0 B6R0.3 C(C(=O)C(=O)O)Br ACT09279 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.3 CCC(=O)N(C)C ACT06844 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.3 CCC(C(=O)C)S ACT06317 [0,0,0,0,0,0|2,1,1]=4 3 B6R0.3 CN(C)C(=O)C=C ACT05674 [0,0,0,0,0,0|2,0,2]=4 4 B6R0.3 CN(C)C(=O)CCl ACT03938 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.3 C[C@@H](C(=O)OC)N ACT02716 [0,0,0,0,0,0|1,0,1]=2 6 B6R0.3 C[C@@H](C(=O)OC)N ACT07687 [0,0,0,0,0,0|1,0,1]=2 7 B6R0.3 C[C@H](C(=O)OC)N ACT07214 [0,0,0,0,0,0|1,0,1]=2 8 B5R0.1 CC(=CC#N)N ACT07325 [1,0,0,0,0,0|3,0,0]=4 9 B5R0.1 CC(=CCS)C ACT06408 [1,0,0,0,0,0|2,0,1]=4 10 B5R0.1 CCSC(=O)C ACT06390 [1,0,0,0,0,0|3,0,0]=4 11 B5R0.3 CCC(C=C)O ACT06029 [1,0,0,0,0,0|1,0,2]=4 12 B5R0.3 COC(=O)C#C ACT08917 [1,0,0,0,0,0|0,0,2]=3 13 B5R0.3 COC(=O)CBr ACT01939 [1,0,0,0,0,0|1,0,1]=3 14 B5R0.3 COC(=O)CN ACT08376 [1,0,0,0,0,0|1,0,1]=3 15 B5R0.5 CC(=O)C(=O)C ACT06100 [1,0,0,0,0,0|1,0,0]=2 16 B5R0.5 CC(C(=O)Br)Br ACT03417 [1,0,0,0,0,0|2,0,1]=4 17 B5R0.5 CC(C(=O)C)O ACT06054 [1,0,0,0,0,0|1,0,1]=3 18 B5R0.5 CC(C(=O)C)S ACT06274 [1,0,0,0,0,0|1,0,1]=3 19 B5R0.5 CC(C(=O)O)Br ACT01974 [1,0,0,0,0,0|1,0,1]=3 20 B5R0.5 CC(C(=O)O)N ACT07794 [1,0,0,0,0,0|1,0,1]=3 21 B5R0.5 CC(C)C(=O)Cl ACT05625 [1,0,0,0,0,0|1,0,2]=4 22 B5R0.5 C[C@@H](C(=O)N)N ACT03139 [1,0,0,0,0,0|2,0,1]=4 23 B5R0.5 C[C@H](C(=O)N)N ACT10902 [1,0,0,0,0,0|2,0,1]=4 24 B5R0.5 C[C@H](C(=O)O)N ACT07928 [1,0,0,0,0,0|1,0,1]=3 25 B7R0.5 CCOC(=O)C(=O)Cl ACT12045 [0,1,0,0,0,0|2,0,0]=3 26 B7R0.5 CCOC(=O)C(C)Br ACT02065 [0,1,0,0,0,0|1,0,1]=3 27 B7R0.5 CCOC(=O)C(C)Cl ACT02803 [0,1,0,0,0,0|1,0,1]=3 28 B7R0.5 CCOC(=O)C(C)N ACT08470 [0,1,0,0,0,0|1,0,1]=3 29 B7R0.5 CCOC(=O)[C@H](C)N ACT00044 [0,1,0,0,0,0|1,0,1]=3 30 B7R0.10 CCC(C(=O)OC)Br ACT02122 [0,1,0,0,0,0|1,0,1]=3 31 B7R0.10 CC[C@H](C(=O)OC)N ACT10443 [0,1,0,0,0,0|1,0,1]=3 32 B7R0.10 COC(=O)C(=C)CO ACT03973 [0,1,0,0,0,0|0,0,0]=1 33 B7R0.10 COC(=O)C(CO)N ACT08359 [0,1,0,0,0,0|1,0,1]=3 34 B7R0.10 COC(=O)[C@@H](CO)N ACT05963 [0,1,0,0,0,0|1,0,1]=3 35 B7R0.10 COC(=O)[C@H](CO)N ACT09183 [0,1,0,0,0,0|1,0,1]=3 36 B7R0.10 COC(=O)[C@H](CS)N ACT07406 [0,1,0,0,0,0|1,0,1]=3 37 B7R0.14 CC(C)(C(=O)OC)Br ACT02714 [0,1,0,0,0,0|0,0,2]=3 38 B7R1.4 C1CNC(=O)C1N ACT09401 [0,0,0,1,0,0|2,0,1]=4 39 B7R1.4 CC1C(=O)CCO1 ACT06568 [0,0,0,1,0,0|2,0,1]=4 40 B7R1.4 CC1C(=O)CCS1 ACT06593 [0,0,0,1,0,0|2,0,1]=4 41 B7R1.4 Cc1c(cco1)S ACT06377 [0,0,0,1,0,0|2,0,1]=4 42 B7R1.4 Cc1ccsc1Br ACT02266 [0,0,0,1,0,0|1,1,1]=4 43 B7R1.4 Cc1cscc1Br ACT08579 [0,0,0,1,0,0|3,0,0]=4 44 B7R0.2 COC(=O)CC(=S)N ACT08599 [0,0,0,0,0,1|2,0,0]=3 45 B7R0.2 C[C@H](CC(=O)OC)O ACT06831 [0,0,0,0,0,1|1,0,1]=3 46 B4R0.1 C(=O)C(=O)O ACT06826 [2,0,0,0,0,0|1,0,0]=3 47 B4R0.1 C(C(=O)O)Br ACT01771 [2,0,0,0,0,0|1,0,1]=4 48 B4R0.1 CC(=C)CBr ACT08856 [2,0,0,0,0,0|1,0,1]=4 49 B4R0.1 CC(=N)OC ACT09196 [2,0,0,0,0,0|1,0,0]=3 50 B4R0.1 CC(=O)C#C ACT08607 [2,0,0,0,0,0|0,0,2]=4 51 B4R0.1 CC(=O)CCl ACT09266 [2,0,0,0,0,0|1,0,1]=4 52 B4R0.1 CC(=O)SC ACT06385 [2,0,0,0,0,0|0,1,0]=3 53 B4R0.1 CC=C(C)Br ACT12017 [2,0,0,0,0,0|1,0,0]=3 54 B4R0.2 CNCC=C ACT04698 [2,0,0,0,0,0|1,0,1]=4 55 B4R0.2 CSCC=C ACT06184 [2,0,0,0,0,0|0,1,1]=4 56 B6R0.1 CC\C=C(/C)\C=O ACT06055 [1,1,0,0,0,0|1,0,0]=3 57 B6R0.8 CCS(=O)(=O)C=C ACT04703 [1,1,0,0,0,0|2,0,0]=4 58 B6R0.7 CC(=O)C(C)(C)O ACT02809 [1,1,0,0,0,0|0,0,2]=4 59 B8R0.2 CC(C)C(C(=O)OC)Br ACT03009 [0,1,0,0,0,1|0,0,2]=4 60 B8R0.2 CC(C)[C@@H](C(=O)OC)N ACT08510 [0,1,0,0,0,1|0,0,2]=4 61 B8R0.2 CC(C)[C@H](C(=O)OC)N ACT07567 [0,1,0,0,0,1|0,0,2]=4 62 B8R0.3 CCC(C(=O)OCC)Br ACT02390 [0,2,0,0,0,0|1,0,1]=4 63 B8R0.3 CCOC(=O)[C@H](CO)N ACT07709 [0,2,0,0,0,0|1,0,1]=4 64 B8R0.3 CCOC(=O)[C@H](CS)N ACT08955 [0,2,0,0,0,0|1,0,1]=4 65 B8R0.3 CCOC(=O)\C(=N\O)\Cl ACT04467 [0,2,0,0,0,0|2,0,0]=4 66 B8R0.14 CCOC(=O)C(C)(C)Br ACT02786 [0,2,0,0,0,0|0,0,2]=4 67 B8R0.13 CC[C@@](C)(C(=O)OC)N ACT10604 [0,2,0,0,0,0|0,0,2]=4 68 B6R1.2 Cc1c[nH]nc1 ACT08853 [1,0,0,1,0,0|2,0,0]=4 69 B6R1.2 Cc1cc[nH]c1 ACT05027 [1,0,0,1,0,0|1,0,1]=4 70 B8R1.18 CC1CC(=O)NC1=O ACT09858 [0,0,0,1,0,1|2,0,0]=4 71 B8R1.5 Cc1ccc[nH]c1=O ACT01511 [0,1,0,1,0,0|1,0,1]=4