0 B9R0.2 CCCCCCCC(=N)N O13890 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.7 CC(=O)OCCOCCl A15221 [1,0,0,0,0,0|2,0,0]=3 2 B8R0.7 CCCCCCC(=N)N H13000 [1,0,0,0,0,0|2,0,0]=3 3 B8R0.7 CCCCCC[C@H](C)O O2182 [1,0,0,0,0,0|0,0,2]=3 4 B10R0.3 C=C(C)CCC[C@H](C)CCO R1283 [0,1,0,0,0,0|3,0,0]=4 5 B10R0.4 CCCCCCCCC(=N)N N13879 [0,1,0,0,0,0|3,0,0]=4 6 B10R0.4 CCCCCCCNC(N)=S H8001 [0,1,0,0,0,0|2,1,0]=4 7 B10R0.4 O=C(O)CCCCCCCBr B3812 [0,1,0,0,0,0|2,0,0]=3 8 B10R0.75 CCCCSC[C@@H](N)C(=O)O A8104 [0,1,0,0,0,0|3,0,0]=4 9 B10R0.75 CCCCSC[C@H](N)C(=O)O A8103 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.10 NCCN1CCNC(=O)C1 A15432 [0,0,0,1,0,0|3,0,0]=4 11 B10R1.18 CC(=O)NC1CCCNC1 P12456 [0,0,0,1,0,0|2,0,0]=3 12 B10R1.18 CC(=O)NC1CCNCC1 P12451 [0,0,0,1,0,0|2,0,0]=3 13 B10R1.18 CC(=O)OC1CCNCC1 A15520 [0,0,0,1,0,0|1,0,0]=2 14 B10R1.18 N=C(N)CC1CCCCC1 C16843 [0,0,0,1,0,0|3,0,0]=4 15 B10R1.18 O=C(O)CC1CCCCN1 P14979 [0,0,0,1,0,0|3,0,0]=4 16 B10R1.18 O=C(O)CC1CCCNC1 P15959 [0,0,0,1,0,0|3,0,0]=4 17 B10R1.18 O=C(O)CC1CCNCC1 P4467 [0,0,0,1,0,0|3,0,0]=4 18 B10R1.61 CC(=O)N1CCCCC1=O A17996 [0,0,0,1,0,0|2,0,1]=4 19 B10R1.61 CC1CNCCC1C(=O)O M12883 [0,0,0,1,0,0|3,0,0]=4 20 B10R1.61 NC1CCCCC1C(=O)O A12769 [0,0,0,1,0,0|3,0,0]=4 21 B10R1.64 CC1CCCC1CC(=O)O M13870 [0,0,0,1,0,0|2,0,0]=3 22 B10R1.64 NC1CCCC1CC(=O)O A12909 [0,0,0,1,0,0|3,0,0]=4 23 B10R1.66 O=C(Cl)CCC1CCCC1 C0248 [0,0,0,1,0,0|2,0,0]=3 24 B10R1.348 N=C(N)C1CCCCCC1 C13745 [0,0,0,1,0,0|3,0,0]=4 25 B7R0.4 CC(=O)CCCCCl C18888 [2,0,0,0,0,0|1,0,0]=3 26 B7R0.4 CCCCCC(=N)N H14019 [2,0,0,0,0,0|2,0,0]=4 27 B7R0.4 O=C(Cl)CCCCBr B9001 [2,0,0,0,0,0|2,0,0]=4 28 B9R0.18 CCOCC(N)COCC E17053 [1,1,0,0,0,0|1,0,1]=4 29 B9R0.47 NCCCCC(N)C(=O)O L0399 [1,1,0,0,0,0|2,0,0]=4 30 B9R0.47 NCCCC[C@@H](N)C(=O)O H8309 [1,1,0,0,0,0|2,0,0]=4 31 B9R0.47 NCCCC[C@H](N)C(=O)O L1919 [1,1,0,0,0,0|2,0,0]=4 32 B9R0.47 NCCCC[C@H](N)C(=O)O L1919 [1,1,0,0,0,0|2,0,0]=4 33 B9R0.47 NCCCC[C@H](N)C(=O)O L6200 [1,1,0,0,0,0|2,0,0]=4 34 B9R0.47 NCCCC[C@H](N)C(=O)O L6279 [1,1,0,0,0,0|2,0,0]=4 35 B9R0.47 NCCCC[C@H](N)C(=O)O L6356 [1,1,0,0,0,0|2,0,0]=4 36 B11R0.148 O=C(O)CCCCCCCCBr B18462 [0,2,0,0,0,0|2,0,0]=4 37 B9R1.5 N[C@H]1CCCCNC1=O A0101 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.8 O=C=NC1CCCCC1 C18906 [1,0,0,1,0,0|1,0,1]=4 39 B9R1.15 CCC1NCCNC1=O E15728 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.6 CC(=O)N1CCNCC1 A12427 [1,0,0,1,0,0|2,0,0]=4 41 B9R1.6 CC(=O)N1CCOCC1 A1047 [1,0,0,1,0,0|2,0,0]=4 42 B9R1.6 N=C(N)C1CCCCC1 C13019 [1,0,0,1,0,0|2,0,0]=4 43 B9R1.6 NC(=O)C1CCCCN1 P11625 [1,0,0,1,0,0|2,0,0]=4 44 B9R1.6 NC(=O)C1CCCNC1 P11626 [1,0,0,1,0,0|2,0,0]=4 45 B9R1.6 NC(=O)C1CCNCC1 P11627 [1,0,0,1,0,0|2,0,0]=4 46 B9R1.6 O=C(O)C1CCCCC1 C18818 [1,0,0,1,0,0|1,0,0]=3 47 B9R1.6 O=C(O)C1CCCCN1 P3033 [1,0,0,1,0,0|2,0,0]=4 48 B9R1.6 O=C(O)C1CCCCN1 P3033 [1,0,0,1,0,0|2,0,0]=4 49 B9R1.6 O=C(O)C1CCCCN1 P4996 [1,0,0,1,0,0|2,0,0]=4 50 B9R1.6 O=C(O)C1CCCNC1 P4047 [1,0,0,1,0,0|2,0,0]=4 51 B9R1.6 O=C(O)C1CCNCC1 P1046 [1,0,0,1,0,0|2,0,0]=4 52 B9R1.6 O=C(O)C1CCOCC1 T11054 [1,0,0,1,0,0|2,0,0]=4 53 B9R1.6 O=C(O)[C@@H]1CCCCN1 L6054 [1,0,0,1,0,0|2,0,0]=4 54 B9R1.6 O=C(O)[C@@H]1CCCCN1 L6054 [1,0,0,1,0,0|2,0,0]=4 55 B9R1.6 O=C(O)[C@@H]1CCCNC1 P7231 [1,0,0,1,0,0|2,0,0]=4 56 B9R1.6 O=C(O)[C@H]1CCCNC1 P7232 [1,0,0,1,0,0|2,0,0]=4 57 B9R1.13 CC(=O)N[C@H]1CCNC1 A18034 [1,0,0,1,0,0|2,0,0]=4 58 B9R1.13 O=C(O)CC1CCCN1 P4464 [1,0,0,1,0,0|2,0,0]=4 59 B9R1.13 O=C(O)C[C@@H]1CCCN1 H17104 [1,0,0,1,0,0|2,0,0]=4 60 B9R1.13 O=C(O)C[C@H]1CCNC1 P14085 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.41 CC1CNCC1C(=O)O M13281 [1,0,0,1,0,0|2,0,0]=4 62 B9R1.41 NC1CCCC1C(=O)O A14514 [1,0,0,1,0,0|2,0,0]=4 63 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O A3768 [1,0,0,1,0,0|2,0,0]=4 64 B11R1.86 CC1CNCCC1CC(=O)O M4469 [0,1,0,1,0,0|2,0,0]=4 65 B11R1.91 CC(=O)NCC1CCNCC1 P12461 [0,1,0,1,0,0|1,0,0]=3 66 B11R1.91 N1CCC(CCC(=O)O)CC1 P11831 [0,1,0,1,0,0|2,0,0]=4 67 B11R1.91 O=C(O)CCC1CCCCN1 P14397 [0,1,0,1,0,0|2,0,0]=4 68 B11R1.91 O=C(O)CCC1CCC[NH2+]C1 P12684 [0,1,0,1,0,0|2,0,0]=4 69 B11R1.91 O=C(O)CCN1CCCCC1 P17611 [0,1,0,1,0,0|2,0,0]=4 70 B11R1.143 NC1CCCCCC1C(=O)O A12931 [0,1,0,1,0,0|2,0,0]=4 71 B11R1.928 NC1(CC(=O)O)CCCCC1 A14529 [0,1,0,1,0,0|2,0,0]=4 72 B11R1.20 CC(=O)NC1CCC(=O)CC1 A11713 [0,1,0,1,0,0|1,0,1]=4 73 B11R1.40 COC(=O)CC1CCNCC1 P12406 [0,1,0,1,0,0|2,0,0]=4 74 B11R1.40 COC(=O)CC1CCNCC1 P12406 [0,1,0,1,0,0|2,0,0]=4 75 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O A15463 [0,1,0,1,0,0|2,0,0]=4 76 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 A12812 [0,1,0,1,0,0|2,0,0]=4 77 B11R1.737 NC1(C(=O)O)CCCCCC1 A12845 [0,1,0,1,0,0|2,0,0]=4 78 B11R1.737 O=C(O)C1(O)CCCCCC1 H17065 [0,1,0,1,0,0|2,0,0]=4