0 B11R1.40 CC(CN)OC1=CC=CC=C1 SBB028307 [1,0,0,0,0,0|3,0,0]=4 1 B11R1.40 CCC(=O)CC1=CC=CC=C1 SBB060892 [1,0,0,0,0,0|1,0,2]=4 2 B11R1.40 CNC(C)CC1=CC=CC=N1 SBB025630 [1,0,0,0,0,0|2,0,0]=3 3 B11R1.40 CNC(C)CC1=CN=CC=N1 SBB025635 [1,0,0,0,0,0|3,0,0]=4 4 B13R1.335 CCN(CC)CC1=C(N)C=CC=C1 SBB085443 [0,1,0,0,0,0|3,0,0]=4 5 B13R1.418 CN(C)C(CN)CC1=CC=CC=C1 SBB302163 [0,1,0,0,0,0|3,0,0]=4 6 B13R2.57 OC[C@@H]1CC2=CC=CC=C2CN1 SBB003923 [0,0,0,1,0,0|3,0,0]=4 7 B13R2.64 C1=CC=C(CC2=NCCN2)C=C1 SBB000360 [0,0,0,1,0,0|2,0,1]=4 8 B13R2.64 N1CCN=C1CC2=CC=CC=C2 SBB003964 [0,0,0,1,0,0|2,0,1]=4 9 B11R1.12 CCC(C#N)C1=CC=CC=C1 SBB068828 [0,0,0,0,1,0|3,0,0]=4 10 B11R1.12 CCC(CC)C1=CC=CC=C1 SBB060456 [0,0,0,0,1,0|2,0,0]=3 11 B11R1.12 CCC(CN)C1=CC=CC=C1 SBB073168 [0,0,0,0,1,0|3,0,0]=4 12 B11R1.12 CCN(CC)C1=CC=CC=C1 SBB060520 [0,0,0,0,1,0|3,0,0]=4 13 B13R1.417 N(CC1=CC=CC=C1)[C@H](CC)CO SBB040057 [0,0,0,0,0,1|3,0,0]=4 14 B10R1.17 C(=O)CCC1=CC=CC=C1 SBB006730 [2,0,0,0,0,0|2,0,0]=4 15 B10R1.17 C=CCCC1=CC=CC=C1 SBB008476 [2,0,0,0,0,0|1,0,1]=4 16 B10R1.17 CCCNC1=CC=CC=C1 SBB059800 [2,0,0,0,0,0|2,0,0]=4 17 B10R1.17 CCCOC1=CC=CC=C1 SBB061098 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.17 CCNCC1=CC=CC=C1 SBB058765 [2,0,0,0,0,0|2,0,0]=4 19 B10R1.17 CCOCC1=CC=CC=C1 SBB061196 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.17 CCSCC1=CC=CC=C1 SBB061362 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.17 CNCCC1=NC=CC=C1 SBB017551 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.17 CNCCC1=NC=CC=C1 SBB040053 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.17 ClCCCC1=CC=CC=C1 SBB061361 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.17 NCCCC1=CC=CC=C1 SBB028248 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.17 OCCCC1=CC=CC=C1 SBB061127 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.18 CC(C)NC1=CC=CC=C1 SBB007921 [2,0,0,0,0,0|1,0,0]=3 27 B10R1.18 CC(N)CC1=CC=CC=N1 SBB025629 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.18 CN(C)CC1=CC=CC=C1 SBB060233 [2,0,0,0,0,0|1,0,0]=3 29 B10R1.18 OB(O)CC1=CC=CC=C1 SBB052526 [2,0,0,0,0,0|1,0,0]=3 30 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 SBB053707 [1,1,0,0,0,0|0,0,2]=4 31 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 SBB007734 [1,1,0,0,0,0|0,0,2]=4 32 B12R1.34 COC(=O)C(N)C1=CC=CC=C1 SBB017485 [1,1,0,0,0,0|0,0,2]=4 33 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 SBB051444 [1,1,0,0,0,0|0,0,2]=4 34 B12R1.34 [C@@H](N)(C(=O)OC)C1=CC=CC=C1 SBB057682 [1,1,0,0,0,0|0,0,2]=4 35 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 SBB014560 [1,1,0,0,0,0|2,0,0]=4 36 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SBB012365 [1,1,0,0,0,0|2,0,0]=4 37 B12R1.49 COC(=O)CC1=CC=C(F)C=C1 SBB017032 [1,1,0,0,0,0|0,0,2]=4 38 B12R1.49 COC(=O)CC1=CC=C(N)C=C1 SBB059052 [1,1,0,0,0,0|0,0,2]=4 39 B12R1.50 CNC(C)CC1=CC(C)=CC=N1 SBB025633 [1,1,0,0,0,0|2,0,0]=4 40 B12R1.194 C#CC(C)(O)CC1=CC=CC=C1 SBB002525 [1,1,0,0,0,0|1,0,1]=4 41 B12R1.194 CNC(C)(C)CC1=CC=CC=C1 SBB015072 [1,1,0,0,0,0|1,0,0]=3 42 B12R1.3 CCCC(CC)C1=CC=CC=C1 SBB061240 [0,1,0,0,1,0|2,0,0]=4 43 B12R1.12 CCC(NC)C1=CC=C(F)C=C1 SBB044867 [0,1,0,0,1,0|2,0,0]=4 44 B12R1.13 COC(OC)C1=CC=NC(N)=N1 SBB013669 [0,1,0,0,1,0|2,0,0]=4 45 B12R1.13 COC(OC)C1=NC(C)=NC=C1 SBB065707 [0,1,0,0,1,0|2,0,0]=4 46 B12R1.478 CO[C@H](C(=O)O)C1=CC=CC=C1 SBB058045 [0,1,0,0,1,0|2,0,0]=4 47 B14R1.529 COC(CNC1=NC=C(Br)C=N1)OC SBB102508 [0,1,0,0,0,1|2,0,0]=4 48 B12R2.18 CC1CC2=CC=CC=C2C1=O SBB067570 [1,0,0,1,0,0|2,0,0]=4 49 B12R2.18 NC1C2=CC=CC=C2CC1O SBB052066 [1,0,0,1,0,0|2,0,0]=4 50 B12R2.18 O[C@H]1CC2=C(C=CC=C2)[C@H]1N SBB006600 [1,0,0,1,0,0|2,0,0]=4 51 B12R2.24 CC1CCC2=CC=CC=C2N1 SBB039108 [1,0,0,1,0,0|2,0,0]=4 52 B12R2.24 NC1CCC2=C(C=CC=C2)C1 SBB072624 [1,0,0,1,0,0|2,0,0]=4 53 B12R2.24 O=C1CC2=C(C=CC=C2)CO1 SBB068599 [1,0,0,1,0,0|0,0,2]=4 54 B12R2.24 OC1CCC2=C(C=CC=C2)C1 SBB008511 [1,0,0,1,0,0|1,0,0]=3 55 B12R2.27 OCC1CC1C2=CC=CC=C2 SBB084422 [1,0,0,1,0,0|2,0,0]=4 56 B12R2.32 NCC1CC2=CC=CC=C2O1 SBB013722 [1,0,0,1,0,0|2,0,0]=4 57 B12R2.32 OCC1CC2=CC=CC=C2O1 SBB017925 [1,0,0,1,0,0|2,0,0]=4 58 B12R2.2 C1=CC=C(C2CCCC2)C=C1 SBB060080 [0,0,0,1,1,0|2,0,0]=4 59 B12R2.2 C1=CC=C(C2CCCN2)C=C1 SBB056158 [0,0,0,1,1,0|2,0,0]=4 60 B12R2.2 C1=CC=C(C2NCCS2)C=C1 SBB087945 [0,0,0,1,1,0|1,1,0]=4 61 B12R2.2 C1=CC=C(C2OCCO2)C=C1 SBB058599 [0,0,0,1,1,0|0,0,0]=2 62 B12R2.2 C1=CC=C(C2OCCS2)C=C1 SBB056712 [0,0,0,1,1,0|0,1,0]=3 63 B14R2.93 COC1OCC2=C(C=CC=C2)CO1 SBB056967 [0,0,0,1,0,1|0,0,0]=2 64 B14R2.6 C1=CC=C(CC2CCCCN2)C=C1 SBB010587 [0,1,0,1,0,0|2,0,0]=4 65 B14R2.6 C1=CC=C(CC2CCCNC2)C=C1 SBB010586 [0,1,0,1,0,0|2,0,0]=4 66 B14R2.6 N1CCC(CC2=CC=CC=C2)CC1 SBB027306 [0,1,0,1,0,0|2,0,0]=4 67 B10R1.15 C#CC(O)C1=CC=CC=C1 SBB008986 [1,0,0,0,1,0|1,0,1]=4 68 B10R1.15 C(=O)C(C)C1=CC=CC=C1 SBB007693 [1,0,0,0,1,0|2,0,0]=4 69 B10R1.15 CC(CN)C1=CC=CC=C1 SBB028247 [1,0,0,0,1,0|2,0,0]=4 70 B10R1.15 CC(CO)C1=CC=CC=C1 SBB007853 [1,0,0,0,1,0|2,0,0]=4 71 B10R1.15 CCC(Br)C1=CC=CC=C1 SBB060201 [1,0,0,0,1,0|2,0,0]=4 72 B10R1.15 CCC(C)C1=CC=CC=C1 SBB060615 [1,0,0,0,1,0|1,0,0]=3 73 B10R1.15 CCC(N)C1=CC=CC=C1 SBB029878 [1,0,0,0,1,0|2,0,0]=4 74 B10R1.15 CCC(N)C1=CC=CC=C1 SBB080382 [1,0,0,0,1,0|2,0,0]=4 75 B10R1.15 CCC(O)C1=CC=CC=C1 SBB058750 [1,0,0,0,1,0|1,0,0]=3 76 B10R1.15 COC(=N)C1=CC=CC=C1 SBB055305 [1,0,0,0,1,0|1,0,1]=4 77 B10R1.15 COC(=O)C1=CC=CC=C1 SBB058212 [1,0,0,0,1,0|0,0,2]=4 78 B10R1.15 C[C@H](CN)C1=CC=CC=C1 SBB052360 [1,0,0,0,1,0|2,0,0]=4 79 B10R1.15 NCC(O)C1=CC=CC=C1 SBB063224 [1,0,0,0,1,0|2,0,0]=4 80 B10R1.15 OCC(O)C1=CC=CC=C1 SBB063119 [1,0,0,0,1,0|2,0,0]=4 81 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SBB064282 [1,0,0,0,1,0|2,0,0]=4 82 B12R1.27 CC(CO)NCC1=CC=CC=C1 SBB010465 [1,0,0,0,0,1|2,0,0]=4 83 B12R1.27 CCC(O)C#CC1=CC=CC=C1 SBB008984 [1,0,0,0,0,1|1,0,1]=4 84 B12R1.27 COC(=O)CSC1=CC=CC=C1 SBB089934 [1,0,0,0,0,1|0,0,2]=4 85 B12R1.27 COC(=O)NCC1=CC=CC=C1 SBB080563 [1,0,0,0,0,1|0,0,2]=4 86 B12R1.27 OC(CCl)COC1=CC=CC=C1 SBB061224 [1,0,0,0,0,1|2,0,0]=4 87 B12R1.27 OC(COC1=CC=CC=C1)CN SBB010049 [1,0,0,0,0,1|2,0,0]=4 88 B12R1.27 OC[C@H](O)COC1=CC=CC=C1 SBB088177 [1,0,0,0,0,1|2,0,0]=4