0 B13R1.9 CCCCCCC1=CC=C(Br)C=C1 092808 [0,0,1,0,0,0|1,1,0]=3 1 B13R1.9 CCCCCOC1=CC=C(N)C=C1 005867 [0,0,1,0,0,0|3,0,0]=4 2 B13R2.162 NC1=CC2=C(C=C1)CCCC2=O 040218 [0,0,0,0,1,0|2,0,1]=4 3 B13R2.162 O=C1CCCC2=C1C=C(Br)C=C2 043683 [0,0,0,0,1,0|1,1,1]=4 4 B13R2.162 O=C1CCSC2=C1C=C(Cl)C=C2 349640 [0,0,0,0,1,0|2,0,1]=4 5 B12R1.1 CCCCCC1=CC=C(Br)C=C1 018302 [1,0,1,0,0,0|0,1,0]=3 6 B12R1.1 CCCCCC1=CC=C(Cl)C=C1 018420 [1,0,1,0,0,0|0,0,0]=2 7 B12R1.1 CCCCCC1=CC=C(F)C=C1 006311 [1,0,1,0,0,0|0,1,0]=3 8 B12R1.1 CCCCCC1=CC=C(I)C=C1 018749 [1,0,1,0,0,0|0,1,0]=3 9 B12R1.1 CCCCOC1=CC=C(I)C=C1 035660 [1,0,1,0,0,0|1,1,0]=4 10 B12R1.1 CCCCOC1=CC=C(N)C=C1 001735 [1,0,1,0,0,0|2,0,0]=4 11 B12R1.1 CCCCOC1=CC=C(O)C=C1 240953 [1,0,1,0,0,0|2,0,0]=4 12 B12R1.8 BrCCCCCC1=CC=CC=C1 008939 [1,0,1,0,0,0|2,0,0]=4 13 B12R1.8 CCCCCNC1=CC=CC=C1 099449 [1,0,1,0,0,0|2,0,0]=4 14 B12R1.8 CCCCCSC1=CC=CC=C1 094610 [1,0,1,0,0,0|2,0,0]=4 15 B12R1.8 CCCCNCC1=CC=CC=C1 001047 [1,0,1,0,0,0|2,0,0]=4 16 B12R1.8 NCCNCCC1=CC=NC=C1 024702 [1,0,1,0,0,0|2,0,0]=4 17 B12R1.8 OCCCCCC1=CC=CC=C1 242471 [1,0,1,0,0,0|2,0,0]=4 18 B12R1.30 CCCCC(O)C1=CC=CC=C1 242321 [1,0,1,0,0,0|2,0,0]=4 19 B12R2.41 C1=CC2=C(C=C1)CCNCC2 046252 [2,0,0,0,0,0|0,0,0]=2 20 B12R2.41 C1=CC=C2NCCCCC2=C1 036434 [2,0,0,0,0,0|2,0,0]=4 21 B14R1.14 CCCCCCOC1=CC=C(N)C=C1 001769 [0,1,1,0,0,0|2,0,0]=4 22 B14R1.776 CCCCCCC1=CC=C(NN)C=C1 023516 [0,1,1,0,0,0|2,0,0]=4 23 B14R2.68 BrC1=CC=C(C2CCCCC2)C=C1 048742 [0,0,1,1,0,0|1,1,0]=4 24 B14R2.68 BrC1=CC=C(C2CNCCN2)C=C1 033143 [0,0,1,1,0,0|1,1,0]=4 25 B14R2.68 ClC1=CC=C(C2CCNCC2)C=C1 011642 [0,0,1,1,0,0|2,0,0]=4 26 B14R2.68 FC1=CC=C(C2CNCCN2)C=C1 024816 [0,0,1,1,0,0|1,1,0]=4 27 B14R2.68 NC1=CC=C(C2CCCCC2)C=C1 064753 [0,0,1,1,0,0|2,0,0]=4 28 B14R2.68 OC1=CC=C(C2CCCCC2)C=C1 008835 [0,0,1,1,0,0|2,0,0]=4 29 B14R2.21 FC1=CC(C2CNCCN2)=CC=C1 033465 [0,0,1,1,0,0|1,1,0]=4 30 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 077414 [1,0,0,0,1,0|0,1,0]=3 31 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 076472 [1,0,0,0,1,0|0,1,0]=3 32 B12R2.24 CC1=CC=C2NCCCC2=C1 431465 [1,0,0,0,1,0|2,0,0]=4 33 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 231154 [1,0,0,0,1,0|1,0,0]=3 34 B12R2.24 OC1=CC=C2CCCCC2=C1 078989 [1,0,0,0,1,0|1,0,0]=3 35 B12R2.1081 CC1NCCC2=C1C=CC=C2 077277 [1,0,0,0,1,0|0,0,0]=2 36 B12R2.1081 NC1CCCC2=C1C=CC=C2 219818 [1,0,0,0,1,0|1,0,0]=3 37 B12R2.1081 NC1CCCC2=CC=CC=C21 048220 [1,0,0,0,1,0|1,0,0]=3 38 B12R2.1081 NC1COCC2=C1C=CC=C2 091889 [1,0,0,0,1,0|2,0,0]=4 39 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 048221 [1,0,0,0,1,0|1,0,0]=3 40 B12R2.1081 O=C1CCCC2=C1C=CC=C2 208977 [1,0,0,0,1,0|1,0,1]=4 41 B12R2.1081 OC1CCCC2=C1N=CC=C2 040155 [1,0,0,0,1,0|2,0,0]=4 42 B12R2.1081 OC1CCCC2=CC=CC=C21 069137 [1,0,0,0,1,0|1,0,0]=3 43 B12R2.1081 OC1CCOC2=CC=CC=C21 104541 [1,0,0,0,1,0|2,0,0]=4 44 B12R2.1081 O[C@@H]1CCCC2=C1C=CC=C2 219879 [1,0,0,0,1,0|1,0,0]=3 45 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 219880 [1,0,0,0,1,0|1,0,0]=3