0 B8R0.8 CC(=O)C(C)CCC#N BB01-5869 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.8 CCCCC(C)C(=O)O BB58-4619 [0,0,0,0,0,0|0,0,0]=0 2 B8R0.8 CCCNC(=O)C(=O)O BB55-4706 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.8 CCCNC(C)C(C)C BB55-6529 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.8 NCCCC(N)C(=O)O BB57-0193 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.3 CC(CO)CCCO BB58-5344 [1,0,0,0,0,0|1,0,1]=3 6 B7R0.3 CCCNC(C)CC BB57-3735 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.3 CSCCC(N)CO BB01-7854 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.4 C=C(C)CCCCC BB58-4377 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.4 CC(=O)CCCCCl BB57-6752 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.4 CC(=O)NCCCBr BB58-5163 [1,0,0,0,0,0|3,0,0]=4 11 B7R0.4 CC(=O)NCCCCl BB58-5165 [1,0,0,0,0,0|3,0,0]=4 12 B7R0.4 CCCCOC(=S)[S-] BB55-6492 [1,0,0,0,0,0|1,2,0]=4 13 B7R0.4 CCOCCC(=O)O BB57-3742 [1,0,0,0,0,0|1,0,0]=2 14 B7R0.4 CNCCCC(=O)O BB58-0143 [1,0,0,0,0,0|1,0,0]=2 15 B7R0.5 CCNC(C)C(N)=O BB58-3590 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.5 NCCC(N)C(=O)O BB57-6108 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.5 O=C(Cl)C(Br)CCBr BB58-1369 [1,0,0,0,0,0|3,0,0]=4 18 B9R0.7 CC(C)CNC(=O)C(=O)O BB57-0815 [0,1,0,0,0,0|2,0,1]=4 19 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O BB55-8164 [0,1,0,0,0,0|2,0,0]=3 20 B9R0.8 CCCCN(C)C(=O)CCl BB01-1058 [0,1,0,0,0,0|2,0,0]=3 21 B9R0.42 CC(NC(=O)CN)C(=O)O BB58-4661 [0,1,0,0,0,0|2,0,1]=4 22 B9R0.42 CCC(C)NC(=O)C(=O)O BB55-4719 [0,1,0,0,0,0|2,0,1]=4 23 B9R1.5 NC1CCCCNC1=O BB57-3738 [0,0,0,1,0,0|2,0,0]=3 24 B9R1.5 O=C1NCCCCC1Br BB58-3108 [0,0,0,1,0,0|2,0,0]=3 25 B9R1.6 NC(=O)C1CCCNC1 BB58-0148 [0,0,0,1,0,0|2,0,0]=3 26 B9R1.6 NC(=O)C1CCNCC1 BB57-6677 [0,0,0,1,0,0|2,0,0]=3 27 B9R1.6 NC(=O)N1CCOCC1 BB57-5065 [0,0,0,1,0,0|3,0,0]=4 28 B9R1.6 O=C(O)C1CCCCC1 BB01-5902 [0,0,0,1,0,0|0,0,0]=1 29 B9R1.6 O=C(O)C1CCOCC1 BB01-8327 [0,0,0,1,0,0|1,0,0]=2 30 B9R1.6 O=C(O)C1CNCCN1 BB01-8283 [0,0,0,1,0,0|2,0,0]=3 31 B9R1.6 O=C(O)C1SCCCS1 BB58-0269 [0,0,0,1,0,0|2,0,0]=3 32 B9R1.35 O=C(O)C1CC(O)CN1 BB57-0232 [0,0,0,1,0,0|2,0,0]=3 33 B9R1.35 O=C1CCC(C(=O)O)C1 BB01-6440 [0,0,0,1,0,0|1,0,1]=3 34 B9R0.4 CCCCC(N)CC(=O)O BB57-0288 [0,0,0,0,0,1|1,0,0]=2 35 B6R0.4 CCNCC(=O)O BB20-0183 [2,0,0,0,0,0|1,0,0]=3 36 B6R0.3 CC(CN)C(=O)O BB58-0275 [2,0,0,0,0,0|1,0,0]=3 37 B6R0.3 CCC(N)C(=O)O BB55-8838 [2,0,0,0,0,0|1,0,0]=3 38 B6R0.3 NCC(O)C(=O)O BB58-4543 [2,0,0,0,0,0|2,0,0]=4 39 B8R0.7 CCCCCSC(=N)N BB58-4675 [1,1,0,0,0,0|2,0,0]=4 40 B8R0.7 COCCOCC(=O)O BB57-6814 [1,1,0,0,0,0|1,0,0]=3 41 B8R0.7 NCCCCCC(=O)O BB57-3834 [1,1,0,0,0,0|0,0,0]=2 42 B8R0.2 CCN(C)C(C)C(=O)O BB58-2807 [1,1,0,0,0,0|1,0,0]=3 43 B8R0.12 CCCC(C)(C)C(=O)O BB57-6787 [1,1,0,0,0,0|0,0,0]=2 44 B10R0.82 CNC(=O)CCC(N)C(=O)O BB58-4683 [0,2,0,0,0,0|1,0,1]=4 45 B10R0.82 COC(=O)CCC(N)C(=O)O BB17-2988 [0,2,0,0,0,0|1,0,1]=4 46 B10R0.93 CC(N)C(=O)NC(C)C(=O)O BB57-4871 [0,2,0,0,0,0|1,0,1]=4 47 B10R0.85 CCCCC(CC)C(=O)NN BB55-2165 [0,2,0,0,0,0|1,0,0]=3 48 B10R0.98 NC(CCCC(=O)O)C(=O)O BB57-6646 [0,2,0,0,0,0|1,0,1]=4 49 B8R1.2 N#CC1CCCCC1 BB58-4600 [1,0,0,1,0,0|1,0,1]=4 50 B8R1.2 O=CC1CCCCC1 BB01-6149 [1,0,0,1,0,0|0,0,0]=2 51 B8R1.2 OCC1CCCCO1 BB01-4802 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.2 OCC1CCNCC1 BB58-3415 [1,0,0,1,0,0|1,0,1]=4 53 B8R1.2 OCC1CCOCC1 BB55-3597 [1,0,0,1,0,0|1,0,1]=4 54 B8R1.5 CC1SCCNC1=O BB57-3772 [1,0,0,1,0,0|2,0,0]=4 55 B8R1.5 CN1CCCNC1=O BB58-3630 [1,0,0,1,0,0|2,0,0]=4 56 B8R1.5 NC1CCCNC1=O BB01-4609 [1,0,0,1,0,0|2,0,0]=4 57 B8R1.7 O=C(O)C1CC=CC1 BB01-7889 [1,0,0,1,0,0|0,0,2]=4 58 B8R1.7 O=C(O)C1CCOC1 BB58-1384 [1,0,0,1,0,0|1,0,0]=3 59 B8R1.7 O=C(O)C1CSCN1 BB57-0213 [1,0,0,1,0,0|2,0,0]=4 60 B10R1.18 CC(=O)NC1CCCNC1 BB58-0018 [0,0,0,1,0,1|2,0,0]=4 61 B10R1.18 O=C(Cl)CC1CCCCC1 BB20-1593 [0,0,0,1,0,1|1,0,0]=3 62 B10R1.18 O=C(O)CN1CCOCC1 BB01-3856 [0,0,0,1,0,1|2,0,0]=4 63 B10R1.61 CC1CCCCC1C(=O)O BB58-4370 [0,0,0,1,0,1|0,0,0]=2 64 B10R1.13 CC(=O)N1CCC(N)CC1 BB53-1175 [0,1,0,1,0,0|2,0,0]=4 65 B10R1.13 CC1CCC(C(=O)O)CC1 BB58-4355 [0,1,0,1,0,0|0,0,0]=2 66 B10R1.15 CNC(=O)C1CCNCC1 BB20-0010 [0,1,0,1,0,0|2,0,0]=4 67 B10R1.15 COC(=O)C1CCOCC1 BB58-1132 [0,1,0,1,0,0|1,0,0]=3 68 B10R1.15 NNC(=O)C1CCCCC1 BB01-5051 [0,1,0,1,0,0|1,0,0]=3 69 B10R1.15 O=C(CCl)N1CCCCC1 BB01-8181 [0,1,0,1,0,0|2,0,0]=4 70 B10R1.31 CCC1NC(C(=O)O)CS1 BB57-4293 [0,1,0,1,0,0|1,0,0]=3 71 B10R1.348 O=C(O)C1CCCCCC1 BB58-4365 [0,1,0,1,0,0|0,0,0]=2 72 B10R1.477 NCC1(C(=O)O)CCCC1 BB57-0992 [0,1,0,1,0,0|0,0,0]=2 73 B10R1.63 CC1(C)CCC(=O)OC1=O BB01-8368 [0,1,0,1,0,0|1,0,1]=4 74 B10R1.113 CC1CCCC(C(=O)O)C1 BB58-4369 [0,1,0,1,0,0|0,0,0]=2 75 B10R1.113 CN1CCC=C(C(=O)O)C1 BB58-4653 [0,1,0,1,0,0|0,0,2]=4