0 B15R2.1342 CCNC(=O)C1CC1c2ccccc2 WXVL_AK00476SB2474 [1,0,0,0,0,0|2,0,0]=3 1 B15R2.1342 CCNC(=O)C1CC1c2ccccc2 WXVL_AK00476SB2474 [1,0,0,0,0,0|2,0,0]=3 2 B15R2.1342 CCNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00476SB3176 [1,0,0,0,0,0|2,0,0]=3 3 B15R2.1342 CCNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00476SB3176 [1,0,0,0,0,0|2,0,0]=3 4 B15R1.89 CCCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0073 [0,0,1,0,0,0|3,0,0]=4 5 B15R1.89 CCCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0073 [0,0,1,0,0,0|3,0,0]=4 6 B15R1.89 CCCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0073 [0,0,1,0,0,0|3,0,0]=4 7 B15R1.89 CCCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0073 [0,0,1,0,0,0|3,0,0]=4 8 B15R1.807 CCCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0073 [0,0,1,0,0,0|3,0,0]=4 9 B15R1.807 CCCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0073 [0,0,1,0,0,0|3,0,0]=4 10 B15R1.807 CCNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00476SB0461 [0,0,1,0,0,0|2,0,0]=3 11 B15R1.807 CCNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00476SB0461 [0,0,1,0,0,0|2,0,0]=3 12 B14R1.163 CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0064 [1,0,1,0,0,0|2,0,0]=4 13 B14R1.163 CCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0064 [1,0,1,0,0,0|2,0,0]=4 14 B14R1.163 CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0064 [1,0,1,0,0,0|2,0,0]=4 15 B14R1.163 CCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0064 [1,0,1,0,0,0|2,0,0]=4 16 B14R1.520 CCNC(=O)CCCc1ccccc1 WXVL_AK00476SB0121 [1,0,1,0,0,0|2,0,0]=4 17 B14R1.520 CCNC(=O)CCCc1ccccc1 WXVL_AK00476SB0121 [1,0,1,0,0,0|2,0,0]=4 18 B14R1.520 CCNC(=O)COCc1ccccc1 WXVL_AK00476SB0185 [1,0,1,0,0,0|1,0,0]=3 19 B14R1.520 CCNC(=O)COCc1ccccc1 WXVL_AK00476SB0185 [1,0,1,0,0,0|1,0,0]=3 20 B14R1.29 CCNC(=O)CC(C)c1ccccc1 WXVL_AK00476SB0419 [1,0,1,0,0,0|1,0,0]=3 21 B14R1.29 CCNC(=O)CC(C)c1ccccc1 WXVL_AK00476SB0419 [1,0,1,0,0,0|1,0,0]=3 22 B14R1.29 CCNC(=O)CC(O)c1ccccc1 WXVL_AK00476SB2325 [1,0,1,0,0,0|1,0,0]=3 23 B14R1.29 CCNC(=O)CC(O)c1ccccc1 WXVL_AK00476SB2325 [1,0,1,0,0,0|1,0,0]=3 24 B14R1.29 CCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00476YV0029 [1,0,1,0,0,0|2,0,0]=4 25 B14R1.29 CCNC(=O)N[C@@H](C)c1ccccc1 WXVL_AK00476YV0029 [1,0,1,0,0,0|2,0,0]=4 26 B14R1.29 CCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00476YV0061 [1,0,1,0,0,0|2,0,0]=4 27 B14R1.29 CCNC(=O)N[C@H](C)c1ccccc1 WXVL_AK00476YV0061 [1,0,1,0,0,0|2,0,0]=4 28 B14R1.60 CCNC(=O)C(C)Cc1ccccc1 WXVL_AK00476SB3205 [1,0,1,0,0,0|2,0,0]=4 29 B14R1.60 CCNC(=O)C(C)Cc1ccccc1 WXVL_AK00476SB3205 [1,0,1,0,0,0|2,0,0]=4 30 B14R1.741 CCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0064 [1,0,1,0,0,0|2,0,0]=4 31 B14R1.741 CCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0064 [1,0,1,0,0,0|2,0,0]=4 32 B14R1.741 CNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00442SB0461 [1,0,1,0,0,0|2,0,0]=4 33 B14R1.741 CNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00442SB0461 [1,0,1,0,0,0|2,0,0]=4 34 B14R2.958 CNC(=O)C1CC1c2ccccc2 WXVL_AK00442SB2474 [2,0,0,0,0,0|2,0,0]=4 35 B14R2.958 CNC(=O)C1CC1c2ccccc2 WXVL_AK00442SB2474 [2,0,0,0,0,0|2,0,0]=4 36 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00442SB3176 [2,0,0,0,0,0|2,0,0]=4 37 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00442SB3176 [2,0,0,0,0,0|2,0,0]=4 38 B16R1.700 CCOCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0091 [0,1,1,0,0,0|2,0,0]=4 39 B16R1.700 CCOCC(=O)NCC(C)c1ccccc1 WXVL_AK00546SB0091 [0,1,1,0,0,0|2,0,0]=4 40 B16R1.700 CCOCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0091 [0,1,1,0,0,0|2,0,0]=4 41 B16R1.700 CCOCC(=O)NC[C@@H](C)c1ccccc1 WXVL_AK00506SB0091 [0,1,1,0,0,0|2,0,0]=4 42 B16R1.1495 CC(C)(CC(=O)NCCF)c1ccccc1 WXVL_AK00466SB0461 [0,1,1,0,0,0|2,0,0]=4 43 B16R1.1495 CC(C)(CC(=O)NCCF)c1ccccc1 WXVL_AK00466SB0461 [0,1,1,0,0,0|2,0,0]=4 44 B16R1.1495 CCCNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00504SB0461 [0,1,1,0,0,0|2,0,0]=4 45 B16R1.1495 CCCNC(=O)CC(C)(C)c1ccccc1 WXVL_AK00504SB0461 [0,1,1,0,0,0|2,0,0]=4 46 B16R1.1495 CCOCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0091 [0,1,1,0,0,0|2,0,0]=4 47 B16R1.1495 CCOCC(=O)NC(C)(C)c1ccccc1 WXVL_AK0415SB0091 [0,1,1,0,0,0|2,0,0]=4 48 B16R1.6939 CC(C)NC(=O)CC(C)(C)c1ccccc1 WXVL_AK0030SB0461 [0,1,1,0,0,0|2,0,0]=4 49 B16R1.6939 CC(C)NC(=O)CC(C)(C)c1ccccc1 WXVL_AK0030SB0461 [0,1,1,0,0,0|2,0,0]=4 50 B16R2.723 CCNC(=O)C1CC1c2ccc(cc2)Cl WXVL_AK00476SB0852 [1,1,0,0,0,0|2,0,0]=4 51 B16R2.723 CCNC(=O)C1CC1c2ccc(cc2)Cl WXVL_AK00476SB0852 [1,1,0,0,0,0|2,0,0]=4 52 B16R2.723 CCNC(=O)C1CC1c2ccc(cc2)F WXVL_AK00476SB3469 [1,1,0,0,0,0|2,0,0]=4 53 B16R2.723 CCNC(=O)C1CC1c2ccc(cc2)F WXVL_AK00476SB3469 [1,1,0,0,0,0|2,0,0]=4 54 B16R2.723 CCNC(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br WXVL_AK00476SB6328 [1,1,0,0,0,0|2,0,0]=4 55 B16R2.723 CCNC(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br WXVL_AK00476SB6328 [1,1,0,0,0,0|2,0,0]=4 56 B16R2.2114 CCCNC(=O)C1CC1c2ccccc2 WXVL_AK00504SB2474 [1,1,0,0,0,0|2,0,0]=4 57 B16R2.2114 CCCNC(=O)C1CC1c2ccccc2 WXVL_AK00504SB2474 [1,1,0,0,0,0|2,0,0]=4 58 B16R2.2114 CCCNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00504SB3176 [1,1,0,0,0,0|2,0,0]=4 59 B16R2.2114 CCCNC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00504SB3176 [1,1,0,0,0,0|2,0,0]=4 60 B16R2.2114 O=C(NCCF)C1CC1c2ccccc2 WXVL_AK00466SB2474 [1,1,0,0,0,0|2,0,0]=4 61 B16R2.2114 O=C(NCCF)C1CC1c2ccccc2 WXVL_AK00466SB2474 [1,1,0,0,0,0|2,0,0]=4 62 B16R2.2114 O=C(NCCF)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00466SB3176 [1,1,0,0,0,0|2,0,0]=4 63 B16R2.2114 O=C(NCCF)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK00466SB3176 [1,1,0,0,0,0|2,0,0]=4 64 B16R2.11580 CC(C)NC(=O)C1CC1c2ccccc2 WXVL_AK0030SB2474 [1,1,0,0,0,0|2,0,0]=4 65 B16R2.11580 CC(C)NC(=O)C1CC1c2ccccc2 WXVL_AK0030SB2474 [1,1,0,0,0,0|2,0,0]=4 66 B16R2.11580 CC(C)NC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK0030SB3176 [1,1,0,0,0,0|2,0,0]=4 67 B16R2.11580 CC(C)NC(=O)[C@@H]1C[C@H]1c2ccccc2 WXVL_AK0030SB3176 [1,1,0,0,0,0|2,0,0]=4 68 B18R3.1057117 CCNC(=O)C12CC(C1)(C2)c3ccccc3 WXVL_AK00476SB0775 [0,0,0,1,0,1|2,0,0]=4 69 B18R3.1057117 CCNC(=O)C12CC(C1)(C2)c3ccccc3 WXVL_AK00476SB0775 [0,0,0,1,0,1|2,0,0]=4 70 B14R1.510 CCNC(=O)C(C)(C)c1ccccc1 WXVL_AK00476SB0135 [0,0,1,0,1,0|2,0,0]=4 71 B14R1.510 CCNC(=O)C(C)(C)c1ccccc1 WXVL_AK00476SB0135 [0,0,1,0,1,0|2,0,0]=4