0 B11R1.35 NC(CC1=CC=CO1)C(=O)O SC-62587 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.35 NC(CC1=CNC=N1)C(=O)O SC-15765 [0,0,0,0,0,0|0,0,2]=2 2 B11R1.35 NC(CC1=CSC=C1)C(=O)O SC-62610 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.35 NC(CN1C=CC=N1)C(=O)O SC-31242 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O SC-48559 [0,0,0,0,0,0|0,0,2]=2 5 B10R1.27 N[C@H](CO)CC1=CNC=N1 SC-26127 [1,0,0,0,0,0|0,0,3]=4 6 B10R1.66 O=C(O)CCC1=CC=CN1 SC-21976 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.66 O=C(O)CCC1=NC=CS1 SC-43633 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.145 NC(CN1N=CC=C1Br)C(=O)O SC-31348 [0,1,0,0,0,0|2,0,1]=4 9 B12R1.145 NC(CN1N=CC=C1Cl)C(=O)O SC-30929 [0,1,0,0,0,0|2,0,1]=4 10 B12R2.252 O=C(O)C1=CC2=C(N=CS2)N1 SC-50040 [0,0,0,1,0,0|1,0,2]=4 11 B10R1.23 NC(C(=O)O)C1=CC=CN1 SC-12442 [0,0,0,0,1,0|1,0,0]=2 12 B10R1.23 NC(C(=O)O)C1=COC=C1 SC-12433 [0,0,0,0,1,0|2,0,0]=3 13 B10R1.23 NC(C(=O)O)C1=CSC=C1 SC-65975 [0,0,0,0,1,0|2,0,0]=3 14 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SC-24697 [0,0,0,0,0,1|3,0,0]=4 15 B12R1.43 NC(CC1=CC=CN=C1)C(=O)O SC-11174 [0,0,0,0,0,1|1,0,0]=2 16 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O SC-11181 [0,0,0,0,0,1|1,0,0]=2 17 B12R1.43 NC(CC1=NC=CC=C1)C(=O)O SC-11171 [0,0,0,0,0,1|1,0,1]=3 18 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-10967 [0,0,0,0,0,1|2,0,0]=3 19 B12R1.264 N[C@H](CCC1=CN=CN1)C(=O)O SC-49292 [0,0,0,0,0,1|0,0,0]=1 20 B9R0.47 C=CCSC[C@H](N)C(=O)O SC-10023 [1,0,1,0,0,0|2,0,0]=4 21 B9R1.12 O=CCCN1C=CN=C1 SC-31596 [2,0,0,0,0,0|2,0,0]=4 22 B11R1.25 COC(=O)CCC1=CC=CN1 SC-90967 [1,1,0,0,0,0|1,0,0]=3 23 B11R1.25 COC(=O)CCC1=CC=CS1 SC-44693 [1,1,0,0,0,0|2,0,0]=4 24 B11R1.25 COC(=O)CCC1=CNC=N1 SC-65950 [1,1,0,0,0,0|0,0,2]=4 25 B11R1.75 NC1=NC=C(CCC(=O)O)S1 SC-88277 [1,1,0,0,0,0|1,0,0]=3 26 B11R1.77 NC(CC(=O)O)C1=CC=CN1 SC-59379 [1,1,0,0,0,0|1,0,0]=3 27 B11R1.77 NC(CC(=O)O)C1=CC=CO1 SC-59318 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.77 NC(CC(=O)O)C1=COC=C1 SC-59278 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.90 CC1=C(\C=C\C(=O)O)NC=N1 SC-40847 [1,1,0,0,0,0|0,0,2]=4 30 B11R1.90 CN1C=NC=C1\C=C\C(=O)O SC-13427 [1,1,0,0,0,0|0,0,2]=4 31 B11R1.90 CN1C=NC=C1\C=C\C(=O)O SC-39249 [1,1,0,0,0,0|0,0,2]=4 32 B11R1.314 CC1=NC=C(C(C)C(=O)O)S1 SC-49680 [0,1,0,0,1,0|2,0,0]=4 33 B11R1.314 NC(C(=O)O)C1=CC(Br)=CS1 SC-59476 [0,1,0,0,1,0|2,0,0]=4 34 B11R1.314 NC(C(=O)O)C1=CC=C(Br)S1 SC-12437 [0,1,0,0,1,0|2,0,0]=4 35 B11R1.314 NC(C(=O)O)C1=CC=C(Cl)S1 SC-12430 [0,1,0,0,1,0|2,0,0]=4 36 B13R1.133 CC1=CC=C(CC(N)C(=O)O)C=C1 SC-10870 [0,1,0,0,0,1|2,0,0]=4 37 B13R1.133 NC(CC1=CC=C(Br)C=C1)C(=O)O SC-10523 [0,1,0,0,0,1|2,0,0]=4 38 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SC-09927 [0,1,0,0,0,1|2,0,0]=4 39 B13R1.133 N[C@@H](CC1=CC=C(I)C=C1)C(=O)O SC-10814 [0,1,0,0,0,1|2,0,0]=4 40 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 SC-52634 [0,1,0,0,0,1|2,0,0]=4 41 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 SC-09796 [0,1,0,0,0,1|2,0,0]=4 42 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 SC-70627 [0,1,0,0,0,1|2,0,0]=4 43 B13R1.148 NC(CC1=CC(O)=CC=C1)C(=O)O SC-10792 [0,1,0,0,0,1|2,0,0]=4 44 B13R1.152 CC(C1=CC=CC=C1)C(N)C(=O)O SC-59523 [0,1,0,0,0,1|2,0,0]=4 45 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O SC-10505 [0,1,0,0,0,1|2,0,0]=4 46 B13R1.202 NC(CC1=CC=CC=C1Cl)C(=O)O SC-10540 [0,1,0,0,0,1|2,0,0]=4 47 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O SC-14196 [0,1,0,0,0,1|2,0,0]=4 48 B13R1.66 CCOC(=O)C(N)CC1=CNC=N1 SC-41672 [0,2,0,0,0,0|0,0,2]=4 49 B13R1.3571 CN(C)[C@@H](CC1=CNC=N1)C(=O)O SC-20879 [0,2,0,0,0,0|0,0,2]=4 50 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)N1 SC-46307 [0,0,0,1,0,1|2,0,0]=4 51 B11R1.91 O=C(O)CCC1=CC=CC=C1 SC-04862 [1,0,0,0,0,1|2,0,0]=4 52 B11R1.91 O=C(O)CCC1=CC=NC=C1 SC-50418 [1,0,0,0,0,1|1,0,0]=3 53 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-12427 [0,0,0,0,0,2|2,0,0]=4 54 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-43726 [0,0,0,0,0,2|2,0,0]=4 55 B13R1.351 NC(CCC1=CC=NC=C1)C(=O)O SC-31254 [0,0,0,0,0,2|1,0,0]=3