0 B9R1.6 NC(=O)C1CCCNC1 BB58-0148 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 NC(=O)C1CCNCC1 BB57-6677 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 NC(=O)N1CCOCC1 BB57-5065 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 NC(=S)N1CCOCC1 BB55-6892 [0,0,0,0,0,0|3,1,0]=4 4 B9R1.6 O=C(O)C1CCCCC1 BB01-5902 [0,0,0,0,0,0|0,0,0]=0 5 B9R1.6 O=C(O)C1CCOCC1 BB01-8327 [0,0,0,0,0,0|1,0,0]=1 6 B9R1.6 O=C(O)C1CNCCN1 BB01-8283 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 O=C(O)C1SCCCS1 BB58-0269 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.2 COC1CCNCC1 BB01-8265 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.2 N#CC1CCCCC1 BB58-4600 [1,0,0,0,0,0|1,0,1]=3 10 B8R1.2 NCC1CCNCC1 BB01-6277 [1,0,0,0,0,0|2,0,1]=4 11 B8R1.2 O=CC1CCCCC1 BB01-6149 [1,0,0,0,0,0|0,0,0]=1 12 B8R1.2 OCC1CCCCO1 BB01-4802 [1,0,0,0,0,0|1,0,1]=3 13 B8R1.2 OCC1CCNCC1 BB58-3415 [1,0,0,0,0,0|1,0,1]=3 14 B8R1.2 OCC1CCOCC1 BB55-3597 [1,0,0,0,0,0|1,0,1]=3 15 B8R1.2 OC[C@H]1COCCN1 BB31-4175 [1,0,0,0,0,0|2,0,1]=4 16 B8R1.2 ON=C1CCOCC1 BB55-3583 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.13 CC(=O)N1CCC(N)CC1 BB53-1175 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.13 CC1CCC(C(=O)O)CC1 BB58-4355 [0,1,0,0,0,0|0,0,0]=1 19 B10R1.13 CN(C)[C@H]1CC[C@H](O)CC1 BB31-8758 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.15 CNC(=O)C1CCNCC1 BB20-0010 [0,1,0,0,0,0|2,0,0]=3 21 B10R1.15 COC(=O)C1CCOCC1 BB58-1132 [0,1,0,0,0,0|1,0,0]=2 22 B10R1.15 NNC(=O)C1CCCCC1 BB01-5051 [0,1,0,0,0,0|1,0,0]=2 23 B10R1.15 O=C(CCl)N1CCCCC1 BB01-8181 [0,1,0,0,0,0|2,0,0]=3 24 B10R1.15 O=C(CCl)N1CCOCC1 BB53-0771 [0,1,0,0,0,0|3,0,0]=4 25 B10R1.61 CC1CCCCC1C(=O)O BB58-4370 [0,1,0,0,0,0|0,0,0]=1 26 B10R1.61 CN(C)[C@@H]1CCCC[C@H]1O BB55-6313 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.113 CC1CCCC(C(=O)O)C1 BB58-4369 [0,1,0,0,0,0|0,0,0]=1 28 B10R1.113 CN1CCC=C(C(=O)O)C1 BB58-4653 [0,1,0,0,0,0|1,0,2]=4 29 B8R0.7 CCCCCSC(=N)N BB58-4675 [0,0,1,0,0,0|3,0,0]=4 30 B8R0.7 COCCOCC(=O)O BB57-6814 [0,0,1,0,0,0|2,0,0]=3 31 B8R0.7 NCCCCCC(=O)O BB57-3834 [0,0,1,0,0,0|1,0,0]=2 32 B8R0.8 CC(=O)C(C)CCC#N BB01-5869 [0,0,1,0,0,0|2,0,1]=4 33 B8R0.8 CCCCC(C)C(=O)O BB58-4619 [0,0,1,0,0,0|0,0,0]=1 34 B8R0.8 CCCNC(=O)C(=O)O BB55-4706 [0,0,1,0,0,0|2,0,1]=4 35 B8R0.8 NCCCC(N)C(=O)O BB57-0193 [0,0,1,0,0,0|2,0,0]=3 36 B8R1.7 N=C(N)N1CCCC1 BB58-4298 [0,0,0,0,1,0|3,0,0]=4 37 B8R1.7 NC(=S)N1CCCC1 BB55-6891 [0,0,0,0,1,0|2,1,0]=4 38 B8R1.7 O=C(O)C1CC=CC1 BB01-7889 [0,0,0,0,1,0|0,0,2]=3 39 B8R1.7 O=C(O)C1CCOC1 BB58-1384 [0,0,0,0,1,0|1,0,0]=2 40 B8R1.7 O=C(O)C1CSCN1 BB57-0213 [0,0,0,0,1,0|2,0,0]=3 41 B10R1.18 CC(=O)NC1CCCNC1 BB58-0018 [0,0,0,0,0,1|2,0,0]=3 42 B10R1.18 CC(C)NC1CCCCC1 BB57-0223 [0,0,0,0,0,1|2,0,1]=4 43 B10R1.18 O=C(Cl)CC1CCCCC1 BB20-1593 [0,0,0,0,0,1|1,0,0]=2 44 B10R1.18 O=C(O)CN1CCOCC1 BB01-3856 [0,0,0,0,0,1|2,0,0]=3 45 B10R1.348 O=C(O)C1CCCCCC1 BB58-4365 [0,0,0,0,0,1|0,0,0]=1 46 B7R0.4 C=C(C)CCCCC BB58-4377 [1,0,1,0,0,0|2,0,0]=4 47 B7R0.4 CC(=O)CCCCCl BB57-6752 [1,0,1,0,0,0|2,0,0]=4 48 B7R0.4 CCOCCC(=O)O BB57-3742 [1,0,1,0,0,0|1,0,0]=3 49 B7R0.4 CNCCCC(=O)O BB58-0143 [1,0,1,0,0,0|1,0,0]=3 50 B7R0.3 CC(CO)CCCO BB58-5344 [1,0,1,0,0,0|1,0,1]=4 51 B7R0.5 CCNC(C)C(N)=O BB58-3590 [1,0,1,0,0,0|2,0,0]=4 52 B7R0.5 NCCC(N)C(=O)O BB57-6108 [1,0,1,0,0,0|2,0,0]=4 53 B7R1.3 FC1CCCNC1 BB31-0459 [2,0,0,0,0,0|2,0,0]=4 54 B7R1.3 O=C1CCOCC1 BB53-1277 [2,0,0,0,0,0|1,0,1]=4 55 B7R1.3 O=C1CCSCC1 BB53-1260 [2,0,0,0,0,0|1,0,1]=4 56 B7R1.3 OC1CCCNC1 BB01-6209 [2,0,0,0,0,0|1,0,0]=3 57 B7R1.3 OC1CCNCC1 BB17-2908 [2,0,0,0,0,0|1,0,0]=3 58 B9R0.2 NCCCCCCC(=O)O BB58-1683 [0,1,1,0,0,0|0,0,0]=2 59 B9R0.4 CCCCC(N)CC(=O)O BB57-0288 [0,1,1,0,0,0|0,0,0]=2 60 B9R0.46 CCCCCNC(=O)CCl BB53-1222 [0,1,1,0,0,0|2,0,0]=4 61 B9R0.46 NNC(=O)CCCCCO BB57-6571 [0,1,1,0,0,0|2,0,0]=4 62 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O BB55-8164 [0,1,1,0,0,0|2,0,0]=4 63 B9R0.8 CCCCN(C)C(=O)CCl BB01-1058 [0,1,1,0,0,0|2,0,0]=4 64 B9R0.15 CCCC(CCC)C(=O)Cl BB20-1580 [0,1,1,0,0,0|1,0,0]=3 65 B9R0.39 CCC(NC(C)=O)C(=O)O BB57-4742 [0,1,1,0,0,0|1,0,1]=4 66 B9R1.8 COCC1CCNCC1 BB01-5648 [1,1,0,0,0,0|1,0,1]=4 67 B9R1.8 O=C=NC1CCCCC1 BB01-7794 [1,1,0,0,0,0|0,0,1]=3 68 B9R1.8 OCCC1CCCCN1 BB01-6270 [1,1,0,0,0,0|1,0,1]=4 69 B9R1.8 OCCN1CCCCC1 BB01-7783 [1,1,0,0,0,0|1,0,1]=4 70 B9R1.15 CN1CCCCC1CO BB57-3381 [1,1,0,0,0,0|1,0,1]=4 71 B9R1.118 N#CC1(O)CCCCC1 BB58-5226 [1,1,0,0,0,0|1,0,1]=4 72 B9R1.11 CNC(=O)C1CCNC1 BB58-3620 [0,1,0,0,1,0|2,0,0]=4 73 B9R1.11 COC(=O)C1CCCN1 BB58-4127 [0,1,0,0,1,0|1,0,0]=3 74 B9R1.11 O=C(CCl)N1CCCC1 BB01-6299 [0,1,0,0,1,0|2,0,0]=4 75 B9R1.35 O=C(O)C1CC(O)CN1 BB57-0232 [0,1,0,0,1,0|1,0,0]=3 76 B9R1.35 O=C1CCC(C(=O)O)C1 BB01-6440 [0,1,0,0,1,0|0,0,1]=3 77 B11R1.20 CC(=O)NC1CCC(=O)CC1 BB17-2907 [0,1,0,0,0,1|1,0,1]=4 78 B11R1.20 CN1CCC(CC(=O)O)CC1 BB01-8266 [0,1,0,0,0,1|1,0,0]=3 79 B11R1.36 CC(C(=O)O)C1CCCCC1 BB57-1761 [0,1,0,0,0,1|0,0,0]=2 80 B11R1.36 O=C(O)C(=O)N1CCCCC1 BB55-4722 [0,1,0,0,0,1|1,0,0]=3 81 B11R1.40 CNC(=O)CN1CCCCC1 BB17-0210 [0,1,0,0,0,1|2,0,0]=4 82 B11R1.40 COC(=O)CC1CCNCC1 BB53-1263 [0,1,0,0,0,1|1,0,0]=3 83 B11R1.40 NNC(=O)CC1CCCCC1 BB01-5066 [0,1,0,0,0,1|1,0,0]=3 84 B11R1.40 NNC(=O)CN1CCCCC1 BB57-2018 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.40 NNC(=O)NC1CCCCC1 BB57-7082 [0,1,0,0,0,1|1,0,0]=3 86 B11R1.40 NNC(=S)NC1CCCCC1 BB55-2240 [0,1,0,0,0,1|1,1,0]=4 87 B11R1.40 O=C(CCl)NC1CCCCC1 BB53-1223 [0,1,0,0,0,1|1,0,0]=3 88 B11R1.928 NC1(CC(=O)O)CCCCC1 BB01-8057 [0,1,0,0,0,1|0,0,0]=2 89 B11R1.852 O=C(CCl)N1CCCCCC1 BB01-5148 [0,1,0,0,0,1|2,0,0]=4 90 B11R1.3 NCC1CCC(C(=O)O)CC1 BB57-0219 [0,2,0,0,0,0|0,0,0]=2 91 B11R1.22 CC1CCN(C(=O)CCl)CC1 BB01-5129 [0,2,0,0,0,0|2,0,0]=4 92 B11R1.22 COC(=O)C1CCN(C)CC1 BB58-0811 [0,2,0,0,0,0|1,0,0]=3 93 B11R1.16 CCOC(=O)C1CCCCN1 BB01-4553 [0,2,0,0,0,0|1,0,0]=3 94 B11R1.16 CCOC(=O)C1CCCNC1 BB01-6178 [0,2,0,0,0,0|1,0,0]=3 95 B11R1.16 CCOC(=O)N1CCNCC1 BB17-0793 [0,2,0,0,0,0|2,0,0]=4 96 B11R1.16 O=C(CCBr)N1CCCCC1 BB58-4252 [0,2,0,0,0,0|2,0,0]=4 97 B11R1.878 CNC(=O)C1(N)CCCCC1 BB55-8839 [0,2,0,0,0,0|1,0,0]=3 98 B11R1.53 CCN1CCCCC1C(=O)O BB58-0837 [0,2,0,0,0,0|1,0,0]=3 99 B11R1.74 O=C1CC(=O)CC(C(=O)O)C1 BB01-8366 [0,2,0,0,0,0|0,0,2]=4 100 B9R1.13 O=C(Cl)CC1CCCC1 BB20-1616 [0,0,1,1,0,0|1,0,0]=3 101 B9R1.5 NC1CCCCNC1=O BB57-3738 [0,0,1,1,0,0|2,0,0]=4 102 B9R1.5 O=C1NCCCCC1Br BB58-3108 [0,0,1,1,0,0|2,0,0]=4 103 B11R2.10 S=C1NC2CCCCC2N1 BB01-5722 [0,0,0,1,0,1|1,1,0]=4 104 B11R2.845 CC(=O)C1CC2CCC1C2 BB55-2251 [0,1,0,1,0,0|1,0,0]=3 105 B7R1.1 OCC1CCCN1 BB01-5343 [1,0,0,0,1,0|1,0,1]=4 106 B7R1.1 OC[C@H]1CCCO1 BB31-4654 [1,0,0,0,1,0|1,0,1]=4 107 B9R1.89 O=CN1CCCNCC1 BB57-0181 [1,0,0,0,0,1|1,0,0]=3 108 B11R1.91 O=C(O)CCN1CCCCC1 BB01-4158 [0,0,0,0,0,2|1,0,0]=3 109 B11R1.91 O=C(O)CCN1CCCCO1 BB57-1027 [0,0,0,0,0,2|2,0,0]=4 110 B11R1.91 O=C(O)CNC1=NCCCC1 BB52-7683 [0,0,0,0,0,2|1,0,1]=4