0 B6R0.4 C=C(C)CCCBr F1913-0542 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.4 C=C(C)CCCO F1913-0541 [0,0,0,0,0,0|3,0,0]=3 2 B6R0.4 CCCNC(C)C F8889-6089 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.4 CCNCC(C)C F8880-2710 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.4 CCOCC(C)N F2167-3742 [0,0,0,0,0,0|3,0,1]=4 5 B5R0.1 CC(O)CCN F8880-3625 [1,0,0,0,0,0|1,0,2]=4 6 B5R0.1 CNCC(N)=O F8880-4275 [1,0,0,0,0,0|2,0,0]=3 7 B5R0.1 COCC(N)=O F1913-0020 [1,0,0,0,0,0|1,1,0]=3 8 B5R0.2 C#CCCNC F1913-0949 [1,0,0,0,0,0|1,0,2]=4 9 B5R0.2 C=CCCNC F1911-1847 [1,0,0,0,0,0|1,0,1]=3 10 B7R0.3 CCCCC(O)CN F2189-0851 [0,1,0,0,0,0|1,0,2]=4 11 B7R0.3 COC(=O)NCCN F8882-3539 [0,1,0,0,0,0|3,0,0]=4 12 B7R0.4 C#CCSCC(=O)O F2147-0623 [0,1,0,0,0,0|2,0,1]=4 13 B7R0.4 CC(=O)NCCCN F8888-5285 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.4 CCCCNC(C)C F1911-1667 [0,1,0,0,0,0|2,0,1]=4 15 B7R0.4 CCNCCC(C)C F1911-1772 [0,1,0,0,0,0|2,0,1]=4 16 B7R0.5 C=CCC(F)C(=O)O F2147-5538 [0,1,0,0,0,0|2,0,1]=4 17 B7R0.8 CNCCC(C)(C)C F8883-2000 [0,1,0,0,0,0|2,0,1]=4 18 B7R0.8 CS(=O)(=O)CCCBr F8881-7268 [0,1,0,0,0,0|3,0,0]=4 19 B7R1.2 CC1CCC(C)N1 F2124-0275 [0,0,0,1,0,0|2,0,1]=4 20 B7R1.2 NC1CNC(=O)C1 F2158-1004 [0,0,0,1,0,0|3,0,0]=4 21 B7R1.10 C=C1CC(CN)C1 F2147-8211 [0,0,0,1,0,0|3,0,0]=4 22 B7R1.10 COC1CN(N)C1 F1907-5025 [0,0,0,1,0,0|2,1,0]=4 23 B7R1.10 CO[C@H]1C[C@H](N)C1 F1913-1435 [0,0,0,1,0,0|1,1,1]=4 24 B7R1.14 CC1(C)CCNC1 F2148-0037 [0,0,0,1,0,0|2,0,1]=4 25 B6R0.1 CCNC(=O)CBr F3310-0889 [1,1,0,0,0,0|1,0,0]=3 26 B6R0.1 CCS(=O)CCN F2147-1018 [1,1,0,0,0,0|2,0,0]=4 27 B6R0.2 CC(=O)CC(C)N F1791-1136 [1,1,0,0,0,0|0,0,0]=2 28 B6R0.2 CC(=O)CC(C)N F1997-0017 [1,1,0,0,0,0|0,0,0]=2 29 B6R0.6 CCOCCNC F8880-1014 [1,1,0,0,0,0|1,0,1]=4 30 B8R0.16 CCC(CC)CC(=O)O F8880-1844 [0,2,0,0,0,0|2,0,0]=4 31 B8R0.23 C=C(C)CC(N)C(=O)O F2147-6638 [0,2,0,0,0,0|2,0,0]=4 32 B8R0.23 CC(=O)CC(=O)C(C)C F8887-7353 [0,2,0,0,0,0|1,0,1]=4 33 B8R0.25 COCCC(C)(C)C=O F2147-6255 [0,2,0,0,0,0|0,1,1]=4 34 B8R0.28 CC(C)=CCCC(=O)O F8885-2839 [0,2,0,0,0,0|2,0,0]=4 35 B8R0.12 COCC(C)(C)C(=O)O F8881-4697 [0,2,0,0,0,0|1,1,0]=4 36 B8R0.29 CC(C)(N)CCC(=O)O F8887-3924 [0,2,0,0,0,0|2,0,0]=4 37 B6R1.2 NC1CCSC1 F2147-1613 [1,0,0,1,0,0|1,0,1]=4 38 B6R1.5 CC1CC(C)N1 F8887-5508 [1,0,0,1,0,0|1,0,1]=4 39 B6R1.6 CCC1CNC1 F8881-5075 [1,0,0,1,0,0|1,0,1]=4 40 B8R1.34 CC(=O)C=C1COC1 F2147-8623 [0,1,0,1,0,0|0,1,1]=4 41 B8R1.34 CC(=O)OC1CNC1 F2147-1188 [0,1,0,1,0,0|1,0,0]=3 42 B8R1.34 O=C(O)CC1CNC1 F8887-4133 [0,1,0,1,0,0|2,0,0]=4 43 B8R1.40 NCC(=O)NC1CC1 F2158-0297 [0,1,0,1,0,0|2,0,0]=4 44 B8R1.51 CC1(C)COC(=O)C1 F1913-2916 [0,1,0,1,0,0|2,0,0]=4 45 B8R1.3 O=C1CCC(O)CN1 F1911-5594 [0,1,0,1,0,0|2,0,0]=4 46 B8R1.3 O=C1CC[C@H](O)CN1 F1911-5595 [0,1,0,1,0,0|2,0,0]=4 47 B8R1.7 O=C(Cl)C1CCOC1 F0001-1806 [0,1,0,1,0,0|1,1,0]=4 48 B8R1.35 O=C(O)CNC1CC1 F2147-0954 [0,1,0,1,0,0|2,0,0]=4 49 B8R1.37 CSCC(N)C1CC1 F2147-8202 [0,1,0,1,0,0|1,0,1]=4 50 B8R1.78 NC1(C(=O)O)COC1 F2165-0030 [0,1,0,1,0,0|1,1,0]=4 51 B8R1.55 CS(=O)(=O)C1CNC1 F2147-1204 [0,1,0,1,0,0|2,0,0]=4