0 B7R0.5 CCOC(=O)C(F)F 26-787 [0,0,0,0,0,0|2,0,0]=2 1 B7R0.5 CCOC(=O)[C@@H](F)Cl 26-781 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.5 CCOC(=O)[C@@H](F)I 26-809 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.5 CCOC(=O)[C@H](C)F 26-799 [0,0,0,0,0,0|1,0,0]=1 4 B7R0.5 CCOC(=O)[C@H](C)N 04-132 [0,0,0,0,0,0|1,0,0]=1 5 B6R0.1 CCCC(=O)OC 20-0400 [1,0,0,0,0,0|2,0,0]=3 6 B6R0.1 CCC[C@@H](O)CC 40-0600 [1,0,0,0,0,0|1,0,2]=4 7 B6R0.1 CCNC(=O)CO 08-10467 [1,0,0,0,0,0|1,1,0]=3 8 B6R0.1 CCOC(=O)CF 26-792 [1,0,0,0,0,0|1,0,0]=2 9 B6R0.1 CCOC(=O)CN 04-1586 [1,0,0,0,0,0|1,0,0]=2 10 B6R0.1 CNCC(=O)OC 04-2425 [1,0,0,0,0,0|3,0,0]=4 11 B6R0.3 CC(C)C(=O)NN 08-5319 [1,0,0,0,0,0|3,0,0]=4 12 B6R0.3 CCC(=O)C(=O)O BIO-852 [1,0,0,0,0,0|1,1,1]=4 13 B6R0.3 CNC(=O)[C@@H](F)Cl 27-190 [1,0,0,0,0,0|3,0,0]=4 14 B6R0.3 CNC(=O)[C@@H](F)I 27-192 [1,0,0,0,0,0|3,0,0]=4 15 B6R0.3 COC(=O)C(F)F 09-1640 [1,0,0,0,0,0|2,0,0]=3 16 B6R0.3 COC(=O)[C@H](C)N 024047 [1,0,0,0,0,0|1,0,0]=2 17 B6R0.3 COC(=O)[C@H](C)N 04-140 [1,0,0,0,0,0|1,0,0]=2 18 B8R0.2 COC(=O)C(=O)[C@H](C)Br 08-6545 [0,1,0,0,0,0|3,0,0]=4 19 B8R0.3 C=C(CBr)C(=O)OCC 08-10346 [0,1,0,0,0,0|1,0,1]=3 20 B8R0.3 CCCC(=O)[C@@H](N)CO 56-1313 [0,1,0,0,0,0|2,0,0]=3 21 B8R0.3 CCOC(=O)C(=O)CBr 08-1104 [0,1,0,0,0,0|0,1,1]=3 22 B8R0.3 CCOC(=O)[C@@H](N)CO 04-2440 [0,1,0,0,0,0|1,0,0]=2 23 B8R0.3 CCOC(=O)[C@@H](N)CO 22-408 [0,1,0,0,0,0|1,0,0]=2 24 B8R0.3 CCOC(=O)[C@@H](N)CS 04-1079 [0,1,0,0,0,0|1,0,0]=2 25 B8R0.3 CCOC(=O)\C(Cl)=N\O 08-2123 [0,1,0,0,0,0|1,1,1]=4 26 B8R0.8 C=C(C)C(=O)OCCF 26-912 [0,1,0,0,0,0|1,0,1]=3 27 B8R0.14 CCOC(=O)C(F)(Br)Br 26-786 [0,1,0,0,0,0|2,0,0]=3 28 B8R0.14 CCOC(=O)C(F)(F)Cl 26-780 [0,1,0,0,0,0|2,0,0]=3 29 B8R0.14 CCOC(=O)C(F)(F)F 26-837 [0,1,0,0,0,0|2,0,0]=3 30 B8R0.14 CCOC(=O)C(F)(F)I 27-128 [0,1,0,0,0,0|2,0,0]=3 31 B8R1.5 O=C1CCOC[C@@H]1Br 08-6716 [0,0,0,1,0,0|3,0,0]=4 32 B8R1.5 O=C1CCOC[C@@H]1F 08-3979 [0,0,0,1,0,0|3,0,0]=4 33 B8R1.18 C[C@@H]1NC(=O)OC1=O 19-1463 [0,0,0,1,0,0|2,0,1]=4 34 B8R0.5 CCOC(=O)CC(C)C 023335S [0,0,0,0,0,1|1,0,0]=2 35 B5R0.1 C=C(C)OCC 08-3147 [2,0,0,0,0,0|1,0,0]=3 36 B5R0.1 CCCC(=O)O 10-0400 [2,0,0,0,0,0|1,1,0]=4 37 B5R0.2 CCCCCC 05-0600 [2,0,0,0,0,0|1,0,1]=4 38 B5R0.2 CCO\C=C/Br 08-929 [2,0,0,0,0,0|1,0,1]=4 39 B5R0.3 CCC(=O)OC 20-0300 [2,0,0,0,0,0|0,0,0]=2 40 B5R0.3 COC(=O)CN 04-1589 [2,0,0,0,0,0|1,0,0]=3 41 B5R0.3 O=C(CCl)CCl 08-2018 [2,0,0,0,0,0|2,0,0]=4 42 B5R0.5 CC(=O)C(=O)O 020761 [2,0,0,0,0,0|0,1,1]=4 43 B5R0.5 CC(=O)C(F)F 27-108 [2,0,0,0,0,0|2,0,0]=4 44 B5R0.5 CC(=O)[C@H](C)F 26-3573 [2,0,0,0,0,0|1,0,0]=3 45 B5R0.5 CC(C)C(N)=O 08-2289 [2,0,0,0,0,0|2,0,0]=4 46 B5R0.5 C[C@H](Cl)C(=O)Cl CS-223 [2,0,0,0,0,0|2,0,0]=4 47 B5R0.5 C[C@H](N)C(=O)O 04-113 [2,0,0,0,0,0|1,0,0]=3 48 B5R0.5 C[C@H](N)C(=O)O BIO-434 [2,0,0,0,0,0|1,0,0]=3 49 B5R0.5 C[C@H](N)C(=O)O BIO-440 [2,0,0,0,0,0|1,0,0]=3 50 B5R0.5 C[C@H](N)C(N)=O 04-120 [2,0,0,0,0,0|2,0,0]=4 51 B5R0.5 C[C@H](N)C(N)=O 04-121 [2,0,0,0,0,0|2,0,0]=4 52 B5R0.5 C[C@H](O)C(=O)O BIO-636 [2,0,0,0,0,0|0,1,0]=3 53 B5R0.5 O=C(O)[C@@H](F)Cl 27-077 [2,0,0,0,0,0|2,0,0]=4 54 B7R0.3 CCCCC(=O)OC 20-0500 [1,1,0,0,0,0|2,0,0]=4 55 B7R0.3 COC(=O)CCCBr CS-741 [1,1,0,0,0,0|2,0,0]=4 56 B7R0.7 CCCC(=O)OCC 023317S [1,1,0,0,0,0|0,0,0]=2 57 B7R0.7 CCOC(=O)CCN 04-130 [1,1,0,0,0,0|0,0,0]=2 58 B7R0.7 CCOC(=O)CNC 04-2424 [1,1,0,0,0,0|0,0,0]=2 59 B7R0.14 CCC(=O)C(F)(F)F 09-1791 [1,1,0,0,0,0|2,0,0]=4 60 B7R0.14 COC(=O)C(F)(F)F 26-4198 [1,1,0,0,0,0|2,0,0]=4 61 B9R0.6 CCOC(=O)[C@@H](N)C(C)C 04-2677 [0,1,0,0,0,1|1,0,0]=3 62 B9R0.6 CCOC(=O)[C@@H](N)C(C)C 20-1831 [0,1,0,0,0,1|1,0,0]=3 63 B9R0.44 CCOC(=O)CC(F)(F)F 27-136 [0,1,0,0,0,1|2,0,0]=4 64 B9R0.19 CCOC(=O)C(C)(C)NC 08-10213 [0,2,0,0,0,0|1,0,0]=3 65 B9R0.37 CCOC(=O)C(C=O)C=O 08-7333 [0,2,0,0,0,0|0,1,1]=4 66 B9R0.47 CCCCOC(=O)C(F)F 26-2683 [0,2,0,0,0,0|2,0,0]=4 67 B9R0.47 CCCCOC(=O)[C@@H](F)Cl 26-2682 [0,2,0,0,0,0|2,0,0]=4 68 B9R0.10 CC(C)OC(=O)C(F)(F)F 09-2457 [0,2,0,0,0,0|2,0,0]=4 69 B9R0.57 C[C@H](N)C(=O)OC(C)(C)C 04-128 [0,2,0,0,0,0|1,0,0]=3 70 B9R0.57 C[C@H](N)C(=O)OC(C)(C)C 04-129 [0,2,0,0,0,0|1,0,0]=3 71 B7R1.2 CN1CCC(=O)C1 08-3269 [1,0,0,1,0,0|2,0,0]=4 72 B7R1.3 O=C1CCCNC1 08-7861 [1,0,0,1,0,0|2,0,0]=4 73 B7R1.3 O=C1CCCOC1 08-7989 [1,0,0,1,0,0|1,1,0]=4 74 B7R1.3 O=C1CCCSC1 08-7956 [1,0,0,1,0,0|1,0,0]=3 75 B7R1.3 O=C1CCNCC1 06-1702 [1,0,0,1,0,0|2,0,0]=4 76 B7R1.3 O=C1CCSCC1 08-5722 [1,0,0,1,0,0|2,0,0]=4 77 B7R1.3 O=C1COCCN1 08-7686 [1,0,0,1,0,0|1,1,0]=4 78 B7R1.4 N[C@H]1CCSC1=O BIO-831 [1,0,0,1,0,0|1,1,0]=4 79 B7R1.4 O=C1NCC[C@@H]1Br 08-10050 [1,0,0,1,0,0|2,0,0]=4 80 B7R1.4 O=C1NCC[C@H]1O 08-10451 [1,0,0,1,0,0|1,1,0]=4 81 B9R1.48 C[C@H]1CC(=O)NCCN1 08-7452 [0,0,0,1,0,1|2,0,0]=4 82 B9R1.73 CCOC(=O)C1CNC1 08-5203 [0,1,0,1,0,0|1,0,0]=3 83 B9R1.74 CCOC(=O)C1(N)CC1 04-265 [0,1,0,1,0,0|1,0,0]=3 84 B9R2.39 O=C1CC2CCC1C2 025054 [0,0,0,2,0,0|2,0,0]=4 85 B9R0.48 CCOC(=O)CNC(C)=O 04-047 [0,0,0,0,0,2|0,1,1]=4