0 B14R1.29 CCOC(=O)CC(=O)C1=CC=NC=C1 E8734 [0,0,0,0,0,0|1,0,0]=1 1 B14R1.29 CCOC(=O)CC(N)C1=CC=CC=C1 A14485 [0,0,0,0,0,0|1,0,1]=2 2 B14R1.29 CCOC(=O)CC(N)C1=CN=CC=C1 A14604 [0,0,0,0,0,0|2,0,1]=3 3 B13R1.11 COC(=O)CC(N)C1=CC=CC=C1 A15460 [1,0,0,0,0,0|1,0,1]=3 4 B13R1.11 COC(=O)CC(N)C1=NC=CC=C1 A15332 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.11 COC(=O)C[C@H](N)C1=CC=CN=C1 A17903 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.11 COC(=O)C[C@H](N)C1=CC=CN=C1 M1931 [1,0,0,0,0,0|2,0,1]=4 7 B13R1.24 CCNCCC(=O)C1=CC=CC=C1 M9617 [1,0,0,0,0,0|1,0,1]=3 8 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 P11245 [1,0,0,0,0,0|1,0,1]=3 9 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 E8131 [1,0,0,0,0,0|0,0,1]=2 10 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 P16662 [1,0,0,0,0,0|1,0,1]=3 11 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C)C=C1 O9278 [0,1,0,0,0,0|0,0,0]=1 12 B15R1.23 CCOC(=O)CC(N)C1=CC=C(Cl)C=C1 A14472 [0,1,0,0,0,0|1,0,1]=3 13 B15R1.23 CCOC(=O)CC(N)C1=CC=C(O)C=C1 A14475 [0,1,0,0,0,0|1,0,1]=3 14 B15R1.23 CCOC(=O)C[C@H](N)C1=CC=C(F)C=C1 A15296 [0,1,0,0,0,0|1,0,1]=3 15 B15R1.24 CCOC(=O)CC(=O)C1=CC(F)=CC=C1 E4407 [0,1,0,0,0,0|0,0,0]=1 16 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(C)=C1 O9279 [0,1,0,0,0,0|0,0,0]=1 17 B15R1.24 CCOC(=O)CC(N)C1=CC(Cl)=CC=C1 A14551 [0,1,0,0,0,0|1,0,1]=3 18 B15R1.24 CCOC(=O)CC(N)C1=CC(F)=CC=C1 A14550 [0,1,0,0,0,0|1,0,1]=3 19 B15R1.24 CCOC(=O)CC(N)C1=CC(F)=CC=C1 A14618 [0,1,0,0,0,0|1,0,1]=3 20 B15R1.24 CCOC(=O)CC(N)C1=CC=CC(O)=C1 A14528 [0,1,0,0,0,0|1,0,1]=3 21 B15R1.578 CCOC(=O)C(N)C(O)C1=CC=CC=C1 A14500 [0,1,0,0,0,0|0,0,2]=3 22 B15R1.578 CCOC(=O)C(N)C(O)C1=CC=CC=C1 A14500 [0,1,0,0,0,0|0,0,2]=3 23 B15R1.3722 CCOC(=O)CC(=O)C1=C(C)C=CC=C1 O9280 [0,1,0,0,0,0|0,0,0]=1 24 B13R1.33 CCOC(=O)CC(=O)C1=CC=CO1 E4409 [0,0,0,0,1,0|1,0,0]=2 25 B13R1.33 CCOC(=O)CC(=O)C1=CC=CS1 E4400 [0,0,0,0,1,0|1,0,0]=2 26 B13R1.33 CCOC(=O)CC(=O)C1=COC=C1 E4408 [0,0,0,0,1,0|1,0,0]=2 27 B13R1.33 CCOC(=O)CC(=O)C1=CSC=C1 E4399 [0,0,0,0,1,0|1,0,0]=2 28 B13R1.47 CCOC(=O)C(=O)C1=CC=CC=C1 E8121 [0,0,0,0,1,0|0,0,0]=1 29 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 E9709 [0,0,0,0,1,0|1,0,1]=3 30 B15R1.89 CCOC(=O)CCC(=O)C1=CC=NC=C1 O15893 [0,0,0,0,0,1|1,0,0]=2 31 B15R1.89 CCOC(=O)\C=C\C(=O)C1=CC=CC=C1 E9202 [0,0,0,0,0,1|0,0,1]=2 32 B15R1.809 CCOC(=O)\C=C(\N)OC1=CC=CC=C1 A15239 [0,0,0,0,0,1|1,0,1]=3 33 B12R1.27 CCC(=O)CCC1=CC=CC=C1 P7542 [2,0,0,0,0,0|0,0,1]=3 34 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 A12635 [2,0,0,0,0,0|1,0,1]=4 35 B12R1.107 O=C(C[N+](=O)[O-])C1=CC=CC=C1 B7666 [2,0,0,0,0,0|1,0,1]=4 36 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 H14844 [2,0,0,0,0,0|0,0,2]=4 37 B14R1.10 COC(=O)CC(=O)C1=CC=C(C)C=C1 O8686 [1,1,0,0,0,0|0,0,0]=2 38 B14R1.10 COC(=O)CC(N)C1=CC=C(Cl)C=C1 A15331 [1,1,0,0,0,0|1,0,1]=4 39 B14R1.11 COC(=O)CC(=O)C1=CC=CC(C)=C1 O8682 [1,1,0,0,0,0|0,0,0]=2 40 B14R1.587 COC(=O)CC(=O)C1=C(C)C=CC=C1 O8687 [1,1,0,0,0,0|0,0,0]=2 41 B14R1.19 CCCCCC(=O)C1=CC=C(O)C=C1 H8698 [1,1,0,0,0,0|1,0,1]=4 42 B14R1.32 CCOC(=O)\C=C\C1=CC=CC(F)=C1 F15738 [1,1,0,0,0,0|0,0,1]=3 43 B14R1.502 CCOC(=O)\C=C\C1=CC=C(F)C=C1 F8771 [1,1,0,0,0,0|0,0,1]=3 44 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 E8648 [1,1,0,0,0,0|0,0,1]=3 45 B14R1.502 CCOC(=O)\C=C\C1=CN=C(Cl)C=C1 C15606 [1,1,0,0,0,0|1,0,1]=4 46 B14R1.502 CCOC(=O)\N=C\C1=CC=C(Cl)C=C1 C9524 [1,1,0,0,0,0|1,0,0]=3 47 B14R1.502 CCOC(=O)\N=C\C1=CC=C(F)C=C1 F8804 [1,1,0,0,0,0|1,0,0]=3 48 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Cl)C=C1 E9575 [0,1,0,0,1,0|0,0,0]=2 49 B14R1.36 CCOC(=O)C(=O)C1=CC(Cl)=CC=C1 E9576 [0,1,0,0,1,0|0,0,0]=2 50 B14R1.36 CCOC(=O)C(=O)C1=CC=CC(F)=C1 E8841 [0,1,0,0,1,0|0,0,0]=2 51 B14R1.510 CCOC(=O)C(C)(C)C1=CC=CC=C1 E2961 [0,1,0,0,1,0|1,0,1]=4 52 B14R1.510 CCOC(=O)C(C)(O)C1=CC=CC=C1 H15790 [0,1,0,0,1,0|0,0,2]=4 53 B16R1.955 CCOC(=O)CC(=O)CC1=CC=C(C)C=C1 O15882 [0,1,0,0,0,1|0,0,0]=2 54 B16R1.956 CCOC(=O)CC(=O)CC1=CC=CC(Cl)=C1 C15634 [0,1,0,0,0,1|0,0,0]=2 55 B16R1.956 CCOC(=O)CC(=O)CC1=CC=CC(F)=C1 F15731 [0,1,0,0,0,1|0,0,0]=2 56 B16R1.685 CCOC(=O)\C(F)=C(/F)C1=CC=C(F)C=C1 E16225 [0,2,0,0,0,0|1,0,1]=4 57 B16R1.953 CCOC(=O)CS(=O)(=O)C1=CC=C(O)C=C1 H15742 [0,2,0,0,0,0|1,0,0]=3 58 B16R1.4218 CCOC(=O)CC(N)C1=CC=C(CC)C=C1 A14619 [0,2,0,0,0,0|1,0,1]=4 59 B16R1.24755 CCOC(=O)CC(=O)C1=CC=C(Cl)C=C1Cl E4404 [0,2,0,0,0,0|0,0,0]=2 60 B16R1.24755 CCOC(=O)CC(N)C1=C(F)C=C(F)C=C1 A14623 [0,2,0,0,0,0|1,0,1]=4 61 B16R1.24755 CCOC(=O)CC(N)C1=CC=C(C)C=C1C A14620 [0,2,0,0,0,0|1,0,1]=4 62 B16R1.19 CCOC(=O)CC(N)C1=C(Cl)C(Cl)=CC=C1 A14621 [0,2,0,0,0,0|1,0,1]=4 63 B16R1.4216 CCOC(=O)C[C@H](N)C1=CC(Cl)=CC(Cl)=C1 A14666 [0,2,0,0,0,0|1,0,1]=4 64 B16R1.4229 CCOC(=O)CC(N)C1=CC=CC=C1OC A14549 [0,2,0,0,0,0|1,0,1]=4 65 B16R1.104268 CCOC(=O)CC(=O)C1=C(Cl)C=CC=C1Cl E4403 [0,2,0,0,0,0|0,0,0]=2 66 B16R2.734 CCOC(=O)CC1=NC2=C(C=CC=C2)N1 B14850 [0,0,0,1,0,1|1,0,0]=3 67 B16R2.29842 CCOC(=O)C1=C(C)NC2=CC=CC=C21 E13435 [0,0,0,1,0,1|1,0,1]=4 68 B16R2.757 CCOC(=O)C1=C(N)C2=CC=CC=C2N1 E17045 [0,1,0,1,0,0|1,0,1]=4 69 B12R1.15 COC(=O)CC(=O)C1=CC=CS1 O8368 [1,0,0,0,1,0|1,0,0]=3 70 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 M7621 [1,0,0,0,1,0|0,0,0]=2 71 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 M8386 [1,0,0,0,1,0|1,0,1]=4 72 B12R1.34 [C@@H](N)(C(=O)OC)C1=CC=CC=C1 P2153 [1,0,0,0,1,0|1,0,1]=4 73 B12R1.32 CCCC(=O)OC1=CC=CC=C1 P7639 [1,0,0,0,1,0|2,0,0]=4 74 B12R1.32 CNCC(=O)CC1=CC=CC=C1 M5866 [1,0,0,0,1,0|2,0,0]=4 75 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 O8685 [1,0,0,0,0,1|0,0,0]=2 76 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 B17740 [1,0,0,0,0,1|0,0,1]=3 77 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 B17741 [1,0,0,0,0,1|0,0,1]=3 78 B14R1.100 CCOC(=O)CNC(=O)C1=CC=CS1 E9600 [0,0,0,0,1,1|1,0,0]=3