0 B11R1.17 CC1=C(CCCO)C=CC=C1 BB32-0475 [0,0,0,1,0,0|2,0,1]=4 1 B11R1.17 CCCOC1=C(N)C=CC=C1 BB31-5710 [0,0,0,1,0,0|2,0,1]=4 2 B11R1.17 CCNCC1=C(O)C=CC=C1 BB31-9257 [0,0,0,1,0,0|1,0,2]=4 3 B11R1.17 COCCC1=C(O)C=CC=C1 BB32-1663 [0,0,0,1,0,0|1,0,2]=4 4 B11R1.17 NCCCC1=C(Br)C=CC=C1 BB31-5716 [0,0,0,1,0,0|2,0,1]=4 5 B11R1.17 OCCCC1=C(Cl)C=CC=C1 BB32-3226 [0,0,0,1,0,0|2,0,1]=4 6 B11R1.17 OCCCC1=C(F)C=CC=C1 BB31-8703 [0,0,0,1,0,0|2,0,1]=4 7 B11R1.28 CCCC#CC1=CC=CC=C1 BB31-3592 [0,0,0,1,0,0|1,0,2]=4 8 B11R1.28 CCCCCC1=CC=NC=C1 BB31-4566 [0,0,0,1,0,0|2,0,0]=3 9 B11R1.28 CNCCSC1=NC=CC=C1 BB52-9534 [0,0,0,1,0,0|3,0,0]=4 10 B11R1.28 ClCCCSC1=NC=CC=C1 BB53-0616 [0,0,0,1,0,0|3,0,0]=4 11 B11R1.28 ClCCNCC1=NC=CC=C1 BB53-0573 [0,0,0,1,0,0|3,0,0]=4 12 B11R1.28 NCCCOC1=CC=CC=C1 BB31-8683 [0,0,0,1,0,0|3,0,0]=4 13 B11R1.28 NCCNCC1=NC=CC=C1 BB53-0185 [0,0,0,1,0,0|3,0,0]=4 14 B11R1.28 OCCCCC1=CN=CC=C1 BB31-5838 [0,0,0,1,0,0|3,0,0]=4 15 B11R1.28 OCCCCC1=NC=CC=C1 BB31-3724 [0,0,0,1,0,0|2,0,0]=3 16 B11R1.28 OCCCSC1=NC=CC=C1 BB52-9523 [0,0,0,1,0,0|3,0,0]=4 17 B11R1.28 OCCNCC1=NC=CC=C1 BB52-9143 [0,0,0,1,0,0|3,0,0]=4 18 B11R1.41 CCOC1=C(C=O)C=CC=N1 BB31-6380 [0,0,0,1,0,0|2,0,1]=4 19 B12R0.5 C\C=C\C=C\CCCCCCCO BB31-8006 [0,2,0,0,0,0|1,0,1]=4 20 B10R1.5 CCCN1C=CN=C1C=O BB52-0219 [1,0,0,1,0,0|2,0,0]=4 21 B10R1.17 CCCCC1=CC=CN=C1 BB31-4701 [1,0,0,1,0,0|1,0,1]=4 22 B12R1.8 CCCCCCC1=CC=NC=C1 BB32-1186 [0,1,0,1,0,0|1,0,1]=4 23 B12R1.8 CCNCCSC1=NC=CC=C1 BB53-0726 [0,1,0,1,0,0|2,0,0]=4 24 B12R1.8 CNCCNCC1=NC=CC=C1 BB53-0219 [0,1,0,1,0,0|2,0,0]=4 25 B12R1.8 ClCCCNCC1=NC=CC=C1 BB53-0582 [0,1,0,1,0,0|2,0,0]=4 26 B12R1.8 NCCCCCC1=CC=CC=C1 BB31-3637 [0,1,0,1,0,0|1,0,0]=3 27 B12R1.8 OCCCNCC1=NC=CC=C1 BB53-1152 [0,1,0,1,0,0|2,0,0]=4 28 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 BB32-3592 [0,1,0,1,0,0|2,0,0]=4 29 B12R1.1 NCCCCC1=CC=C(Cl)C=C1 BB32-3534 [0,1,0,1,0,0|2,0,0]=4 30 B12R1.30 NC(CCCO)C1=CC=CC=C1 BB32-2038 [0,1,0,1,0,0|2,0,0]=4 31 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 BB32-3315 [0,0,0,2,0,0|2,0,0]=4 32 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 BB32-3398 [0,0,0,2,0,0|2,0,0]=4 33 B12R2.229 O=C1CCCCN2N=CC=C12 BB31-3852 [0,0,0,2,0,0|2,0,0]=4 34 B12R2.315 O=CC1=C2CCCC2=CC=C1 BB32-2800 [0,0,0,2,0,0|0,0,2]=4 35 B12R2.41 C1=CC2=C(C=C1)CCNCC2 BB31-3408 [0,0,0,2,0,0|2,0,0]=4 36 B12R2.1081 BrC1=C2CCCCC2=CC=C1 BB32-3385 [0,0,0,2,0,0|1,0,1]=4 37 B12R2.1081 CC1CCNC2=C1C=CC=C2 BB31-4716 [0,0,0,2,0,0|2,0,0]=4 38 B12R2.1081 N[C@@H]1CCCC2=C1C=CC=C2 BB32-1584 [0,0,0,2,0,0|2,0,0]=4 39 B12R2.1081 O[C@@H]1CCCC2=C1C=CC=C2 BB31-4223 [0,0,0,2,0,0|2,0,0]=4 40 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 BB31-8032 [0,0,0,2,0,0|0,0,2]=4 41 B12R2.2057 C1=CN=C(CNC2CC2)C=C1 BB52-8660 [0,0,0,2,0,0|2,0,0]=4 42 B12R2.2048 O=CC1=C(C2CC2)C=CC=C1 BB32-0977 [0,0,0,2,0,0|0,0,2]=4