0 B13R1.42 CCOC(=O)CCC1=CC=NC=C1 AC6299 [1,0,0,0,0,0|1,0,0]=2 1 B13R1.42 CCOC(=O)CCC1=CN=CC=C1 AC6533 [1,0,0,0,0,0|1,0,0]=2 2 B13R1.42 CCOC(=O)COC1=CN=CC=C1 24941 [1,0,0,0,0,0|2,0,0]=3 3 B13R1.42 CCOC(=O)COC1=NC=CC=C1 O11747 [1,0,0,0,0,0|2,0,0]=3 4 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 AC5716 [1,0,0,0,0,0|1,0,2]=4 5 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 F21164 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 D77832 [1,0,0,0,0,0|3,0,0]=4 7 B13R1.135 NNC(=O)[C@@H](N)CC1=CC=CC=C1 F10918 [1,0,0,0,0,0|3,0,0]=4 8 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(Cl)C=C1 C11800 [0,1,0,0,0,0|1,0,2]=4 9 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 39377 [0,1,0,0,0,0|1,0,0]=2 10 B15R1.551 C=CCOC(=O)[C@@H](N)CC1=CC=CC=C1 F11074 [0,1,0,0,0,0|1,0,1]=3 11 B15R1.10540 CCOC(=O)[C@@](C)(N)CC1=CC=CC=C1 D78559 [0,1,0,0,0,0|1,0,0]=2 12 B15R2.1356 CCOC(=O)N1CC2=C(C=CC=C2)C1 SC5143 [0,0,0,1,0,0|2,0,0]=3 13 B13R1.47 CCNC(=O)C(=O)C1=CC=CC=C1 E72124 [0,0,0,0,1,0|1,0,2]=4 14 B13R1.47 CCNC(=O)[C@H](O)C1=CC=CC=C1 E72125 [0,0,0,0,1,0|1,0,0]=2 15 B13R1.47 CCOC(=O)[C@H](I)C1=CC=CC=C1 D90601 [0,0,0,0,1,0|1,0,0]=2 16 B13R1.66 CCOC(=O)[C@@H](N)CC1=CNC=N1 FD21716 [0,0,0,0,1,0|3,0,0]=4 17 B12R1.27 COC(=O)CCC1=CC=NC=C1 AC7192 [2,0,0,0,0,0|1,0,0]=3 18 B12R1.27 NCC(=O)OCC1=CC=CC=C1 H11970 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 AB10382 [2,0,0,0,0,0|1,0,1]=4 20 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O A10414 [2,0,0,0,0,0|1,0,0]=3 21 B12R1.43 C[C@H](SC1=CC=CC=C1)C(=O)O W18223 [2,0,0,0,0,0|2,0,0]=4 22 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 F10693 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O N12125 [2,0,0,0,0,0|1,0,0]=3 24 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O A50242 [2,0,0,0,0,0|2,0,0]=4 25 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O N12178 [2,0,0,0,0,0|2,0,0]=4 26 B14R1.29 CCOC(=O)C[S@](=O)C1=CC=CC=C1 D92077 [1,1,0,0,0,0|1,0,0]=3 27 B14R1.32 CCOC(=O)COC1=CC=CC(Br)=C1 D78582 [1,1,0,0,0,0|1,0,0]=3 28 B14R1.502 CCOC(=O)\C=C\C1=CC=C(C)C=C1 H10135 [1,1,0,0,0,0|0,0,2]=4 29 B14R1.598 CCOC(=O)COC1=C(C)C=CC=C1 D86261 [1,1,0,0,0,0|1,0,0]=3 30 B14R1.818 CC(C)OC(=O)\C=C\C1=CC=CC=C1 D89457 [1,1,0,0,0,0|0,0,2]=4 31 B14R1.85 COC(=O)[C@@H](C)C(=O)C1=CC=CC=C1 AC5824 [1,1,0,0,0,0|1,0,1]=4 32 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Br)=C1 AC6686 [1,1,0,0,0,0|1,0,0]=3 33 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Br)=C1 AC7063 [1,1,0,0,0,0|1,0,0]=3 34 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(F)=C1 64047 [1,1,0,0,0,0|1,0,0]=3 35 B14R1.1007 COC(=O)[C@@H](N)CC1=C(Cl)C=CC=C1 N10819 [1,1,0,0,0,0|1,0,0]=3 36 B14R1.1007 COC(=O)[C@@H](N)CC1=C(F)C=CC=C1 N12205 [1,1,0,0,0,0|1,0,0]=3 37 B14R1.36 CCOC(=O)C(=O)C1=CC=CC(Cl)=C1 D87682 [0,1,0,0,1,0|0,0,2]=4 38 B14R1.510 CCOC(=O)C(F)(F)C1=CC=CC=C1 H10440 [0,1,0,0,1,0|1,0,0]=3 39 B14R1.510 CCOC(=O)C(F)(F)C1=NC=CC=C1 P10429 [0,1,0,0,1,0|2,0,0]=4 40 B16R1.912 CCOC(=O)[C@@H](O)CC(=O)C1=CC=CC=C1 D86074 [0,1,0,0,0,1|0,0,0]=2 41 B16R1.15339 CCOC(=O)C(C)(C)CC1=CC=C(F)C=C1 O11764 [0,2,0,0,0,0|1,0,0]=3 42 B16R1.4966 CCOC(=O)[C@H](C)OC1=CC(OC)=CC=C1 AC4166 [0,2,0,0,0,0|2,0,0]=4 43 B14R2.6 C1=CC=C(C[C@H]2CNCCO2)C=C1 C80057 [1,0,0,1,0,0|1,0,1]=4 44 B14R2.972 COC(=O)[C@@H]1CC2=C(C=CC=C2)N1 I11546 [1,0,0,1,0,0|1,0,0]=3 45 B16R2.767 CCOC(=O)[C@@H]1CC2=C(C=CC=C2)CN1 F53186 [0,0,0,1,0,1|1,0,0]=3 46 B12R1.51 CCOC(=O)CCC1=CSC=C1 78213 [1,0,0,0,1,0|1,0,0]=3 47 B12R1.30 CCCC[C@H](O)C1=CC=CC=C1 D89432 [1,0,0,0,1,0|1,0,1]=4 48 B12R1.30 CCCC[C@H](O)C1=CC=CC=C1 D92069 [1,0,0,0,1,0|1,0,1]=4 49 B14R1.520 C=COC(=O)CCCC1=CC=CC=C1 E71846 [1,0,0,0,0,1|0,0,2]=4 50 B16R1.14049 CCOC(=O)[C@@H](N)CSCC1=CC=CC=C1 FD21335 [0,0,0,0,0,2|1,0,0]=3