0 B13R2.32 CN1C(=O)C=CC2=CC=CC=C21 15912 [1,0,0,0,0,0|1,0,2]=4 1 B13R2.369 NC1CC2=CC=CC=C2NC1=O 17875 [1,0,0,0,0,0|0,0,0]=1 2 B13R2.369 NC1CC2=CN=CC=C2NC1=O 17876 [1,0,0,0,0,0|1,0,0]=2 3 B13R2.369 NC1CC2=NC=CC=C2NC1=O 17874 [1,0,0,0,0,0|1,0,0]=2 4 B13R1.135 COC(=O)C(O)Cc1ccccc1 23902 [0,0,1,0,0,0|3,0,0]=4 5 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 10882 [0,0,1,0,0,0|2,0,0]=3 6 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 6055 [0,0,1,0,0,0|3,0,0]=4 7 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 10883 [0,0,1,0,0,0|2,0,0]=3 8 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 14742 [0,0,1,0,0,0|3,0,0]=4 9 B13R1.135 N[C@H](Cc1ccccc1)C(=O)CCl 11515 [0,0,1,0,0,0|2,0,0]=3 10 B12R1.371 O=C(CCl)NC1=C(F)C=CC=C1 8396 [1,0,1,0,0,0|2,0,0]=4 11 B12R1.27 COC(=O)CCC1=CC=CC=C1 18417 [1,0,1,0,0,0|2,0,0]=4 12 B12R1.27 NNC(=O)OCC1=CC=CC=C1 13705 [1,0,1,0,0,0|2,0,0]=4 13 B12R1.27 O=C(NO)OCC1=CC=CC=C1 22874 [1,0,1,0,0,0|1,0,0]=3 14 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O 16952 [1,0,1,0,0,0|2,0,0]=4 15 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 20603 [1,0,1,0,0,0|0,0,0]=2 16 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 19011 [1,0,1,0,0,0|0,0,0]=2 17 B12R1.43 NC(CC1=CC=CC=C1)B(O)O 33620 [1,0,1,0,0,0|1,0,1]=4 18 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O 2375 [1,0,1,0,0,0|0,0,0]=2 19 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O 21965 [1,0,1,0,0,0|1,0,0]=3 20 B12R1.43 N[C@@H](CC1=CC=CC=C1)B(O)O 33651 [1,0,1,0,0,0|1,0,1]=4 21 B12R1.43 N[C@@H](CC1=CC=CC=C1)B(O)O 33652 [1,0,1,0,0,0|1,0,1]=4 22 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O 11004 [1,0,1,0,0,0|0,0,0]=2 23 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O 18595 [1,0,1,0,0,0|0,0,0]=2 24 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O 20966 [1,0,1,0,0,0|1,0,0]=3 25 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O 24900 [1,0,1,0,0,0|1,0,0]=3 26 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O 20967 [1,0,1,0,0,0|1,0,0]=3 27 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O 5696 [1,0,1,0,0,0|1,0,0]=3 28 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O 10975 [1,0,1,0,0,0|0,0,0]=2 29 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O 15910 [1,0,1,0,0,0|1,0,0]=3 30 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O 29810 [1,0,1,0,0,0|1,0,0]=3 31 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 10725 [1,0,1,0,0,0|1,0,0]=3 32 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 6413 [1,0,1,0,0,0|1,0,0]=3 33 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 6414 [1,0,1,0,0,0|1,0,0]=3 34 B12R1.34 CN(C(=O)CN)C1=CC=CC=C1 9267 [1,0,1,0,0,0|1,0,0]=3 35 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 10350 [1,0,1,0,0,0|2,0,0]=4 36 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 13835 [1,0,1,0,0,0|2,0,0]=4 37 B12R1.34 COC(=O)[C@H](O)c1ccccc1 10418 [1,0,1,0,0,0|2,0,0]=4 38 B12R2.24 CC1CCC2=CC=CC=C2N1 7515 [2,0,0,0,0,0|1,0,1]=4 39 B12R2.24 N[C@H]1CCC2=CC=CC=C2C1 23249 [2,0,0,0,0,0|1,0,1]=4 40 B12R2.24 O=C1CC2=CC=CC=C2CO1 22155 [2,0,0,0,0,0|2,0,0]=4 41 B12R2.24 O=C1CCC2=CC=CC=C2C1 17934 [2,0,0,0,0,0|1,0,0]=3 42 B12R2.24 O=C1COC2=C(C=CC=C2)N1 18791 [2,0,0,0,0,0|1,0,0]=3 43 B12R2.24 O=C1COC2=CC=CC=C2C1 9704 [2,0,0,0,0,0|2,0,0]=4 44 B14R1.3135 COC1=C(C[C@@H](N)C(=O)O)C=CC=C1 18013 [0,1,1,0,0,0|2,0,0]=4 45 B14R1.3135 COC1=C(C[C@H](N)C(=O)O)C=CC=C1 18015 [0,1,1,0,0,0|2,0,0]=4 46 B14R1.3135 N#CC1=C(C[C@@H](N)C(=O)O)C=CC=C1 29814 [0,1,1,0,0,0|2,0,0]=4 47 B14R1.3135 N#CC1=C(C[C@H](N)C(=O)O)C=CC=C1 29813 [0,1,1,0,0,0|2,0,0]=4 48 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 19008 [0,1,1,0,0,0|2,0,0]=4 49 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 10889 [0,1,1,0,0,0|2,0,0]=4 50 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 10902 [0,1,1,0,0,0|2,0,0]=4 51 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(O)C=C1 10891 [0,1,1,0,0,0|2,0,0]=4 52 B14R1.134 NNC(=O)[C@@H](N)CC1=CC=C(O)C=C1 27073 [0,1,1,0,0,0|1,0,0]=3 53 B14R2.29369 CN1C(=O)CNC2=CC(Cl)=CC=C21 34758 [1,1,0,0,0,0|2,0,0]=4 54 B14R2.8239 NC1CC2=CC=C(Cl)C=C2NC1=O 14885 [1,1,0,0,0,0|0,0,0]=2 55 B12R2.18 Cn1c(=O)oc2ccccc21 8685 [1,0,0,0,1,0|2,0,0]=4 56 B14R1.743 COC(=O)CC(N)CC1=CC=CC=C1 25420 [0,0,1,0,0,1|2,0,0]=4