0 B8R0.8 C#CCCC(=O)N(C)C CS-0783902 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.8 CC(C)C(=O)OCCO CS-0608394 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.3 C=CC(=O)NCCO CS-0146430 [1,0,0,0,0,0|2,0,1]=4 3 B7R0.3 C=CC(=O)OCCN CS-0646604 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.3 COC(=O)CCCO CS-0042326 [1,0,0,0,0,0|2,0,0]=3 5 B7R0.3 O=C(CBr)CCCBr CS-1172752 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.4 CC(=O)CCCCO CS-0514254 [1,0,0,0,0,0|1,0,1]=3 7 B7R0.4 CCCCCC(N)=O CS-0128758 [1,0,0,0,0,0|1,0,1]=3 8 B7R0.5 COCC(=O)C(C)C CS-0310664 [1,0,0,0,0,0|2,0,1]=4 9 B9R0.7 CC(C)CC[C@H](N)C(=O)O CS-0154246 [0,1,0,0,0,0|2,0,1]=4 10 B9R0.47 C=C(C)C(=O)OCCSC CS-0504469 [0,1,0,0,0,0|2,0,0]=3 11 B9R0.47 [C@H](N)(CCCCN)C(=O)O CS-W015322 [0,1,0,0,0,0|2,0,1]=4 12 B9R1.5 CN1CCCCCC1=O CS-0151090 [0,0,0,1,0,0|2,0,0]=3 13 B9R1.6 CC(=O)C1CCCCO1 CS-0863898 [0,0,0,1,0,0|0,0,2]=3 14 B9R1.6 CC(=O)C1CCCOC1 CS-0308732 [0,0,0,1,0,0|2,0,1]=4 15 B9R1.23 CN1CC(CI)CC1=O CS-0309949 [0,0,0,1,0,0|3,0,0]=4 16 B9R1.23 CN1C[C@@H](CN)CC1=O CS-0501438 [0,0,0,1,0,0|3,0,0]=4 17 B9R1.35 CC1CCC(C(=O)O)C1 CS-0217541 [0,0,0,1,0,0|2,0,1]=4 18 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 CS-0035602 [0,0,0,1,0,0|1,0,2]=4 19 B9R1.69 CC1=NN(C)C(=O)CC1 CS-0105619 [0,0,0,1,0,0|2,0,1]=4 20 B9R1.110 CC(C(=O)O)C1CCC1 CS-0254257 [0,0,0,1,0,0|2,0,1]=4 21 B9R1.110 O=C(O)C(F)C1CCC1 CS-0633846 [0,0,0,1,0,0|2,0,1]=4 22 B6R0.1 CCC(=O)CSC CS-0434652 [2,0,0,0,0,0|1,0,1]=4 23 B6R0.1 COC(=O)CSC CS-W013574 [2,0,0,0,0,0|2,0,0]=4 24 B6R0.4 O=C(O)CCCF CS-0491783 [2,0,0,0,0,0|1,0,1]=4 25 B8R0.1 CCOC(=O)CCCO CS-0539430 [1,1,0,0,0,0|1,0,1]=4 26 B8R0.1 CCOC(=O)CCSC CS-W010980 [1,1,0,0,0,0|1,0,1]=4 27 B8R0.3 COC(=O)[C@@H](O)CCN CS-0611326 [1,1,0,0,0,0|2,0,0]=4 28 B8R0.6 CCCCCC(=O)O[Na] CS-0152338 [1,1,0,0,0,0|2,0,0]=4 29 B8R0.5 CCOC(C)SC(C)=O CS-0160359 [1,1,0,0,0,0|2,0,0]=4 30 B8R0.7 CCCC\C=C\C(=O)O CS-0161412 [1,1,0,0,0,0|1,0,0]=3 31 B10R0.6 COCCOC(=O)CC(C)=O CS-W016168 [0,1,0,0,0,1|1,0,0]=3 32 B10R0.17 CCCCC(C(=O)O)C(=O)O CS-0315860 [0,2,0,0,0,0|1,0,1]=4 33 B10R0.88 CCCC[C@H](NC=O)C(=O)O CS-0444767 [0,2,0,0,0,0|1,0,1]=4 34 B10R0.98 C=C(C)C(=O)OCCN(C)C CS-0540035 [0,2,0,0,0,0|2,0,0]=4 35 B8R1.1 CCC1CCC(=O)O1 CS-W016608 [1,0,0,1,0,0|1,0,1]=4 36 B8R1.5 CC1CCCCC1=O CS-W011265 [1,0,0,1,0,0|0,0,1]=3 37 B8R1.22 O=C1CCCOCC1 CS-0037287 [1,0,0,1,0,0|1,0,1]=4 38 B8R1.4 CC1CCNC(=O)C1 CS-0052341 [1,0,0,1,0,0|1,0,0]=3 39 B8R1.7 CC(=O)C1CCOC1 CS-W004273 [1,0,0,1,0,0|1,0,1]=4 40 B8R1.7 CC(=O)[C@@H]1CCCO1 CS-0444349 [1,0,0,1,0,0|1,0,1]=4 41 B8R1.18 CC1CC(=O)C(C)O1 CS-0784607 [1,0,0,1,0,0|0,0,2]=4 42 B10R1.61 CC(=O)N1CCCCC1=O CS-0171654 [0,0,0,1,0,1|0,0,0]=2 43 B10R1.23 O=C(O)C(=O)C1CCCC1 CS-0149594 [0,1,0,1,0,0|1,0,0]=3 44 B10R1.23 O=C(O)C(=O)C1CCOC1 CS-0527555 [0,1,0,1,0,0|1,0,0]=3 45 B10R1.23 O=C(O)C(=O)N1CCCC1 CS-0452963 [0,1,0,1,0,0|1,0,0]=3 46 B10R1.19 O=C1CCCCCN1CO CS-0241684 [0,1,0,1,0,0|1,0,1]=4 47 B10R1.119 CN1C(=O)CCC(N)C1=O CS-0530591 [0,1,0,1,0,0|2,0,0]=4