0 B7R0.7 [C-]#[N+]CC(=O)OCC SPC-q003 [1,0,0,0,0,0|1,0,1]=3 1 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 SPC-r047 [0,0,0,1,0,0|2,0,0]=3 2 B9R1.41 O=C(O)[C@@H]1CCNC1=O SPC-n002 [0,0,0,1,0,0|2,0,1]=4 3 B9R1.48 C[C@H]1CC(=O)NCCN1 SPC-p861 [0,0,0,1,0,0|2,0,0]=3 4 B9R1.66 CC1(C)CC(=O)CCO1 SPC-s192 [0,0,0,1,0,0|3,0,0]=4 5 B9R1.66 CC1(C)CCCC(=O)C1 SPC-p301 [0,0,0,1,0,0|2,0,0]=3 6 B9R1.75 CCOC(=O)CC1CC1 SPC-q002 [0,0,0,1,0,0|1,0,0]=2 7 B7R0.5 CC(C)C(=O)OCCl SPC-n339 [0,0,0,0,1,0|2,0,0]=3 8 B7R0.5 CCOC(=O)C(N)=S SPC-m739 [0,0,0,0,1,0|1,1,1]=4 9 B6R0.1 CCOC(=O)C#N SPC-g163 [2,0,0,0,0,0|1,0,1]=4 10 B8R0.1 CCC#CC(=O)OCC SPC-t629 [1,1,0,0,0,0|0,0,1]=3 11 B8R0.14 CCOC(=O)C(Cl)(Cl)Cl SPC-n384 [0,1,0,0,1,0|2,0,0]=4 12 B10R0.32 CCOC(=O)C(=O)CC(C)=O SPC-t641 [0,1,0,0,0,1|0,0,2]=4 13 B10R0.31 CC(C)(C)OC(=O)CC(=O)O SPC-n033 [0,2,0,0,0,0|1,0,1]=4 14 B8R1.4 CC1CC(N)CCO1 SPC-m997 [1,0,0,1,0,0|1,0,1]=4 15 B8R1.4 CC1CC(O)CCO1 SPC-g891 [1,0,0,1,0,0|0,0,2]=4 16 B8R1.4 CN1CCC[C@@H](O)C1 SPC-j194 [1,0,0,1,0,0|2,0,0]=4 17 B8R1.4 CN1CCC[C@H](O)C1 SPC-j195 [1,0,0,1,0,0|2,0,0]=4 18 B8R1.4 C[C@@H]1CC(=O)CCN1 SPC-j888 [1,0,0,1,0,0|1,0,0]=3 19 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-j895 [1,0,0,1,0,0|1,0,0]=3 20 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-m537 [1,0,0,1,0,0|1,0,0]=3 21 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-n719 [1,0,0,1,0,0|1,0,0]=3 22 B8R1.4 C[C@H]1CC(=O)CCO1 SPC-k855 [1,0,0,1,0,0|0,0,0]=2 23 B8R1.4 C[C@H]1CCNC(=O)C1 SPC-p144 [1,0,0,1,0,0|2,0,0]=4 24 B8R1.4 N[C@@H]1COCC(=O)C1 SPC-u616 [1,0,0,1,0,0|2,0,0]=4 25 B8R1.4 N[C@H]1CCC[C@H](O)C1 SPC-n635 [1,0,0,1,0,0|1,0,1]=4 26 B8R1.4 N[C@H]1CCNC(=O)C1 SPC-j029 [1,0,0,1,0,0|2,0,0]=4 27 B8R1.4 O=C1CCC[C@H](O)C1 SPC-p385 [1,0,0,1,0,0|0,0,0]=2 28 B8R1.18 CN1C[C@@H](N)CC1=O SPC-p485 [1,0,0,1,0,0|2,0,0]=4 29 B8R1.40 COC(=O)CC1CC1 SPC-k723 [1,0,0,1,0,0|1,0,0]=3 30 B8R1.51 CC1(C)COC(=O)N1 SPC-k094 [1,0,0,1,0,0|2,0,0]=4 31 B8R1.6 CCOC1CC(N)C1 SPC-p372 [1,0,0,1,0,0|1,0,1]=4 32 B8R1.72 CC1(N)CCOCC1 SPC-h385 [1,0,0,1,0,0|1,0,1]=4 33 B8R1.72 CC1(N)CCOCC1 SPC-r348 [1,0,0,1,0,0|1,0,1]=4 34 B8R1.72 CC1(O)CCNCC1 SPC-j073 [1,0,0,1,0,0|1,0,1]=4 35 B8R1.72 CC1(O)CCNCC1 SPC-n154 [1,0,0,1,0,0|1,0,1]=4 36 B8R1.72 C[C@]1(O)CCCNC1 SPC-h456 [1,0,0,1,0,0|2,0,0]=4 37 B8R1.72 C[C@]1(O)CCCNC1 SPC-u662 [1,0,0,1,0,0|2,0,0]=4 38 B8R1.11 O=C1NCC[C@@H]1CO SPC-k007 [1,0,0,1,0,0|1,0,0]=3 39 B8R1.37 CCCC(=O)C1CC1 SPC-u760 [1,0,0,1,0,0|1,0,0]=3 40 B8R1.37 CCOC(=O)[C@@H]1CO1 SPC-g805 [1,0,0,1,0,0|0,0,0]=2 41 B8R1.54 C[C@H](Br)C(=O)C1CC1 SPC-p141 [0,0,0,1,1,0|2,0,0]=4 42 B10R1.140 CCOC(=O)C1CC(=O)C1 SPC-g491 [0,0,0,1,0,1|0,0,2]=4 43 B10R1.140 CCOC(=O)C1CC(Br)C1 SPC-t179 [0,0,0,1,0,1|1,0,0]=3 44 B10R1.140 CCOC(=O)C1CC(O)C1 SPC-m100 [0,0,0,1,0,1|0,0,0]=2 45 B10R1.140 CCOC(=O)[C@H]1C[C@H](O)C1 SPC-i529 [0,0,0,1,0,1|0,0,0]=2 46 B10R1.212 CCOC(=O)[C@@H](Br)C1CC1 SPC-h187 [0,1,0,1,0,0|1,0,0]=3 47 B10R1.135 CCOC(=O)C1CC1C#N SPC-h586 [0,1,0,1,0,0|1,0,0]=3 48 B10R1.135 CCOC(=O)C1CC1CO SPC-n385 [0,1,0,1,0,0|0,0,0]=2 49 B10R1.137 CCOC(=O)C=C1COC1 SPC-a009 [0,1,0,1,0,0|0,0,2]=4 50 B10R1.181 CCOC(=O)CC1(N)CC1 SPC-n379 [0,1,0,1,0,0|1,0,0]=3 51 B10R2.71 O=C1CC2CCC(C1)C2 SPC-j939 [0,0,0,2,0,0|2,0,0]=4 52 B10R2.71 O=C1CC2CCC(C1)N2 SPC-g260 [0,0,0,2,0,0|2,0,0]=4 53 B10R2.71 O=C1CC2CCC(C1)O2 SPC-h399 [0,0,0,2,0,0|1,0,0]=3 54 B10R2.534 O=C1CCCC2(CC2)C1 SPC-q768 [0,0,0,2,0,0|2,0,0]=4 55 B10R2.485 O=C(CC1CC1)C2CC2 SPC-n928 [0,0,0,2,0,0|2,0,0]=4