0 B7R0.7 CCOC(=O)C#CC ACT02922 [0,0,0,0,0,0|0,0,2]=2 1 B7R0.7 CCOC(=O)CCN ACT00057 [0,0,0,0,0,0|1,0,0]=1 2 B7R0.7 CCOC(=O)CNC ACT08249 [0,0,0,0,0,0|1,0,0]=1 3 B7R0.7 CCOC(=O)C[N+]#[C-] ACT02731 [0,0,0,0,0,0|1,0,1]=2 4 B7R0.7 CCOP(OCC)Cl ACT04090 [0,0,0,0,0,0|3,0,0]=3 5 B6R0.1 CC#CC(=O)OC ACT09348 [1,0,0,0,0,0|0,0,2]=3 6 B6R0.1 CCCC(=O)SC ACT06405 [1,0,0,0,0,0|0,1,0]=2 7 B6R0.1 CCOC(=O)C#C ACT08916 [1,0,0,0,0,0|0,0,2]=3 8 B6R0.1 CCOC(=O)CBr ACT01957 [1,0,0,0,0,0|1,0,0]=2 9 B6R0.1 CCOC(=O)CN ACT03311 [1,0,0,0,0,0|1,0,0]=2 10 B6R0.1 CNCC(=O)OC ACT07185 [1,0,0,0,0,0|1,0,0]=2 11 B6R0.1 COC(=O)CCN ACT07866 [1,0,0,0,0,0|1,0,0]=2 12 B6R0.6 CCC\C=C\C=O ACT06041 [1,0,0,0,0,0|2,0,1]=4 13 B8R0.1 CCOC(=O)CCCBr ACT03470 [0,1,0,0,0,0|0,0,0]=1 14 B8R0.1 CCOC(=O)CCSC ACT06366 [0,1,0,0,0,0|0,0,0]=1 15 B8R0.1 CCOC(=O)NCCCl ACT09961 [0,1,0,0,0,0|1,0,0]=2 16 B8R0.3 CCC(C(=O)OCC)Br ACT02390 [0,1,0,0,0,0|0,0,0]=1 17 B8R0.3 CCOC(=O)[C@H](CO)N ACT07709 [0,1,0,0,0,0|1,0,0]=2 18 B8R0.3 CCOC(=O)[C@H](CS)N ACT08955 [0,1,0,0,0,0|1,0,0]=2 19 B8R0.3 CCOC(=O)\C(=N\O)\Cl ACT04467 [0,1,0,0,0,0|2,0,1]=4 20 B8R0.30 CCOP(=O)(OCC)Cl ACT04089 [0,1,0,0,0,0|2,0,0]=3 21 B8R1.4 C1C(=O)OC(=O)CS1 ACT03974 [0,0,0,1,0,0|2,0,1]=4 22 B8R1.4 C1CNC(=O)CC1O ACT02046 [0,0,0,1,0,0|2,0,0]=3 23 B8R1.4 C1CNC(=O)C[C@H]1O ACT09754 [0,0,0,1,0,0|2,0,0]=3 24 B8R1.18 C1[C@H](C(=O)OC1=O)N ACT04893 [0,0,0,1,0,0|2,0,1]=4 25 B8R1.18 CC1CC(=O)NC1=O ACT09858 [0,0,0,1,0,0|2,0,1]=4 26 B8R1.18 Cc1c(oc(=O)o1)C ACT08015 [0,0,0,1,0,0|1,0,2]=4 27 B5R0.1 C(CN)C(=O)N ACT05141 [2,0,0,0,0,0|2,0,0]=4 28 B5R0.1 C(CN)C(=O)O ACT04890 [2,0,0,0,0,0|1,0,0]=3 29 B5R0.1 CC#CC(=O)O ACT02801 [2,0,0,0,0,0|0,0,2]=4 30 B5R0.1 CCSC(=O)C ACT06390 [2,0,0,0,0,0|0,1,0]=3 31 B5R0.1 CNCC(=O)O ACT04970 [2,0,0,0,0,0|1,0,0]=3 32 B5R0.2 CCCSSC ACT06210 [2,0,0,0,0,0|1,1,0]=4 33 B5R0.2 CCSSCC ACT06136 [2,0,0,0,0,0|1,1,0]=4 34 B5R0.3 COC(=O)C#C ACT08917 [2,0,0,0,0,0|0,0,2]=4 35 B5R0.3 COC(=O)CBr ACT01939 [2,0,0,0,0,0|1,0,0]=3 36 B5R0.3 COC(=O)CN ACT08376 [2,0,0,0,0,0|1,0,0]=3 37 B7R0.2 COC(=O)CC(=S)N ACT08599 [1,1,0,0,0,0|1,0,1]=4 38 B7R0.2 C[C@H](CC(=O)OC)O ACT06831 [1,1,0,0,0,0|0,0,0]=2 39 B7R0.3 COC(=O)CCC=O ACT08469 [1,1,0,0,0,0|0,0,1]=3 40 B7R0.3 COC(=O)CCSC ACT06346 [1,1,0,0,0,0|0,0,0]=2 41 B7R0.5 CCOC(=O)C(=O)Cl ACT12045 [1,1,0,0,0,0|1,0,1]=4 42 B7R0.5 CCOC(=O)C(C)Br ACT02065 [1,1,0,0,0,0|0,0,0]=2 43 B7R0.5 CCOC(=O)C(C)Cl ACT02803 [1,1,0,0,0,0|0,0,0]=2 44 B7R0.5 CCOC(=O)C(C)N ACT08470 [1,1,0,0,0,0|0,0,0]=2 45 B7R0.5 CCOC(=O)[C@H](C)N ACT00044 [1,1,0,0,0,0|0,0,0]=2 46 B7R0.10 CCC(C(=O)OC)Br ACT02122 [1,1,0,0,0,0|0,0,0]=2 47 B7R0.10 CC[C@H](C(=O)OC)N ACT10443 [1,1,0,0,0,0|0,0,0]=2 48 B7R0.10 COC(=O)C(=C)CO ACT03973 [1,1,0,0,0,0|1,0,1]=4 49 B7R0.10 COC(=O)C(CO)N ACT08359 [1,1,0,0,0,0|1,0,0]=3 50 B7R0.10 COC(=O)[C@@H](CO)N ACT05963 [1,1,0,0,0,0|1,0,0]=3 51 B7R0.10 COC(=O)[C@H](CO)N ACT09183 [1,1,0,0,0,0|1,0,0]=3 52 B7R0.10 COC(=O)[C@H](CS)N ACT07406 [1,1,0,0,0,0|1,0,0]=3 53 B7R0.1 CCCSSCCC ACT06139 [1,1,0,0,0,0|1,1,0]=4 54 B9R0.5 CCOC(=O)COCCCl ACT02883 [0,2,0,0,0,0|0,0,0]=2 55 B9R0.5 CCO\C=C\C(=O)OCC ACT04466 [0,2,0,0,0,0|0,0,1]=3 56 B9R0.34 CCOC(=O)C[C@@H](CBr)O ACT10695 [0,2,0,0,0,0|0,0,0]=2 57 B9R0.35 CCCC(C(=O)CCC)O ACT06072 [0,2,0,0,0,0|1,0,0]=3 58 B9R0.48 CCOC(=O)CNC(=O)C ACT05046 [0,2,0,0,0,0|0,0,1]=3 59 B9R0.6 CCOC(=O)C(C(C)C)Br ACT02956 [0,2,0,0,0,0|0,0,0]=2 60 B9R0.6 CCOC(=O)[C@H](C(C)C)N ACT07377 [0,2,0,0,0,0|0,0,0]=2 61 B9R0.44 CC(C)(C)OC(=O)CC#N ACT02253 [0,2,0,0,0,0|1,0,1]=4 62 B9R0.44 CC(C)(C)OC(=O)CCN ACT10871 [0,2,0,0,0,0|1,0,0]=3 63 B9R0.44 CC(C)(C)OC(=O)CNC ACT09345 [0,2,0,0,0,0|1,0,0]=3 64 B9R0.44 CCOC(=O)C[Si](C)(C)C ACT08965 [0,2,0,0,0,0|0,1,0]=3 65 B9R0.15 CCCC(CCC)C(=O)O ACT05281 [0,2,0,0,0,0|1,0,1]=4 66 B7R1.2 C1CC(=O)OC1=O ACT11409 [1,0,0,1,0,0|1,0,1]=4 67 B7R1.2 C1[C@@H](CNC1=O)O ACT01696 [1,0,0,1,0,0|2,0,0]=4 68 B7R1.3 C1CCN(CC1)N ACT09283 [1,0,0,1,0,0|2,0,0]=4 69 B7R1.3 C1CCN(CC1)O ACT09755 [1,0,0,1,0,0|1,0,1]=4 70 B7R1.3 C1CNCCC1=O ACT02123 [1,0,0,1,0,0|1,0,0]=3 71 B7R1.3 C1COCCC1=O ACT01867 [1,0,0,1,0,0|1,0,0]=3 72 B7R1.4 C1CNC(=O)C1N ACT09401 [1,0,0,1,0,0|2,0,0]=4 73 B7R1.4 CC1C(=O)CCO1 ACT06568 [1,0,0,1,0,0|1,0,0]=3 74 B7R1.4 CC1C(=O)CCS1 ACT06593 [1,0,0,1,0,0|1,0,0]=3 75 B9R1.15 COC1CCCNC1=O ACT04469 [0,1,0,1,0,0|2,0,0]=4 76 B9R1.33 C1CN(C(=O)N1)CCCl ACT09378 [0,1,0,1,0,0|2,0,0]=4 77 B9R1.33 C=CCN1CCCC1=O ACT09428 [0,1,0,1,0,0|1,0,1]=4 78 B9R1.49 CN1CCC(=O)NCC1 ACT09833 [0,1,0,1,0,0|1,0,0]=3 79 B9R1.5 C1CCNC(=O)C(C1)N ACT01818 [0,1,0,1,0,0|1,0,0]=3 80 B9R1.5 C1CCNC(=O)[C@H](C1)N ACT05209 [0,1,0,1,0,0|1,0,0]=3 81 B9R1.5 CN1CCCCCC1=O ACT05308 [0,1,0,1,0,0|1,0,0]=3