0 B11R0.191 CCCCC(C#N)C(=O)OCC SBB069508 [0,0,0,0,0,0|1,0,1]=2 1 B11R0.191 CCCCC(CC)C(=O)OCC SBB061119 [0,0,0,0,0,0|0,0,0]=0 2 B10R0.19 CCCCC(Br)C(=O)OCC SBB070817 [1,0,0,0,0,0|1,0,0]=2 3 B10R0.19 CCOC(=O)C(N)CCSC SBB000541 [1,0,0,0,0,0|2,0,0]=3 4 B10R0.19 CCOC(=O)[C@@H](N)CCCN SBB070614 [1,0,0,0,0,0|2,0,0]=3 5 B10R0.85 CCCCC(CC)C(=O)NN SBB046909 [1,0,0,0,0,0|2,0,0]=3 6 B10R0.85 CCCCC(CC)C(=O)OC SBB061118 [1,0,0,0,0,0|0,0,0]=1 7 B12R0.8 CCOC(=O)C(CC)C(=O)OCC SBB060956 [0,1,0,0,0,0|1,0,1]=3 8 B12R0.215 CCCCC(CC)C(=O)OC(C)C SBB061198 [0,1,0,0,0,0|0,0,0]=1 9 B12R0.351 CCCCC(CC)C(=O)OCCC SBB061120 [0,1,0,0,0,0|0,0,0]=1 10 B12R1.16 CCOC(=O)C1CCC(=O)CC1 SBB054032 [0,0,0,1,0,0|1,0,1]=3 11 B12R1.16 CCOC(=O)N1CCC(=O)CC1 SBB057202 [0,0,0,1,0,0|2,0,1]=4 12 B12R1.16 CCOC(=O)N1CCC(N)CC1 SBB003834 [0,0,0,1,0,0|2,0,0]=3 13 B12R1.308 CCOC(=O)C1=C(N)CCCC1 SBB072592 [0,0,0,1,0,0|1,0,2]=4 14 B12R1.308 CCOC(=O)C1CCCCC1=O SBB057217 [0,0,0,1,0,0|1,0,1]=3 15 B12R1.308 CCOC(=O)C1CCCNC1=O SBB002124 [0,0,0,1,0,0|2,0,1]=4 16 B12R1.308 CCOC(=O)C1CNCCC1=O SBB003473 [0,0,0,1,0,0|2,0,1]=4 17 B9R0.5 CCCC#CC(=O)OCC SBB008805 [2,0,0,0,0,0|0,0,2]=4 18 B9R0.5 CCCCCC(=O)CCC SBB005828 [2,0,0,0,0,0|1,0,0]=3 19 B9R0.5 CCCCCC(=O)OCC SBB060316 [2,0,0,0,0,0|0,0,0]=2 20 B9R0.5 CCCCOC(=O)CCC SBB061107 [2,0,0,0,0,0|2,0,0]=4 21 B9R0.5 CCOC(=O)CCCCBr SBB070781 [2,0,0,0,0,0|1,0,0]=3 22 B9R0.8 COC(=O)C(N)CCCN SBB072642 [2,0,0,0,0,0|2,0,0]=4 23 B9R0.8 COC(=O)C(N)CCSC SBB003548 [2,0,0,0,0,0|2,0,0]=4 24 B9R0.8 N[C@@H](CCSC)C(=O)OC SBB005764 [2,0,0,0,0,0|2,0,0]=4 25 B9R0.35 CCCC(=O)C(O)CCC SBB008396 [2,0,0,0,0,0|2,0,0]=4 26 B9R0.37 CCCC(=O)N(CC)CC SBB008344 [2,0,0,0,0,0|2,0,0]=4 27 B9R0.13 CCCCC(CC)C(=O)Cl SBB058897 [2,0,0,0,0,0|1,0,0]=3 28 B9R0.13 CCCCC(CC)C(=O)O SBB060021 [2,0,0,0,0,0|0,0,0]=2 29 B9R0.13 CCCCC(CC)C(N)=O SBB061054 [2,0,0,0,0,0|1,0,0]=3 30 B11R0.152 CCCCC(CC)COCCCl SBB059965 [1,1,0,0,0,0|0,0,1]=3 31 B11R0.164 CCCCC(CC)COC(C)=O SBB060584 [1,1,0,0,0,0|0,0,2]=4 32 B11R0.68 CSCC[C@@H](N)C(=O)OC(C)C SBB070583 [1,1,0,0,0,0|2,0,0]=4 33 B11R0.155 CCOC(=O)C(N)CCCCN SBB058160 [1,1,0,0,0,0|1,0,0]=3 34 B11R0.61 CCOC(=O)C(OCC)OCC SBB089170 [1,1,0,0,0,0|1,0,0]=3 35 B13R0.753 CCOC(=O)C(C(=O)OCC)C(C)C SBB080610 [0,2,0,0,0,0|1,0,1]=4 36 B13R0.378 CCCCC(CC)C(=O)OCC(C)C SBB061199 [0,2,0,0,0,0|0,0,0]=2 37 B13R0.1281 CCCCOC(=O)C(CC)CCCC SBB061121 [0,2,0,0,0,0|0,0,0]=2 38 B11R1.15 CCOC(=O)C1CC(O)CN1 SBB010410 [1,0,0,1,0,0|2,0,0]=4 39 B11R1.16 CCOC(=O)C1CCCNC1 SBB027354 [1,0,0,1,0,0|1,0,0]=3 40 B11R1.16 CCOC(=O)C1CCNCC1 SBB004006 [1,0,0,1,0,0|1,0,0]=3 41 B11R1.16 CCOC(=O)C1CNCCO1 SBB054017 [1,0,0,1,0,0|2,0,0]=4 42 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 SBB054010 [1,0,0,1,0,0|1,0,0]=3 43 B11R1.16 CCOC(=O)[C@H]1CCCNC1 SBB066252 [1,0,0,1,0,0|1,0,0]=3 44 B11R1.16 N1CCN(C(=O)OCC)CC1 SBB003993 [1,0,0,1,0,0|2,0,0]=4 45 B11R1.819 CCOC(=O)C1(N)CCCC1 SBB116027 [1,0,0,1,0,0|1,0,0]=3 46 B11R1.199 CCOC(=O)C1CCCC1=O SBB048123 [1,0,0,1,0,0|1,0,1]=4 47 B11R1.22 CC1CCN(C(=O)CCl)CC1 SBB010590 [1,0,0,1,0,0|2,0,0]=4 48 B11R1.22 COC(=O)C1CCC(O)CC1 SBB054036 [1,0,0,1,0,0|1,0,0]=3 49 B11R1.222 CCC(=O)C1CCCCC1=O SBB056586 [1,0,0,1,0,0|1,0,1]=4 50 B11R1.852 O=C(CCl)N1CCCCCC1 SBB038719 [1,0,0,1,0,0|2,0,0]=4 51 B13R1.19 CCOC(=O)CN1CCN(C)CC1 SBB050875 [0,0,0,1,0,1|2,0,0]=4 52 B13R1.470 CCOC(=O)CN1CCCCC1C SBB046523 [0,0,0,1,0,1|1,0,0]=3 53 B13R1.1512 CCOC(=O)C1CCC(F)(F)CC1 SBB054038 [0,1,0,1,0,0|1,0,0]=3 54 B13R2.5187 C=C1OC(=O)C2CCC(C)CC12 SBB061348 [0,0,0,2,0,0|0,0,2]=4 55 B13R2.328 CC1CC(=O)C2CCCCC2N1 SBB007454 [0,0,0,2,0,0|2,0,0]=4 56 B13R2.856 CCOC(=O)C1CC2C=CC1C2 SBB060557 [0,0,0,2,0,0|0,0,2]=4