C(N=CC(=C1)CN)C Z3300709046 [2,0,0,0,0,0|2,0,0]=4 62 B10R1.176 CC1=C(N=CC(=C1)CO)C Z1255392915 [2,0,0,0,0,0|1,0,0]=3 63 B10R1.176 CC1=C(N=NC(=C1)CO)C Z4189815936 [2,0,0,0,0,0|2,0,0]=4 64 B10R1.176 NC1=C(C=C(C=N1)CO)Cl Z1065630414 [2,0,0,0,0,0|2,0,0]=4 65 B10R1.176 OCC1=CC(=C(C=C1)I)O Z1269159331 [2,0,0,0,0,0|2,0,0]=4 66 B12R1.78 COC1=CC(=NC=C1CO)OC Z1862017631 [1,1,0,0,0,0|2,0,0]=4 67 B12R1.894 CC1=C(C(=C(C=C1)C)C(=O)O)O Z367679246 [1,1,0,0,0,0|1,0,1]=4 68 B12R1.893 CC1=C(C(=C(C=C1)C(=O)O)O)O Z367679376 [1,1,0,0,0,0|1,0,1]=4 69 B12R1.893 CC1=C(C(=C(C=N1)C(=O)O)O)Cl Z1262561407 [1,1,0,0,0,0|1,0,1]=4 70 B14R1.7434 CCNCC1=C(C=NC(=C1O)C)CO Z2327029975 [0,2,0,0,0,0|1,0,0]=3 71 B12R2.132 CC1=CC2=C(C=C1)COB2O Z1939443826 [1,0,0,1,0,0|2,0,0]=4 72 B12R2.612 CC1=CC2=C(C=C1)B(OC2)O Z1504670737 [1,0,0,1,0,0|2,0,0]=4 73 B12R2.82 CC1=C(C2=C(C=C1)CCC2)O Z1255490620 [1,0,0,1,0,0|2,0,0]=4 74 B12R2.82 CC1=C(C2=C(C=N1)COC2)O Z1216824433 [1,0,0,1,0,0|0,0,0]=2 75 B12R2.196 OB1OCC2=C(C=CC=C12)O Z1513908647 [1,0,0,1,0,0|2,0,0]=4 76 B12R2.196 OC1CCC2=C(C=NC=C12)Br Z1813120127 [1,0,0,1,0,0|2,0,0]=4 77 B12R2.1081 OC1=C2CCOCC2=CC=C1 Z1255506128 [1,0,0,1,0,0|2,0,0]=4 78 B10R1.257 CCC1=C(C(=NO1)C)CO Z1725998736 [1,0,0,0,1,0|2,0,0]=4 79 B10R1.256 CC1=NN(C(=C1CO)C)C Z385370256 [1,0,0,0,1,0|2,0,0]=4 80 B10R1.256 CC1=NN(C(=C1CO)Cl)C Z385373752 [1,0,0,0,1,0|2,0,0]=4