0 B10R1.66 O=C(O)CCC1OCCO1 SC-88729 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.66 O=C(O)\C=C\C1CCCC1 SC-39527 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.25 NNC(=O)CCC1CCCC1 SC-59721 [0,1,0,0,0,0|3,0,0]=4 3 B11R1.25 NNC(=S)NCC1CCCO1 SC-54384 [0,1,0,0,0,0|2,1,0]=4 4 B11R1.77 NC(=O)CC(N)C1CCCC1 SC-59230 [0,1,0,0,0,0|3,0,0]=4 5 B11R1.77 NC(CC(=O)O)C1CCCC1 SC-59229 [0,1,0,0,0,0|3,0,0]=4 6 B11R1.77 O=C(Cl)CC(Cl)C1CCCC1 SC-21652 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.77 O=C(O)CC(O)C1CCCC1 SC-22024 [0,1,0,0,0,0|3,0,0]=4 8 B11R1.510 CS(=O)(=O)OCC1CCCC1 SC-62749 [0,1,0,0,0,0|2,0,0]=3 9 B9R0.2 CC(=O)OCCOCCCl SC-48054 [0,0,1,0,0,0|1,0,0]=2 10 B9R0.2 CCCCCCCC(=O)[O-] SC-18483 [0,0,1,0,0,0|3,0,0]=4 11 B9R0.2 CCCCCCCC(=O)[O-] SC-26042 [0,0,1,0,0,0|3,0,0]=4 12 B9R0.2 CCCCCCCC(=O)[O-] SC-52189 [0,0,1,0,0,0|3,0,0]=4 13 B9R0.2 CCCCCCCC(=O)[O-] SC-79959 [0,0,1,0,0,0|3,0,0]=4 14 B9R0.2 NCCCCCCC(=O)O SC-52825 [0,0,1,0,0,0|3,0,0]=4 15 B9R0.43 COC(CCC(=O)O)OC SC-33144 [0,0,1,0,0,0|3,0,0]=4 16 B9R1.13 CC(=O)NC1CCNC1 SC-08933 [0,0,0,0,1,0|3,0,0]=4 17 B9R1.13 CC(=O)N[C@@H]1CCNC1 SC-08932 [0,0,0,0,1,0|3,0,0]=4 18 B9R1.13 CC(C)CC1CCCN1 SC-29304 [0,0,0,0,1,0|2,0,1]=4 19 B9R1.13 O=C(O)CC1CCCC1 SC-65869 [0,0,0,0,1,0|2,0,0]=3 20 B9R1.13 O=C(O)CC1CCNC1 SC-48282 [0,0,0,0,1,0|3,0,0]=4 21 B9R1.84 O=C(O)\C=C\C1CCC1 SC-14219 [0,0,0,0,1,0|2,0,1]=4 22 B11R1.91 O=C(Cl)CCC1CCCCC1 SC-46177 [0,0,0,0,0,1|3,0,0]=4 23 B11R1.91 O=C(O)CCC1CCCNC1 SC-30960 [0,0,0,0,0,1|3,0,0]=4 24 B11R1.91 O=C(O)CCC1CCNCC1 SC-31217 [0,0,0,0,0,1|3,0,0]=4 25 B11R1.91 O=C(O)CCC1OCCCO1 SC-34403 [0,0,0,0,0,1|2,0,0]=3 26 B8R0.4 CCCCCCCCO SC-19079 [1,0,1,0,0,0|1,0,1]=4 27 B8R0.7 CC(C)CCCCCO SC-51101 [1,0,1,0,0,0|1,0,1]=4 28 B8R0.7 CCCCCOC(=O)Cl SC-18359 [1,0,1,0,0,0|1,0,0]=3 29 B8R0.7 CCOCCOC(=O)Cl SC-51564 [1,0,1,0,0,0|1,0,0]=3 30 B8R0.7 COCCCOC(C)=O SC-26578 [1,0,1,0,0,0|1,0,0]=3 31 B8R0.7 COCOCCC(=O)O SC-50551 [1,0,1,0,0,0|2,0,0]=4 32 B8R1.8 NNCC1CCCO1 SC-42789 [2,0,0,0,0,0|2,0,0]=4 33 B8R1.8 NNCC1CCCO1 SC-48294 [2,0,0,0,0,0|2,0,0]=4 34 B10R0.4 CCCCOCCOC(C)=O SC-19073 [0,1,1,0,0,0|0,0,0]=2 35 B10R0.74 CCCCCCOC(=O)CN SC-62344 [0,1,1,0,0,0|1,0,0]=3 36 B10R1.23 NC(C(=O)O)C1CCCC1 SC-51785 [0,1,0,0,1,0|2,0,0]=4 37 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](O)C1 SC-49020 [0,1,0,0,1,0|1,0,1]=4 38 B10R1.370 CC1(CC(=O)O)CCCN1 SC-87777 [0,1,0,0,1,0|2,0,0]=4 39 B10R1.204 C=C(CC1CCC1)C(=O)O SC-31103 [0,1,0,0,1,0|2,0,0]=4 40 B12R1.891 CS(=O)(=O)OCC1CCCCC1 SC-62750 [0,1,0,0,0,1|2,0,0]=4 41 B12R1.477 COC(=O)CCNC1CCCC1 SC-48393 [0,1,0,0,0,1|2,0,0]=4 42 B12R1.15 COC(=O)CC(O)C1CCCC1 SC-22025 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.51 CCCC(=O)OCC1CCCO1 SC-67302 [0,2,0,0,0,0|0,0,0]=2 44 B10R1.10 O=C1CN(CCO)CCN1 SC-66040 [0,0,1,1,0,0|2,0,0]=4 45 B10R1.18 CC(=O)NC1CCCNC1 SC-47509 [0,0,1,1,0,0|2,0,0]=4 46 B10R1.61 O=C(O)C1CCCCC1O SC-22272 [0,0,1,1,0,0|2,0,0]=4 47 B12R2.2918 O=C1CC2(CCCCC2)CN1 SC-12106 [0,0,0,1,0,1|2,0,0]=4 48 B12R2.1175 O=C1CCC2(CCCC2)CC1 SC-91193 [0,1,0,1,0,0|2,0,0]=4 49 B12R2.5111 O=C1OCC2(CCCC2)[C@@H]1O SC-53499 [0,1,0,1,0,0|1,0,0]=3 50 B8R0.5 CCOC(=O)CC(C)=O SC-18922 [0,0,1,0,1,0|1,0,1]=4 51 B8R1.7 CC(=O)C1CCCC1 SC-34558 [0,0,0,0,2,0|1,0,0]=3 52 B8R1.7 N=C(N)C1CCCO1 SC-54449 [0,0,0,0,2,0|2,0,0]=4 53 B8R1.7 NC(=O)[C@H]1CCCN1 SC-09817 [0,0,0,0,2,0|2,0,0]=4 54 B8R1.7 OC(=S)[C@H]1CCCO1 SC-28168 [0,0,0,0,2,0|1,0,1]=4 55 B8R1.7 [C@@H]1(C(N)=O)CCCN1 SC-09818 [0,0,0,0,2,0|2,0,0]=4 56 B8R1.34 CC(=O)NC1CNC1 SC-48410 [0,0,0,0,2,0|2,0,0]=4 57 B8R1.35 CC(=O)OCC1CO1 SC-74435 [0,0,0,0,2,0|0,0,0]=2