0 B11R1.166 Cc1ccc(c(c1)N)C(=O)O 4M0 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 Cc1ccc(c(c1)O)C(C)C IPB [0,0,0,0,0,0|0,0,0]=0 2 B11R1.166 c1cc(c(cc1N)O)C(=O)O BHA [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 c1cc(c(cc1O)O)C(=O)O DOB [0,0,0,0,0,0|3,0,1]=4 4 B10R1.13 CC(=O)c1ccc(cc1)Br PBP [1,0,0,0,0,0|2,0,1]=4 5 B10R1.13 CC(=O)c1ccc(cc1)O AC6 [1,0,0,0,0,0|2,0,1]=4 6 B10R1.13 CC(C)c1ccc(cc1)N ISO [1,0,0,0,0,0|1,0,0]=2 7 B10R1.13 Cc1ccc(cc1)C(=O)O 4MA [1,0,0,0,0,0|2,0,1]=4 8 B10R1.13 Cc1ccc(cc1)C(C)C MML [1,0,0,0,0,0|0,0,0]=1 9 B10R1.13 Cc1ccc(cc1)[S@@](=O)O TOS [1,0,0,0,0,0|3,0,0]=4 10 B10R1.25 COc1ccc(cc1F)N 71B [1,0,0,0,0,0|3,0,0]=4 11 B10R1.25 Cc1ccc(c(c1)N)OC ZZT [1,0,0,0,0,0|2,0,0]=3 12 B10R1.25 c1cc(c(cc1F)F)CO 24B [1,0,0,0,0,0|3,0,0]=4 13 B10R1.25 c1cc(c(cc1O)O)SO TH7 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.61 CC(=O)c1ccccc1N VNJ [1,0,0,0,0,0|2,0,1]=4 15 B10R1.61 CC(C)c1ccccc1O IP0 [1,0,0,0,0,0|0,0,0]=1 16 B10R1.61 c1ccc(c(c1)C(=O)N)O OHB [1,0,0,0,0,0|2,0,1]=4 17 B10R1.61 c1ccc(c(c1)C(=O)O)O SAL [1,0,0,0,0,0|2,0,1]=4 18 B10R1.61 c1ccc(c(c1)[N+](=O)O)O CG3 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])O OPO [1,0,0,0,0,0|3,0,0]=4 20 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)C IMW [0,1,0,0,0,0|0,0,1]=2 21 B12R1.1703 CCC(=O)c1ccc(cc1O)O 2FY [0,1,0,0,0,0|2,0,1]=4 22 B12R1.1703 C\C(=N/O)\c1ccc(cc1O)O ODO [0,1,0,0,0,0|2,0,1]=4 23 B9R1.1 CCc1ccc(cc1)O ETY [2,0,0,0,0,0|1,0,0]=3 24 B9R1.1 COc1ccc(cc1)Br BOP [2,0,0,0,0,0|2,0,0]=4 25 B9R1.1 COc1ccc(cc1)O 4KS [2,0,0,0,0,0|2,0,0]=4 26 B9R1.1 CSc1ccc(cc1)N 4JM [2,0,0,0,0,0|2,0,0]=4 27 B9R1.1 C[n+]1ccc(cc1)CN NNK [2,0,0,0,0,0|2,0,0]=4 28 B9R1.1 Cc1ccc(cc1)CN 02N [2,0,0,0,0,0|1,0,0]=3 29 B9R1.1 c1cc(ccc1CN)Br PZH [2,0,0,0,0,0|2,0,0]=4 30 B9R1.1 c1cc(ccc1CN)Cl C2B [2,0,0,0,0,0|2,0,0]=4 31 B9R1.1 c1cc(ccc1CN)N 4ZY [2,0,0,0,0,0|2,0,0]=4 32 B9R1.1 c1cc(ccc1CO)Br BRB [2,0,0,0,0,0|2,0,0]=4 33 B9R1.1 c1cc(ccc1CO)Cl 4JL [2,0,0,0,0,0|2,0,0]=4 34 B9R1.1 c1cc(ccc1C[NH3+])F FBA [2,0,0,0,0,0|2,0,0]=4 35 B9R1.6 CC(=O)c1ccccc1 AC0 [2,0,0,0,0,0|1,0,1]=4 36 B9R1.6 C[C@@H](c1ccccc1)N 98B [2,0,0,0,0,0|1,0,0]=3 37 B9R1.6 C[C@@H](c1ccccc1)O SS1 [2,0,0,0,0,0|1,0,0]=3 38 B9R1.6 C[C@H](c1ccccc1)N QSC [2,0,0,0,0,0|1,0,0]=3 39 B9R1.6 C[C@H](c1ccccc1)O SS2 [2,0,0,0,0,0|1,0,0]=3 40 B9R1.15 CCc1ccccc1O JZ1 [2,0,0,0,0,0|0,0,0]=2 41 B9R1.15 COc1ccccc1O JZ3 [2,0,0,0,0,0|1,0,0]=3 42 B9R1.15 Cc1ccccc1CN KNN [2,0,0,0,0,0|2,0,0]=4 43 B9R1.15 c1ccc(c(c1)C#N)O 0R0 [2,0,0,0,0,0|1,0,1]=4 44 B9R1.15 c1ccc(c(c1)C=O)O NK [2,0,0,0,0,0|1,0,1]=4 45 B9R1.15 c1ccc(c(c1)CN)Cl 02R [2,0,0,0,0,0|2,0,0]=4 46 B9R1.15 c1ccc(c(c1)CO)Br 4HR [2,0,0,0,0,0|2,0,0]=4 47 B9R1.15 c1ccc(c(c1)CO)N SOA [2,0,0,0,0,0|2,0,0]=4 48 B9R1.15 c1ccc(c(c1)CO)O SA9 [2,0,0,0,0,0|1,0,0]=3 49 B9R1.15 c1ccc(c(c1)CS)I IBZ [2,0,0,0,0,0|2,0,0]=4 50 B9R1.69 CC1=CN(C(=S)C=C1)O 5MH [2,0,0,0,0,0|2,0,0]=4 51 B9R1.69 Cc1ccc(c(c1)C)C XBZ [2,0,0,0,0,0|1,0,0]=3 52 B9R1.69 Cc1ccc(c(c1)C)N 51S [2,0,0,0,0,0|2,0,0]=4 53 B9R1.69 Cc1ccc(c(c1)N)C XYD [2,0,0,0,0,0|1,0,0]=3 54 B9R1.69 Cc1ccc(c(c1)N)O 2AC [2,0,0,0,0,0|2,0,0]=4 55 B9R1.69 Cc1ccc(c(c1)O)O MCT [2,0,0,0,0,0|1,0,0]=3 56 B9R1.69 Cc1ccc(c(c1)S)O HT4 [2,0,0,0,0,0|1,1,0]=4 57 B9R1.69 Cc1ccc(c(c1)S)S TLD [2,0,0,0,0,0|1,1,0]=4 58 B9R1.69 Cc1ccc(cc1C)N 34A [2,0,0,0,0,0|2,0,0]=4 59 B9R1.69 Cc1ccc(cc1C)O 2MP [2,0,0,0,0,0|2,0,0]=4 60 B9R1.69 Cc1ccc(cc1O)Cl JZ2 [2,0,0,0,0,0|1,0,0]=3 61 B9R1.69 c1cc(c(cc1Cl)O)O 4CL [2,0,0,0,0,0|2,0,0]=4 62 B9R1.69 c1cc(c(cc1F)O)O 3N8 [2,0,0,0,0,0|2,0,0]=4 63 B9R1.69 c1cc(c(cc1O)O)O HQN [2,0,0,0,0,0|2,0,0]=4 64 B9R1.69 c1cc(c(cc1O)O)S TH0 [2,0,0,0,0,0|2,0,0]=4 65 B11R1.21 Cc1ccc(cc1O)C(=C)C 0WV [1,1,0,0,0,0|0,0,2]=4 66 B11R1.22 c1cc(ccc1[C@@H](CN)O)F 489 [1,1,0,0,0,0|2,0,0]=4 67 B11R1.22 c1cc(ccc1[C@@H](CN)O)O OTS [1,1,0,0,0,0|2,0,0]=4 68 B11R1.22 c1cc(ccc1[C@H](CN)O)O OTR [1,1,0,0,0,0|2,0,0]=4 69 B11R1.279 COc1ccc(c(c1)O)CN HV7 [1,1,0,0,0,0|1,0,0]=3 70 B11R1.279 COc1ccc(cc1O)CN 47G [1,1,0,0,0,0|1,0,0]=3 71 B11R1.279 COc1ccc(cc1O)CO 2A9 [1,1,0,0,0,0|1,0,0]=3 72 B11R1.53 CC(C)c1c(nccn1)OC IPZ [1,1,0,0,0,0|2,0,0]=4 73 B13R1.3800 CC(C)C1=CC=C(C(=O)C(=C1)O)O JTH [0,1,0,0,0,1|1,0,0]=3 74 B13R1.651 CC1=CC(=O)C(=CC1=NO)C(C)C PXE [0,2,0,0,0,0|0,0,1]=3 75 B11R2.36 c1cc2c(cc1O)OCO2 BZX [1,0,0,1,0,0|2,0,0]=4 76 B11R1.20 C[C@H](Cc1ccc(cc1)O)N AEG [1,0,0,0,0,1|2,0,0]=4