0 B14R1.818 CC(=CC(=O)NCc1ccccc1)C WXVL_AK00502SB0342 [0,0,0,0,0,0|2,0,2]=4 1 B14R1.818 CC(=CC(=O)NCc1ccccc1)C WXVL_AK00502SB0342 [0,0,0,0,0,0|2,0,2]=4 2 B14R1.818 CC(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0063 [0,0,0,0,0,0|2,0,1]=3 3 B14R1.818 CC(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0063 [0,0,0,0,0,0|2,0,1]=3 4 B14R1.818 CC(C)CC(=O)NCc1ccccn1 WXVL_AK0018SB0063 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.818 CC(C)CC(=O)NCc1ccccn1 WXVL_AK0018SB0063 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.818 CC(C)CC(=O)NCc1cccnc1 WXVL_AK0020SB0063 [0,0,0,0,0,0|3,0,1]=4 7 B14R1.818 CC(C)CC(=O)NCc1cccnc1 WXVL_AK0020SB0063 [0,0,0,0,0,0|3,0,1]=4 8 B14R1.818 CC(C)CC(=O)NCc1ccncc1 WXVL_AK0021SB0063 [0,0,0,0,0,0|3,0,1]=4 9 B14R1.818 CC(C)CC(=O)NCc1ccncc1 WXVL_AK0021SB0063 [0,0,0,0,0,0|3,0,1]=4 10 B14R1.818 CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK0030SB0115 [0,0,0,0,0,0|1,0,0]=1 11 B14R1.818 CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK0030SB0115 [0,0,0,0,0,0|1,0,0]=1 12 B14R1.818 CC(C)NC(=O)/C=C/c1cccnc1 WXVL_AK0030SA0193 [0,0,0,0,0,0|2,0,0]=2 13 B14R1.818 CC(C)NC(=O)/C=C/c1cccnc1 WXVL_AK0030SA0193 [0,0,0,0,0,0|2,0,0]=2 14 B14R1.818 CC(C)NC(=O)/C=C/c1cnccn1 WXVL_AK0030SA2885 [0,0,0,0,0,0|3,0,0]=3 15 B14R1.818 CC(C)NC(=O)/C=C/c1cnccn1 WXVL_AK0030SA2885 [0,0,0,0,0,0|3,0,0]=3 16 B14R1.818 CC(C)NC(=O)C#Cc1ccccc1 WXVL_AK0030SB0114 [0,0,0,0,0,0|1,0,2]=3 17 B14R1.818 CC(C)NC(=O)C#Cc1ccccc1 WXVL_AK0030SB0114 [0,0,0,0,0,0|1,0,2]=3 18 B14R1.818 CC(C)NC(=O)CCc1ccccc1 WXVL_AK0030SB0067 [0,0,0,0,0,0|1,0,2]=3 19 B14R1.818 CC(C)NC(=O)CCc1ccccc1 WXVL_AK0030SB0067 [0,0,0,0,0,0|1,0,2]=3 20 B14R1.818 CC(C)NC(=O)CCc1ccccn1 WXVL_AK0030SA0316 [0,0,0,0,0,0|2,0,2]=4 21 B14R1.818 CC(C)NC(=O)CCc1ccccn1 WXVL_AK0030SA0316 [0,0,0,0,0,0|2,0,2]=4 22 B14R1.818 CC(C)NC(=O)CCc1cccnc1 WXVL_AK0030SA0031 [0,0,0,0,0,0|2,0,2]=4 23 B14R1.818 CC(C)NC(=O)CCc1cccnc1 WXVL_AK0030SA0031 [0,0,0,0,0,0|2,0,2]=4 24 B14R1.818 CC(C)NC(=O)COc1ccccc1 WXVL_AK0030SB0086 [0,0,0,0,0,0|2,0,1]=3 25 B14R1.818 CC(C)NC(=O)COc1ccccc1 WXVL_AK0030SB0086 [0,0,0,0,0,0|2,0,1]=3 26 B14R1.818 CC(C)NC(=O)COc1cccnc1 WXVL_AK0030SA0051 [0,0,0,0,0,0|3,0,1]=4 27 B14R1.818 CC(C)NC(=O)COc1cccnc1 WXVL_AK0030SA0051 [0,0,0,0,0,0|3,0,1]=4 28 B14R1.818 CC(C)NC(=O)CSc1ccccc1 WXVL_AK0030SB0113 [0,0,0,0,0,0|2,0,1]=3 29 B14R1.818 CC(C)NC(=O)CSc1ccccc1 WXVL_AK0030SB0113 [0,0,0,0,0,0|2,0,1]=3 30 B14R1.818 CC(C)NC(=O)CSc1ccncc1 WXVL_AK0030SA0055 [0,0,0,0,0,0|3,0,1]=4 31 B14R1.818 CC(C)NC(=O)CSc1ccncc1 WXVL_AK0030SA0055 [0,0,0,0,0,0|3,0,1]=4 32 B14R1.818 CC(O)CC(=O)NCc1ccccc1 WXVL_AK00502SB3643 [0,0,0,0,0,0|3,0,1]=4 33 B14R1.818 CC(O)CC(=O)NCc1ccccc1 WXVL_AK00502SB3643 [0,0,0,0,0,0|3,0,1]=4 34 B14R1.818 CN(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0085 [0,0,0,0,0,0|3,0,1]=4 35 B14R1.818 CN(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0085 [0,0,0,0,0,0|3,0,1]=4 36 B13R1.42 CCCC(=O)NCc1ccccc1 WXVL_AK00502SB0073 [1,0,0,0,0,0|2,0,1]=4 37 B13R1.42 CCCC(=O)NCc1ccccc1 WXVL_AK00502SB0073 [1,0,0,0,0,0|2,0,1]=4 38 B13R1.42 CCNC(=O)/C=C/c1ccccc1 WXVL_AK00476SB0115 [1,0,0,0,0,0|1,0,0]=2 39 B13R1.42 CCNC(=O)/C=C/c1ccccc1 WXVL_AK00476SB0115 [1,0,0,0,0,0|1,0,0]=2 40 B13R1.42 CCNC(=O)/C=C/c1cccnc1 WXVL_AK00476SA0193 [1,0,0,0,0,0|2,0,0]=3 41 B13R1.42 CCNC(=O)/C=C/c1cccnc1 WXVL_AK00476SA0193 [1,0,0,0,0,0|2,0,0]=3 42 B13R1.42 CCNC(=O)/C=C/c1cnccn1 WXVL_AK00476SA2885 [1,0,0,0,0,0|3,0,0]=4 43 B13R1.42 CCNC(=O)/C=C/c1cnccn1 WXVL_AK00476SA2885 [1,0,0,0,0,0|3,0,0]=4 44 B13R1.42 CCNC(=O)C#Cc1ccccc1 WXVL_AK00476SB0114 [1,0,0,0,0,0|1,0,2]=4 45 B13R1.42 CCNC(=O)C#Cc1ccccc1 WXVL_AK00476SB0114 [1,0,0,0,0,0|1,0,2]=4 46 B13R1.42 CCNC(=O)CCc1ccccc1 WXVL_AK00476SB0067 [1,0,0,0,0,0|1,0,2]=4 47 B13R1.42 CCNC(=O)CCc1ccccc1 WXVL_AK00476SB0067 [1,0,0,0,0,0|1,0,2]=4 48 B13R1.42 CCNC(=O)COc1ccccc1 WXVL_AK00476SB0086 [1,0,0,0,0,0|2,0,1]=4 49 B13R1.42 CCNC(=O)COc1ccccc1 WXVL_AK00476SB0086 [1,0,0,0,0,0|2,0,1]=4 50 B13R1.42 CCNC(=O)CSc1ccccc1 WXVL_AK00476SB0113 [1,0,0,0,0,0|2,0,1]=4 51 B13R1.42 CCNC(=O)CSc1ccccc1 WXVL_AK00476SB0113 [1,0,0,0,0,0|2,0,1]=4 52 B15R1.130 CC(C)CC(=O)NCc1ccccc1Br WXVL_AK1632SB0063 [0,1,0,0,0,0|2,0,1]=4 53 B15R1.130 CC(C)CC(=O)NCc1ccccc1Br WXVL_AK1632SB0063 [0,1,0,0,0,0|2,0,1]=4 54 B15R1.130 CC(C)CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0063 [0,1,0,0,0,0|2,0,1]=4 55 B15R1.130 CC(C)CC(=O)NCc1ccccc1Cl WXVL_AK0038SB0063 [0,1,0,0,0,0|2,0,1]=4 56 B15R1.130 CC(C)CC(=O)NCc1ccccc1F WXVL_AK0037SB0063 [0,1,0,0,0,0|2,0,1]=4 57 B15R1.130 CC(C)CC(=O)NCc1ccccc1F WXVL_AK0037SB0063 [0,1,0,0,0,0|2,0,1]=4 58 B15R1.130 CC(C)CC(=O)NCc1ccccc1I WXVL_AK3923SB0063 [0,1,0,0,0,0|2,0,1]=4 59 B15R1.130 CC(C)CC(=O)NCc1ccccc1I WXVL_AK3923SB0063 [0,1,0,0,0,0|2,0,1]=4 60 B15R1.130 CC(C)CC(=O)NCc1ccccc1O WXVL_AK0963SB0063 [0,1,0,0,0,0|2,0,1]=4 61 B15R1.130 CC(C)CC(=O)NCc1ccccc1O WXVL_AK0963SB0063 [0,1,0,0,0,0|2,0,1]=4 62 B15R1.130 CC(C)NC(=O)C=Cc1ccccc1Br WXVL_AK0030SB3065 [0,1,0,0,0,0|1,0,0]=2 63 B15R1.130 CC(C)NC(=O)C=Cc1ccccc1Br WXVL_AK0030SB3065 [0,1,0,0,0,0|1,0,0]=2 64 B15R1.130 CC(C)NC(=O)CCc1ccccc1Br WXVL_AK0030SB1278 [0,1,0,0,0,0|1,0,2]=4 65 B15R1.130 CC(C)NC(=O)CCc1ccccc1Br WXVL_AK0030SB1278 [0,1,0,0,0,0|1,0,2]=4 66 B15R1.130 CC(C)NC(=O)CCc1ccccc1Cl WXVL_AK0030SB0140 [0,1,0,0,0,0|1,0,2]=4 67 B15R1.130 CC(C)NC(=O)CCc1ccccc1Cl WXVL_AK0030SB0140 [0,1,0,0,0,0|1,0,2]=4 68 B15R1.130 CC(C)NC(=O)CCc1ccccc1F WXVL_AK0030SB0008 [0,1,0,0,0,0|1,0,2]=4 69 B15R1.130 CC(C)NC(=O)CCc1ccccc1F WXVL_AK0030SB0008 [0,1,0,0,0,0|1,0,2]=4 70 B15R1.130 CC(C)NC(=O)COc1ccccc1F WXVL_AK0030SB0441 [0,1,0,0,0,0|2,0,1]=4 71 B15R1.130 CC(C)NC(=O)COc1ccccc1F WXVL_AK0030SB0441 [0,1,0,0,0,0|2,0,1]=4 72 B15R1.130 Cc1ccccc1CCC(=O)NC(C)C WXVL_AK0030SB0422 [0,1,0,0,0,0|1,0,2]=4 73 B15R1.130 Cc1ccccc1CCC(=O)NC(C)C WXVL_AK0030SB0422 [0,1,0,0,0,0|1,0,2]=4 74 B15R1.130 Cc1ccccc1CNC(=O)CC(C)C WXVL_AK0040SB0063 [0,1,0,0,0,0|2,0,1]=4 75 B15R1.130 Cc1ccccc1CNC(=O)CC(C)C WXVL_AK0040SB0063 [0,1,0,0,0,0|2,0,1]=4 76 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C WXVL_AK0030SB0136 [0,1,0,0,0,0|2,0,1]=4 77 B15R1.130 Cc1ccccc1OCC(=O)NC(C)C WXVL_AK0030SB0136 [0,1,0,0,0,0|2,0,1]=4 78 B15R1.496 C/C(=C\c1cccnc1)/C(=O)NC(C)C WXVL_AK0030SA1933 [0,1,0,0,0,0|2,0,0]=3 79 B15R1.496 C/C(=C\c1cccnc1)/C(=O)NC(C)C WXVL_AK0030SA1933 [0,1,0,0,0,0|2,0,0]=3 80 B15R1.496 C=C(Cc1ccccc1)C(=O)NC(C)C WXVL_AK0030SB0413 [0,1,0,0,0,0|1,0,1]=3 81 B15R1.496 C=C(Cc1ccccc1)C(=O)NC(C)C WXVL_AK0030SB0413 [0,1,0,0,0,0|1,0,1]=3 82 B15R1.496 CC(C)CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0063 [0,1,0,0,0,0|2,0,1]=4 83 B15R1.496 CC(C)CC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0063 [0,1,0,0,0,0|2,0,1]=4 84 B15R1.496 CC(C)NC(=O)C(C)Cc1ccccc1 WXVL_AK0030SB3205 [0,1,0,0,0,0|1,0,2]=4 85 B15R1.496 CC(C)NC(=O)C(C)Cc1ccccc1 WXVL_AK0030SB3205 [0,1,0,0,0,0|1,0,2]=4 86 B15R1.496 CC(C)NC(=O)C(C)Oc1ccccc1 WXVL_AK0030SB0426 [0,1,0,0,0,0|2,0,1]=4 87 B15R1.496 CC(C)NC(=O)C(C)Oc1ccccc1 WXVL_AK0030SB0426 [0,1,0,0,0,0|2,0,1]=4 88 B15R1.496 CC(C)NC(=O)C(C)Sc1ccccc1 WXVL_AK0030SB9992 [0,1,0,0,0,0|2,0,1]=4 89 B15R1.496 CC(C)NC(=O)C(C)Sc1ccccc1 WXVL_AK0030SB9992 [0,1,0,0,0,0|2,0,1]=4 90 B15R1.496 CC(C)NC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK0030SB5803 [0,1,0,0,0,0|2,0,1]=4 91 B15R1.496 CC(C)NC(=O)[C@@H](C)Oc1ccccc1 WXVL_AK0030SB5803 [0,1,0,0,0,0|2,0,1]=4 92 B15R1.741 C#C[C@@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00735SB0115 [0,1,0,0,0,0|1,0,1]=3 93 B15R1.741 C#C[C@@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00735SB0115 [0,1,0,0,0,0|1,0,1]=3 94 B15R1.741 C#C[C@@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00735SA0193 [0,1,0,0,0,0|2,0,1]=4 95 B15R1.741 C#C[C@@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00735SA0193 [0,1,0,0,0,0|2,0,1]=4 96 B15R1.741 C=CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK00769SB0115 [0,1,0,0,0,0|1,0,1]=3 97 B15R1.741 C=CC(C)NC(=O)/C=C/c1ccccc1 WXVL_AK00769SB0115 [0,1,0,0,0,0|1,0,1]=3 98 B15R1.741 C=CC(C)NC(=O)/C=C/c1cccnc1 WXVL_AK00769SA0193 [0,1,0,0,0,0|2,0,1]=4 99 B15R1.741 C=CC(C)NC(=O)/C=C/c1cccnc1 WXVL_AK00769SA0193 [0,1,0,0,0,0|2,0,1]=4 100 B15R1.741 CC(C#N)NC(=O)/C=C/c1ccccc1 WXVL_AK00810SB0115 [0,1,0,0,0,0|1,0,1]=3 101 B15R1.741 CC(C#N)NC(=O)/C=C/c1ccccc1 WXVL_AK00810SB0115 [0,1,0,0,0,0|1,0,1]=3 102 B15R1.741 CC(C#N)NC(=O)/C=C/c1cccnc1 WXVL_AK00810SA0193 [0,1,0,0,0,0|2,0,1]=4 103 B15R1.741 CC(C#N)NC(=O)/C=C/c1cccnc1 WXVL_AK00810SA0193 [0,1,0,0,0,0|2,0,1]=4 104 B15R1.741 CCC(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0353 [0,1,0,0,0,0|2,0,1]=4 105 B15R1.741 CCC(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0353 [0,1,0,0,0,0|2,0,1]=4 106 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccccc1 WXVL_AK00502SB8650 [0,1,0,0,0,0|2,0,1]=4 107 B15R1.741 CC[C@@H](C)CC(=O)NCc1ccccc1 WXVL_AK00502SB8650 [0,1,0,0,0,0|2,0,1]=4 108 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00678SB0115 [0,1,0,0,0,0|1,0,0]=2 109 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00678SB0115 [0,1,0,0,0,0|1,0,0]=2 110 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00678SA0193 [0,1,0,0,0,0|2,0,0]=3 111 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00678SA0193 [0,1,0,0,0,0|2,0,0]=3 112 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1cnccn1 WXVL_AK00678SA2885 [0,1,0,0,0,0|3,0,0]=4 113 B15R1.741 CC[C@H](C)NC(=O)/C=C/c1cnccn1 WXVL_AK00678SA2885 [0,1,0,0,0,0|3,0,0]=4 114 B15R1.741 CC[C@H](C)NC(=O)C#Cc1ccccc1 WXVL_AK00678SB0114 [0,1,0,0,0,0|1,0,2]=4 115 B15R1.741 CC[C@H](C)NC(=O)C#Cc1ccccc1 WXVL_AK00678SB0114 [0,1,0,0,0,0|1,0,2]=4 116 B15R1.741 CC[C@H](C)NC(=O)CCc1ccccc1 WXVL_AK00678SB0067 [0,1,0,0,0,0|1,0,2]=4 117 B15R1.741 CC[C@H](C)NC(=O)CCc1ccccc1 WXVL_AK00678SB0067 [0,1,0,0,0,0|1,0,2]=4 118 B15R1.741 CC[C@H](C)NC(=O)COc1ccccc1 WXVL_AK00678SB0086 [0,1,0,0,0,0|2,0,1]=4 119 B15R1.741 CC[C@H](C)NC(=O)COc1ccccc1 WXVL_AK00678SB0086 [0,1,0,0,0,0|2,0,1]=4 120 B15R1.741 CC[C@H](C)NC(=O)CSc1ccccc1 WXVL_AK00678SB0113 [0,1,0,0,0,0|2,0,1]=4 121 B15R1.741 CC[C@H](C)NC(=O)CSc1ccccc1 WXVL_AK00678SB0113 [0,1,0,0,0,0|2,0,1]=4 122 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1ccccc1 WXVL_AK00558SB0115 [0,1,0,0,0,0|1,0,0]=2 123 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1ccccc1 WXVL_AK00558SB0115 [0,1,0,0,0,0|1,0,0]=2 124 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1cccnc1 WXVL_AK00558SA0193 [0,1,0,0,0,0|2,0,0]=3 125 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1cccnc1 WXVL_AK00558SA0193 [0,1,0,0,0,0|2,0,0]=3 126 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1cnccn1 WXVL_AK00558SA2885 [0,1,0,0,0,0|3,0,0]=4 127 B15R1.741 C[C@@H](CF)NC(=O)/C=C/c1cnccn1 WXVL_AK00558SA2885 [0,1,0,0,0,0|3,0,0]=4 128 B15R1.741 C[C@@H](CF)NC(=O)C#Cc1ccccc1 WXVL_AK00558SB0114 [0,1,0,0,0,0|1,0,2]=4 129 B15R1.741 C[C@@H](CF)NC(=O)C#Cc1ccccc1 WXVL_AK00558SB0114 [0,1,0,0,0,0|1,0,2]=4 130 B15R1.741 C[C@@H](CF)NC(=O)CCc1ccccc1 WXVL_AK00558SB0067 [0,1,0,0,0,0|1,0,2]=4 131 B15R1.741 C[C@@H](CF)NC(=O)CCc1ccccc1 WXVL_AK00558SB0067 [0,1,0,0,0,0|1,0,2]=4 132 B15R1.741 C[C@@H](CF)NC(=O)COc1ccccc1 WXVL_AK00558SB0086 [0,1,0,0,0,0|2,0,1]=4 133 B15R1.741 C[C@@H](CF)NC(=O)COc1ccccc1 WXVL_AK00558SB0086 [0,1,0,0,0,0|2,0,1]=4 134 B15R1.741 C[C@@H](CF)NC(=O)CSc1ccccc1 WXVL_AK00558SB0113 [0,1,0,0,0,0|2,0,1]=4 135 B15R1.741 C[C@@H](CF)NC(=O)CSc1ccccc1 WXVL_AK00558SB0113 [0,1,0,0,0,0|2,0,1]=4 136 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0109SB0115 [0,1,0,0,0,0|1,0,0]=2 137 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0109SB0115 [0,1,0,0,0,0|1,0,0]=2 138 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1cccnc1 WXVL_AK0109SA0193 [0,1,0,0,0,0|2,0,0]=3 139 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1cccnc1 WXVL_AK0109SA0193 [0,1,0,0,0,0|2,0,0]=3 140 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1cnccn1 WXVL_AK0109SA2885 [0,1,0,0,0,0|3,0,0]=4 141 B15R1.741 C[C@@H](CO)NC(=O)/C=C/c1cnccn1 WXVL_AK0109SA2885 [0,1,0,0,0,0|3,0,0]=4 142 B15R1.741 C[C@@H](CO)NC(=O)C#Cc1ccccc1 WXVL_AK0109SB0114 [0,1,0,0,0,0|1,0,2]=4 143 B15R1.741 C[C@@H](CO)NC(=O)C#Cc1ccccc1 WXVL_AK0109SB0114 [0,1,0,0,0,0|1,0,2]=4 144 B15R1.741 C[C@@H](CO)NC(=O)CCc1ccccc1 WXVL_AK0109SB0067 [0,1,0,0,0,0|1,0,2]=4 145 B15R1.741 C[C@@H](CO)NC(=O)CCc1ccccc1 WXVL_AK0109SB0067 [0,1,0,0,0,0|1,0,2]=4 146 B15R1.741 C[C@@H](CO)NC(=O)COc1ccccc1 WXVL_AK0109SB0086 [0,1,0,0,0,0|2,0,1]=4 147 B15R1.741 C[C@@H](CO)NC(=O)COc1ccccc1 WXVL_AK0109SB0086 [0,1,0,0,0,0|2,0,1]=4 148 B15R1.741 C[C@@H](CO)NC(=O)CSc1ccccc1 WXVL_AK0109SB0113 [0,1,0,0,0,0|2,0,1]=4 149 B15R1.741 C[C@@H](CO)NC(=O)CSc1ccccc1 WXVL_AK0109SB0113 [0,1,0,0,0,0|2,0,1]=4 150 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0063 [0,1,0,0,0,0|2,0,1]=4 151 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0063 [0,1,0,0,0,0|2,0,1]=4 152 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0063 [0,1,0,0,0,0|2,0,1]=4 153 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0063 [0,1,0,0,0,0|2,0,1]=4 154 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0063 [0,1,0,0,0,0|2,0,1]=4 155 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0063 [0,1,0,0,0,0|2,0,1]=4 156 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0063 [0,1,0,0,0,0|2,0,1]=4 157 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0063 [0,1,0,0,0,0|2,0,1]=4 158 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0063 [0,1,0,0,0,0|2,0,1]=4 159 B15R1.870 CC(C)CC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0063 [0,1,0,0,0,0|2,0,1]=4 160 B15R1.870 CC(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0030SB0418 [0,1,0,0,0,0|1,0,0]=2 161 B15R1.870 CC(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0030SB0418 [0,1,0,0,0,0|1,0,0]=2 162 B15R1.870 CC(C)NC(=O)C#Cc1ccc(cc1)Cl WXVL_AK0030SB3517 [0,1,0,0,0,0|1,0,2]=4 163 B15R1.870 CC(C)NC(=O)C#Cc1ccc(cc1)Cl WXVL_AK0030SB3517 [0,1,0,0,0,0|1,0,2]=4 164 B15R1.870 CC(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0030SB1122 [0,1,0,0,0,0|1,0,0]=2 165 B15R1.870 CC(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0030SB1122 [0,1,0,0,0,0|1,0,0]=2 166 B15R1.870 CC(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0030SB0119 [0,1,0,0,0,0|1,0,0]=2 167 B15R1.870 CC(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0030SB0119 [0,1,0,0,0,0|1,0,0]=2 168 B15R1.870 CC(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK0030SB1186 [0,1,0,0,0,0|1,0,0]=2 169 B15R1.870 CC(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK0030SB1186 [0,1,0,0,0,0|1,0,0]=2 170 B15R1.870 CC(C)NC(=O)CCc1ccc(cc1)Br WXVL_AK0030SB1166 [0,1,0,0,0,0|1,0,2]=4 171 B15R1.870 CC(C)NC(=O)CCc1ccc(cc1)Br WXVL_AK0030SB1166 [0,1,0,0,0,0|1,0,2]=4 172 B15R1.870 CC(C)NC(=O)CCc1ccc(cc1)F WXVL_AK0030SB1123 [0,1,0,0,0,0|1,0,2]=4 173 B15R1.870 CC(C)NC(=O)CCc1ccc(cc1)F WXVL_AK0030SB1123 [0,1,0,0,0,0|1,0,2]=4 174 B15R1.870 CC(C)NC(=O)CCc1ccc(cc1)O WXVL_AK0030SB2324 [0,1,0,0,0,0|1,0,2]=4 175 B15R1.870 CC(C)NC(=O)CCc1ccc(cc1)O WXVL_AK0030SB2324 [0,1,0,0,0,0|1,0,2]=4 176 B15R1.870 CC(C)NC(=O)COc1ccc(cc1)F WXVL_AK0030SB0088 [0,1,0,0,0,0|2,0,1]=4 177 B15R1.870 CC(C)NC(=O)COc1ccc(cc1)F WXVL_AK0030SB0088 [0,1,0,0,0,0|2,0,1]=4 178 B15R1.870 CC(C)NC(=O)COc1ccc(cc1)O WXVL_AK0030SB3388 [0,1,0,0,0,0|2,0,1]=4 179 B15R1.870 CC(C)NC(=O)COc1ccc(cc1)O WXVL_AK0030SB3388 [0,1,0,0,0,0|2,0,1]=4 180 B15R1.870 Cc1ccc(cc1)C=CC(=O)NC(C)C WXVL_AK0030SB0060 [0,1,0,0,0,0|1,0,0]=2 181 B15R1.870 Cc1ccc(cc1)C=CC(=O)NC(C)C WXVL_AK0030SB0060 [0,1,0,0,0,0|1,0,0]=2 182 B15R1.870 Cc1ccc(cc1)CCC(=O)NC(C)C WXVL_AK0030SB0421 [0,1,0,0,0,0|1,0,2]=4 183 B15R1.870 Cc1ccc(cc1)CCC(=O)NC(C)C WXVL_AK0030SB0421 [0,1,0,0,0,0|1,0,2]=4 184 B15R1.870 Cc1ccc(cc1)CNC(=O)CC(C)C WXVL_AK0048SB0063 [0,1,0,0,0,0|2,0,1]=4 185 B15R1.870 Cc1ccc(cc1)CNC(=O)CC(C)C WXVL_AK0048SB0063 [0,1,0,0,0,0|2,0,1]=4 186 B15R1.870 Cc1ccc(cc1)CNC(=O)NC(C)C WXVL_AK0030YV0067 [0,1,0,0,0,0|2,0,1]=4 187 B15R1.870 Cc1ccc(cc1)CNC(=O)NC(C)C WXVL_AK0030YV0067 [0,1,0,0,0,0|2,0,1]=4 188 B15R1.870 Cc1ccc(cc1)OCC(=O)NC(C)C WXVL_AK0030SB0138 [0,1,0,0,0,0|2,0,1]=4 189 B15R1.870 Cc1ccc(cc1)OCC(=O)NC(C)C WXVL_AK0030SB0138 [0,1,0,0,0,0|2,0,1]=4 190 B15R1.870 Cc1ccc(cc1)SCC(=O)NC(C)C WXVL_AK0030SB0830 [0,1,0,0,0,0|2,0,1]=4 191 B15R1.870 Cc1ccc(cc1)SCC(=O)NC(C)C WXVL_AK0030SB0830 [0,1,0,0,0,0|2,0,1]=4 192 B15R1.1076 CC(C)NC(=O)CC(C)c1ccccc1 WXVL_AK0030SB0419 [0,1,0,0,0,0|1,0,2]=4 193 B15R1.1076 CC(C)NC(=O)CC(C)c1ccccc1 WXVL_AK0030SB0419 [0,1,0,0,0,0|1,0,2]=4 194 B15R1.1076 CC(C)NC(=O)CC(O)c1ccccc1 WXVL_AK0030SB2325 [0,1,0,0,0,0|1,0,2]=4 195 B15R1.1076 CC(C)NC(=O)CC(O)c1ccccc1 WXVL_AK0030SB2325 [0,1,0,0,0,0|1,0,2]=4 196 B15R1.1076 CC(C)NC(=O)NC(=O)c1ccccc1 WXVL_AK0030YV0027 [0,1,0,0,0,0|2,0,0]=3 197 B15R1.1076 CC(C)NC(=O)NC(=O)c1ccccc1 WXVL_AK0030YV0027 [0,1,0,0,0,0|2,0,0]=3 198 B15R1.1076 CC(C)NC(=O)N[C@@H](C)c1ccccc1 WXVL_AK0030YV0029 [0,1,0,0,0,0|2,0,1]=4 199 B15R1.1076 CC(C)NC(=O)N[C@@H](C)c1ccccc1 WXVL_AK0030YV0029 [0,1,0,0,0,0|2,0,1]=4 200 B15R1.1076 CC(C)NC(=O)N[C@H](C)c1ccccc1 WXVL_AK0030YV0061 [0,1,0,0,0,0|2,0,1]=4 201 B15R1.1076 CC(C)NC(=O)N[C@H](C)c1ccccc1 WXVL_AK0030YV0061 [0,1,0,0,0,0|2,0,1]=4 202 B15R1.3465 CC(C)(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0062 [0,1,0,0,0,0|2,0,1]=4 203 B15R1.3465 CC(C)(C)CC(=O)NCc1ccccc1 WXVL_AK00502SB0062 [0,1,0,0,0,0|2,0,1]=4 204 B15R1.3465 CC(C)(C)NC(=O)/C=C/c1ccccc1 WXVL_AK0024SB0115 [0,1,0,0,0,0|1,0,0]=2 205 B15R1.3465 CC(C)(C)NC(=O)/C=C/c1ccccc1 WXVL_AK0024SB0115 [0,1,0,0,0,0|1,0,0]=2 206 B15R1.3465 CC(C)(C)NC(=O)/C=C/c1cccnc1 WXVL_AK0024SA0193 [0,1,0,0,0,0|2,0,0]=3 207 B15R1.3465 CC(C)(C)NC(=O)/C=C/c1cccnc1 WXVL_AK0024SA0193 [0,1,0,0,0,0|2,0,0]=3 208 B15R1.3465 CC(C)(C)NC(=O)/C=C/c1cnccn1 WXVL_AK0024SA2885 [0,1,0,0,0,0|3,0,0]=4 209 B15R1.3465 CC(C)(C)NC(=O)/C=C/c1cnccn1 WXVL_AK0024SA2885 [0,1,0,0,0,0|3,0,0]=4 210 B15R1.3465 CC(C)(C)NC(=O)C#Cc1ccccc1 WXVL_AK0024SB0114 [0,1,0,0,0,0|1,0,2]=4 211 B15R1.3465 CC(C)(C)NC(=O)C#Cc1ccccc1 WXVL_AK0024SB0114 [0,1,0,0,0,0|1,0,2]=4 212 B15R1.3465 CC(C)(C)NC(=O)CCc1ccccc1 WXVL_AK0024SB0067 [0,1,0,0,0,0|1,0,2]=4 213 B15R1.3465 CC(C)(C)NC(=O)CCc1ccccc1 WXVL_AK0024SB0067 [0,1,0,0,0,0|1,0,2]=4 214 B15R1.3465 CC(C)(C)NC(=O)COc1ccccc1 WXVL_AK0024SB0086 [0,1,0,0,0,0|2,0,1]=4 215 B15R1.3465 CC(C)(C)NC(=O)COc1ccccc1 WXVL_AK0024SB0086 [0,1,0,0,0,0|2,0,1]=4 216 B15R1.3465 CC(C)(C)NC(=O)CSc1ccccc1 WXVL_AK0024SB0113 [0,1,0,0,0,0|2,0,1]=4 217 B15R1.3465 CC(C)(C)NC(=O)CSc1ccccc1 WXVL_AK0024SB0113 [0,1,0,0,0,0|2,0,1]=4 218 B15R1.3465 CC(C)(O)CC(=O)NCc1ccccc1 WXVL_AK00502SB0163 [0,1,0,0,0,0|2,0,1]=4 219 B15R1.3465 CC(C)(O)CC(=O)NCc1ccccc1 WXVL_AK00502SB0163 [0,1,0,0,0,0|2,0,1]=4 220 B15R1.3678 CC(C)C(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB2578 [0,1,0,0,0,0|2,0,1]=4 221 B15R1.3678 CC(C)C(=O)C(=O)NCc1ccccc1 WXVL_AK00502SB2578 [0,1,0,0,0,0|2,0,1]=4 222 B15R1.3678 CC(C)C(O)C(=O)NCc1ccccc1 WXVL_AK00502SB1147 [0,1,0,0,0,0|2,0,1]=4 223 B15R1.3678 CC(C)C(O)C(=O)NCc1ccccc1 WXVL_AK00502SB1147 [0,1,0,0,0,0|2,0,1]=4 224 B15R1.3678 CC(C)N(C)C(=O)/C=C/c1ccccc1 WXVL_AN0073SB0115 [0,1,0,0,0,0|1,0,0]=2 225 B15R1.3678 CC(C)N(C)C(=O)/C=C/c1ccccc1 WXVL_AN0073SB0115 [0,1,0,0,0,0|1,0,0]=2 226 B15R1.3678 CC(C)N(C)C(=O)/C=C/c1cccnc1 WXVL_AN0073SA0193 [0,1,0,0,0,0|2,0,0]=3 227 B15R1.3678 CC(C)N(C)C(=O)/C=C/c1cccnc1 WXVL_AN0073SA0193 [0,1,0,0,0,0|2,0,0]=3 228 B15R1.3678 CC(C)N(C)C(=O)/C=C/c1cnccn1 WXVL_AN0073SA2885 [0,1,0,0,0,0|3,0,0]=4 229 B15R1.3678 CC(C)N(C)C(=O)/C=C/c1cnccn1 WXVL_AN0073SA2885 [0,1,0,0,0,0|3,0,0]=4 230 B15R1.3678 CC(C)N(C)C(=O)C#Cc1ccccc1 WXVL_AN0073SB0114 [0,1,0,0,0,0|1,0,2]=4 231 B15R1.3678 CC(C)N(C)C(=O)C#Cc1ccccc1 WXVL_AN0073SB0114 [0,1,0,0,0,0|1,0,2]=4 232 B15R1.3678 CC(C)N(C)C(=O)CCc1ccccc1 WXVL_AN0073SB0067 [0,1,0,0,0,0|1,0,2]=4 233 B15R1.3678 CC(C)N(C)C(=O)CCc1ccccc1 WXVL_AN0073SB0067 [0,1,0,0,0,0|1,0,2]=4 234 B15R1.3678 CC(C)N(C)C(=O)COc1ccccc1 WXVL_AN0073SB0086 [0,1,0,0,0,0|2,0,1]=4 235 B15R1.3678 CC(C)N(C)C(=O)COc1ccccc1 WXVL_AN0073SB0086 [0,1,0,0,0,0|2,0,1]=4 236 B15R1.3678 CC(C)N(C)C(=O)CSc1ccccc1 WXVL_AN0073SB0113 [0,1,0,0,0,0|2,0,1]=4 237 B15R1.3678 CC(C)N(C)C(=O)CSc1ccccc1 WXVL_AN0073SB0113 [0,1,0,0,0,0|2,0,1]=4 238 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0063 [0,1,0,0,0,0|2,0,1]=4 239 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0063 [0,1,0,0,0,0|2,0,1]=4 240 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0063 [0,1,0,0,0,0|2,0,1]=4 241 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0063 [0,1,0,0,0,0|2,0,1]=4 242 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0063 [0,1,0,0,0,0|2,0,1]=4 243 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)F WXVL_AK0041SB0063 [0,1,0,0,0,0|2,0,1]=4 244 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0063 [0,1,0,0,0,0|2,0,1]=4 245 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)I WXVL_AK1572SB0063 [0,1,0,0,0,0|2,0,1]=4 246 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0063 [0,1,0,0,0,0|2,0,1]=4 247 B15R1.8263 CC(C)CC(=O)NCc1cccc(c1)O WXVL_AK0974SB0063 [0,1,0,0,0,0|2,0,1]=4 248 B15R1.8263 CC(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0030SB1601 [0,1,0,0,0,0|1,0,0]=2 249 B15R1.8263 CC(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0030SB1601 [0,1,0,0,0,0|1,0,0]=2 250 B15R1.8263 CC(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK0030SB0417 [0,1,0,0,0,0|1,0,0]=2 251 B15R1.8263 CC(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK0030SB0417 [0,1,0,0,0,0|1,0,0]=2 252 B15R1.8263 CC(C)NC(=O)CCc1cccc(c1)Br WXVL_AK0030SB0278 [0,1,0,0,0,0|1,0,2]=4 253 B15R1.8263 CC(C)NC(=O)CCc1cccc(c1)Br WXVL_AK0030SB0278 [0,1,0,0,0,0|1,0,2]=4 254 B15R1.8263 CC(C)NC(=O)CCc1cccc(c1)O WXVL_AK0030SB3088 [0,1,0,0,0,0|1,0,2]=4 255 B15R1.8263 CC(C)NC(=O)CCc1cccc(c1)O WXVL_AK0030SB3088 [0,1,0,0,0,0|1,0,2]=4 256 B15R1.8263 CC(C)NC(=O)COc1cccc(c1)Cl WXVL_AK0030SB0493 [0,1,0,0,0,0|2,0,1]=4 257 B15R1.8263 CC(C)NC(=O)COc1cccc(c1)Cl WXVL_AK0030SB0493 [0,1,0,0,0,0|2,0,1]=4 258 B15R1.8263 CC(C)NC(=O)NCc1cccc(c1)F WXVL_AK0030YV0073 [0,1,0,0,0,0|2,0,1]=4 259 B15R1.8263 CC(C)NC(=O)NCc1cccc(c1)F WXVL_AK0030YV0073 [0,1,0,0,0,0|2,0,1]=4 260 B15R1.8263 Cc1cccc(c1)CCC(=O)NC(C)C WXVL_AK0030SB1394 [0,1,0,0,0,0|1,0,2]=4 261 B15R1.8263 Cc1cccc(c1)CCC(=O)NC(C)C WXVL_AK0030SB1394 [0,1,0,0,0,0|1,0,2]=4 262 B15R1.8263 Cc1cccc(c1)CNC(=O)CC(C)C WXVL_AK0045SB0063 [0,1,0,0,0,0|2,0,1]=4 263 B15R1.8263 Cc1cccc(c1)CNC(=O)CC(C)C WXVL_AK0045SB0063 [0,1,0,0,0,0|2,0,1]=4 264 B15R1.8263 Cc1cccc(c1)CNC(=O)NC(C)C WXVL_AK0030YV0178 [0,1,0,0,0,0|2,0,1]=4 265 B15R1.8263 Cc1cccc(c1)CNC(=O)NC(C)C WXVL_AK0030YV0178 [0,1,0,0,0,0|2,0,1]=4 266 B15R1.12240 CC(C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0030HU0026 [0,1,0,0,0,0|2,0,0]=3 267 B15R1.12240 CC(C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0030HU0026 [0,1,0,0,0,0|2,0,0]=3 268 B15R2.505 CC1CC1C(=O)NCc2ccccc2 WXVL_AK00502SB0041 [0,0,0,1,0,0|2,0,1]=4 269 B15R2.505 CC1CC1C(=O)NCc2ccccc2 WXVL_AK00502SB0041 [0,0,0,1,0,0|2,0,1]=4 270 B15R2.1668 CC(C)Nc1ncc2ccccc2n1 WXVL_AK0030LP0064 [0,0,0,1,0,0|3,0,0]=4 271 B15R2.1668 CC(C)Nc1ncc2ccccc2n1 WXVL_AK0030LP0064 [0,0,0,1,0,0|3,0,0]=4 272 B15R2.24494 O=C(/C=C/c1ccccc1)NC2CC2 WXVL_AK0001SB0115 [0,0,0,1,0,0|1,0,0]=2 273 B15R2.24494 O=C(/C=C/c1ccccc1)NC2CC2 WXVL_AK0001SB0115 [0,0,0,1,0,0|1,0,0]=2 274 B15R2.24494 O=C(/C=C/c1cccnc1)NC2CC2 WXVL_AK0001SA0193 [0,0,0,1,0,0|2,0,0]=3 275 B15R2.24494 O=C(/C=C/c1cccnc1)NC2CC2 WXVL_AK0001SA0193 [0,0,0,1,0,0|2,0,0]=3 276 B15R2.24494 O=C(/C=C/c1cnccn1)NC2CC2 WXVL_AK0001SA2885 [0,0,0,1,0,0|3,0,0]=4 277 B15R2.24494 O=C(/C=C/c1cnccn1)NC2CC2 WXVL_AK0001SA2885 [0,0,0,1,0,0|3,0,0]=4 278 B15R2.24494 O=C(C#Cc1ccccc1)NC2CC2 WXVL_AK0001SB0114 [0,0,0,1,0,0|1,0,2]=4 279 B15R2.24494 O=C(C#Cc1ccccc1)NC2CC2 WXVL_AK0001SB0114 [0,0,0,1,0,0|1,0,2]=4 280 B15R2.24494 O=C(CC1CC1)NCc2ccccc2 WXVL_AK00502SB0155 [0,0,0,1,0,0|2,0,1]=4 281 B15R2.24494 O=C(CC1CC1)NCc2ccccc2 WXVL_AK00502SB0155 [0,0,0,1,0,0|2,0,1]=4 282 B15R2.24494 O=C(CCc1ccccc1)NC2CC2 WXVL_AK0001SB0067 [0,0,0,1,0,0|1,0,2]=4 283 B15R2.24494 O=C(CCc1ccccc1)NC2CC2 WXVL_AK0001SB0067 [0,0,0,1,0,0|1,0,2]=4 284 B15R2.24494 O=C(COc1ccccc1)NC2CC2 WXVL_AK0001SB0086 [0,0,0,1,0,0|2,0,1]=4 285 B15R2.24494 O=C(COc1ccccc1)NC2CC2 WXVL_AK0001SB0086 [0,0,0,1,0,0|2,0,1]=4 286 B15R2.24494 O=C(CSc1ccccc1)NC2CC2 WXVL_AK0001SB0113 [0,0,0,1,0,0|2,0,1]=4 287 B15R2.24494 O=C(CSc1ccccc1)NC2CC2 WXVL_AK0001SB0113 [0,0,0,1,0,0|2,0,1]=4 288 B13R1.348 CC(=CC(=O)Nc1ccccc1)C WXVL_AG00183SB0342 [0,0,0,0,1,0|2,0,1]=4 289 B13R1.348 CC(=CC(=O)Nc1ccccc1)C WXVL_AG00183SB0342 [0,0,0,0,1,0|2,0,1]=4 290 B13R1.348 CC(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0063 [0,0,0,0,1,0|2,0,0]=3 291 B13R1.348 CC(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0063 [0,0,0,0,1,0|2,0,0]=3 292 B13R1.348 CC(C)CC(=O)Nc1ccccn1 WXVL_AF00298SB0063 [0,0,0,0,1,0|3,0,0]=4 293 B13R1.348 CC(C)CC(=O)Nc1ccccn1 WXVL_AF00298SB0063 [0,0,0,0,1,0|3,0,0]=4 294 B13R1.348 CC(C)NC(=O)Cc1ccccc1 WXVL_AK0030SB0092 [0,0,0,0,1,0|1,0,1]=3 295 B13R1.348 CC(C)NC(=O)Cc1ccccc1 WXVL_AK0030SB0092 [0,0,0,0,1,0|1,0,1]=3 296 B13R1.348 CC(C)NC(=O)Cc1ccccn1 WXVL_AK0030SA0032 [0,0,0,0,1,0|2,0,1]=4 297 B13R1.348 CC(C)NC(=O)Cc1ccccn1 WXVL_AK0030SA0032 [0,0,0,0,1,0|2,0,1]=4 298 B13R1.348 CC(C)NC(=O)Cc1cccnc1 WXVL_AK0030SA0029 [0,0,0,0,1,0|2,0,1]=4 299 B13R1.348 CC(C)NC(=O)Cc1cccnc1 WXVL_AK0030SA0029 [0,0,0,0,1,0|2,0,1]=4 300 B13R1.348 CC(C)NC(=O)Cc1cccnc1 WXVL_AK0030SB00049 [0,0,0,0,1,0|2,0,1]=4 301 B13R1.348 CC(C)NC(=O)Cc1cccnc1 WXVL_AK0030SB00049 [0,0,0,0,1,0|2,0,1]=4 302 B13R1.348 CC(C)NC(=O)Cc1ccncc1 WXVL_AK0030SA00106 [0,0,0,0,1,0|2,0,1]=4 303 B13R1.348 CC(C)NC(=O)Cc1ccncc1 WXVL_AK0030SA00106 [0,0,0,0,1,0|2,0,1]=4 304 B13R1.348 CC(C)NC(=O)Nc1ccccn1 WXVL_AK0030YV0189 [0,0,0,0,1,0|3,0,0]=4 305 B13R1.348 CC(C)NC(=O)Nc1ccccn1 WXVL_AK0030YV0189 [0,0,0,0,1,0|3,0,0]=4 306 B13R1.348 CC(O)CC(=O)Nc1ccccc1 WXVL_AG00183SB3643 [0,0,0,0,1,0|3,0,0]=4 307 B13R1.348 CC(O)CC(=O)Nc1ccccc1 WXVL_AG00183SB3643 [0,0,0,0,1,0|3,0,0]=4 308 B13R1.348 CN(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0085 [0,0,0,0,1,0|3,0,0]=4 309 B13R1.348 CN(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0085 [0,0,0,0,1,0|3,0,0]=4 310 B13R1.351 CC(C)C(=O)NCc1ccccc1 WXVL_AK00502SB0052 [0,0,0,0,1,0|1,0,1]=3 311 B13R1.351 CC(C)C(=O)NCc1ccccc1 WXVL_AK00502SB0052 [0,0,0,0,1,0|1,0,1]=3 312 B13R1.351 CC(C)C(=O)NCc1ccccn1 WXVL_AK0018SB0052 [0,0,0,0,1,0|2,0,1]=4 313 B13R1.351 CC(C)C(=O)NCc1ccccn1 WXVL_AK0018SB0052 [0,0,0,0,1,0|2,0,1]=4 314 B13R1.351 CC(C)C(=O)NCc1cccnc1 WXVL_AK0020SB0052 [0,0,0,0,1,0|2,0,1]=4 315 B13R1.351 CC(C)C(=O)NCc1cccnc1 WXVL_AK0020SB0052 [0,0,0,0,1,0|2,0,1]=4 316 B13R1.351 CC(C)C(=O)NCc1ccncc1 WXVL_AK0021SB0052 [0,0,0,0,1,0|2,0,1]=4 317 B13R1.351 CC(C)C(=O)NCc1ccncc1 WXVL_AK0021SB0052 [0,0,0,0,1,0|2,0,1]=4 318 B13R1.351 CC(S)C(=O)NCc1ccccc1 WXVL_AK00502SB2708 [0,0,0,0,1,0|2,0,1]=4 319 B13R1.351 CC(S)C(=O)NCc1ccccc1 WXVL_AK00502SB2708 [0,0,0,0,1,0|2,0,1]=4 320 B13R1.351 CN(C)C(=O)/C=C/c1ccccc1 WXVL_AN0032SB0115 [0,0,0,0,1,0|1,0,0]=2 321 B13R1.351 CN(C)C(=O)/C=C/c1ccccc1 WXVL_AN0032SB0115 [0,0,0,0,1,0|1,0,0]=2 322 B13R1.351 CN(C)C(=O)/C=C/c1cccnc1 WXVL_AN0032SA0193 [0,0,0,0,1,0|2,0,0]=3 323 B13R1.351 CN(C)C(=O)/C=C/c1cccnc1 WXVL_AN0032SA0193 [0,0,0,0,1,0|2,0,0]=3 324 B13R1.351 CN(C)C(=O)/C=C/c1cnccn1 WXVL_AN0032SA2885 [0,0,0,0,1,0|3,0,0]=4 325 B13R1.351 CN(C)C(=O)/C=C/c1cnccn1 WXVL_AN0032SA2885 [0,0,0,0,1,0|3,0,0]=4 326 B13R1.351 CN(C)C(=O)C#Cc1ccccc1 WXVL_AN0032SB0114 [0,0,0,0,1,0|1,0,2]=4 327 B13R1.351 CN(C)C(=O)C#Cc1ccccc1 WXVL_AN0032SB0114 [0,0,0,0,1,0|1,0,2]=4 328 B13R1.351 CN(C)C(=O)CCc1ccccc1 WXVL_AN0032SB0067 [0,0,0,0,1,0|1,0,2]=4 329 B13R1.351 CN(C)C(=O)CCc1ccccc1 WXVL_AN0032SB0067 [0,0,0,0,1,0|1,0,2]=4 330 B13R1.351 CN(C)C(=O)COc1ccccc1 WXVL_AN0032SB0086 [0,0,0,0,1,0|2,0,1]=4 331 B13R1.351 CN(C)C(=O)COc1ccccc1 WXVL_AN0032SB0086 [0,0,0,0,1,0|2,0,1]=4 332 B13R1.351 CN(C)C(=O)CSc1ccccc1 WXVL_AN0032SB0113 [0,0,0,0,1,0|2,0,1]=4 333 B13R1.351 CN(C)C(=O)CSc1ccccc1 WXVL_AN0032SB0113 [0,0,0,0,1,0|2,0,1]=4 334 B13R1.351 C[C@@H](O)C(=O)NCc1ccccc1 WXVL_AK00502SB1085 [0,0,0,0,1,0|2,0,1]=4 335 B13R1.351 C[C@@H](O)C(=O)NCc1ccccc1 WXVL_AK00502SB1085 [0,0,0,0,1,0|2,0,1]=4 336 B13R1.593 CC(C)NC(=O)/C=C/c1c[nH]cn1 WXVL_AK0030SA0730 [0,0,0,0,1,0|3,0,0]=4 337 B13R1.593 CC(C)NC(=O)/C=C/c1c[nH]cn1 WXVL_AK0030SA0730 [0,0,0,0,1,0|3,0,0]=4 338 B13R1.593 CC(C)NC(=O)/C=C/c1ccco1 WXVL_AK0030SA0180 [0,0,0,0,1,0|2,0,0]=3 339 B13R1.593 CC(C)NC(=O)/C=C/c1ccco1 WXVL_AK0030SA0180 [0,0,0,0,1,0|2,0,0]=3 340 B13R1.593 CC(C)NC(=O)/C=C/c1cccs1 WXVL_AK0030SA0001 [0,0,0,0,1,0|2,0,0]=3 341 B13R1.593 CC(C)NC(=O)/C=C/c1cccs1 WXVL_AK0030SA0001 [0,0,0,0,1,0|2,0,0]=3 342 B13R1.593 CC(C)NC(=O)/C=C/c1ccoc1 WXVL_AK0030SA0047 [0,0,0,0,1,0|2,0,0]=3 343 B13R1.593 CC(C)NC(=O)/C=C/c1ccoc1 WXVL_AK0030SA0047 [0,0,0,0,1,0|2,0,0]=3 344 B13R1.593 CC(C)NC(=O)/C=C/c1ccsc1 WXVL_AK0030SA0251 [0,0,0,0,1,0|2,0,0]=3 345 B13R1.593 CC(C)NC(=O)/C=C/c1ccsc1 WXVL_AK0030SA0251 [0,0,0,0,1,0|2,0,0]=3 346 B15R1.5919 C=C(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK0761SB0115 [0,0,0,0,0,1|1,0,2]=4 347 B15R1.5919 C=C(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK0761SB0115 [0,0,0,0,0,1|1,0,2]=4 348 B15R1.5919 CC(C)/C=C/C(=O)NCc1ccccc1 WXVL_AK00502SB0036 [0,0,0,0,0,1|2,0,1]=4 349 B15R1.5919 CC(C)/C=C/C(=O)NCc1ccccc1 WXVL_AK00502SB0036 [0,0,0,0,0,1|2,0,1]=4 350 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0354 [0,0,0,0,0,1|2,0,1]=4 351 B15R1.5919 CC(C)CCC(=O)NCc1ccccc1 WXVL_AK00502SB0354 [0,0,0,0,0,1|2,0,1]=4 352 B15R1.5919 CC(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00544SB0115 [0,0,0,0,0,1|1,0,0]=2 353 B15R1.5919 CC(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00544SB0115 [0,0,0,0,0,1|1,0,0]=2 354 B15R1.5919 CC(C)CNC(=O)/C=C/c1cccnc1 WXVL_AK00544SA0193 [0,0,0,0,0,1|2,0,0]=3 355 B15R1.5919 CC(C)CNC(=O)/C=C/c1cccnc1 WXVL_AK00544SA0193 [0,0,0,0,0,1|2,0,0]=3 356 B15R1.5919 CC(C)CNC(=O)/C=C/c1cnccn1 WXVL_AK00544SA2885 [0,0,0,0,0,1|3,0,0]=4 357 B15R1.5919 CC(C)CNC(=O)/C=C/c1cnccn1 WXVL_AK00544SA2885 [0,0,0,0,0,1|3,0,0]=4 358 B15R1.5919 CC(C)CNC(=O)C#Cc1ccccc1 WXVL_AK00544SB0114 [0,0,0,0,0,1|1,0,2]=4 359 B15R1.5919 CC(C)CNC(=O)C#Cc1ccccc1 WXVL_AK00544SB0114 [0,0,0,0,0,1|1,0,2]=4 360 B15R1.5919 CC(C)CNC(=O)CCc1ccccc1 WXVL_AK00544SB0067 [0,0,0,0,0,1|1,0,2]=4 361 B15R1.5919 CC(C)CNC(=O)CCc1ccccc1 WXVL_AK00544SB0067 [0,0,0,0,0,1|1,0,2]=4 362 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 WXVL_AK00544SB0086 [0,0,0,0,0,1|2,0,1]=4 363 B15R1.5919 CC(C)CNC(=O)COc1ccccc1 WXVL_AK00544SB0086 [0,0,0,0,0,1|2,0,1]=4 364 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 WXVL_AK00544SB0113 [0,0,0,0,0,1|2,0,1]=4 365 B15R1.5919 CC(C)CNC(=O)CSc1ccccc1 WXVL_AK00544SB0113 [0,0,0,0,0,1|2,0,1]=4 366 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 WXVL_AK00502SB0213 [0,0,0,0,0,1|1,0,1]=3 367 B15R1.5919 CC(C)OCC(=O)NCc1ccccc1 WXVL_AK00502SB0213 [0,0,0,0,0,1|1,0,1]=3 368 B15R1.5919 CC(C)OCC(=O)NCc1ccccn1 WXVL_AK0018SB0213 [0,0,0,0,0,1|2,0,1]=4 369 B15R1.5919 CC(C)OCC(=O)NCc1ccccn1 WXVL_AK0018SB0213 [0,0,0,0,0,1|2,0,1]=4 370 B15R1.5919 CC(C)OCC(=O)NCc1cccnc1 WXVL_AK0020SB0213 [0,0,0,0,0,1|2,0,1]=4 371 B15R1.5919 CC(C)OCC(=O)NCc1cccnc1 WXVL_AK0020SB0213 [0,0,0,0,0,1|2,0,1]=4 372 B15R1.5919 CC(C)OCC(=O)NCc1ccncc1 WXVL_AK0021SB0213 [0,0,0,0,0,1|2,0,1]=4 373 B15R1.5919 CC(C)OCC(=O)NCc1ccncc1 WXVL_AK0021SB0213 [0,0,0,0,0,1|2,0,1]=4 374 B15R1.5919 CC(O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0052SB0115 [0,0,0,0,0,1|2,0,0]=3 375 B15R1.5919 CC(O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0052SB0115 [0,0,0,0,0,1|2,0,0]=3 376 B15R1.5919 CC(O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0052SA0193 [0,0,0,0,0,1|3,0,0]=4 377 B15R1.5919 CC(O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0052SA0193 [0,0,0,0,0,1|3,0,0]=4 378 B15R1.5919 C[C@H](O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0113SB0115 [0,0,0,0,0,1|2,0,0]=3 379 B15R1.5919 C[C@H](O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0113SB0115 [0,0,0,0,0,1|2,0,0]=3 380 B15R1.5919 C[C@H](O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0113SA0193 [0,0,0,0,0,1|3,0,0]=4 381 B15R1.5919 C[C@H](O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0113SA0193 [0,0,0,0,0,1|3,0,0]=4 382 B15R1.5919 O=C(/C=C/c1ccccc1)NCC(F)F WXVL_AK0136SB0115 [0,0,0,0,0,1|3,0,0]=4 383 B15R1.5919 O=C(/C=C/c1ccccc1)NCC(F)F WXVL_AK0136SB0115 [0,0,0,0,0,1|3,0,0]=4 384 B15R1.9084 CC(C)CC(=O)NCCc1ccccc1 WXVL_AK00498SB0063 [0,0,0,0,0,1|1,0,2]=4 385 B15R1.9084 CC(C)CC(=O)NCCc1ccccc1 WXVL_AK00498SB0063 [0,0,0,0,0,1|1,0,2]=4 386 B15R1.9084 CC(C)NC(=O)CCCc1ccccc1 WXVL_AK0030SB0121 [0,0,0,0,0,1|1,0,2]=4 387 B15R1.9084 CC(C)NC(=O)CCCc1ccccc1 WXVL_AK0030SB0121 [0,0,0,0,0,1|1,0,2]=4 388 B15R1.9084 CC(C)NC(=O)CCOc1ccccc1 WXVL_AK0030SB0066 [0,0,0,0,0,1|1,0,2]=4 389 B15R1.9084 CC(C)NC(=O)CCOc1ccccc1 WXVL_AK0030SB0066 [0,0,0,0,0,1|1,0,2]=4 390 B15R1.9084 CC(C)NC(=O)COCc1ccccc1 WXVL_AK0030SB0185 [0,0,0,0,0,1|1,0,2]=4 391 B15R1.9084 CC(C)NC(=O)COCc1ccccc1 WXVL_AK0030SB0185 [0,0,0,0,0,1|1,0,2]=4 392 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [2,0,0,0,0,0|1,0,1]=4 393 B12R1.27 CCC(=O)NCc1ccccc1 WXVL_AK00502SB0064 [2,0,0,0,0,0|1,0,1]=4 394 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [2,0,0,0,0,0|1,0,0]=3 395 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [2,0,0,0,0,0|1,0,0]=3 396 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [2,0,0,0,0,0|2,0,0]=4 397 B12R1.27 CNC(=O)/C=C/c1cccnc1 WXVL_AK00442SA0193 [2,0,0,0,0,0|2,0,0]=4 398 B14R1.29 CCNC(=O)NC(=O)c1ccccc1 WXVL_AK00476YV0027 [1,1,0,0,0,0|2,0,0]=4 399 B14R1.29 CCNC(=O)NC(=O)c1ccccc1 WXVL_AK00476YV0027 [1,1,0,0,0,0|2,0,0]=4 400 B14R1.32 CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00476SB1601 [1,1,0,0,0,0|1,0,0]=3 401 B14R1.32 CCNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00476SB1601 [1,1,0,0,0,0|1,0,0]=3 402 B14R1.32 CCNC(=O)C=Cc1cccc(c1)O WXVL_AK00476SB0417 [1,1,0,0,0,0|1,0,0]=3 403 B14R1.32 CCNC(=O)C=Cc1cccc(c1)O WXVL_AK00476SB0417 [1,1,0,0,0,0|1,0,0]=3 404 B14R1.60 C=C(Cc1ccccc1)C(=O)NCC WXVL_AK00476SB0413 [1,1,0,0,0,0|1,0,1]=4 405 B14R1.60 C=C(Cc1ccccc1)C(=O)NCC WXVL_AK00476SB0413 [1,1,0,0,0,0|1,0,1]=4 406 B14R1.60 CCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00476SA1933 [1,1,0,0,0,0|2,0,0]=4 407 B14R1.60 CCNC(=O)/C(=C/c1cccnc1)/C WXVL_AK00476SA1933 [1,1,0,0,0,0|2,0,0]=4 408 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB4144 [1,1,0,0,0,0|1,0,0]=3 409 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB4144 [1,1,0,0,0,0|1,0,0]=3 410 B14R1.60 CCOC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB4144 [1,1,0,0,0,0|2,0,0]=4 411 B14R1.60 CCOC(=O)C(=O)Nc1ccccn1 WXVL_AF00298SB4144 [1,1,0,0,0,0|2,0,0]=4 412 B14R1.156 C=CCNC(=O)/C=C/c1ccccc1 WXVL_AK00561SB0115 [1,1,0,0,0,0|1,0,1]=4 413 B14R1.156 C=CCNC(=O)/C=C/c1ccccc1 WXVL_AK00561SB0115 [1,1,0,0,0,0|1,0,1]=4 414 B14R1.156 CCCNC(=O)/C=C/c1ccccc1 WXVL_AK00504SB0115 [1,1,0,0,0,0|1,0,0]=3 415 B14R1.156 CCCNC(=O)/C=C/c1ccccc1 WXVL_AK00504SB0115 [1,1,0,0,0,0|1,0,0]=3 416 B14R1.156 CCCNC(=O)/C=C/c1cccnc1 WXVL_AK00504SA0193 [1,1,0,0,0,0|2,0,0]=4 417 B14R1.156 CCCNC(=O)/C=C/c1cccnc1 WXVL_AK00504SA0193 [1,1,0,0,0,0|2,0,0]=4 418 B14R1.156 CCOCC(=O)NCc1ccccc1 WXVL_AK00502SB0091 [1,1,0,0,0,0|1,0,1]=4 419 B14R1.156 CCOCC(=O)NCc1ccccc1 WXVL_AK00502SB0091 [1,1,0,0,0,0|1,0,1]=4 420 B14R1.156 N#CCNC(=O)/C=C/c1ccccc1 WXVL_AK0683SB0115 [1,1,0,0,0,0|1,0,1]=4 421 B14R1.156 N#CCNC(=O)/C=C/c1ccccc1 WXVL_AK0683SB0115 [1,1,0,0,0,0|1,0,1]=4 422 B14R1.156 O=C(/C=C/c1ccccc1)NCCF WXVL_AK00466SB0115 [1,1,0,0,0,0|1,0,0]=3 423 B14R1.156 O=C(/C=C/c1ccccc1)NCCF WXVL_AK00466SB0115 [1,1,0,0,0,0|1,0,0]=3 424 B14R1.156 O=C(/C=C/c1cccnc1)NCCF WXVL_AK00466SA0193 [1,1,0,0,0,0|2,0,0]=4 425 B14R1.156 O=C(/C=C/c1cccnc1)NCCF WXVL_AK00466SA0193 [1,1,0,0,0,0|2,0,0]=4 426 B14R1.502 CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00476SB0418 [1,1,0,0,0,0|1,0,0]=3 427 B14R1.502 CCNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00476SB0418 [1,1,0,0,0,0|1,0,0]=3 428 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00476SB1122 [1,1,0,0,0,0|1,0,0]=3 429 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00476SB1122 [1,1,0,0,0,0|1,0,0]=3 430 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00476SB0060 [1,1,0,0,0,0|1,0,0]=3 431 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)C WXVL_AK00476SB0060 [1,1,0,0,0,0|1,0,0]=3 432 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00476SB0119 [1,1,0,0,0,0|1,0,0]=3 433 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00476SB0119 [1,1,0,0,0,0|1,0,0]=3 434 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00476SB1186 [1,1,0,0,0,0|1,0,0]=3 435 B14R1.502 CCNC(=O)C=Cc1ccc(cc1)F WXVL_AK00476SB1186 [1,1,0,0,0,0|1,0,0]=3 436 B14R1.598 CCNC(=O)C=Cc1ccccc1Br WXVL_AK00476SB3065 [1,1,0,0,0,0|1,0,0]=3 437 B14R1.598 CCNC(=O)C=Cc1ccccc1Br WXVL_AK00476SB3065 [1,1,0,0,0,0|1,0,0]=3 438 B14R1.6829 CCNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00476HU0026 [1,1,0,0,0,0|2,0,0]=4 439 B14R1.6829 CCNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00476HU0026 [1,1,0,0,0,0|2,0,0]=4 440 B14R1.423 CC(C)/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0036 [1,1,0,0,0,0|2,0,0]=4 441 B14R1.423 CC(C)/C=C/C(=O)Nc1ccccc1 WXVL_AG00183SB0036 [1,1,0,0,0,0|2,0,0]=4 442 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 WXVL_AG00183SB0213 [1,1,0,0,0,0|1,0,1]=4 443 B14R1.423 CC(C)OCC(=O)Nc1ccccc1 WXVL_AG00183SB0213 [1,1,0,0,0,0|1,0,1]=4 444 B14R1.337 CC(C)CC(=O)Nc1ccccc1Br WXVL_AG00180SB0063 [0,1,0,0,1,0|2,0,0]=4 445 B14R1.337 CC(C)CC(=O)Nc1ccccc1Br WXVL_AG00180SB0063 [0,1,0,0,1,0|2,0,0]=4 446 B14R1.337 CC(C)CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0063 [0,1,0,0,1,0|2,0,0]=4 447 B14R1.337 CC(C)CC(=O)Nc1ccccc1Cl WXVL_AG00129SB0063 [0,1,0,0,1,0|2,0,0]=4 448 B14R1.337 CC(C)CC(=O)Nc1ccccc1I WXVL_AG0385SB0063 [0,1,0,0,1,0|2,0,0]=4 449 B14R1.337 CC(C)CC(=O)Nc1ccccc1I WXVL_AG0385SB0063 [0,1,0,0,1,0|2,0,0]=4 450 B14R1.337 CC(C)NC(=O)Cc1ccccc1Br WXVL_AK0030SB0093 [0,1,0,0,1,0|1,0,1]=4 451 B14R1.337 CC(C)NC(=O)Cc1ccccc1Br WXVL_AK0030SB0093 [0,1,0,0,1,0|1,0,1]=4 452 B14R1.337 CC(C)NC(=O)Cc1ccccc1Cl WXVL_AK0030SB0095 [0,1,0,0,1,0|1,0,1]=4 453 B14R1.337 CC(C)NC(=O)Cc1ccccc1Cl WXVL_AK0030SB0095 [0,1,0,0,1,0|1,0,1]=4 454 B14R1.337 CC(C)NC(=O)Cc1ccccc1F WXVL_AK0030SB0094 [0,1,0,0,1,0|1,0,1]=4 455 B14R1.337 CC(C)NC(=O)Cc1ccccc1F WXVL_AK0030SB0094 [0,1,0,0,1,0|1,0,1]=4 456 B14R1.337 CC(C)NC(=O)Cc1ccccc1I WXVL_AK0030SB1145 [0,1,0,0,1,0|1,0,1]=4 457 B14R1.337 CC(C)NC(=O)Cc1ccccc1I WXVL_AK0030SB1145 [0,1,0,0,1,0|1,0,1]=4 458 B14R1.337 CC(C)NC(=O)Cc1ccccc1O WXVL_AK0030SB0400 [0,1,0,0,1,0|1,0,1]=4 459 B14R1.337 CC(C)NC(=O)Cc1ccccc1O WXVL_AK0030SB0400 [0,1,0,0,1,0|1,0,1]=4 460 B14R1.337 CC(C)NC(=O)Nc1ccccc1Br WXVL_AK0030YV0003 [0,1,0,0,1,0|2,0,0]=4 461 B14R1.337 CC(C)NC(=O)Nc1ccccc1Br WXVL_AK0030YV0003 [0,1,0,0,1,0|2,0,0]=4 462 B14R1.337 CC(C)NC(=O)Nc1ccccc1Cl WXVL_AK0030YV0007 [0,1,0,0,1,0|2,0,0]=4 463 B14R1.337 CC(C)NC(=O)Nc1ccccc1Cl WXVL_AK0030YV0007 [0,1,0,0,1,0|2,0,0]=4 464 B14R1.337 Cc1ccccc1CC(=O)NC(C)C WXVL_AK0030SB0098 [0,1,0,0,1,0|1,0,1]=4 465 B14R1.337 Cc1ccccc1CC(=O)NC(C)C WXVL_AK0030SB0098 [0,1,0,0,1,0|1,0,1]=4 466 B14R1.337 Cc1ccccc1NC(=O)CC(C)C WXVL_AG0027SB0063 [0,1,0,0,1,0|2,0,0]=4 467 B14R1.337 Cc1ccccc1NC(=O)CC(C)C WXVL_AG0027SB0063 [0,1,0,0,1,0|2,0,0]=4 468 B14R1.337 Cc1ccccc1NC(=O)NC(C)C WXVL_AK0030YV0013 [0,1,0,0,1,0|2,0,0]=4 469 B14R1.337 Cc1ccccc1NC(=O)NC(C)C WXVL_AK0030YV0013 [0,1,0,0,1,0|2,0,0]=4 470 B14R1.417 CC(C)NC(=O)C(=O)c1ccccc1 WXVL_AK0030SB0050 [0,1,0,0,1,0|1,0,0]=3 471 B14R1.417 CC(C)NC(=O)C(=O)c1ccccc1 WXVL_AK0030SB0050 [0,1,0,0,1,0|1,0,0]=3 472 B14R1.417 CC(C)NC(=O)C(C)c1ccccc1 WXVL_AK0030SB2326 [0,1,0,0,1,0|1,0,1]=4 473 B14R1.417 CC(C)NC(=O)C(C)c1ccccc1 WXVL_AK0030SB2326 [0,1,0,0,1,0|1,0,1]=4 474 B14R1.417 CC(C)NC(=O)C(O)c1ccccc1 WXVL_AK0030SB0168 [0,1,0,0,1,0|1,0,1]=4 475 B14R1.417 CC(C)NC(=O)C(O)c1ccccc1 WXVL_AK0030SB0168 [0,1,0,0,1,0|1,0,1]=4 476 B14R1.425 CC(C)C(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB2578 [0,1,0,0,1,0|2,0,0]=4 477 B14R1.425 CC(C)C(=O)C(=O)Nc1ccccc1 WXVL_AG00183SB2578 [0,1,0,0,1,0|2,0,0]=4 478 B14R1.425 CC(C)C(O)C(=O)Nc1ccccc1 WXVL_AG00183SB1147 [0,1,0,0,1,0|2,0,0]=4 479 B14R1.425 CC(C)C(O)C(=O)Nc1ccccc1 WXVL_AG00183SB1147 [0,1,0,0,1,0|2,0,0]=4 480 B14R1.425 CC(C)N(C)C(=O)Cc1ccccc1 WXVL_AN0073SB0092 [0,1,0,0,1,0|1,0,1]=4 481 B14R1.425 CC(C)N(C)C(=O)Cc1ccccc1 WXVL_AN0073SB0092 [0,1,0,0,1,0|1,0,1]=4 482 B14R1.433 CC(C)(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0062 [0,1,0,0,1,0|2,0,0]=4 483 B14R1.433 CC(C)(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0062 [0,1,0,0,1,0|2,0,0]=4 484 B14R1.433 CC(C)(C)NC(=O)Cc1ccccc1 WXVL_AK0024SB0092 [0,1,0,0,1,0|1,0,1]=4 485 B14R1.433 CC(C)(C)NC(=O)Cc1ccccc1 WXVL_AK0024SB0092 [0,1,0,0,1,0|1,0,1]=4 486 B14R1.433 CC(C)(O)CC(=O)Nc1ccccc1 WXVL_AG00183SB0163 [0,1,0,0,1,0|2,0,0]=4 487 B14R1.433 CC(C)(O)CC(=O)Nc1ccccc1 WXVL_AG00183SB0163 [0,1,0,0,1,0|2,0,0]=4 488 B14R1.698 CC(C)CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0063 [0,1,0,0,1,0|2,0,0]=4 489 B14R1.698 CC(C)CC(=O)Nc1ccc(cc1)Cl WXVL_AG0062SB0063 [0,1,0,0,1,0|2,0,0]=4 490 B14R1.698 CC(C)CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0063 [0,1,0,0,1,0|2,0,0]=4 491 B14R1.698 CC(C)CC(=O)Nc1ccc(cc1)I WXVL_AG1742SB0063 [0,1,0,0,1,0|2,0,0]=4 492 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)Br WXVL_AK0030SB0926 [0,1,0,0,1,0|1,0,1]=4 493 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)Br WXVL_AK0030SB0926 [0,1,0,0,1,0|1,0,1]=4 494 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK0030SB0107 [0,1,0,0,1,0|1,0,1]=4 495 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)Cl WXVL_AK0030SB0107 [0,1,0,0,1,0|1,0,1]=4 496 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)F WXVL_AK0030SB0106 [0,1,0,0,1,0|1,0,1]=4 497 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)F WXVL_AK0030SB0106 [0,1,0,0,1,0|1,0,1]=4 498 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)O WXVL_AK0030SB0110 [0,1,0,0,1,0|1,0,1]=4 499 B14R1.698 CC(C)NC(=O)Cc1ccc(cc1)O WXVL_AK0030SB0110 [0,1,0,0,1,0|1,0,1]=4 500 B14R1.698 CC(C)NC(=O)Nc1ccc(cc1)Cl WXVL_AK0030YV0023 [0,1,0,0,1,0|2,0,0]=4 501 B14R1.698 CC(C)NC(=O)Nc1ccc(cc1)Cl WXVL_AK0030YV0023 [0,1,0,0,1,0|2,0,0]=4 502 B14R1.698 Cc1ccc(cc1)CC(=O)NC(C)C WXVL_AK0030SB0112 [0,1,0,0,1,0|1,0,1]=4 503 B14R1.698 Cc1ccc(cc1)CC(=O)NC(C)C WXVL_AK0030SB0112 [0,1,0,0,1,0|1,0,1]=4 504 B14R1.698 Cc1ccc(cc1)NC(=O)NC(C)C WXVL_AK0030YV0026 [0,1,0,0,1,0|2,0,0]=4 505 B14R1.698 Cc1ccc(cc1)NC(=O)NC(C)C WXVL_AK0030YV0026 [0,1,0,0,1,0|2,0,0]=4 506 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0353 [0,1,0,0,1,0|2,0,0]=4 507 B14R1.743 CCC(C)CC(=O)Nc1ccccc1 WXVL_AG00183SB0353 [0,1,0,0,1,0|2,0,0]=4 508 B14R1.743 CC[C@@H](C)CC(=O)Nc1ccccc1 WXVL_AG00183SB8650 [0,1,0,0,1,0|2,0,0]=4 509 B14R1.743 CC[C@@H](C)CC(=O)Nc1ccccc1 WXVL_AG00183SB8650 [0,1,0,0,1,0|2,0,0]=4 510 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00678SB0092 [0,1,0,0,1,0|1,0,1]=4 511 B14R1.743 CC[C@H](C)NC(=O)Cc1ccccc1 WXVL_AK00678SB0092 [0,1,0,0,1,0|1,0,1]=4 512 B14R1.743 C[C@@H](CF)NC(=O)Cc1ccccc1 WXVL_AK00558SB0092 [0,1,0,0,1,0|1,0,1]=4 513 B14R1.743 C[C@@H](CF)NC(=O)Cc1ccccc1 WXVL_AK00558SB0092 [0,1,0,0,1,0|1,0,1]=4 514 B14R1.743 C[C@@H](CO)NC(=O)Cc1ccccc1 WXVL_AK0109SB0092 [0,1,0,0,1,0|1,0,1]=4 515 B14R1.743 C[C@@H](CO)NC(=O)Cc1ccccc1 WXVL_AK0109SB0092 [0,1,0,0,1,0|1,0,1]=4 516 B14R1.5978 CC(C)CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0063 [0,1,0,0,1,0|2,0,0]=4 517 B14R1.5978 CC(C)CC(=O)Nc1cccc(c1)I WXVL_AG0649SB0063 [0,1,0,0,1,0|2,0,0]=4 518 B14R1.5978 CC(C)CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0063 [0,1,0,0,1,0|2,0,0]=4 519 B14R1.5978 CC(C)CC(=O)Nc1cccc(c1)O WXVL_AG00200SB0063 [0,1,0,0,1,0|2,0,0]=4 520 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)Br WXVL_AK0030SB0099 [0,1,0,0,1,0|1,0,1]=4 521 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)Br WXVL_AK0030SB0099 [0,1,0,0,1,0|1,0,1]=4 522 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)Cl WXVL_AK0030SB0101 [0,1,0,0,1,0|1,0,1]=4 523 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)Cl WXVL_AK0030SB0101 [0,1,0,0,1,0|1,0,1]=4 524 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)F WXVL_AK0030SB0100 [0,1,0,0,1,0|1,0,1]=4 525 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)F WXVL_AK0030SB0100 [0,1,0,0,1,0|1,0,1]=4 526 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)O WXVL_AK0030SB0104 [0,1,0,0,1,0|1,0,1]=4 527 B14R1.5978 CC(C)NC(=O)Cc1cccc(c1)O WXVL_AK0030SB0104 [0,1,0,0,1,0|1,0,1]=4 528 B14R1.5978 CC(C)NC(=O)Nc1cccc(c1)Br WXVL_AK0030YV0098 [0,1,0,0,1,0|2,0,0]=4 529 B14R1.5978 CC(C)NC(=O)Nc1cccc(c1)Br WXVL_AK0030YV0098 [0,1,0,0,1,0|2,0,0]=4 530 B14R1.5978 CC(C)NC(=O)Nc1cccc(c1)Cl WXVL_AK0030YV0016 [0,1,0,0,1,0|2,0,0]=4 531 B14R1.5978 CC(C)NC(=O)Nc1cccc(c1)Cl WXVL_AK0030YV0016 [0,1,0,0,1,0|2,0,0]=4 532 B14R1.5978 Cc1cccc(c1)CC(=O)NC(C)C WXVL_AK0030SB0105 [0,1,0,0,1,0|1,0,1]=4 533 B14R1.5978 Cc1cccc(c1)CC(=O)NC(C)C WXVL_AK0030SB0105 [0,1,0,0,1,0|1,0,1]=4 534 B14R1.5978 Cc1cccc(c1)NC(=O)CC(C)C WXVL_AG0052SB0063 [0,1,0,0,1,0|2,0,0]=4 535 B14R1.5978 Cc1cccc(c1)NC(=O)CC(C)C WXVL_AG0052SB0063 [0,1,0,0,1,0|2,0,0]=4 536 B14R1.5978 Cc1cccc(c1)NC(=O)NC(C)C WXVL_AK0030YV0020 [0,1,0,0,1,0|2,0,0]=4 537 B14R1.5978 Cc1cccc(c1)NC(=O)NC(C)C WXVL_AK0030YV0020 [0,1,0,0,1,0|2,0,0]=4 538 B14R1.161 CC(C)C(=O)NCc1ccccc1Br WXVL_AK1632SB0052 [0,1,0,0,1,0|1,0,1]=4 539 B14R1.161 CC(C)C(=O)NCc1ccccc1Br WXVL_AK1632SB0052 [0,1,0,0,1,0|1,0,1]=4 540 B14R1.161 CC(C)C(=O)NCc1ccccc1Cl WXVL_AK0038SB0052 [0,1,0,0,1,0|1,0,1]=4 541 B14R1.161 CC(C)C(=O)NCc1ccccc1Cl WXVL_AK0038SB0052 [0,1,0,0,1,0|1,0,1]=4 542 B14R1.161 CC(C)C(=O)NCc1ccccc1F WXVL_AK0037SB0052 [0,1,0,0,1,0|1,0,1]=4 543 B14R1.161 CC(C)C(=O)NCc1ccccc1F WXVL_AK0037SB0052 [0,1,0,0,1,0|1,0,1]=4 544 B14R1.161 CC(C)C(=O)NCc1ccccc1I WXVL_AK3923SB0052 [0,1,0,0,1,0|1,0,1]=4 545 B14R1.161 CC(C)C(=O)NCc1ccccc1I WXVL_AK3923SB0052 [0,1,0,0,1,0|1,0,1]=4 546 B14R1.161 CC(C)C(=O)NCc1ccccc1O WXVL_AK0963SB0052 [0,1,0,0,1,0|1,0,1]=4 547 B14R1.161 CC(C)C(=O)NCc1ccccc1O WXVL_AK0963SB0052 [0,1,0,0,1,0|1,0,1]=4 548 B14R1.161 CN(C)C(=O)C=Cc1ccccc1Br WXVL_AN0032SB3065 [0,1,0,0,1,0|1,0,0]=3 549 B14R1.161 CN(C)C(=O)C=Cc1ccccc1Br WXVL_AN0032SB3065 [0,1,0,0,1,0|1,0,0]=3 550 B14R1.161 Cc1ccccc1CNC(=O)C(C)C WXVL_AK0040SB0052 [0,1,0,0,1,0|1,0,1]=4 551 B14R1.161 Cc1ccccc1CNC(=O)C(C)C WXVL_AK0040SB0052 [0,1,0,0,1,0|1,0,1]=4 552 B14R1.415 CN(C)C(=O)NC(=O)c1ccccc1 WXVL_AN0032YV0027 [0,1,0,0,1,0|2,0,0]=4 553 B14R1.415 CN(C)C(=O)NC(=O)c1ccccc1 WXVL_AN0032YV0027 [0,1,0,0,1,0|2,0,0]=4 554 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0052 [0,1,0,0,1,0|1,0,1]=4 555 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0052 [0,1,0,0,1,0|1,0,1]=4 556 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0052 [0,1,0,0,1,0|1,0,1]=4 557 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0052 [0,1,0,0,1,0|1,0,1]=4 558 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)F WXVL_AK0046SB0052 [0,1,0,0,1,0|1,0,1]=4 559 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)F WXVL_AK0046SB0052 [0,1,0,0,1,0|1,0,1]=4 560 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)I WXVL_AK1644SB0052 [0,1,0,0,1,0|1,0,1]=4 561 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)I WXVL_AK1644SB0052 [0,1,0,0,1,0|1,0,1]=4 562 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)O WXVL_AK0926SB0052 [0,1,0,0,1,0|1,0,1]=4 563 B14R1.679 CC(C)C(=O)NCc1ccc(cc1)O WXVL_AK0926SB0052 [0,1,0,0,1,0|1,0,1]=4 564 B14R1.679 CN(C)C(=O)/C=C/c1ccc(cc1)O WXVL_AN0032SB0418 [0,1,0,0,1,0|1,0,0]=3 565 B14R1.679 CN(C)C(=O)/C=C/c1ccc(cc1)O WXVL_AN0032SB0418 [0,1,0,0,1,0|1,0,0]=3 566 B14R1.679 CN(C)C(=O)C=Cc1ccc(cc1)Br WXVL_AN0032SB1122 [0,1,0,0,1,0|1,0,0]=3 567 B14R1.679 CN(C)C(=O)C=Cc1ccc(cc1)Br WXVL_AN0032SB1122 [0,1,0,0,1,0|1,0,0]=3 568 B14R1.679 CN(C)C(=O)C=Cc1ccc(cc1)Cl WXVL_AN0032SB0119 [0,1,0,0,1,0|1,0,0]=3 569 B14R1.679 CN(C)C(=O)C=Cc1ccc(cc1)Cl WXVL_AN0032SB0119 [0,1,0,0,1,0|1,0,0]=3 570 B14R1.679 CN(C)C(=O)C=Cc1ccc(cc1)F WXVL_AN0032SB1186 [0,1,0,0,1,0|1,0,0]=3 571 B14R1.679 CN(C)C(=O)C=Cc1ccc(cc1)F WXVL_AN0032SB1186 [0,1,0,0,1,0|1,0,0]=3 572 B14R1.679 Cc1ccc(cc1)C=CC(=O)N(C)C WXVL_AN0032SB0060 [0,1,0,0,1,0|1,0,0]=3 573 B14R1.679 Cc1ccc(cc1)C=CC(=O)N(C)C WXVL_AN0032SB0060 [0,1,0,0,1,0|1,0,0]=3 574 B14R1.679 Cc1ccc(cc1)CNC(=O)C(C)C WXVL_AK0048SB0052 [0,1,0,0,1,0|1,0,1]=4 575 B14R1.679 Cc1ccc(cc1)CNC(=O)C(C)C WXVL_AK0048SB0052 [0,1,0,0,1,0|1,0,1]=4 576 B14R1.3099 CC(C)(Br)C(=O)NCc1ccccc1 WXVL_AK00502SB0432 [0,1,0,0,1,0|1,0,1]=4 577 B14R1.3099 CC(C)(Br)C(=O)NCc1ccccc1 WXVL_AK00502SB0432 [0,1,0,0,1,0|1,0,1]=4 578 B14R1.3099 CC(C)(C)C(=O)NCc1ccccc1 WXVL_AK00502SB0078 [0,1,0,0,1,0|1,0,1]=4 579 B14R1.3099 CC(C)(C)C(=O)NCc1ccccc1 WXVL_AK00502SB0078 [0,1,0,0,1,0|1,0,1]=4 580 B14R1.3099 CC(C)(F)C(=O)NCc1ccccc1 WXVL_AK00502SB0199 [0,1,0,0,1,0|1,0,1]=4 581 B14R1.3099 CC(C)(F)C(=O)NCc1ccccc1 WXVL_AK00502SB0199 [0,1,0,0,1,0|1,0,1]=4 582 B14R1.3099 CC(C)(O)C(=O)NCc1ccccc1 WXVL_AK00502SB0125 [0,1,0,0,1,0|1,0,1]=4 583 B14R1.3099 CC(C)(O)C(=O)NCc1ccccc1 WXVL_AK00502SB0125 [0,1,0,0,1,0|1,0,1]=4 584 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)Br WXVL_AK1177SB0052 [0,1,0,0,1,0|1,0,1]=4 585 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)Br WXVL_AK1177SB0052 [0,1,0,0,1,0|1,0,1]=4 586 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0052 [0,1,0,0,1,0|1,0,1]=4 587 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0052 [0,1,0,0,1,0|1,0,1]=4 588 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)F WXVL_AK0041SB0052 [0,1,0,0,1,0|1,0,1]=4 589 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)F WXVL_AK0041SB0052 [0,1,0,0,1,0|1,0,1]=4 590 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)I WXVL_AK1572SB0052 [0,1,0,0,1,0|1,0,1]=4 591 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)I WXVL_AK1572SB0052 [0,1,0,0,1,0|1,0,1]=4 592 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)O WXVL_AK0974SB0052 [0,1,0,0,1,0|1,0,1]=4 593 B14R1.5956 CC(C)C(=O)NCc1cccc(c1)O WXVL_AK0974SB0052 [0,1,0,0,1,0|1,0,1]=4 594 B14R1.5956 CN(C)C(=O)C=Cc1cccc(c1)Cl WXVL_AN0032SB1601 [0,1,0,0,1,0|1,0,0]=3 595 B14R1.5956 CN(C)C(=O)C=Cc1cccc(c1)Cl WXVL_AN0032SB1601 [0,1,0,0,1,0|1,0,0]=3 596 B14R1.5956 CN(C)C(=O)C=Cc1cccc(c1)O WXVL_AN0032SB0417 [0,1,0,0,1,0|1,0,0]=3 597 B14R1.5956 CN(C)C(=O)C=Cc1cccc(c1)O WXVL_AN0032SB0417 [0,1,0,0,1,0|1,0,0]=3 598 B14R1.5956 Cc1cccc(c1)CNC(=O)C(C)C WXVL_AK0045SB0052 [0,1,0,0,1,0|1,0,1]=4 599 B14R1.5956 Cc1cccc(c1)CNC(=O)C(C)C WXVL_AK0045SB0052 [0,1,0,0,1,0|1,0,1]=4 600 B14R1.6395 CN(C)S(=O)(=O)/C=C/c1ccccc1 WXVL_AN0032HU0026 [0,1,0,0,1,0|2,0,0]=4 601 B14R1.6395 CN(C)S(=O)(=O)/C=C/c1ccccc1 WXVL_AN0032HU0026 [0,1,0,0,1,0|2,0,0]=4 602 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccco1 WXVL_AK00678SA0180 [0,1,0,0,1,0|2,0,0]=4 603 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccco1 WXVL_AK00678SA0180 [0,1,0,0,1,0|2,0,0]=4 604 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1cccs1 WXVL_AK00678SA0001 [0,1,0,0,1,0|2,0,0]=4 605 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1cccs1 WXVL_AK00678SA0001 [0,1,0,0,1,0|2,0,0]=4 606 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccoc1 WXVL_AK00678SA0047 [0,1,0,0,1,0|2,0,0]=4 607 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccoc1 WXVL_AK00678SA0047 [0,1,0,0,1,0|2,0,0]=4 608 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccsc1 WXVL_AK00678SA0251 [0,1,0,0,1,0|2,0,0]=4 609 B14R1.588 CC[C@H](C)NC(=O)/C=C/c1ccsc1 WXVL_AK00678SA0251 [0,1,0,0,1,0|2,0,0]=4 610 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1ccco1 WXVL_AK00558SA0180 [0,1,0,0,1,0|2,0,0]=4 611 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1ccco1 WXVL_AK00558SA0180 [0,1,0,0,1,0|2,0,0]=4 612 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1cccs1 WXVL_AK00558SA0001 [0,1,0,0,1,0|2,0,0]=4 613 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1cccs1 WXVL_AK00558SA0001 [0,1,0,0,1,0|2,0,0]=4 614 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1ccoc1 WXVL_AK00558SA0047 [0,1,0,0,1,0|2,0,0]=4 615 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1ccoc1 WXVL_AK00558SA0047 [0,1,0,0,1,0|2,0,0]=4 616 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1ccsc1 WXVL_AK00558SA0251 [0,1,0,0,1,0|2,0,0]=4 617 B14R1.588 C[C@@H](CF)NC(=O)/C=C/c1ccsc1 WXVL_AK00558SA0251 [0,1,0,0,1,0|2,0,0]=4 618 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1ccco1 WXVL_AK0109SA0180 [0,1,0,0,1,0|2,0,0]=4 619 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1ccco1 WXVL_AK0109SA0180 [0,1,0,0,1,0|2,0,0]=4 620 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1cccs1 WXVL_AK0109SA0001 [0,1,0,0,1,0|2,0,0]=4 621 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1cccs1 WXVL_AK0109SA0001 [0,1,0,0,1,0|2,0,0]=4 622 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1ccoc1 WXVL_AK0109SA0047 [0,1,0,0,1,0|2,0,0]=4 623 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1ccoc1 WXVL_AK0109SA0047 [0,1,0,0,1,0|2,0,0]=4 624 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1ccsc1 WXVL_AK0109SA0251 [0,1,0,0,1,0|2,0,0]=4 625 B14R1.588 C[C@@H](CO)NC(=O)/C=C/c1ccsc1 WXVL_AK0109SA0251 [0,1,0,0,1,0|2,0,0]=4 626 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1ccco1 WXVL_AN0073SA0180 [0,1,0,0,1,0|2,0,0]=4 627 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1ccco1 WXVL_AN0073SA0180 [0,1,0,0,1,0|2,0,0]=4 628 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1cccs1 WXVL_AN0073SA0001 [0,1,0,0,1,0|2,0,0]=4 629 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1cccs1 WXVL_AN0073SA0001 [0,1,0,0,1,0|2,0,0]=4 630 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1ccoc1 WXVL_AN0073SA0047 [0,1,0,0,1,0|2,0,0]=4 631 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1ccoc1 WXVL_AN0073SA0047 [0,1,0,0,1,0|2,0,0]=4 632 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1ccsc1 WXVL_AN0073SA0251 [0,1,0,0,1,0|2,0,0]=4 633 B14R1.3224 CC(C)N(C)C(=O)/C=C/c1ccsc1 WXVL_AN0073SA0251 [0,1,0,0,1,0|2,0,0]=4 634 B14R1.4262 Cc1ccc(s1)/C=C/C(=O)NC(C)C WXVL_AK0030SA1334 [0,1,0,0,1,0|2,0,0]=4 635 B14R1.4262 Cc1ccc(s1)/C=C/C(=O)NC(C)C WXVL_AK0030SA1334 [0,1,0,0,1,0|2,0,0]=4 636 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1ccco1 WXVL_AK0024SA0180 [0,1,0,0,1,0|2,0,0]=4 637 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1ccco1 WXVL_AK0024SA0180 [0,1,0,0,1,0|2,0,0]=4 638 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1cccs1 WXVL_AK0024SA0001 [0,1,0,0,1,0|2,0,0]=4 639 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1cccs1 WXVL_AK0024SA0001 [0,1,0,0,1,0|2,0,0]=4 640 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1ccoc1 WXVL_AK0024SA0047 [0,1,0,0,1,0|2,0,0]=4 641 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1ccoc1 WXVL_AK0024SA0047 [0,1,0,0,1,0|2,0,0]=4 642 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1ccsc1 WXVL_AK0024SA0251 [0,1,0,0,1,0|2,0,0]=4 643 B14R1.9400 CC(C)(C)NC(=O)/C=C/c1ccsc1 WXVL_AK0024SA0251 [0,1,0,0,1,0|2,0,0]=4 644 B16R1.400 CC(C)CNC(=O)C=Cc1ccccc1Br WXVL_AK00544SB3065 [0,1,0,0,0,1|1,0,0]=3 645 B16R1.400 CC(C)CNC(=O)C=Cc1ccccc1Br WXVL_AK00544SB3065 [0,1,0,0,0,1|1,0,0]=3 646 B16R1.400 CC(C)OCC(=O)NCc1ccccc1Br WXVL_AK1632SB0213 [0,1,0,0,0,1|1,0,1]=4 647 B16R1.400 CC(C)OCC(=O)NCc1ccccc1Br WXVL_AK1632SB0213 [0,1,0,0,0,1|1,0,1]=4 648 B16R1.400 CC(C)OCC(=O)NCc1ccccc1Cl WXVL_AK0038SB0213 [0,1,0,0,0,1|1,0,1]=4 649 B16R1.400 CC(C)OCC(=O)NCc1ccccc1Cl WXVL_AK0038SB0213 [0,1,0,0,0,1|1,0,1]=4 650 B16R1.400 CC(C)OCC(=O)NCc1ccccc1F WXVL_AK0037SB0213 [0,1,0,0,0,1|1,0,1]=4 651 B16R1.400 CC(C)OCC(=O)NCc1ccccc1F WXVL_AK0037SB0213 [0,1,0,0,0,1|1,0,1]=4 652 B16R1.400 CC(C)OCC(=O)NCc1ccccc1I WXVL_AK3923SB0213 [0,1,0,0,0,1|1,0,1]=4 653 B16R1.400 CC(C)OCC(=O)NCc1ccccc1I WXVL_AK3923SB0213 [0,1,0,0,0,1|1,0,1]=4 654 B16R1.400 CC(C)OCC(=O)NCc1ccccc1O WXVL_AK0963SB0213 [0,1,0,0,0,1|1,0,1]=4 655 B16R1.400 CC(C)OCC(=O)NCc1ccccc1O WXVL_AK0963SB0213 [0,1,0,0,0,1|1,0,1]=4 656 B16R1.400 CC(O)CNC(=O)C=Cc1ccccc1Br WXVL_AK0052SB3065 [0,1,0,0,0,1|2,0,0]=4 657 B16R1.400 CC(O)CNC(=O)C=Cc1ccccc1Br WXVL_AK0052SB3065 [0,1,0,0,0,1|2,0,0]=4 658 B16R1.400 C[C@H](O)CNC(=O)C=Cc1ccccc1Br WXVL_AK0113SB3065 [0,1,0,0,0,1|2,0,0]=4 659 B16R1.400 C[C@H](O)CNC(=O)C=Cc1ccccc1Br WXVL_AK0113SB3065 [0,1,0,0,0,1|2,0,0]=4 660 B16R1.400 Cc1ccccc1CNC(=O)COC(C)C WXVL_AK0040SB0213 [0,1,0,0,0,1|1,0,1]=4 661 B16R1.400 Cc1ccccc1CNC(=O)COC(C)C WXVL_AK0040SB0213 [0,1,0,0,0,1|1,0,1]=4 662 B16R1.1061 CC(C)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00544SB0418 [0,1,0,0,0,1|1,0,0]=3 663 B16R1.1061 CC(C)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK00544SB0418 [0,1,0,0,0,1|1,0,0]=3 664 B16R1.1061 CC(C)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00544SB1122 [0,1,0,0,0,1|1,0,0]=3 665 B16R1.1061 CC(C)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK00544SB1122 [0,1,0,0,0,1|1,0,0]=3 666 B16R1.1061 CC(C)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00544SB0119 [0,1,0,0,0,1|1,0,0]=3 667 B16R1.1061 CC(C)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00544SB0119 [0,1,0,0,0,1|1,0,0]=3 668 B16R1.1061 CC(C)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK00544SB1186 [0,1,0,0,0,1|1,0,0]=3 669 B16R1.1061 CC(C)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK00544SB1186 [0,1,0,0,0,1|1,0,0]=3 670 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0213 [0,1,0,0,0,1|1,0,1]=4 671 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)Br WXVL_AK1474SB0213 [0,1,0,0,0,1|1,0,1]=4 672 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0213 [0,1,0,0,0,1|1,0,1]=4 673 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)Cl WXVL_AK0047SB0213 [0,1,0,0,0,1|1,0,1]=4 674 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0213 [0,1,0,0,0,1|1,0,1]=4 675 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)F WXVL_AK0046SB0213 [0,1,0,0,0,1|1,0,1]=4 676 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0213 [0,1,0,0,0,1|1,0,1]=4 677 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)I WXVL_AK1644SB0213 [0,1,0,0,0,1|1,0,1]=4 678 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0213 [0,1,0,0,0,1|1,0,1]=4 679 B16R1.1061 CC(C)OCC(=O)NCc1ccc(cc1)O WXVL_AK0926SB0213 [0,1,0,0,0,1|1,0,1]=4 680 B16R1.1061 CC(O)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0052SB0418 [0,1,0,0,0,1|2,0,0]=4 681 B16R1.1061 CC(O)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0052SB0418 [0,1,0,0,0,1|2,0,0]=4 682 B16R1.1061 CC(O)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0052SB1122 [0,1,0,0,0,1|2,0,0]=4 683 B16R1.1061 CC(O)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0052SB1122 [0,1,0,0,0,1|2,0,0]=4 684 B16R1.1061 CC(O)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0052SB0119 [0,1,0,0,0,1|2,0,0]=4 685 B16R1.1061 CC(O)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0052SB0119 [0,1,0,0,0,1|2,0,0]=4 686 B16R1.1061 CC(O)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0052SB1186 [0,1,0,0,0,1|2,0,0]=4 687 B16R1.1061 CC(O)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0052SB1186 [0,1,0,0,0,1|2,0,0]=4 688 B16R1.1061 C[C@H](O)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0113SB0418 [0,1,0,0,0,1|2,0,0]=4 689 B16R1.1061 C[C@H](O)CNC(=O)/C=C/c1ccc(cc1)O WXVL_AK0113SB0418 [0,1,0,0,0,1|2,0,0]=4 690 B16R1.1061 C[C@H](O)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0113SB1122 [0,1,0,0,0,1|2,0,0]=4 691 B16R1.1061 C[C@H](O)CNC(=O)C=Cc1ccc(cc1)Br WXVL_AK0113SB1122 [0,1,0,0,0,1|2,0,0]=4 692 B16R1.1061 C[C@H](O)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0113SB0119 [0,1,0,0,0,1|2,0,0]=4 693 B16R1.1061 C[C@H](O)CNC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0113SB0119 [0,1,0,0,0,1|2,0,0]=4 694 B16R1.1061 C[C@H](O)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0113SB1186 [0,1,0,0,0,1|2,0,0]=4 695 B16R1.1061 C[C@H](O)CNC(=O)C=Cc1ccc(cc1)F WXVL_AK0113SB1186 [0,1,0,0,0,1|2,0,0]=4 696 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NCC(C)C WXVL_AK00544SB0060 [0,1,0,0,0,1|1,0,0]=3 697 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NCC(C)C WXVL_AK00544SB0060 [0,1,0,0,0,1|1,0,0]=3 698 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NCC(C)O WXVL_AK0052SB0060 [0,1,0,0,0,1|2,0,0]=4 699 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NCC(C)O WXVL_AK0052SB0060 [0,1,0,0,0,1|2,0,0]=4 700 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NC[C@H](C)O WXVL_AK0113SB0060 [0,1,0,0,0,1|2,0,0]=4 701 B16R1.1061 Cc1ccc(cc1)C=CC(=O)NC[C@H](C)O WXVL_AK0113SB0060 [0,1,0,0,0,1|2,0,0]=4 702 B16R1.1061 Cc1ccc(cc1)CNC(=O)COC(C)C WXVL_AK0048SB0213 [0,1,0,0,0,1|1,0,1]=4 703 B16R1.1061 Cc1ccc(cc1)CNC(=O)COC(C)C WXVL_AK0048SB0213 [0,1,0,0,0,1|1,0,1]=4 704 B16R1.1284 C/C(=C\c1cccnc1)/C(=O)NCC(C)C WXVL_AK00544SA1933 [0,1,0,0,0,1|2,0,0]=4 705 B16R1.1284 C/C(=C\c1cccnc1)/C(=O)NCC(C)C WXVL_AK00544SA1933 [0,1,0,0,0,1|2,0,0]=4 706 B16R1.1284 C=C(Cc1ccccc1)C(=O)NCC(C)C WXVL_AK00544SB0413 [0,1,0,0,0,1|1,0,1]=4 707 B16R1.1284 C=C(Cc1ccccc1)C(=O)NCC(C)C WXVL_AK00544SB0413 [0,1,0,0,0,1|1,0,1]=4 708 B16R1.1284 CC(C)OCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0213 [0,1,0,0,0,1|1,0,1]=4 709 B16R1.1284 CC(C)OCC(=O)N(C)Cc1ccccc1 WXVL_AN0033SB0213 [0,1,0,0,0,1|1,0,1]=4 710 B16R1.1343 CO[C@H](C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00704SB0115 [0,1,0,0,0,1|1,0,0]=3 711 B16R1.1343 CO[C@H](C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00704SB0115 [0,1,0,0,0,1|1,0,0]=3 712 B16R1.1343 CO[C@H](C)CNC(=O)/C=C/c1cccnc1 WXVL_AK00704SA0193 [0,1,0,0,0,1|2,0,0]=4 713 B16R1.1343 CO[C@H](C)CNC(=O)/C=C/c1cccnc1 WXVL_AK00704SA0193 [0,1,0,0,0,1|2,0,0]=4 714 B16R1.1343 O=C(/C=C/c1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0115 [0,1,0,0,0,1|2,0,0]=4 715 B16R1.1343 O=C(/C=C/c1ccccc1)NC[C@@H](F)CO WXVL_AK00590SB0115 [0,1,0,0,0,1|2,0,0]=4 716 B16R1.1343 O=C(/C=C/c1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0115 [0,1,0,0,0,1|2,0,0]=4 717 B16R1.1343 O=C(/C=C/c1ccccc1)NC[C@H](O)CO WXVL_AK00483SB0115 [0,1,0,0,0,1|2,0,0]=4 718 B16R1.1771 CC(C)CNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00544HU0026 [0,1,0,0,0,1|2,0,0]=4 719 B16R1.1771 CC(C)CNS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00544HU0026 [0,1,0,0,0,1|2,0,0]=4 720 B16R1.7611 CC(C)CNC(=O)NC(=O)c1ccccc1 WXVL_AK00544YV0027 [0,1,0,0,0,1|2,0,0]=4 721 B16R1.7611 CC(C)CNC(=O)NC(=O)c1ccccc1 WXVL_AK00544YV0027 [0,1,0,0,0,1|2,0,0]=4 722 B16R1.11227 CC(C)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00544SB1601 [0,1,0,0,0,1|1,0,0]=3 723 B16R1.11227 CC(C)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK00544SB1601 [0,1,0,0,0,1|1,0,0]=3 724 B16R1.11227 CC(C)CNC(=O)C=Cc1cccc(c1)O WXVL_AK00544SB0417 [0,1,0,0,0,1|1,0,0]=3 725 B16R1.11227 CC(C)CNC(=O)C=Cc1cccc(c1)O WXVL_AK00544SB0417 [0,1,0,0,0,1|1,0,0]=3 726 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0213 [0,1,0,0,0,1|1,0,1]=4 727 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)Br WXVL_AK1177SB0213 [0,1,0,0,0,1|1,0,1]=4 728 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0213 [0,1,0,0,0,1|1,0,1]=4 729 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)Cl WXVL_AK0094SB0213 [0,1,0,0,0,1|1,0,1]=4 730 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)F WXVL_AK0041SB0213 [0,1,0,0,0,1|1,0,1]=4 731 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)F WXVL_AK0041SB0213 [0,1,0,0,0,1|1,0,1]=4 732 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)I WXVL_AK1572SB0213 [0,1,0,0,0,1|1,0,1]=4 733 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)I WXVL_AK1572SB0213 [0,1,0,0,0,1|1,0,1]=4 734 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)O WXVL_AK0974SB0213 [0,1,0,0,0,1|1,0,1]=4 735 B16R1.11227 CC(C)OCC(=O)NCc1cccc(c1)O WXVL_AK0974SB0213 [0,1,0,0,0,1|1,0,1]=4 736 B16R1.11227 CC(O)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0052SB1601 [0,1,0,0,0,1|2,0,0]=4 737 B16R1.11227 CC(O)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0052SB1601 [0,1,0,0,0,1|2,0,0]=4 738 B16R1.11227 CC(O)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0052SB0417 [0,1,0,0,0,1|2,0,0]=4 739 B16R1.11227 CC(O)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0052SB0417 [0,1,0,0,0,1|2,0,0]=4 740 B16R1.11227 C[C@H](O)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0113SB1601 [0,1,0,0,0,1|2,0,0]=4 741 B16R1.11227 C[C@H](O)CNC(=O)C=Cc1cccc(c1)Cl WXVL_AK0113SB1601 [0,1,0,0,0,1|2,0,0]=4 742 B16R1.11227 C[C@H](O)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0113SB0417 [0,1,0,0,0,1|2,0,0]=4 743 B16R1.11227 C[C@H](O)CNC(=O)C=Cc1cccc(c1)O WXVL_AK0113SB0417 [0,1,0,0,0,1|2,0,0]=4 744 B16R1.11227 Cc1cccc(c1)CNC(=O)COC(C)C WXVL_AK0045SB0213 [0,1,0,0,0,1|1,0,1]=4 745 B16R1.11227 Cc1cccc(c1)CNC(=O)COC(C)C WXVL_AK0045SB0213 [0,1,0,0,0,1|1,0,1]=4 746 B16R1.22556 CC(C)(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00655SB0115 [0,1,0,0,0,1|1,0,0]=3 747 B16R1.22556 CC(C)(C)CNC(=O)/C=C/c1ccccc1 WXVL_AK00655SB0115 [0,1,0,0,0,1|1,0,0]=3 748 B16R1.22556 CC(C)(C)CNC(=O)/C=C/c1cccnc1 WXVL_AK00655SA0193 [0,1,0,0,0,1|2,0,0]=4 749 B16R1.22556 CC(C)(C)CNC(=O)/C=C/c1cccnc1 WXVL_AK00655SA0193 [0,1,0,0,0,1|2,0,0]=4 750 B16R1.22556 CC(C)(C)OCC(=O)NCc1ccccc1 WXVL_AK00502SB1440 [0,1,0,0,0,1|1,0,1]=4 751 B16R1.22556 CC(C)(C)OCC(=O)NCc1ccccc1 WXVL_AK00502SB1440 [0,1,0,0,0,1|1,0,1]=4 752 B16R1.22556 CC(C)(F)CNC(=O)/C=C/c1ccccc1 WXVL_AK00660SB0115 [0,1,0,0,0,1|1,0,0]=3 753 B16R1.22556 CC(C)(F)CNC(=O)/C=C/c1ccccc1 WXVL_AK00660SB0115 [0,1,0,0,0,1|1,0,0]=3 754 B16R1.22556 CC(C)(F)CNC(=O)/C=C/c1cccnc1 WXVL_AK00660SA0193 [0,1,0,0,0,1|2,0,0]=4 755 B16R1.22556 CC(C)(F)CNC(=O)/C=C/c1cccnc1 WXVL_AK00660SA0193 [0,1,0,0,0,1|2,0,0]=4 756 B16R1.22556 CC(C)(O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0490SB0115 [0,1,0,0,0,1|1,0,0]=3 757 B16R1.22556 CC(C)(O)CNC(=O)/C=C/c1ccccc1 WXVL_AK0490SB0115 [0,1,0,0,0,1|1,0,0]=3 758 B16R1.22556 CC(C)(O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0490SA0193 [0,1,0,0,0,1|2,0,0]=4 759 B16R1.22556 CC(C)(O)CNC(=O)/C=C/c1cccnc1 WXVL_AK0490SA0193 [0,1,0,0,0,1|2,0,0]=4 760 B16R1.22556 CC(F)(F)CNC(=O)/C=C/c1ccccc1 WXVL_AK0308SB0115 [0,1,0,0,0,1|2,0,0]=4 761 B16R1.22556 CC(F)(F)CNC(=O)/C=C/c1ccccc1 WXVL_AK0308SB0115 [0,1,0,0,0,1|2,0,0]=4 762 B16R1.612 CC(C)NC(=O)CNC(=O)c1ccccc1 WXVL_AK0030SB0466 [0,1,0,0,0,1|1,0,1]=4 763 B16R1.612 CC(C)NC(=O)CNC(=O)c1ccccc1 WXVL_AK0030SB0466 [0,1,0,0,0,1|1,0,1]=4 764 B16R1.853 C#C[C@@H](C)NC(=O)C=Cc1ccccc1Br WXVL_AK00735SB3065 [0,2,0,0,0,0|1,0,1]=4 765 B16R1.853 C#C[C@@H](C)NC(=O)C=Cc1ccccc1Br WXVL_AK00735SB3065 [0,2,0,0,0,0|1,0,1]=4 766 B16R1.853 C=CC(C)NC(=O)C=Cc1ccccc1Br WXVL_AK00769SB3065 [0,2,0,0,0,0|1,0,1]=4 767 B16R1.853 C=CC(C)NC(=O)C=Cc1ccccc1Br WXVL_AK00769SB3065 [0,2,0,0,0,0|1,0,1]=4 768 B16R1.853 CC(C#N)NC(=O)C=Cc1ccccc1Br WXVL_AK00810SB3065 [0,2,0,0,0,0|1,0,1]=4 769 B16R1.853 CC(C#N)NC(=O)C=Cc1ccccc1Br WXVL_AK00810SB3065 [0,2,0,0,0,0|1,0,1]=4 770 B16R1.853 CC[C@H](C)NC(=O)C=Cc1ccccc1Br WXVL_AK00678SB3065 [0,2,0,0,0,0|1,0,0]=3 771 B16R1.853 CC[C@H](C)NC(=O)C=Cc1ccccc1Br WXVL_AK00678SB3065 [0,2,0,0,0,0|1,0,0]=3 772 B16R1.853 C[C@@H](CF)NC(=O)C=Cc1ccccc1Br WXVL_AK00558SB3065 [0,2,0,0,0,0|1,0,0]=3 773 B16R1.853 C[C@@H](CF)NC(=O)C=Cc1ccccc1Br WXVL_AK00558SB3065 [0,2,0,0,0,0|1,0,0]=3 774 B16R1.853 C[C@@H](CO)NC(=O)C=Cc1ccccc1Br WXVL_AK0109SB3065 [0,2,0,0,0,0|1,0,0]=3 775 B16R1.853 C[C@@H](CO)NC(=O)C=Cc1ccccc1Br WXVL_AK0109SB3065 [0,2,0,0,0,0|1,0,0]=3 776 B16R1.7422 CC(C)(C)NC(=O)C=Cc1ccccc1Br WXVL_AK0024SB3065 [0,2,0,0,0,0|1,0,0]=3 777 B16R1.7422 CC(C)(C)NC(=O)C=Cc1ccccc1Br WXVL_AK0024SB3065 [0,2,0,0,0,0|1,0,0]=3 778 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1Cl)Br WXVL_AK0030SB5557 [0,2,0,0,0,0|1,0,0]=3 779 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1Cl)Br WXVL_AK0030SB5557 [0,2,0,0,0,0|1,0,0]=3 780 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1Cl)O WXVL_AK0030SB8094 [0,2,0,0,0,0|1,0,0]=3 781 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1Cl)O WXVL_AK0030SB8094 [0,2,0,0,0,0|1,0,0]=3 782 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1F)Br WXVL_AK0030SB1318 [0,2,0,0,0,0|1,0,0]=3 783 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1F)Br WXVL_AK0030SB1318 [0,2,0,0,0,0|1,0,0]=3 784 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1F)F WXVL_AK0030SB1257 [0,2,0,0,0,0|1,0,0]=3 785 B16R1.7459 CC(C)NC(=O)/C=C/c1ccc(cc1F)F WXVL_AK0030SB1257 [0,2,0,0,0,0|1,0,0]=3 786 B16R1.7459 CC(C)NC(=O)C=Cc1ccc(cc1Cl)Cl WXVL_AK0030SB0256 [0,2,0,0,0,0|1,0,0]=3 787 B16R1.7459 CC(C)NC(=O)C=Cc1ccc(cc1Cl)Cl WXVL_AK0030SB0256 [0,2,0,0,0,0|1,0,0]=3 788 B16R1.7459 CC(C)NC(=O)C=Cc1ccc(cc1Cl)F WXVL_AK0030SB3115 [0,2,0,0,0,0|1,0,0]=3 789 B16R1.7459 CC(C)NC(=O)C=Cc1ccc(cc1Cl)F WXVL_AK0030SB3115 [0,2,0,0,0,0|1,0,0]=3 790 B16R1.7459 CC(C)NC(=O)C=Cc1ccc(cc1F)Cl WXVL_AK0030SB0235 [0,2,0,0,0,0|1,0,0]=3 791 B16R1.7459 CC(C)NC(=O)C=Cc1ccc(cc1F)Cl WXVL_AK0030SB0235 [0,2,0,0,0,0|1,0,0]=3 792 B16R1.8820 CC(C)N(C)C(=O)C=Cc1ccccc1Br WXVL_AN0073SB3065 [0,2,0,0,0,0|1,0,0]=3 793 B16R1.8820 CC(C)N(C)C(=O)C=Cc1ccccc1Br WXVL_AN0073SB3065 [0,2,0,0,0,0|1,0,0]=3 794 B16R1.1065 CC(C)NC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK0030SB2710 [0,2,0,0,0,0|1,0,1]=4 795 B16R1.1065 CC(C)NC(=O)C(=O)Cc1ccc(cc1)O WXVL_AK0030SB2710 [0,2,0,0,0,0|1,0,1]=4 796 B16R1.1127 C/C(=C\c1cccnc1)/C(=O)N[C@@H](C)CF WXVL_AK00558SA1933 [0,2,0,0,0,0|2,0,0]=4 797 B16R1.1127 C/C(=C\c1cccnc1)/C(=O)N[C@@H](C)CF WXVL_AK00558SA1933 [0,2,0,0,0,0|2,0,0]=4 798 B16R1.1127 C/C(=C\c1cccnc1)/C(=O)N[C@@H](C)CO WXVL_AK0109SA1933 [0,2,0,0,0,0|2,0,0]=4 799 B16R1.1127 C/C(=C\c1cccnc1)/C(=O)N[C@@H](C)CO WXVL_AK0109SA1933 [0,2,0,0,0,0|2,0,0]=4 800 B16R1.1127 C=C(Cc1ccccc1)C(=O)N[C@@H](C)CC WXVL_AK00678SB0413 [0,2,0,0,0,0|1,0,1]=4 801 B16R1.1127 C=C(Cc1ccccc1)C(=O)N[C@@H](C)CC WXVL_AK00678SB0413 [0,2,0,0,0,0|1,0,1]=4 802 B16R1.1127 C=C(Cc1ccccc1)C(=O)N[C@@H](C)CF WXVL_AK00558SB0413 [0,2,0,0,0,0|1,0,1]=4 803 B16R1.1127 C=C(Cc1ccccc1)C(=O)N[C@@H](C)CF WXVL_AK00558SB0413 [0,2,0,0,0,0|1,0,1]=4 804 B16R1.1127 C=C(Cc1ccccc1)C(=O)N[C@@H](C)CO WXVL_AK0109SB0413 [0,2,0,0,0,0|1,0,1]=4 805 B16R1.1127 C=C(Cc1ccccc1)C(=O)N[C@@H](C)CO WXVL_AK0109SB0413 [0,2,0,0,0,0|1,0,1]=4 806 B16R1.1127 CC[C@H](C)NC(=O)/C(=C/c1cccnc1)/C WXVL_AK00678SA1933 [0,2,0,0,0,0|2,0,0]=4 807 B16R1.1127 CC[C@H](C)NC(=O)/C(=C/c1cccnc1)/C WXVL_AK00678SA1933 [0,2,0,0,0,0|2,0,0]=4 808 B16R1.4134 C/C(=C\c1cccnc1)/C(=O)N(C)C(C)C WXVL_AN0073SA1933 [0,2,0,0,0,0|2,0,0]=4 809 B16R1.4134 C/C(=C\c1cccnc1)/C(=O)N(C)C(C)C WXVL_AN0073SA1933 [0,2,0,0,0,0|2,0,0]=4 810 B16R1.4134 C=C(Cc1ccccc1)C(=O)N(C)C(C)C WXVL_AN0073SB0413 [0,2,0,0,0,0|1,0,1]=4 811 B16R1.4134 C=C(Cc1ccccc1)C(=O)N(C)C(C)C WXVL_AN0073SB0413 [0,2,0,0,0,0|1,0,1]=4 812 B16R1.12572 C/C(=C\c1cccnc1)/C(=O)NC(C)(C)C WXVL_AK0024SA1933 [0,2,0,0,0,0|2,0,0]=4 813 B16R1.12572 C/C(=C\c1cccnc1)/C(=O)NC(C)(C)C WXVL_AK0024SA1933 [0,2,0,0,0,0|2,0,0]=4 814 B16R1.12572 C=C(Cc1ccccc1)C(=O)NC(C)(C)C WXVL_AK0024SB0413 [0,2,0,0,0,0|1,0,1]=4 815 B16R1.12572 C=C(Cc1ccccc1)C(=O)NC(C)(C)C WXVL_AK0024SB0413 [0,2,0,0,0,0|1,0,1]=4 816 B16R1.847 CC[C@H](C)NC(=O)NC(=O)c1ccccc1 WXVL_AK00678YV0027 [0,2,0,0,0,0|2,0,0]=4 817 B16R1.847 CC[C@H](C)NC(=O)NC(=O)c1ccccc1 WXVL_AK00678YV0027 [0,2,0,0,0,0|2,0,0]=4 818 B16R1.847 C[C@@H](CF)NC(=O)NC(=O)c1ccccc1 WXVL_AK00558YV0027 [0,2,0,0,0,0|2,0,0]=4 819 B16R1.847 C[C@@H](CF)NC(=O)NC(=O)c1ccccc1 WXVL_AK00558YV0027 [0,2,0,0,0,0|2,0,0]=4 820 B16R1.847 C[C@@H](CO)NC(=O)NC(=O)c1ccccc1 WXVL_AK0109YV0027 [0,2,0,0,0,0|2,0,0]=4 821 B16R1.847 C[C@@H](CO)NC(=O)NC(=O)c1ccccc1 WXVL_AK0109YV0027 [0,2,0,0,0,0|2,0,0]=4 822 B16R1.850 C#C[C@@H](C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00735SB0418 [0,2,0,0,0,0|1,0,1]=4 823 B16R1.850 C#C[C@@H](C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00735SB0418 [0,2,0,0,0,0|1,0,1]=4 824 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00735SB1122 [0,2,0,0,0,0|1,0,1]=4 825 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00735SB1122 [0,2,0,0,0,0|1,0,1]=4 826 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00735SB0060 [0,2,0,0,0,0|1,0,1]=4 827 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00735SB0060 [0,2,0,0,0,0|1,0,1]=4 828 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00735SB0119 [0,2,0,0,0,0|1,0,1]=4 829 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00735SB0119 [0,2,0,0,0,0|1,0,1]=4 830 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00735SB1186 [0,2,0,0,0,0|1,0,1]=4 831 B16R1.850 C#C[C@@H](C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00735SB1186 [0,2,0,0,0,0|1,0,1]=4 832 B16R1.850 C=CC(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00769SB0418 [0,2,0,0,0,0|1,0,1]=4 833 B16R1.850 C=CC(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00769SB0418 [0,2,0,0,0,0|1,0,1]=4 834 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00769SB1122 [0,2,0,0,0,0|1,0,1]=4 835 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00769SB1122 [0,2,0,0,0,0|1,0,1]=4 836 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00769SB0060 [0,2,0,0,0,0|1,0,1]=4 837 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00769SB0060 [0,2,0,0,0,0|1,0,1]=4 838 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00769SB0119 [0,2,0,0,0,0|1,0,1]=4 839 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00769SB0119 [0,2,0,0,0,0|1,0,1]=4 840 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00769SB1186 [0,2,0,0,0,0|1,0,1]=4 841 B16R1.850 C=CC(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00769SB1186 [0,2,0,0,0,0|1,0,1]=4 842 B16R1.850 CC(C#N)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00810SB0418 [0,2,0,0,0,0|1,0,1]=4 843 B16R1.850 CC(C#N)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00810SB0418 [0,2,0,0,0,0|1,0,1]=4 844 B16R1.850 CC(C#N)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00810SB1122 [0,2,0,0,0,0|1,0,1]=4 845 B16R1.850 CC(C#N)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00810SB1122 [0,2,0,0,0,0|1,0,1]=4 846 B16R1.850 CC(C#N)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00810SB0119 [0,2,0,0,0,0|1,0,1]=4 847 B16R1.850 CC(C#N)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00810SB0119 [0,2,0,0,0,0|1,0,1]=4 848 B16R1.850 CC(C#N)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00810SB1186 [0,2,0,0,0,0|1,0,1]=4 849 B16R1.850 CC(C#N)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00810SB1186 [0,2,0,0,0,0|1,0,1]=4 850 B16R1.850 CC[C@H](C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00678SB0418 [0,2,0,0,0,0|1,0,0]=3 851 B16R1.850 CC[C@H](C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00678SB0418 [0,2,0,0,0,0|1,0,0]=3 852 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00678SB1122 [0,2,0,0,0,0|1,0,0]=3 853 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00678SB1122 [0,2,0,0,0,0|1,0,0]=3 854 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00678SB0060 [0,2,0,0,0,0|1,0,0]=3 855 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)C WXVL_AK00678SB0060 [0,2,0,0,0,0|1,0,0]=3 856 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00678SB0119 [0,2,0,0,0,0|1,0,0]=3 857 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00678SB0119 [0,2,0,0,0,0|1,0,0]=3 858 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00678SB1186 [0,2,0,0,0,0|1,0,0]=3 859 B16R1.850 CC[C@H](C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00678SB1186 [0,2,0,0,0,0|1,0,0]=3 860 B16R1.850 C[C@@H](CF)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00558SB0418 [0,2,0,0,0,0|1,0,0]=3 861 B16R1.850 C[C@@H](CF)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK00558SB0418 [0,2,0,0,0,0|1,0,0]=3 862 B16R1.850 C[C@@H](CF)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00558SB1122 [0,2,0,0,0,0|1,0,0]=3 863 B16R1.850 C[C@@H](CF)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK00558SB1122 [0,2,0,0,0,0|1,0,0]=3 864 B16R1.850 C[C@@H](CF)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00558SB0119 [0,2,0,0,0,0|1,0,0]=3 865 B16R1.850 C[C@@H](CF)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK00558SB0119 [0,2,0,0,0,0|1,0,0]=3 866 B16R1.850 C[C@@H](CF)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00558SB1186 [0,2,0,0,0,0|1,0,0]=3 867 B16R1.850 C[C@@H](CF)NC(=O)C=Cc1ccc(cc1)F WXVL_AK00558SB1186 [0,2,0,0,0,0|1,0,0]=3 868 B16R1.850 C[C@@H](CO)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0109SB0418 [0,2,0,0,0,0|1,0,0]=3 869 B16R1.850 C[C@@H](CO)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0109SB0418 [0,2,0,0,0,0|1,0,0]=3 870 B16R1.850 C[C@@H](CO)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0109SB1122 [0,2,0,0,0,0|1,0,0]=3 871 B16R1.850 C[C@@H](CO)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0109SB1122 [0,2,0,0,0,0|1,0,0]=3 872 B16R1.850 C[C@@H](CO)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0109SB0119 [0,2,0,0,0,0|1,0,0]=3 873 B16R1.850 C[C@@H](CO)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0109SB0119 [0,2,0,0,0,0|1,0,0]=3 874 B16R1.850 C[C@@H](CO)NC(=O)C=Cc1ccc(cc1)F WXVL_AK0109SB1186 [0,2,0,0,0,0|1,0,0]=3 875 B16R1.850 C[C@@H](CO)NC(=O)C=Cc1ccc(cc1)F WXVL_AK0109SB1186 [0,2,0,0,0,0|1,0,0]=3 876 B16R1.850 Cc1ccc(cc1)C=CC(=O)NC(C)C#N WXVL_AK00810SB0060 [0,2,0,0,0,0|1,0,1]=4 877 B16R1.850 Cc1ccc(cc1)C=CC(=O)NC(C)C#N WXVL_AK00810SB0060 [0,2,0,0,0,0|1,0,1]=4 878 B16R1.850 Cc1ccc(cc1)C=CC(=O)N[C@@H](C)CF WXVL_AK00558SB0060 [0,2,0,0,0,0|1,0,0]=3 879 B16R1.850 Cc1ccc(cc1)C=CC(=O)N[C@@H](C)CF WXVL_AK00558SB0060 [0,2,0,0,0,0|1,0,0]=3 880 B16R1.850 Cc1ccc(cc1)C=CC(=O)N[C@@H](C)CO WXVL_AK0109SB0060 [0,2,0,0,0,0|1,0,0]=3 881 B16R1.850 Cc1ccc(cc1)C=CC(=O)N[C@@H](C)CO WXVL_AK0109SB0060 [0,2,0,0,0,0|1,0,0]=3 882 B16R1.851 C#C[C@@H](C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00735SB1601 [0,2,0,0,0,0|1,0,1]=4 883 B16R1.851 C#C[C@@H](C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00735SB1601 [0,2,0,0,0,0|1,0,1]=4 884 B16R1.851 C#C[C@@H](C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00735SB0417 [0,2,0,0,0,0|1,0,1]=4 885 B16R1.851 C#C[C@@H](C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00735SB0417 [0,2,0,0,0,0|1,0,1]=4 886 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00769SB1601 [0,2,0,0,0,0|1,0,1]=4 887 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00769SB1601 [0,2,0,0,0,0|1,0,1]=4 888 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00769SB0417 [0,2,0,0,0,0|1,0,1]=4 889 B16R1.851 C=CC(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00769SB0417 [0,2,0,0,0,0|1,0,1]=4 890 B16R1.851 CC(C#N)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00810SB1601 [0,2,0,0,0,0|1,0,1]=4 891 B16R1.851 CC(C#N)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00810SB1601 [0,2,0,0,0,0|1,0,1]=4 892 B16R1.851 CC(C#N)NC(=O)C=Cc1cccc(c1)O WXVL_AK00810SB0417 [0,2,0,0,0,0|1,0,1]=4 893 B16R1.851 CC(C#N)NC(=O)C=Cc1cccc(c1)O WXVL_AK00810SB0417 [0,2,0,0,0,0|1,0,1]=4 894 B16R1.851 CC[C@H](C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00678SB1601 [0,2,0,0,0,0|1,0,0]=3 895 B16R1.851 CC[C@H](C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00678SB1601 [0,2,0,0,0,0|1,0,0]=3 896 B16R1.851 CC[C@H](C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00678SB0417 [0,2,0,0,0,0|1,0,0]=3 897 B16R1.851 CC[C@H](C)NC(=O)C=Cc1cccc(c1)O WXVL_AK00678SB0417 [0,2,0,0,0,0|1,0,0]=3 898 B16R1.851 C[C@@H](CF)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00558SB1601 [0,2,0,0,0,0|1,0,0]=3 899 B16R1.851 C[C@@H](CF)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK00558SB1601 [0,2,0,0,0,0|1,0,0]=3 900 B16R1.851 C[C@@H](CF)NC(=O)C=Cc1cccc(c1)O WXVL_AK00558SB0417 [0,2,0,0,0,0|1,0,0]=3 901 B16R1.851 C[C@@H](CF)NC(=O)C=Cc1cccc(c1)O WXVL_AK00558SB0417 [0,2,0,0,0,0|1,0,0]=3 902 B16R1.851 C[C@@H](CO)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0109SB1601 [0,2,0,0,0,0|1,0,0]=3 903 B16R1.851 C[C@@H](CO)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0109SB1601 [0,2,0,0,0,0|1,0,0]=3 904 B16R1.851 C[C@@H](CO)NC(=O)C=Cc1cccc(c1)O WXVL_AK0109SB0417 [0,2,0,0,0,0|1,0,0]=3 905 B16R1.851 C[C@@H](CO)NC(=O)C=Cc1cccc(c1)O WXVL_AK0109SB0417 [0,2,0,0,0,0|1,0,0]=3 906 B16R1.1570 CC(CCO)NC(=O)/C=C/c1ccccc1 WXVL_AK1288SB0115 [0,2,0,0,0,0|1,0,0]=3 907 B16R1.1570 CC(CCO)NC(=O)/C=C/c1ccccc1 WXVL_AK1288SB0115 [0,2,0,0,0,0|1,0,0]=3 908 B16R1.1570 CC(CCO)NC(=O)/C=C/c1cccnc1 WXVL_AK1288SA0193 [0,2,0,0,0,0|2,0,0]=4 909 B16R1.1570 CC(CCO)NC(=O)/C=C/c1cccnc1 WXVL_AK1288SA0193 [0,2,0,0,0,0|2,0,0]=4 910 B16R1.1570 CCC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00682SB0115 [0,2,0,0,0,0|1,0,0]=3 911 B16R1.1570 CCC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00682SB0115 [0,2,0,0,0,0|1,0,0]=3 912 B16R1.1570 CCC[C@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00682SA0193 [0,2,0,0,0,0|2,0,0]=4 913 B16R1.1570 CCC[C@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00682SA0193 [0,2,0,0,0,0|2,0,0]=4 914 B16R1.1570 COC[C@@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00613SB0115 [0,2,0,0,0,0|1,0,0]=3 915 B16R1.1570 COC[C@@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK00613SB0115 [0,2,0,0,0,0|1,0,0]=3 916 B16R1.1570 COC[C@@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00613SA0193 [0,2,0,0,0,0|2,0,0]=4 917 B16R1.1570 COC[C@@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK00613SA0193 [0,2,0,0,0,0|2,0,0]=4 918 B16R1.1570 COC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK0137SB0115 [0,2,0,0,0,0|1,0,0]=3 919 B16R1.1570 COC[C@H](C)NC(=O)/C=C/c1ccccc1 WXVL_AK0137SB0115 [0,2,0,0,0,0|1,0,0]=3 920 B16R1.1570 COC[C@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK0137SA0193 [0,2,0,0,0,0|2,0,0]=4 921 B16R1.1570 COC[C@H](C)NC(=O)/C=C/c1cccnc1 WXVL_AK0137SA0193 [0,2,0,0,0,0|2,0,0]=4 922 B16R1.1570 C[C@@H](CC#N)NC(=O)/C=C/c1ccccc1 WXVL_AK00595SB0115 [0,2,0,0,0,0|1,0,0]=3 923 B16R1.1570 C[C@@H](CC#N)NC(=O)/C=C/c1ccccc1 WXVL_AK00595SB0115 [0,2,0,0,0,0|1,0,0]=3 924 B16R1.1570 C[C@@H](CC#N)NC(=O)/C=C/c1cccnc1 WXVL_AK00595SA0193 [0,2,0,0,0,0|2,0,0]=4 925 B16R1.1570 C[C@@H](CC#N)NC(=O)/C=C/c1cccnc1 WXVL_AK00595SA0193 [0,2,0,0,0,0|2,0,0]=4 926 B16R1.7289 C=C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK00581SB0115 [0,2,0,0,0,0|1,0,1]=4 927 B16R1.7289 C=C[C@@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK00581SB0115 [0,2,0,0,0,0|1,0,1]=4 928 B16R1.7289 CC[C@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0111SB0115 [0,2,0,0,0,0|1,0,0]=3 929 B16R1.7289 CC[C@H](CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0111SB0115 [0,2,0,0,0,0|1,0,0]=3 930 B16R1.7289 CC[C@H](CO)NC(=O)/C=C/c1cccnc1 WXVL_AK0111SA0193 [0,2,0,0,0,0|2,0,0]=4 931 B16R1.7289 CC[C@H](CO)NC(=O)/C=C/c1cccnc1 WXVL_AK0111SA0193 [0,2,0,0,0,0|2,0,0]=4 932 B16R1.7289 O=C(/C=C/c1ccccc1)NC(CO)CO WXVL_AK0741SB0115 [0,2,0,0,0,0|1,0,0]=3 933 B16R1.7289 O=C(/C=C/c1ccccc1)NC(CO)CO WXVL_AK0741SB0115 [0,2,0,0,0,0|1,0,0]=3 934 B16R1.7289 O=C(/C=C/c1cccnc1)NC(CO)CO WXVL_AK0741SA0193 [0,2,0,0,0,0|2,0,0]=4 935 B16R1.7289 O=C(/C=C/c1cccnc1)NC(CO)CO WXVL_AK0741SA0193 [0,2,0,0,0,0|2,0,0]=4 936 B16R1.10317 CC(C)(CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0025SB0115 [0,2,0,0,0,0|1,0,0]=3 937 B16R1.10317 CC(C)(CO)NC(=O)/C=C/c1ccccc1 WXVL_AK0025SB0115 [0,2,0,0,0,0|1,0,0]=3 938 B16R1.10317 CC(C)(CO)NC(=O)/C=C/c1cccnc1 WXVL_AK0025SA0193 [0,2,0,0,0,0|2,0,0]=4 939 B16R1.10317 CC(C)(CO)NC(=O)/C=C/c1cccnc1 WXVL_AK0025SA0193 [0,2,0,0,0,0|2,0,0]=4 940 B16R1.17161 CC[C@H](C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00678HU0026 [0,2,0,0,0,0|2,0,0]=4 941 B16R1.17161 CC[C@H](C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00678HU0026 [0,2,0,0,0,0|2,0,0]=4 942 B16R1.17161 C[C@@H](CF)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00558HU0026 [0,2,0,0,0,0|2,0,0]=4 943 B16R1.17161 C[C@@H](CF)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK00558HU0026 [0,2,0,0,0,0|2,0,0]=4 944 B16R1.17161 C[C@@H](CO)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0109HU0026 [0,2,0,0,0,0|2,0,0]=4 945 B16R1.17161 C[C@@H](CO)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0109HU0026 [0,2,0,0,0,0|2,0,0]=4 946 B16R1.202 COc1ccc(cc1)/C=C/C(=O)NC(C)C WXVL_AK0030SB0120 [0,2,0,0,0,0|1,0,0]=3 947 B16R1.202 COc1ccc(cc1)/C=C/C(=O)NC(C)C WXVL_AK0030SB0120 [0,2,0,0,0,0|1,0,0]=3 948 B16R1.1040 CC(C)(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0024SB0418 [0,2,0,0,0,0|1,0,0]=3 949 B16R1.1040 CC(C)(C)NC(=O)/C=C/c1ccc(cc1)O WXVL_AK0024SB0418 [0,2,0,0,0,0|1,0,0]=3 950 B16R1.1040 CC(C)(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0024SB1122 [0,2,0,0,0,0|1,0,0]=3 951 B16R1.1040 CC(C)(C)NC(=O)C=Cc1ccc(cc1)Br WXVL_AK0024SB1122 [0,2,0,0,0,0|1,0,0]=3 952 B16R1.1040 CC(C)(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0024SB0119 [0,2,0,0,0,0|1,0,0]=3 953 B16R1.1040 CC(C)(C)NC(=O)C=Cc1ccc(cc1)Cl WXVL_AK0024SB0119 [0,2,0,0,0,0|1,0,0]=3 954 B16R1.1040 CC(C)(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK0024SB1186 [0,2,0,0,0,0|1,0,0]=3 955 B16R1.1040 CC(C)(C)NC(=O)C=Cc1ccc(cc1)F WXVL_AK0024SB1186 [0,2,0,0,0,0|1,0,0]=3 956 B16R1.1040 Cc1ccc(cc1)C=CC(=O)NC(C)(C)C WXVL_AK0024SB0060 [0,2,0,0,0,0|1,0,0]=3 957 B16R1.1040 Cc1ccc(cc1)C=CC(=O)NC(C)(C)C WXVL_AK0024SB0060 [0,2,0,0,0,0|1,0,0]=3 958 B16R1.1084 CC(C)N(C)C(=O)/C=C/c1ccc(cc1)O WXVL_AN0073SB0418 [0,2,0,0,0,0|1,0,0]=3 959 B16R1.1084 CC(C)N(C)C(=O)/C=C/c1ccc(cc1)O WXVL_AN0073SB0418 [0,2,0,0,0,0|1,0,0]=3 960 B16R1.1084 CC(C)N(C)C(=O)C=Cc1ccc(cc1)Br WXVL_AN0073SB1122 [0,2,0,0,0,0|1,0,0]=3 961 B16R1.1084 CC(C)N(C)C(=O)C=Cc1ccc(cc1)Br WXVL_AN0073SB1122 [0,2,0,0,0,0|1,0,0]=3 962 B16R1.1084 CC(C)N(C)C(=O)C=Cc1ccc(cc1)Cl WXVL_AN0073SB0119 [0,2,0,0,0,0|1,0,0]=3 963 B16R1.1084 CC(C)N(C)C(=O)C=Cc1ccc(cc1)Cl WXVL_AN0073SB0119 [0,2,0,0,0,0|1,0,0]=3 964 B16R1.1084 CC(C)N(C)C(=O)C=Cc1ccc(cc1)F WXVL_AN0073SB1186 [0,2,0,0,0,0|1,0,0]=3 965 B16R1.1084 CC(C)N(C)C(=O)C=Cc1ccc(cc1)F WXVL_AN0073SB1186 [0,2,0,0,0,0|1,0,0]=3 966 B16R1.1084 Cc1ccc(cc1)C=CC(=O)N(C)C(C)C WXVL_AN0073SB0060 [0,2,0,0,0,0|1,0,0]=3 967 B16R1.1084 Cc1ccc(cc1)C=CC(=O)N(C)C(C)C WXVL_AN0073SB0060 [0,2,0,0,0,0|1,0,0]=3 968 B16R1.16534 CC(C)NC(=O)C=Cc1ccc(c(c1)Cl)Cl WXVL_AK0030SB0118 [0,2,0,0,0,0|1,0,0]=3 969 B16R1.16534 CC(C)NC(=O)C=Cc1ccc(c(c1)Cl)Cl WXVL_AK0030SB0118 [0,2,0,0,0,0|1,0,0]=3 970 B16R1.4125 CC(C)N(C)C(=O)NC(=O)c1ccccc1 WXVL_AN0073YV0027 [0,2,0,0,0,0|2,0,0]=4 971 B16R1.4125 CC(C)N(C)C(=O)NC(=O)c1ccccc1 WXVL_AN0073YV0027 [0,2,0,0,0,0|2,0,0]=4 972 B16R1.6742 CC(C)(C)NC(=O)NC(=O)c1ccccc1 WXVL_AK0024YV0027 [0,2,0,0,0,0|2,0,0]=4 973 B16R1.6742 CC(C)(C)NC(=O)NC(=O)c1ccccc1 WXVL_AK0024YV0027 [0,2,0,0,0,0|2,0,0]=4 974 B16R1.11198 CC(C)(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0024SB1601 [0,2,0,0,0,0|1,0,0]=3 975 B16R1.11198 CC(C)(C)NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0024SB1601 [0,2,0,0,0,0|1,0,0]=3 976 B16R1.11198 CC(C)(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK0024SB0417 [0,2,0,0,0,0|1,0,0]=3 977 B16R1.11198 CC(C)(C)NC(=O)C=Cc1cccc(c1)O WXVL_AK0024SB0417 [0,2,0,0,0,0|1,0,0]=3 978 B16R1.25877 CC(C)(C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0024HU0026 [0,2,0,0,0,0|2,0,0]=4 979 B16R1.25877 CC(C)(C)NS(=O)(=O)/C=C/c1ccccc1 WXVL_AK0024HU0026 [0,2,0,0,0,0|2,0,0]=4 980 B16R1.11257 CC(C)N(C)C(=O)C=Cc1cccc(c1)Cl WXVL_AN0073SB1601 [0,2,0,0,0,0|1,0,0]=3 981 B16R1.11257 CC(C)N(C)C(=O)C=Cc1cccc(c1)Cl WXVL_AN0073SB1601 [0,2,0,0,0,0|1,0,0]=3 982 B16R1.11257 CC(C)N(C)C(=O)C=Cc1cccc(c1)O WXVL_AN0073SB0417 [0,2,0,0,0,0|1,0,0]=3 983 B16R1.11257 CC(C)N(C)C(=O)C=Cc1cccc(c1)O WXVL_AN0073SB0417 [0,2,0,0,0,0|1,0,0]=3 984 B16R1.24534 CC(C)N(C)S(=O)(=O)/C=C/c1ccccc1 WXVL_AN0073HU0026 [0,2,0,0,0,0|2,0,0]=4 985 B16R1.24534 CC(C)N(C)S(=O)(=O)/C=C/c1ccccc1 WXVL_AN0073HU0026 [0,2,0,0,0,0|2,0,0]=4 986 B16R1.6846 CC(C)NC(=O)C=Cc1cc(cc(c1)F)F WXVL_AK0030SB1124 [0,2,0,0,0,0|1,0,0]=3 987 B16R1.6846 CC(C)NC(=O)C=Cc1cc(cc(c1)F)F WXVL_AK0030SB1124 [0,2,0,0,0,0|1,0,0]=3 988 B16R1.19701 CC(C)NC(=O)/C=C/c1cccc(c1)C#N WXVL_AK0030SB2454 [0,2,0,0,0,0|1,0,0]=3 989 B16R1.19701 CC(C)NC(=O)/C=C/c1cccc(c1)C#N WXVL_AK0030SB2454 [0,2,0,0,0,0|1,0,0]=3 990 B16R1.19701 COc1cccc(c1)C=CC(=O)NC(C)C WXVL_AK0030SB0458 [0,2,0,0,0,0|1,0,0]=3 991 B16R1.19701 COc1cccc(c1)C=CC(=O)NC(C)C WXVL_AK0030SB0458 [0,2,0,0,0,0|1,0,0]=3 992 B14R2.343 CC1CC1C(=O)Nc2ccccc2 WXVL_AG00183SB0041 [0,0,0,1,1,0|2,0,0]=4 993 B14R2.343 CC1CC1C(=O)Nc2ccccc2 WXVL_AG00183SB0041 [0,0,0,1,1,0|2,0,0]=4 994 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 WXVL_AG00183SB0155 [0,0,0,1,1,0|2,0,0]=4 995 B14R2.9593 O=C(CC1CC1)Nc2ccccc2 WXVL_AG00183SB0155 [0,0,0,1,1,0|2,0,0]=4 996 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 WXVL_AK0001SB0092 [0,0,0,1,1,0|1,0,1]=4 997 B14R2.9593 O=C(Cc1ccccc1)NC2CC2 WXVL_AK0001SB0092 [0,0,0,1,1,0|1,0,1]=4 998 B14R2.13184 O=C(/C=C/c1ccco1)NC2CC2 WXVL_AK0001SA0180 [0,0,0,1,1,0|2,0,0]=4 999 B14R2.13184 O=C(/C=C/c1ccco1)NC2CC2 WXVL_AK0001SA0180 [0,0,0,1,1,0|2,0,0]=4 1000 B14R2.13184 O=C(/C=C/c1cccs1)NC2CC2 WXVL_AK0001SA0001 [0,0,0,1,1,0|2,0,0]=4 1001 B14R2.13184 O=C(/C=C/c1cccs1)NC2CC2 WXVL_AK0001SA0001 [0,0,0,1,1,0|2,0,0]=4 1002 B14R2.13184 O=C(/C=C/c1ccoc1)NC2CC2 WXVL_AK0001SA0047 [0,0,0,1,1,0|2,0,0]=4 1003 B14R2.13184 O=C(/C=C/c1ccoc1)NC2CC2 WXVL_AK0001SA0047 [0,0,0,1,1,0|2,0,0]=4 1004 B14R2.13184 O=C(/C=C/c1ccsc1)NC2CC2 WXVL_AK0001SA0251 [0,0,0,1,1,0|2,0,0]=4 1005 B14R2.13184 O=C(/C=C/c1ccsc1)NC2CC2 WXVL_AK0001SA0251 [0,0,0,1,1,0|2,0,0]=4 1006 B16R2.3322 CC1CN(C1)C(=O)/C=C/c2ccccc2 WXVL_AN0291SB0115 [0,0,0,1,0,1|1,0,0]=3 1007 B16R2.3322 CC1CN(C1)C(=O)/C=C/c2ccccc2 WXVL_AN0291SB0115 [0,0,0,1,0,1|1,0,0]=3 1008 B16R2.3322 CC1CN(C1)C(=O)/C=C/c2cccnc2 WXVL_AN0291SA0193 [0,0,0,1,0,1|2,0,0]=4 1009 B16R2.3322 CC1CN(C1)C(=O)/C=C/c2cccnc2 WXVL_AN0291SA0193 [0,0,0,1,0,1|2,0,0]=4 1010 B16R2.3322 O=C(/C=C/c1ccccc1)N2CC(C2)O WXVL_AN0284SB0115 [0,0,0,1,0,1|2,0,0]=4 1011 B16R2.3322 O=C(/C=C/c1ccccc1)N2CC(C2)O WXVL_AN0284SB0115 [0,0,0,1,0,1|2,0,0]=4 1012 B16R2.520 CC(C)NC(=O)c1c[nH]c2c1cccn2 WXVL_AK0030SE0048 [0,0,0,1,0,1|2,0,0]=4 1013 B16R2.520 CC(C)NC(=O)c1c[nH]c2c1cccn2 WXVL_AK0030SE0048 [0,0,0,1,0,1|2,0,0]=4 1014 B16R2.520 CC(C)NC(=O)c1c[nH]c2c1ccnc2 WXVL_AK0030SE0638 [0,0,0,1,0,1|2,0,0]=4 1015 B16R2.520 CC(C)NC(=O)c1c[nH]c2c1ccnc2 WXVL_AK0030SE0638 [0,0,0,1,0,1|2,0,0]=4 1016 B16R2.520 CC(C)NC(=O)c1cnc2n1cccc2 WXVL_AK0030SE0102 [0,0,0,1,0,1|2,0,0]=4 1017 B16R2.520 CC(C)NC(=O)c1cnc2n1cccc2 WXVL_AK0030SE0102 [0,0,0,1,0,1|2,0,0]=4 1018 B16R2.520 CC(C)NC(=O)c1cnn2c1cccc2 WXVL_AK0030SE0033 [0,0,0,1,0,1|2,0,0]=4 1019 B16R2.520 CC(C)NC(=O)c1cnn2c1cccc2 WXVL_AK0030SE0033 [0,0,0,1,0,1|2,0,0]=4 1020 B16R2.520 CC(C)NC(=O)c1coc2c1cccc2 WXVL_AK0030SE0302 [0,0,0,1,0,1|1,0,0]=3 1021 B16R2.520 CC(C)NC(=O)c1coc2c1cccc2 WXVL_AK0030SE0302 [0,0,0,1,0,1|1,0,0]=3 1022 B16R2.520 CC(C)NC(=O)c1csc2c1cccc2 WXVL_AK0030SE0108 [0,0,0,1,0,1|1,0,0]=3 1023 B16R2.520 CC(C)NC(=O)c1csc2c1cccc2 WXVL_AK0030SE0108 [0,0,0,1,0,1|1,0,0]=3 1024 B16R2.520 CC(C)NC(=O)c1n[nH]c2c1cccc2 WXVL_AK0030SE0379 [0,0,0,1,0,1|2,0,0]=4 1025 B16R2.520 CC(C)NC(=O)c1n[nH]c2c1cccc2 WXVL_AK0030SE0379 [0,0,0,1,0,1|2,0,0]=4 1026 B16R2.520 CC(C)NC(=O)c1onc2c1cccc2 WXVL_AK0030SE0896 [0,0,0,1,0,1|2,0,0]=4 1027 B16R2.520 CC(C)NC(=O)c1onc2c1cccc2 WXVL_AK0030SE0896 [0,0,0,1,0,1|2,0,0]=4 1028 B16R2.11592 CC(C)NC(=O)c1cc2ccccc2[nH]1 WXVL_AK0030SE0001 [0,1,0,1,0,0|1,0,0]=3 1029 B16R2.11592 CC(C)NC(=O)c1cc2ccccc2[nH]1 WXVL_AK0030SE0001 [0,1,0,1,0,0|1,0,0]=3 1030 B16R2.11592 CC(C)NC(=O)c1cc2ccccc2o1 WXVL_AK0030SE0105 [0,1,0,1,0,0|1,0,0]=3 1031 B16R2.11592 CC(C)NC(=O)c1cc2ccccc2o1 WXVL_AK0030SE0105 [0,1,0,1,0,0|1,0,0]=3 1032 B16R2.11592 CC(C)NC(=O)c1cc2ccccc2s1 WXVL_AK0030SE0107 [0,1,0,1,0,0|1,0,0]=3 1033 B16R2.11592 CC(C)NC(=O)c1cc2ccccc2s1 WXVL_AK0030SE0107 [0,1,0,1,0,0|1,0,0]=3 1034 B16R2.11592 CC(C)NC(=O)c1cc2ccccn2n1 WXVL_AK0030SE0030 [0,1,0,1,0,0|2,0,0]=4 1035 B16R2.11592 CC(C)NC(=O)c1cc2ccccn2n1 WXVL_AK0030SE0030 [0,1,0,1,0,0|2,0,0]=4 1036 B16R2.11592 CC(C)NC(=O)c1cc2cccnc2[nH]1 WXVL_AK0030SE0450 [0,1,0,1,0,0|2,0,0]=4 1037 B16R2.11592 CC(C)NC(=O)c1cc2cccnc2[nH]1 WXVL_AK0030SE0450 [0,1,0,1,0,0|2,0,0]=4 1038 B16R2.11592 CC(C)NC(=O)c1cc2cccnc2s1 WXVL_AK0030SE0061 [0,1,0,1,0,0|2,0,0]=4 1039 B16R2.11592 CC(C)NC(=O)c1cc2cccnc2s1 WXVL_AK0030SE0061 [0,1,0,1,0,0|2,0,0]=4 1040 B16R2.11592 CC(C)NC(=O)c1cc2cnccc2[nH]1 WXVL_AK0030SE0511 [0,1,0,1,0,0|2,0,0]=4 1041 B16R2.11592 CC(C)NC(=O)c1cc2cnccc2[nH]1 WXVL_AK0030SE0511 [0,1,0,1,0,0|2,0,0]=4 1042 B16R2.11592 CC(C)NC(=O)c1cc2ncccc2[nH]1 WXVL_AK0030SE0680 [0,1,0,1,0,0|2,0,0]=4 1043 B16R2.11592 CC(C)NC(=O)c1cc2ncccc2[nH]1 WXVL_AK0030SE0680 [0,1,0,1,0,0|2,0,0]=4 1044 B16R2.11592 CC(C)NC(=O)c1nc2ccccc2[nH]1 WXVL_AK0030SE0026 [0,1,0,1,0,0|2,0,0]=4 1045 B16R2.11592 CC(C)NC(=O)c1nc2ccccc2[nH]1 WXVL_AK0030SE0026 [0,1,0,1,0,0|2,0,0]=4 1046 B16R2.11592 CC(C)NC(=O)c1nc2ccccc2o1 WXVL_AK0030SE0704 [0,1,0,1,0,0|2,0,0]=4 1047 B16R2.11592 CC(C)NC(=O)c1nc2ccccc2o1 WXVL_AK0030SE0704 [0,1,0,1,0,0|2,0,0]=4 1048 B16R2.14690 O=C(C=Cc1ccccc1Br)NC2CC2 WXVL_AK0001SB3065 [0,1,0,1,0,0|1,0,0]=3 1049 B16R2.14690 O=C(C=Cc1ccccc1Br)NC2CC2 WXVL_AK0001SB3065 [0,1,0,1,0,0|1,0,0]=3 1050 B16R2.27766 C/C(=C\c1cccnc1)/C(=O)NC2CC2 WXVL_AK0001SA1933 [0,1,0,1,0,0|2,0,0]=4 1051 B16R2.27766 C/C(=C\c1cccnc1)/C(=O)NC2CC2 WXVL_AK0001SA1933 [0,1,0,1,0,0|2,0,0]=4 1052 B16R2.27766 C=C(Cc1ccccc1)C(=O)NC2CC2 WXVL_AK0001SB0413 [0,1,0,1,0,0|1,0,1]=4 1053 B16R2.27766 C=C(Cc1ccccc1)C(=O)NC2CC2 WXVL_AK0001SB0413 [0,1,0,1,0,0|1,0,1]=4 1054 B16R2.5766 CC1(CC1)NC(=O)/C=C/c2ccccc2 WXVL_AK0263SB0115 [0,1,0,1,0,0|1,0,0]=3 1055 B16R2.5766 CC1(CC1)NC(=O)/C=C/c2ccccc2 WXVL_AK0263SB0115 [0,1,0,1,0,0|1,0,0]=3 1056 B16R2.5766 CC1(CC1)NC(=O)/C=C/c2cccnc2 WXVL_AK0263SA0193 [0,1,0,1,0,0|2,0,0]=4 1057 B16R2.5766 CC1(CC1)NC(=O)/C=C/c2cccnc2 WXVL_AK0263SA0193 [0,1,0,1,0,0|2,0,0]=4 1058 B16R2.44148 O=C(/C=C/c1ccccc1)NC2CNC2 WXVL_AK1291SB0115 [0,1,0,1,0,0|1,0,0]=3 1059 B16R2.44148 O=C(/C=C/c1ccccc1)NC2CNC2 WXVL_AK1291SB0115 [0,1,0,1,0,0|1,0,0]=3 1060 B16R2.44148 O=C(/C=C/c1ccccc1)NC2CSC2 WXVL_AK2089SB0115 [0,1,0,1,0,0|1,0,0]=3 1061 B16R2.44148 O=C(/C=C/c1ccccc1)NC2CSC2 WXVL_AK2089SB0115 [0,1,0,1,0,0|1,0,0]=3 1062 B16R2.44148 O=C(/C=C/c1cccnc1)NC2CNC2 WXVL_AK1291SA0193 [0,1,0,1,0,0|2,0,0]=4 1063 B16R2.44148 O=C(/C=C/c1cccnc1)NC2CNC2 WXVL_AK1291SA0193 [0,1,0,1,0,0|2,0,0]=4 1064 B16R2.44148 O=C(/C=C/c1cccnc1)NC2CSC2 WXVL_AK2089SA0193 [0,1,0,1,0,0|2,0,0]=4 1065 B16R2.44148 O=C(/C=C/c1cccnc1)NC2CSC2 WXVL_AK2089SA0193 [0,1,0,1,0,0|2,0,0]=4 1066 B16R2.11574 Cc1ccc(cc1)C=CC(=O)NC2CC2 WXVL_AK0001SB0060 [0,1,0,1,0,0|1,0,0]=3 1067 B16R2.11574 Cc1ccc(cc1)C=CC(=O)NC2CC2 WXVL_AK0001SB0060 [0,1,0,1,0,0|1,0,0]=3 1068 B16R2.11574 O=C(/C=C/c1ccc(cc1)O)NC2CC2 WXVL_AK0001SB0418 [0,1,0,1,0,0|1,0,0]=3 1069 B16R2.11574 O=C(/C=C/c1ccc(cc1)O)NC2CC2 WXVL_AK0001SB0418 [0,1,0,1,0,0|1,0,0]=3 1070 B16R2.11574 O=C(C=Cc1ccc(cc1)Br)NC2CC2 WXVL_AK0001SB1122 [0,1,0,1,0,0|1,0,0]=3 1071 B16R2.11574 O=C(C=Cc1ccc(cc1)Br)NC2CC2 WXVL_AK0001SB1122 [0,1,0,1,0,0|1,0,0]=3 1072 B16R2.11574 O=C(C=Cc1ccc(cc1)Cl)NC2CC2 WXVL_AK0001SB0119 [0,1,0,1,0,0|1,0,0]=3 1073 B16R2.11574 O=C(C=Cc1ccc(cc1)Cl)NC2CC2 WXVL_AK0001SB0119 [0,1,0,1,0,0|1,0,0]=3 1074 B16R2.11574 O=C(C=Cc1ccc(cc1)F)NC2CC2 WXVL_AK0001SB1186 [0,1,0,1,0,0|1,0,0]=3 1075 B16R2.11574 O=C(C=Cc1ccc(cc1)F)NC2CC2 WXVL_AK0001SB1186 [0,1,0,1,0,0|1,0,0]=3 1076 B16R2.27712 O=C(NC(=O)c1ccccc1)NC2CC2 WXVL_AK0001YV0027 [0,1,0,1,0,0|2,0,0]=4 1077 B16R2.27712 O=C(NC(=O)c1ccccc1)NC2CC2 WXVL_AK0001YV0027 [0,1,0,1,0,0|2,0,0]=4 1078 B16R2.44151 CN(C(=O)/C=C/c1ccccc1)C2CC2 WXVL_AN0276SB0115 [0,1,0,1,0,0|1,0,0]=3 1079 B16R2.44151 CN(C(=O)/C=C/c1ccccc1)C2CC2 WXVL_AN0276SB0115 [0,1,0,1,0,0|1,0,0]=3 1080 B16R2.44151 CN(C(=O)/C=C/c1cccnc1)C2CC2 WXVL_AN0276SA0193 [0,1,0,1,0,0|2,0,0]=4 1081 B16R2.44151 CN(C(=O)/C=C/c1cccnc1)C2CC2 WXVL_AN0276SA0193 [0,1,0,1,0,0|2,0,0]=4 1082 B16R2.11914 O=C(C=Cc1cccc(c1)Cl)NC2CC2 WXVL_AK0001SB1601 [0,1,0,1,0,0|1,0,0]=3 1083 B16R2.11914 O=C(C=Cc1cccc(c1)Cl)NC2CC2 WXVL_AK0001SB1601 [0,1,0,1,0,0|1,0,0]=3 1084 B16R2.11914 O=C(C=Cc1cccc(c1)O)NC2CC2 WXVL_AK0001SB0417 [0,1,0,1,0,0|1,0,0]=3 1085 B16R2.11914 O=C(C=Cc1cccc(c1)O)NC2CC2 WXVL_AK0001SB0417 [0,1,0,1,0,0|1,0,0]=3 1086 B16R2.322173 O=S(=O)(/C=C/c1ccccc1)NC2CC2 WXVL_AK0001HU0026 [0,1,0,1,0,0|2,0,0]=4 1087 B16R2.322173 O=S(=O)(/C=C/c1ccccc1)NC2CC2 WXVL_AK0001HU0026 [0,1,0,1,0,0|2,0,0]=4 1088 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [1,0,0,0,1,0|2,0,0]=4 1089 B12R1.32 CCCC(=O)Nc1ccccc1 WXVL_AG00183SB0073 [1,0,0,0,1,0|2,0,0]=4 1090 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [1,0,0,0,1,0|1,0,1]=4 1091 B12R1.32 CCNC(=O)Cc1ccccc1 WXVL_AK00476SB0092 [1,0,0,0,1,0|1,0,1]=4 1092 B12R1.51 CCNC(=O)/C=C/c1ccco1 WXVL_AK00476SA0180 [1,0,0,0,1,0|2,0,0]=4 1093 B12R1.51 CCNC(=O)/C=C/c1ccco1 WXVL_AK00476SA0180 [1,0,0,0,1,0|2,0,0]=4 1094 B12R1.51 CCNC(=O)/C=C/c1cccs1 WXVL_AK00476SA0001 [1,0,0,0,1,0|2,0,0]=4 1095 B12R1.51 CCNC(=O)/C=C/c1cccs1 WXVL_AK00476SA0001 [1,0,0,0,1,0|2,0,0]=4 1096 B12R1.51 CCNC(=O)/C=C/c1ccoc1 WXVL_AK00476SA0047 [1,0,0,0,1,0|2,0,0]=4 1097 B12R1.51 CCNC(=O)/C=C/c1ccoc1 WXVL_AK00476SA0047 [1,0,0,0,1,0|2,0,0]=4 1098 B12R1.51 CCNC(=O)/C=C/c1ccsc1 WXVL_AK00476SA0251 [1,0,0,0,1,0|2,0,0]=4 1099 B12R1.51 CCNC(=O)/C=C/c1ccsc1 WXVL_AK00476SA0251 [1,0,0,0,1,0|2,0,0]=4 1100 B12R1.43 CC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0052 [0,0,0,0,2,0|1,0,0]=3 1101 B12R1.43 CC(C)C(=O)Nc1ccccc1 WXVL_AG00183SB0052 [0,0,0,0,2,0|1,0,0]=3 1102 B12R1.43 CC(C)C(=O)Nc1ccccn1 WXVL_AF00298SB0052 [0,0,0,0,2,0|2,0,0]=4 1103 B12R1.43 CC(C)C(=O)Nc1ccccn1 WXVL_AF00298SB0052 [0,0,0,0,2,0|2,0,0]=4 1104 B12R1.43 CC(S)C(=O)Nc1ccccc1 WXVL_AG00183SB2708 [0,0,0,0,2,0|2,0,0]=4 1105 B12R1.43 CC(S)C(=O)Nc1ccccc1 WXVL_AG00183SB2708 [0,0,0,0,2,0|2,0,0]=4 1106 B12R1.43 CN(C)C(=O)Cc1ccccc1 WXVL_AN0032SB0092 [0,0,0,0,2,0|1,0,1]=4 1107 B12R1.43 CN(C)C(=O)Cc1ccccc1 WXVL_AN0032SB0092 [0,0,0,0,2,0|1,0,1]=4 1108 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,0,0,0,2,0|2,0,0]=4 1109 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 WXVL_AG00183SB1085 [0,0,0,0,2,0|2,0,0]=4 1110 B12R1.107 CC(C)NC(=O)c1ccccc1 WXVL_AK0030SD0001 [0,0,0,0,2,0|1,0,0]=3 1111 B12R1.107 CC(C)NC(=O)c1ccccc1 WXVL_AK0030SD0001 [0,0,0,0,2,0|1,0,0]=3 1112 B12R1.107 CC(C)NC(=O)c1ccccn1 WXVL_AK0030SC0058 [0,0,0,0,2,0|2,0,0]=4 1113 B12R1.107 CC(C)NC(=O)c1ccccn1 WXVL_AK0030SC0058 [0,0,0,0,2,0|2,0,0]=4 1114 B12R1.107 CC(C)NC(=O)c1cccnc1 WXVL_AK0030SC0061 [0,0,0,0,2,0|2,0,0]=4 1115 B12R1.107 CC(C)NC(=O)c1cccnc1 WXVL_AK0030SC0061 [0,0,0,0,2,0|2,0,0]=4 1116 B12R1.107 CC(C)NC(=O)c1ccncc1 WXVL_AK0030SC0062 [0,0,0,0,2,0|2,0,0]=4 1117 B12R1.107 CC(C)NC(=O)c1ccncc1 WXVL_AK0030SC0062 [0,0,0,0,2,0|2,0,0]=4 1118 B12R1.264 CN(C)C(=O)/C=C/c1ccco1 WXVL_AN0032SA0180 [0,0,0,0,2,0|2,0,0]=4 1119 B12R1.264 CN(C)C(=O)/C=C/c1ccco1 WXVL_AN0032SA0180 [0,0,0,0,2,0|2,0,0]=4 1120 B12R1.264 CN(C)C(=O)/C=C/c1cccs1 WXVL_AN0032SA0001 [0,0,0,0,2,0|2,0,0]=4 1121 B12R1.264 CN(C)C(=O)/C=C/c1cccs1 WXVL_AN0032SA0001 [0,0,0,0,2,0|2,0,0]=4 1122 B12R1.264 CN(C)C(=O)/C=C/c1ccoc1 WXVL_AN0032SA0047 [0,0,0,0,2,0|2,0,0]=4 1123 B12R1.264 CN(C)C(=O)/C=C/c1ccoc1 WXVL_AN0032SA0047 [0,0,0,0,2,0|2,0,0]=4 1124 B12R1.264 CN(C)C(=O)/C=C/c1ccsc1 WXVL_AN0032SA0251 [0,0,0,0,2,0|2,0,0]=4 1125 B12R1.264 CN(C)C(=O)/C=C/c1ccsc1 WXVL_AN0032SA0251 [0,0,0,0,2,0|2,0,0]=4 1126 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccco1 WXVL_AK00544SA0180 [0,0,0,0,1,1|2,0,0]=4 1127 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccco1 WXVL_AK00544SA0180 [0,0,0,0,1,1|2,0,0]=4 1128 B14R1.4526 CC(C)CNC(=O)/C=C/c1cccs1 WXVL_AK00544SA0001 [0,0,0,0,1,1|2,0,0]=4 1129 B14R1.4526 CC(C)CNC(=O)/C=C/c1cccs1 WXVL_AK00544SA0001 [0,0,0,0,1,1|2,0,0]=4 1130 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccoc1 WXVL_AK00544SA0047 [0,0,0,0,1,1|2,0,0]=4 1131 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccoc1 WXVL_AK00544SA0047 [0,0,0,0,1,1|2,0,0]=4 1132 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccsc1 WXVL_AK00544SA0251 [0,0,0,0,1,1|2,0,0]=4 1133 B14R1.4526 CC(C)CNC(=O)/C=C/c1ccsc1 WXVL_AK00544SA0251 [0,0,0,0,1,1|2,0,0]=4 1134 B16R1.608 CC(C)CCNC(=O)/C=C/c1ccccc1 WXVL_AK0068SB0115 [0,0,0,0,0,2|1,0,0]=3 1135 B16R1.608 CC(C)CCNC(=O)/C=C/c1ccccc1 WXVL_AK0068SB0115 [0,0,0,0,0,2|1,0,0]=3 1136 B16R1.608 CC(C)CCNC(=O)/C=C/c1cccnc1 WXVL_AK0068SA0193 [0,0,0,0,0,2|2,0,0]=4 1137 B16R1.608 CC(C)CCNC(=O)/C=C/c1cccnc1 WXVL_AK0068SA0193 [0,0,0,0,0,2|2,0,0]=4 1138 B16R1.608 CN(C)CCNC(=O)/C=C/c1ccccc1 WXVL_AK0058SB0115 [0,0,0,0,0,2|2,0,0]=4 1139 B16R1.608 CN(C)CCNC(=O)/C=C/c1ccccc1 WXVL_AK0058SB0115 [0,0,0,0,0,2|2,0,0]=4 1140 B16R1.18213 CC(C)OCC(=O)NCCc1ccccc1 WXVL_AK00498SB0213 [0,0,0,0,0,2|0,0,2]=4 1141 B16R1.18213 CC(C)OCC(=O)NCCc1ccccc1 WXVL_AK00498SB0213 [0,0,0,0,0,2|0,0,2]=4 1142 B16R1.6929 CC(=CC(=O)NC/C=C/c1ccccc1)C WXVL_AK00073SB0342 [0,0,0,0,0,2|1,0,1]=4 1143 B16R1.6929 CC(=CC(=O)NC/C=C/c1ccccc1)C WXVL_AK00073SB0342 [0,0,0,0,0,2|1,0,1]=4 1144 B16R1.6929 CC(C)CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0063 [0,0,0,0,0,2|1,0,0]=3 1145 B16R1.6929 CC(C)CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0063 [0,0,0,0,0,2|1,0,0]=3 1146 B16R1.6929 CC(O)CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB3643 [0,0,0,0,0,2|2,0,0]=4 1147 B16R1.6929 CC(O)CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB3643 [0,0,0,0,0,2|2,0,0]=4 1148 B16R1.6929 CN(C)CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0085 [0,0,0,0,0,2|2,0,0]=4 1149 B16R1.6929 CN(C)CC(=O)NC/C=C/c1ccccc1 WXVL_AK00073SB0085 [0,0,0,0,0,2|2,0,0]=4