0 B10R1.4 CC1CCCCN1CCN 4027213 [0,0,0,1,0,0|2,0,0]=3 1 B10R1.4 NCCN1CCCCC1=O 4014128 [0,0,0,1,0,0|2,0,1]=4 2 B10R1.7 N[C@H]1CCCCCC[C@@H]1O 4110432 [0,0,0,1,0,0|3,0,0]=4 3 B10R1.17 CCCNC1CCCCC1 4088015 [0,0,0,1,0,0|3,0,0]=4 4 B10R1.17 CCCNC1CCCCC1 6591639 [0,0,0,1,0,0|3,0,0]=4 5 B10R1.17 NCCSC1CCCCC1 4027109 [0,0,0,1,0,0|3,0,0]=4 6 B10R1.17 OCCCC1CCCCN1 4011271 [0,0,0,1,0,0|3,0,0]=4 7 B10R1.17 OCCCC1CCCNC1 4011272 [0,0,0,1,0,0|3,0,0]=4 8 B10R1.21 CCCNCC1CCCO1 4000752 [0,0,0,1,0,0|3,0,0]=4 9 B10R1.21 NCCCCC1CCCO1 4018236 [0,0,0,1,0,0|3,0,0]=4 10 B10R1.21 NCCCCC1CCCO1 4090493 [0,0,0,1,0,0|3,0,0]=4 11 B10R1.85 CCCN1CCCNCC1 4014915 [0,0,0,1,0,0|2,0,0]=3 12 B10R1.85 NCCC1CCCCCC1 4015076 [0,0,0,1,0,0|3,0,0]=4 13 B9R1.5 N[C@@H]1CCCCC[C@H]1O 4049315 [1,0,0,1,0,0|2,0,0]=4 14 B9R1.8 BrCCC1CCCCN1 4027974 [1,0,0,1,0,0|2,0,0]=4 15 B9R1.8 BrCCC1CCCCN1 4090143 [1,0,0,1,0,0|2,0,0]=4 16 B9R1.8 C#CCN1CCNCC1 4040562 [1,0,0,1,0,0|1,0,1]=4 17 B9R1.8 CCCC1COCCN1 4021666 [1,0,0,1,0,0|2,0,0]=4 18 B9R1.8 NCCC1CCCCC1 4005014 [1,0,0,1,0,0|2,0,0]=4 19 B9R1.8 NCCC1CCCCC1 4089549 [1,0,0,1,0,0|2,0,0]=4 20 B9R1.8 NCCC1CCCCO1 4002169 [1,0,0,1,0,0|2,0,0]=4 21 B9R1.8 NCCC1CCCCO1 4085477 [1,0,0,1,0,0|2,0,0]=4 22 B9R1.8 NCCC1CCCOC1 4036334 [1,0,0,1,0,0|2,0,0]=4 23 B9R1.8 OCCC1CNCCO1 4020258 [1,0,0,1,0,0|2,0,0]=4 24 B9R1.12 CCCNC1CCCC1 4024874 [1,0,0,1,0,0|2,0,0]=4 25 B9R1.12 CCOCC1CCCN1 4030295 [1,0,0,1,0,0|2,0,0]=4 26 B9R1.12 NCCCC1CCCC1 4012706 [1,0,0,1,0,0|2,0,0]=4 27 B9R1.12 NCCCC1CCOC1 4018243 [1,0,0,1,0,0|2,0,0]=4 28 B9R1.14 CCN1CCCC1CCl 4044131 [1,0,0,1,0,0|2,0,0]=4 29 B9R1.14 CCN1CCCC1CO 4015477 [1,0,0,1,0,0|2,0,0]=4 30 B9R1.14 CCN1CCC[C@H]1CO 4045588 [1,0,0,1,0,0|2,0,0]=4 31 B9R1.15 CCN1CCNCC1=O 4011544 [1,0,0,1,0,0|1,0,1]=4 32 B9R1.15 OC[C@H]1CCNC[C@@H]1O 4038678 [1,0,0,1,0,0|2,0,0]=4 33 B9R1.15 OC[C@H]1CCNC[C@H]1O 4037459 [1,0,0,1,0,0|2,0,0]=4 34 B9R1.33 CCN[C@H]1COC[C@@H]1O 4029516 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.33 CCO[C@H]1COC[C@@H]1N 4029260 [1,0,0,1,0,0|2,0,0]=4 36 B9R1.33 NCCN1CCCC1=O 4006050 [1,0,0,1,0,0|1,0,1]=4 37 B9R1.89 CCC1CCCNCC1 4042576 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.89 CCN1CCCNCC1 4013095 [1,0,0,1,0,0|1,0,0]=3 39 B9R1.89 CCN1CCCNCC1 4089876 [1,0,0,1,0,0|1,0,0]=3 40 B9R1.89 OCC1CCCCCN1 5510936 [1,0,0,1,0,0|2,0,0]=4 41 B11R1.189 CCCN1CCCC(CN)C1 4014886 [0,1,0,1,0,0|2,0,0]=4 42 B11R1.189 NCC1CCCN(CCO)C1 4009642 [0,1,0,1,0,0|2,0,0]=4 43 B11R1.189 NCCN1CCCC(CO)C1 4011098 [0,1,0,1,0,0|2,0,0]=4 44 B11R1.742 CC(C)CN1CCCNCC1 4015231 [0,1,0,1,0,0|2,0,0]=4 45 B11R1.742 CC(C)CN1CCCNCC1 4089474 [0,1,0,1,0,0|2,0,0]=4 46 B11R1.17 CNCCN1CCCCC1C 4015189 [0,1,0,1,0,0|2,0,0]=4 47 B11R1.41 NCCN1CCCCC1CO 4011096 [0,1,0,1,0,0|2,0,0]=4 48 B11R1.203 CNCCN1CCCCCC1 4010632 [0,1,0,1,0,0|2,0,0]=4 49 B11R1.203 CNCCN1CCCCCC1 4089714 [0,1,0,1,0,0|2,0,0]=4 50 B11R1.605 C[C@H]1CCC[C@@H](C)N1CCN 4035990 [0,1,0,1,0,0|2,0,0]=4 51 B11R2.20 C1CN2CCOCC2CN1 4085103 [0,0,0,2,0,0|2,0,0]=4 52 B11R2.106 CC1NCCN2CCCC12 4100089 [0,0,0,2,0,0|2,0,0]=4 53 B11R2.36 C[C@@H]1CN2CCC[C@@H]2CN1 4082083 [0,0,0,2,0,0|2,0,0]=4 54 B11R2.36 C[C@@H]1CN2CCC[C@H]2CN1 4065495 [0,0,0,2,0,0|2,0,0]=4 55 B11R2.1098 NCC12CCCN1CCC2 4036016 [0,0,0,2,0,0|2,0,0]=4