0 B10R1.15 CNC(=O)C1CCCCN1 4088672 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.15 CNC(=O)C1CCCNC1 4090914 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.15 COC(=O)C1CNCCO1 4088946 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.15 COC(=O)[C@@H]1CNCCO1 4098226 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 CC(C)C1CCNCC1 4089572 [1,0,0,0,0,0|2,0,1]=4 5 B9R1.6 CC(O)C1CCNCC1 4087900 [1,0,0,0,0,0|1,0,2]=4 6 B9R1.6 CN(C)C1CCCNC1 4090893 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.6 O=C(O)C1=CCCNC1 4088590 [1,0,0,0,0,0|1,0,2]=4 8 B9R1.6 O=C(O)C1CCSCN1 4088340 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.6 O=C(O)C1COCCO1 4016984 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.8 CCNC1CCOCC1 4032839 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.8 CNCC1CCCCC1 4088652 [1,0,0,0,0,0|1,0,1]=3 12 B9R1.8 COCC1CCCCN1 4090582 [1,0,0,0,0,0|1,0,1]=3 13 B9R1.8 COCC1CCCNC1 4091076 [1,0,0,0,0,0|1,0,1]=3 14 B9R1.8 COCC1CCNCC1 4090236 [1,0,0,0,0,0|1,0,1]=3 15 B11R1.22 CCC(=O)N1CCC(N)CC1 4090605 [0,1,0,0,0,0|2,0,0]=3 16 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 4044575 [0,1,0,0,0,0|2,0,1]=4 17 B11R1.222 COC(=O)[C@@H]1NCCO[C@H]1C 4037949 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.222 COC(=O)[C@H]1CNCC[C@@H]1O 4046401 [0,1,0,0,0,0|1,0,0]=2 19 B11R1.878 CNC(=O)C1(C)CCCNC1 4088298 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.878 COC(=O)C1(C)CCCCN1 4090003 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.878 COC(=O)C1(C)CCNCC1 4090274 [0,1,0,0,0,0|1,0,0]=2 22 B11R2.1 O=C1OC[C@@H]2CNCCN12 4096298 [0,0,0,1,0,0|2,0,0]=3 23 B11R2.40 NC1(C2CCCCC2)CC1 4090524 [0,0,0,1,0,0|2,0,1]=4 24 B9R1.11 CNC(=O)C1CCCN1 4018265 [0,0,0,0,1,0|2,0,0]=3 25 B9R1.11 CNC(=O)C1CCNC1 4029785 [0,0,0,0,1,0|2,0,0]=3 26 B9R1.11 CNC(=O)[C@@H]1CCCN1 4088702 [0,0,0,0,1,0|2,0,0]=3 27 B9R1.11 CNC(=O)[C@H]1CCCN1 4090109 [0,0,0,0,1,0|2,0,0]=3 28 B9R1.11 COC(=O)C1C=CCN1 4028931 [0,0,0,0,1,0|1,0,2]=4 29 B9R1.11 NCC(=O)N1CCCC1 4088472 [0,0,0,0,1,0|3,0,0]=4 30 B11R1.40 CNC(=O)CN1CCNCC1 4090520 [0,0,0,0,0,1|3,0,0]=4 31 B11R1.40 CNC(C)CC1CCCCC1 3001688 [0,0,0,0,0,1|2,0,1]=4 32 B11R1.40 COC(=O)CN1CCNCC1 4090906 [0,0,0,0,0,1|2,0,0]=3 33 B8R0.3 COC(=O)[C@@H](N)CSC 4090948 [1,0,1,0,0,0|2,0,0]=4 34 B8R1.2 CNC1CCSCC1 4090591 [2,0,0,0,0,0|2,0,0]=4 35 B10R1.13 CN1CCC(C(=O)O)CC1 4088806 [1,1,0,0,0,0|1,0,0]=3 36 B10R1.61 CN1CCCCC1C(=O)O 4089496 [1,1,0,0,0,0|1,0,0]=3 37 B10R1.61 CN1CCNCC1C(=O)O 4089723 [1,1,0,0,0,0|2,0,0]=4 38 B10R1.61 CN1CCOCC1C(=O)O 4402104 [1,1,0,0,0,0|2,0,0]=4 39 B10R1.61 NC(=O)[C@@H]1CCCC[C@H]1N 4047092 [1,1,0,0,0,0|1,0,0]=3 40 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N 4031246 [1,1,0,0,0,0|1,0,0]=3 41 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N 4090440 [1,1,0,0,0,0|1,0,0]=3 42 B10R1.113 CC(=O)N1CCCC(N)C1 4089265 [1,1,0,0,0,0|1,0,0]=3 43 B10R1.113 CN(C)[C@@H]1CCC[C@@H](O)C1 4038574 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.113 CN1CCNC(C(=O)O)C1 4090798 [1,1,0,0,0,0|2,0,0]=4 45 B10R1.363 CC1(C(=O)O)CCCNC1 4091028 [1,1,0,0,0,0|1,0,0]=3 46 B10R1.363 CC1(C(=O)O)CCNCC1 4090206 [1,1,0,0,0,0|1,0,0]=3 47 B10R1.363 CC1(C(N)=O)CCNCC1 4089906 [1,1,0,0,0,0|2,0,0]=4 48 B10R1.363 O=C(O)C1(O)CCNCC1 4088833 [1,1,0,0,0,0|1,0,0]=3 49 B10R1.17 CCNCC1CCCCC1 4089799 [1,1,0,0,0,0|1,0,1]=4 50 B10R1.17 COCCC1CCCNC1 4090265 [1,1,0,0,0,0|1,0,1]=4 51 B10R1.17 COCCC1CCNCC1 4089767 [1,1,0,0,0,0|1,0,1]=4 52 B10R1.11 CNCC(=O)N1CCCC1 3020358 [0,1,0,0,1,0|2,0,0]=4 53 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 4039321 [0,1,0,0,1,0|1,0,0]=3 54 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 4089275 [0,1,0,0,1,0|1,0,0]=3 55 B10R1.23 CN(C)C(=O)C1CCCN1 4018266 [0,1,0,0,1,0|2,0,0]=4 56 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 4079863 [0,1,0,0,1,0|2,0,0]=4 57 B10R1.411 COC(=O)[C@@]1(C)CCCN1 4042235 [0,1,0,0,1,0|1,0,0]=3 58 B12R1.32 CCOC(=O)CC1COCCN1 4002047 [0,1,0,0,0,1|2,0,0]=4 59 B12R1.34 COC(=O)C(C)C1CCNCC1 4110727 [0,1,0,0,0,1|1,0,0]=3 60 B12R1.43 CN(C)C(=O)CC1CCNCC1 4089592 [0,1,0,0,0,1|2,0,0]=4 61 B12R1.49 COC(=O)CN1CCC(N)CC1 4089378 [0,1,0,0,0,1|1,0,0]=3 62 B12R1.308 CCOC(=O)C1COCCC1=O 4073219 [0,2,0,0,0,0|1,0,1]=4 63 B12R1.1595 CCOC(=O)C1(N)CCOCC1 4089168 [0,2,0,0,0,0|1,0,0]=3 64 B12R1.20 CC(C)C(=O)N1CCC(N)CC1 4089884 [0,2,0,0,0,0|2,0,0]=4 65 B12R1.354 COC(=O)C1CN(C)CCC1=O 4090023 [0,2,0,0,0,0|1,0,1]=4 66 B12R1.3454 CCC1(C(=O)OC)CCNCC1 4090599 [0,2,0,0,0,0|1,0,0]=3 67 B10R2.408 C1CC2COCC(C1)N2 4003104 [1,0,0,1,0,0|1,0,1]=4 68 B10R2.408 C1C[C@@H]2CNC[C@H](C1)C2 4089880 [1,0,0,1,0,0|1,0,1]=4 69 B10R2.408 C1C[C@H]2COC[C@@H](C1)N2 4083604 [1,0,0,1,0,0|1,0,1]=4 70 B12R2.18 CN1C(=O)C[C@@H]2CCNC[C@@H]21 4110816 [0,0,0,1,0,1|2,0,0]=4 71 B12R2.18 CN1C(=O)C[C@@H]2CNCC[C@@H]21 4110824 [0,0,0,1,0,1|2,0,0]=4 72 B12R2.2918 O=C1CCC2(CCNCC2)N1 4044198 [0,0,0,1,0,1|2,0,0]=4 73 B12R2.2918 O=C1NCC2(CCCNC2)O1 4090282 [0,0,0,1,0,1|2,0,0]=4 74 B12R2.2918 O=C1NCC2(CCNCC2)O1 4088986 [0,0,0,1,0,1|2,0,0]=4 75 B12R2.2918 O=C1OCC2(CCNCC2)O1 4091132 [0,0,0,1,0,1|1,0,0]=3 76 B12R2.1479 CCOC(=O)C1C2CNCC21 4106795 [0,1,0,1,0,0|1,0,0]=3 77 B12R2.1479 CCOC(=O)[C@H]1[C@H]2CNC[C@H]21 4108192 [0,1,0,1,0,0|1,0,0]=3 78 B8R1.7 CC(N)C1CCCC1 4090794 [1,0,0,0,1,0|1,0,1]=4 79 B8R1.8 CCNC1CCCC1 4088683 [1,0,0,0,1,0|2,0,0]=4 80 B8R1.8 CNCC1CCCC1 4089391 [1,0,0,0,1,0|1,0,1]=4 81 B10R1.348 O=C(O)C1CCCCCN1 4140254 [1,0,0,0,0,1|0,0,0]=2 82 B12R1.27 CNC(=O)CCC1CCCNC1 4088118 [0,0,0,0,0,2|2,0,0]=4 83 B12R1.27 COC(=O)CCC1CCNCC1 4089021 [0,0,0,0,0,2|1,0,0]=3 84 B12R1.27 COC(=O)CCN1CCNCC1 4090296 [0,0,0,0,0,2|2,0,0]=4 85 B12R1.27 NNC(=O)CCC1CCCCC1 3014985 [0,0,0,0,0,2|2,0,0]=4