0 B7R0.3 CCC(=O)NCCN 4110359 [1,0,0,0,0,0|2,0,0]=3 1 B7R0.3 CCN(C)CCCCl 4032711 [1,0,0,0,0,0|3,0,0]=4 2 B7R0.3 CCN(C)CCCCl 4090852 [1,0,0,0,0,0|3,0,0]=4 3 B7R0.3 CCN(C)CCCO 4027001 [1,0,0,0,0,0|3,0,0]=4 4 B7R0.3 CCOCC(=O)NN 4024074 [1,0,0,0,0,0|3,0,0]=4 5 B7R0.3 CCOCC(=O)NN 4089996 [1,0,0,0,0,0|3,0,0]=4 6 B7R0.3 CNC(=O)CCCN 4030090 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.3 CNCCC(=O)NC 4030744 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.7 CCCC(C)NCC 4024861 [1,0,0,0,0,0|2,0,1]=4 9 B7R0.7 CCNC(=O)CCCl 4027744 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.7 CCOC(=O)CCO 4040900 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.7 CCOC(C)CNC 4030660 [1,0,0,0,0,0|2,0,1]=4 12 B9R0.5 CCCCNC(=O)CNC 4025910 [0,1,0,0,0,0|2,0,0]=3 13 B9R0.5 CCOC(=O)CCN=C=O 3001880 [0,1,0,0,0,0|1,0,1]=3 14 B9R0.48 C=C(C)\C=C\C(=O)OCC 4074677 [0,1,0,0,0,0|0,0,3]=4 15 B9R1.2 CCC1COCC(=O)N1 4027565 [0,0,0,1,0,0|3,0,0]=4 16 B9R1.2 CCN1CCNC(=O)C1 4044495 [0,0,0,1,0,0|2,0,0]=3 17 B9R1.8 CCOC1CCNCC1 4031332 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.8 CCOC1CCNCC1 4088135 [0,0,0,1,0,0|2,0,1]=4 19 B9R1.15 CCC1NCCNC1=O 4004453 [0,0,0,1,0,0|3,0,0]=4 20 B9R1.15 CCC1SCCNC1=O 4045692 [0,0,0,1,0,0|3,0,0]=4 21 B9R1.15 CCN1CCCNC1=O 4040526 [0,0,0,1,0,0|2,0,0]=3 22 B9R1.15 CCN1CCNCC1=O 4011544 [0,0,0,1,0,0|2,0,0]=3 23 B9R1.33 NCCN1CCCC1=O 4006050 [0,0,0,1,0,0|3,0,0]=4 24 B9R1.33 NCCN1CCOC1=O 4012055 [0,0,0,1,0,0|2,0,0]=3 25 B9R1.33 O=C1CCCN1CCBr 4035171 [0,0,0,1,0,0|3,0,0]=4 26 B9R1.33 O=C1CCCN1CCCl 6141229 [0,0,0,1,0,0|3,0,0]=4 27 B9R1.48 CC1CCCCC(=O)N1 4085312 [0,0,0,1,0,0|1,0,0]=2 28 B9R1.49 CC1CCNC(=O)CC1 4041565 [0,0,0,1,0,0|1,0,0]=2 29 B9R1.49 CC1CNC(=O)CCN1 4017913 [0,0,0,1,0,0|3,0,0]=4 30 B9R1.75 O=C(CCCl)NC1CC1 5694825 [0,0,0,1,0,0|3,0,0]=4 31 B6R0.6 CCOCCNC 4030249 [2,0,0,0,0,0|1,0,0]=3 32 B6R0.6 CNCCCOC 4021520 [2,0,0,0,0,0|1,0,1]=4 33 B6R0.1 CCCC(=O)NN 3002586 [2,0,0,0,0,0|2,0,0]=4 34 B6R0.1 CCCC(N)CC 4028240 [2,0,0,0,0,0|1,0,1]=4 35 B6R0.1 CCCC(N)CC 4088911 [2,0,0,0,0,0|1,0,1]=4 36 B6R0.1 CCNC(=O)CBr 4023688 [2,0,0,0,0,0|2,0,0]=4 37 B6R0.1 CNC(=O)CCCl 4027989 [2,0,0,0,0,0|2,0,0]=4 38 B6R0.1 CNC(=O)CCO 4035059 [2,0,0,0,0,0|2,0,0]=4 39 B6R0.1 CNCC(=O)NC 4033340 [2,0,0,0,0,0|2,0,0]=4 40 B6R0.1 COC(=O)CCO 4041011 [2,0,0,0,0,0|1,0,0]=3 41 B6R0.4 CCCCC(=N)N 4012905 [2,0,0,0,0,0|2,0,0]=4 42 B6R0.4 CNCCC(=O)O 4036102 [2,0,0,0,0,0|1,0,0]=3 43 B6R0.4 CNCCC(N)=O 4029061 [2,0,0,0,0,0|2,0,0]=4 44 B6R0.4 COCCC(C)=O 4022132 [2,0,0,0,0,0|1,0,0]=3 45 B6R0.4 NC(=O)CCCCl 4028442 [2,0,0,0,0,0|2,0,0]=4 46 B8R0.3 CCCC(N)C(=O)NC 4042706 [1,1,0,0,0,0|1,0,0]=3 47 B8R0.3 CCC[C@@H](N)C(=O)OC 4107426 [1,1,0,0,0,0|0,0,0]=2 48 B8R0.3 CCOC(=O)C(=O)CC 4013605 [1,1,0,0,0,0|1,0,1]=4 49 B8R0.3 COC(=O)[C@@H](N)CSC 4029499 [1,1,0,0,0,0|1,0,0]=3 50 B8R0.8 CC(C)C(=O)NCCN 4027734 [1,1,0,0,0,0|2,0,0]=4 51 B8R0.8 CCCNC(=O)C(C)Cl 4027198 [1,1,0,0,0,0|1,0,0]=3 52 B8R0.8 CN(C)C(=O)CCCN 4034672 [1,1,0,0,0,0|2,0,0]=4 53 B8R0.9 CC(C)CNC(=O)CCl 4025710 [1,1,0,0,0,0|2,0,0]=4 54 B8R0.19 CCC(C)NC(=O)CCl 4028165 [1,1,0,0,0,0|2,0,0]=4 55 B8R0.19 CNC(=O)CC(C)NC 4034214 [1,1,0,0,0,0|2,0,0]=4 56 B8R0.19 CNC(=O)CC(C)NC 4088864 [1,1,0,0,0,0|2,0,0]=4 57 B8R0.25 CCS(=O)(=O)CCNC 4039868 [1,1,0,0,0,0|2,0,0]=4 58 B8R0.5 CC(C)NC(=O)CCCl 4032028 [1,1,0,0,0,0|2,0,0]=4 59 B10R0.2 CCCC(N)CC(=O)OCC 4012463 [0,2,0,0,0,0|0,0,0]=2 60 B10R0.26 CCOC(=O)CC(N)C(C)C 4012462 [0,2,0,0,0,0|0,0,0]=2 61 B8R1.2 CCC1CCCNC1 4018855 [1,0,0,1,0,0|2,0,0]=4 62 B8R1.2 CCC1CCNCC1 4004580 [1,0,0,1,0,0|1,0,1]=4 63 B8R1.2 CCC1CCNCC1 4110368 [1,0,0,1,0,0|1,0,1]=4 64 B8R1.2 CNC1CCOCC1 4003545 [1,0,0,1,0,0|1,0,1]=4 65 B8R1.2 NCC1=CCCCC1 4019756 [1,0,0,1,0,0|2,0,0]=4 66 B8R1.2 NCC1CCOCC1 4004281 [1,0,0,1,0,0|1,0,1]=4 67 B8R1.2 NCC1CCOCC1 4089498 [1,0,0,1,0,0|1,0,1]=4 68 B8R1.2 OCC1CCOCC1 4027097 [1,0,0,1,0,0|1,0,1]=4 69 B8R1.8 BrCCC1CCOC1 4038663 [1,0,0,1,0,0|1,0,1]=4 70 B8R1.8 CCCC1C=CCN1 4029126 [1,0,0,1,0,0|2,0,0]=4 71 B8R1.8 CCCC1CCNC1 4018767 [1,0,0,1,0,0|1,0,1]=4 72 B8R1.8 CCNC1CCCC1 4024871 [1,0,0,1,0,0|1,0,1]=4 73 B8R1.8 CCOC1CCNC1 4041020 [1,0,0,1,0,0|1,0,1]=4 74 B8R1.8 CNCC1CCOC1 4019736 [1,0,0,1,0,0|1,0,1]=4 75 B8R1.8 NCCC1CCOC1 4037193 [1,0,0,1,0,0|1,0,1]=4 76 B8R1.8 OCCC1CCOC1 4037633 [1,0,0,1,0,0|1,0,1]=4 77 B8R1.22 CC1CCCCCN1 4043402 [1,0,0,1,0,0|1,0,1]=4 78 B8R1.22 CC1CCCNCC1 4041336 [1,0,0,1,0,0|1,0,1]=4 79 B8R1.1 CCC1COC(=O)N1 4044759 [1,0,0,1,0,0|1,0,0]=3 80 B8R1.1 NCC1CCC(=O)N1 4110532 [1,0,0,1,0,0|2,0,0]=4 81 B8R1.1 NCC1CNC(=O)C1 4002894 [1,0,0,1,0,0|2,0,0]=4 82 B8R1.1 O=C1CC(CBr)CN1 4076303 [1,0,0,1,0,0|2,0,0]=4 83 B8R1.1 O=C1CC(CO)CN1 4108826 [1,0,0,1,0,0|2,0,0]=4 84 B8R1.1 O=C1CCC(CBr)O1 4085450 [1,0,0,1,0,0|2,0,0]=4 85 B8R1.1 O=C1CCC(CI)N1 4110716 [1,0,0,1,0,0|2,0,0]=4 86 B8R1.3 C[C@@H]1CNC(=O)CN1 4082079 [1,0,0,1,0,0|2,0,0]=4 87 B8R1.3 C[C@H]1CNC(=O)CN1 4084192 [1,0,0,1,0,0|2,0,0]=4 88 B8R1.3 O=C1CCC(O)CC1 4029093 [1,0,0,1,0,0|1,0,0]=3 89 B8R1.38 NNC(=O)C1CCC1 4032586 [1,0,0,1,0,0|2,0,0]=4 90 B8R1.40 NCC(=O)NC1CC1 4031002 [1,0,0,1,0,0|2,0,0]=4 91 B8R1.40 O=C(CCl)NC1CC1 4027313 [1,0,0,1,0,0|2,0,0]=4 92 B8R1.52 CCC1(N)CCCC1 4017676 [1,0,0,1,0,0|1,0,1]=4 93 B8R1.4 CC1CCCC(=O)N1 4027532 [1,0,0,1,0,0|1,0,0]=3 94 B8R1.4 CC1COCC(=O)N1 4028237 [1,0,0,1,0,0|2,0,0]=4 95 B8R1.4 C[C@@H]1CNCC(=O)N1 4054334 [1,0,0,1,0,0|2,0,0]=4 96 B8R1.4 C[C@H]1CNCC(=O)N1 4108180 [1,0,0,1,0,0|2,0,0]=4 97 B10R1.130 CCCN1CC(N)CC1=O 4014080 [0,1,0,1,0,0|2,0,0]=4 98 B10R1.11 CCNC(=O)C1CCNC1 4030896 [0,1,0,1,0,0|1,0,0]=3 99 B10R1.11 NCCC(=O)N1CCCC1 4031732 [0,1,0,1,0,0|2,0,0]=4 100 B10R1.11 NCCC(=O)N1CCCC1 4091022 [0,1,0,1,0,0|2,0,0]=4 101 B10R1.21 CCCNCC1CCCO1 4000752 [0,1,0,1,0,0|1,0,1]=4 102 B10R1.21 CNCCCC1CCCO1 4018237 [0,1,0,1,0,0|1,0,1]=4 103 B10R1.21 NCCCCC1CCCO1 4018236 [0,1,0,1,0,0|1,0,1]=4 104 B10R1.21 NCCCCC1CCCO1 4090493 [0,1,0,1,0,0|1,0,1]=4 105 B10R1.138 CCOC(=O)\C=C\C1CC1 4069949 [0,1,0,1,0,0|0,0,1]=3 106 B10R1.197 CCC1CCNC(=O)CC1 4042732 [0,1,0,1,0,0|1,0,0]=3 107 B10R1.35 CCN1CC(CN)CC1=O 4002895 [0,1,0,1,0,0|2,0,0]=4 108 B10R1.35 CCN1CC(CO)CC1=O 4034970 [0,1,0,1,0,0|2,0,0]=4 109 B10R1.4 NCCN1CCCCC1=O 4014128 [0,1,0,1,0,0|1,0,0]=3 110 B10R1.4 NCCN1CCCOC1=O 4014989 [0,1,0,1,0,0|2,0,0]=4 111 B10R1.4 O=C1NCCNC1CCO 4016235 [0,1,0,1,0,0|2,0,0]=4 112 B10R1.2 CCN1CCNC(=O)C1C 4044255 [0,1,0,1,0,0|2,0,0]=4 113 B10R1.2 CCN1CCNC(C)C1=O 4005832 [0,1,0,1,0,0|2,0,0]=4 114 B10R1.140 CCOC(=O)C1CC(=O)C1 4108294 [0,1,0,1,0,0|0,0,1]=3 115 B10R1.212 CCOC(=O)C(=O)C1CC1 4045746 [0,1,0,1,0,0|0,0,1]=3 116 B10R1.64 CN(C)CC1CCCC1=O 4023728 [0,1,0,1,0,0|2,0,0]=4 117 B10R1.113 CC(C)C1CC(=O)CCO1 4052864 [0,1,0,1,0,0|2,0,0]=4 118 B10R2.61 O=C1N[C@H]2CCC[C@@H]1C2 4091297 [0,0,0,2,0,0|1,0,0]=3 119 B10R2.32 O=C1NC[C@H]2CNC[C@@H]12 4091201 [0,0,0,2,0,0|2,0,0]=4