0 B8R0.6 COC(=O)CCNC=O 4147AB [0,0,0,0,0,0|2,0,2]=4 1 B7R0.1 CC\C=C/CCC=O 8476AJ [1,0,0,0,0,0|2,0,1]=4 2 B7R0.1 CC\C=C/CCCC 7443AL [1,0,0,0,0,0|1,0,1]=3 3 B7R0.3 CCCCC(=O)CCl 6831AD [1,0,0,0,0,0|2,0,1]=4 4 B7R0.3 CC\C=C\C(C)CC 6800AL [1,0,0,0,0,0|2,0,1]=4 5 B7R0.3 CNC(=O)CCCO 2742AL [1,0,0,0,0,0|2,0,1]=4 6 B7R0.3 C\C=C\CC(C)CC 6795AL [1,0,0,0,0,0|2,0,1]=4 7 B7R0.4 C=C(C)CC\C=C\C 5695AL [1,0,0,0,0,0|1,0,2]=4 8 B7R0.4 C\C=C\C=C\C(=O)Cl Y2082 [1,0,0,0,0,0|1,0,2]=4 9 B7R0.4 C\C=C\C=C\C(C)=O 5332AL [1,0,0,0,0,0|0,0,2]=3 10 B7R0.4 NCCNCC(=O)O W4767 [1,0,0,0,0,0|2,0,1]=4 11 B9R0.24 CCC(=O)CCC(=O)CC 3019AB [0,1,0,0,0,0|1,0,1]=3 12 B9R0.46 C=CCCCCC(=O)OC 0116AQ [0,1,0,0,0,0|0,0,3]=4 13 B9R1.5 CN1CCCNCC1=O 8136AE [0,0,0,1,0,0|2,0,1]=4 14 B9R1.11 COC(=O)C1CSCN1 6568AE [0,0,0,1,0,0|2,0,1]=4 15 B9R1.11 NOC(=O)C1CCOC1 Y5069 [0,0,0,1,0,0|2,0,1]=4 16 B9R1.21 CCC1=CC=C(CC)N1 1950AC [0,0,0,1,0,0|2,0,1]=4 17 B9R1.21 CCC1=CC=C(CC)S1 6997AB [0,0,0,1,0,0|1,1,1]=4 18 B9R1.21 COC1=NC=C(CO)S1 3726AF [0,0,0,1,0,0|2,1,0]=4 19 B9R1.79 COC(=O)CC1CCC1 1218AC [0,0,0,1,0,0|0,0,2]=3 20 B9R1.79 COC(=O)CC1COC1 1315AD [0,0,0,1,0,0|1,0,2]=4 21 B9R1.81 COC(=O)[C@H]1CC[C@H]1N 4769AE [0,0,0,1,0,0|1,0,2]=4 22 B6R0.1 CCCC(=O)OC 8838AJ [2,0,0,0,0,0|0,0,0]=2 23 B6R0.1 COC(=N)CCCl 3040AC [2,0,0,0,0,0|2,0,0]=4 24 B6R0.1 COC(=N)CCCl W4440 [2,0,0,0,0,0|2,0,0]=4 25 B6R0.1 COC(=O)NC=O 3236AB [2,0,0,0,0,0|2,0,0]=4 26 B6R0.4 CCCC[Sn](=O)O 8518AL [2,0,0,0,0,0|1,0,1]=4 27 B6R0.4 C\C=C\CC(=O)O 6149AL [2,0,0,0,0,0|0,0,0]=2 28 B8R0.3 COC(=O)[C@@H](N)CCBr 3496AL [1,1,0,0,0,0|1,0,1]=4 29 B8R0.3 CO\C=C(/I)C(=O)OC 1336AL [1,1,0,0,0,0|1,0,0]=3 30 B8R0.9 COC(=O)CCN(C)C 4989AB [1,1,0,0,0,0|1,0,1]=4 31 B8R0.19 COC(=N)CC(=N)OC 1040AC [1,1,0,0,0,0|2,0,0]=4 32 B8R0.19 COC(=O)CC(O)CCl 1082AA [1,1,0,0,0,0|1,0,1]=4 33 B8R0.28 CC(=O)C\C=C\C(=O)O 7022AA [1,1,0,0,0,0|1,0,1]=4 34 B8R0.28 O=C(O)\C=C\CC(=O)O C638 [1,1,0,0,0,0|1,0,1]=4 35 B10R0.44 COC(=O)CC(=O)CC(C)=O 3050AB [0,2,0,0,0,0|0,0,2]=4 36 B10R0.44 COC(=O)CC(N)CC(C)C TMBA019 [0,2,0,0,0,0|0,0,2]=4 37 B10R0.1 CCOC(=O)CCCCCN 3404AL [0,2,0,0,0,0|0,0,2]=4 38 B10R0.1 CCOC(=O)\C=C\CCCCl 3021AL [0,2,0,0,0,0|0,0,2]=4 39 B10R0.108 CCOC(=O)CCC(=O)CC 0241AE [0,2,0,0,0,0|0,0,1]=3 40 B10R0.108 CCOC(=O)CNC(=O)CN 9485AB [0,2,0,0,0,0|2,0,0]=4 41 B10R0.46 COC(=O)C[C@@H](C)C(=O)OC P621 [0,2,0,0,0,0|1,0,1]=4 42 B10R0.124 CCCCC(F)(F)C(=O)OC 7040AB [0,2,0,0,0,0|0,0,2]=4 43 B10R0.26 CCOC(=O)CC(=O)C(C)F D274 [0,2,0,0,0,0|2,0,0]=4 44 B8R1.1 C=C[C@@H]1COC(=O)C1 4157AA [1,0,0,1,0,0|0,0,2]=4 45 B8R1.1 C=C[C@H]1COC(=O)C1 1309AL [1,0,0,1,0,0|0,0,2]=4 46 B8R1.1 CCN1CCC(=O)C1 0571AA [1,0,0,1,0,0|2,0,0]=4 47 B8R1.3 CC1COC(=O)OC1 3991AC [1,0,0,1,0,0|1,0,1]=4 48 B8R1.3 O=C1COC(=O)CN1 3606AL [1,0,0,1,0,0|2,0,0]=4 49 B8R1.38 CNC(=O)C1CCC1 4798AA [1,0,0,1,0,0|1,0,1]=4 50 B8R1.7 CC(=O)[C@@H]1CCCO1 5805AA [1,0,0,1,0,0|1,0,1]=4 51 B8R1.7 CC(=O)[C@H]1CCCO1 0229AC [1,0,0,1,0,0|1,0,1]=4 52 B8R1.7 O=C(O)[C@@H]1C=CCN1 Z1675 [1,0,0,1,0,0|1,0,0]=3 53 B8R1.31 CC1CCC1C(=O)O 5817AB [1,0,0,1,0,0|0,0,2]=4 54 B8R1.34 CC(=O)C=C1CCC1 0333AC [1,0,0,1,0,0|0,0,2]=4 55 B8R1.34 O=C(O)CN1CCC1 1240AJ [1,0,0,1,0,0|1,0,1]=4 56 B8R1.34 O=C(O)CN1CCC1 9681AH [1,0,0,1,0,0|1,0,1]=4 57 B10R1.14 COC(=O)C1=CC(=O)CC1 X3410 [0,1,0,1,0,0|0,0,1]=3 58 B10R1.14 COC(=O)C1=CC(Br)CC1 6388AC [0,1,0,1,0,0|0,0,2]=4 59 B10R1.14 COC(=O)C1C=CC(=O)C1 8926AB [0,1,0,1,0,0|0,0,1]=3 60 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 1231AL [0,1,0,1,0,0|0,0,1]=3 61 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 9012AA [0,1,0,1,0,0|0,0,2]=4 62 B10R1.11 CCOC(=O)[C@H]1CCNC1 6628AJ [0,1,0,1,0,0|1,0,1]=4 63 B10R1.25 CCN1CCC(=O)CC1=O 5123AJ [0,1,0,1,0,0|2,0,0]=4 64 B10R1.15 COC(=O)N1CCOCC1 7135AJ [0,1,0,1,0,0|1,0,1]=4 65 B10R1.15 COC(=O)[C@@H]1CCCCN1 5103AC [0,1,0,1,0,0|0,0,2]=4 66 B10R1.15 COC(=O)[C@@H]1CNCCN1 Z3220 [0,1,0,1,0,0|1,0,1]=4 67 B10R1.15 COC(=O)[C@@H]1CNCCO1 5838AA [0,1,0,1,0,0|1,0,1]=4 68 B10R1.15 COC(=O)[C@H]1CNCCO1 5839AA [0,1,0,1,0,0|1,0,1]=4 69 B10R1.182 COC(=O)[C@@H](N)C1CCC1 4095AA [0,1,0,1,0,0|0,0,2]=4 70 B10R1.182 COC(=O)[C@H](N)C1CCC1 4748AA [0,1,0,1,0,0|0,0,2]=4 71 B10R1.411 COC(=O)C1(C)CCCC1 4021AE [0,1,0,1,0,0|0,0,2]=4 72 B10R1.27 COC(=O)CC1=CNN=C1 4193AJ [0,1,0,1,0,0|1,0,1]=4 73 B10R1.27 COC(=O)CC1CCCN1 4209AJ [0,1,0,1,0,0|0,0,2]=4 74 B10R1.27 COC(=O)CC1CCCN1 TMBA033 [0,1,0,1,0,0|0,0,2]=4 75 B10R1.27 COC(=O)CC1CCCO1 0352AB [0,1,0,1,0,0|0,0,2]=4 76 B10R1.27 COC(=O)CC1CCNC1 6391AC [0,1,0,1,0,0|0,0,2]=4 77 B10R1.27 COC(=O)C[C@@H]1CCCN1 Z4512 [0,1,0,1,0,0|0,0,2]=4 78 B10R1.149 COC(=O)C1CCCC1N 4088AB [0,1,0,1,0,0|0,0,2]=4 79 B10R1.149 COC(=O)C1CNCC1C 1878AF [0,1,0,1,0,0|0,0,2]=4 80 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N W3364 [0,1,0,1,0,0|0,0,2]=4 81 B10R1.149 COC(=O)[C@@H]1CCC[C@H]1N 8741AA [0,1,0,1,0,0|0,0,2]=4 82 B10R1.256 CCC1=C(C)C(=O)NC1=O 0354AB [0,1,0,1,0,0|2,0,0]=4 83 B10R1.172 COC1=CCC=C(OC)C1 0616AQ [0,1,0,1,0,0|2,0,0]=4