0 B16R1.1674 CC(=O)C(C)C(=O)C(CO)c1ccccc1 1458a_100011218805_100000179758 [0,0,1,0,0,0|3,0,0]=4 1 B16R1.1674 CC(C(=O)N)C(=O)C(CO)c1ccccc1 1458a_100011218805_100000702099 [0,0,1,0,0,0|2,0,0]=3 2 B16R1.1674 CCC(C(=O)C(C)C(=O)C)c1ccccc1 1458a_100000211302_100000179758 [0,0,1,0,0,0|2,0,0]=3 3 B16R1.1674 CCC(C(=O)C(C)C(=O)N)c1ccccc1 1458a_100000211302_100000702099 [0,0,1,0,0,0|1,0,0]=2 4 B16R1.1674 CCC(C(=O)C(F)C(=O)N)c1ccccc1 1458a_100000211302_100009813875 [0,0,1,0,0,0|2,0,0]=3 5 B16R1.1674 CCC(C(=O)C(F)C(=O)[O-])c1ccccc1 1458a_100000211302_100020610796 [0,0,1,0,0,0|3,0,0]=4 6 B16R1.1674 CCC(C(=O)N(C)C(C)C)c1ccccc1 11a_200000211004_100000211302 [0,0,1,0,0,0|2,0,1]=4 7 B16R1.1674 CCC(C(=O)N(C)C(C)C)c1ccccc1 1626a_200000211004_100000211302 [0,0,1,0,0,0|2,0,1]=4 8 B16R1.1674 CCC(C(=O)N(C)C(C)C)c1ccccc1 240690a_200000211004_100000211302 [0,0,1,0,0,0|2,0,1]=4 9 B16R1.1674 CCC(C(=O)N(C)C(C)C)c1ccccc1 527a_200000211004_100000211302 [0,0,1,0,0,0|2,0,1]=4 10 B16R1.1674 CCC(c1ccccc1)N(C)C(C)C(=O)N 2230a_100000737544_100000702099 [0,0,1,0,0,0|3,0,0]=4 11 B16R1.1674 CCC(c1ccccc1)N(C)C(C)C(=O)N 269982a_100000737544_100000184083 [0,0,1,0,0,0|3,0,0]=4 12 B16R1.1674 CCN(C(=O)C(C)C(=O)C)c1ccccc1 1458a_100000070787_100000181168 [0,0,1,0,0,0|3,0,0]=4 13 B16R1.1674 CO[C@@H](C(=O)C(C)C(=O)C)c1ccccc1 1458a_100000698336_100000179758 [0,0,1,0,0,0|3,0,0]=4 14 B16R1.1674 CO[C@@H](C(=O)C(C)C(=O)N)c1ccccc1 1458a_100000698336_100000702099 [0,0,1,0,0,0|2,0,0]=3 15 B16R1.1674 CO[C@@H](C(=O)C(F)C(=O)N)c1ccccc1 1458a_100000698336_100009813875 [0,0,1,0,0,0|3,0,0]=4 16 B16R1.1674 NC(=O)C(F)C(=O)C(CO)c1ccccc1 1458a_100011218805_100009813875 [0,0,1,0,0,0|3,0,0]=4 17 B16R1.2892 CCN(C)C(=O)C(O)(CC)c1ccccc1 240690a_100000225621_100011434905 [0,0,1,0,0,0|2,0,1]=4 18 B16R1.6723 CCC(=O)NC(CC)(CC)c1ccccc1 11a_100020617177_100000210414 [0,0,1,0,0,0|2,0,1]=4 19 B16R1.6723 CCC(=O)NC(CC)(CC)c1ccccc1 1626a_100020617177_100000210414 [0,0,1,0,0,0|2,0,1]=4 20 B16R1.6723 CCC(=O)NC(CC)(CC)c1ccccc1 240690a_100020617177_100000210414 [0,0,1,0,0,0|2,0,1]=4 21 B16R1.6723 CCC(=O)NC(CC)(CC)c1ccccc1 527a_100020617177_100000210414 [0,0,1,0,0,0|2,0,1]=4 22 B16R1.6723 CCC(CC)(NC(=O)NC)c1ccccc1 2708a_100102657272_100020617177 [0,0,1,0,0,0|1,0,1]=3 23 B16R1.6723 CCC(CC)(NC(=O)NC)c1ccccc1 273464a_100020617177_100102657272 [0,0,1,0,0,0|1,0,1]=3 24 B16R1.6723 CCC(CC)(NC(=O)NC)c1ccccc1 273464a_100102657272_100020617177 [0,0,1,0,0,0|1,0,1]=3 25 B16R1.6723 CCC(CC)(NC(=O)NC)c1ccccc1 512a_100020617177_100102657272 [0,0,1,0,0,0|1,0,1]=3 26 B16R1.6723 CCC(CC)(NC(=O)NC)c1ccccc1 512a_106832991638_100020617177 [0,0,1,0,0,0|1,0,1]=3 27 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1ccccc1 11a_100000737752_100020587367 [0,0,1,0,0,0|2,0,0]=3 28 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1ccccc1 1626a_100000737752_100020587367 [0,0,1,0,0,0|2,0,0]=3 29 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1ccccn1 11a_100015186561_100020587367 [0,0,1,0,0,0|3,0,0]=4 30 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1ccccn1 1626a_100015186561_100020587367 [0,0,1,0,0,0|3,0,0]=4 31 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1cccnc1 11a_100000246009_100020587367 [0,0,1,0,0,0|3,0,0]=4 32 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1cccnc1 1626a_100000246009_100020587367 [0,0,1,0,0,0|3,0,0]=4 33 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1ccncc1 11a_100000246010_100020587367 [0,0,1,0,0,0|3,0,0]=4 34 B16R1.6948 C/C=C(\C)/C(=O)NC(CC)c1ccncc1 1626a_100000246010_100020587367 [0,0,1,0,0,0|3,0,0]=4 35 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccc1 11a_100000737752_100011216780 [0,0,1,0,0,0|2,0,0]=3 36 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100011216780 [0,0,1,0,0,0|2,0,0]=3 37 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccc1 240690a_100000737752_100011216780 [0,0,1,0,0,0|2,0,0]=3 38 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccc1 527a_100000737752_100011216780 [0,0,1,0,0,0|2,0,0]=3 39 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccn1 11a_100015186561_100011216780 [0,0,1,0,0,0|3,0,0]=4 40 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccn1 1626a_100015186561_100011216780 [0,0,1,0,0,0|3,0,0]=4 41 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccn1 240690a_100015186561_100011216780 [0,0,1,0,0,0|3,0,0]=4 42 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccccn1 527a_100015186561_100011216780 [0,0,1,0,0,0|3,0,0]=4 43 B16R1.6948 C=CC(C)C(=O)NC(CC)c1cccnc1 11a_100000246009_100011216780 [0,0,1,0,0,0|3,0,0]=4 44 B16R1.6948 C=CC(C)C(=O)NC(CC)c1cccnc1 1626a_100000246009_100011216780 [0,0,1,0,0,0|3,0,0]=4 45 B16R1.6948 C=CC(C)C(=O)NC(CC)c1cccnc1 240690a_100000246009_100011216780 [0,0,1,0,0,0|3,0,0]=4 46 B16R1.6948 C=CC(C)C(=O)NC(CC)c1cccnc1 527a_100000246009_100011216780 [0,0,1,0,0,0|3,0,0]=4 47 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccncc1 11a_100000246010_100011216780 [0,0,1,0,0,0|3,0,0]=4 48 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccncc1 1626a_100000246010_100011216780 [0,0,1,0,0,0|3,0,0]=4 49 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccncc1 240690a_100000246010_100011216780 [0,0,1,0,0,0|3,0,0]=4 50 B16R1.6948 C=CC(C)C(=O)NC(CC)c1ccncc1 527a_100000246010_100011216780 [0,0,1,0,0,0|3,0,0]=4 51 B16R1.6948 C=CC(C)C(=O)N[C@H](CO)c1ccccc1 240690a_100000751927_100011216780 [0,0,1,0,0,0|3,0,0]=4 52 B16R1.6948 C=CC(C)C(=O)N[C@H](CO)c1ccccc1 527a_100000751927_100011216780 [0,0,1,0,0,0|3,0,0]=4 53 B16R1.6948 CCC(C)C(=O)NC(CC)c1ccccc1 11a_100000737752_100011192722 [0,0,1,0,0,0|2,0,1]=4 54 B16R1.6948 CCC(C)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100011192722 [0,0,1,0,0,0|2,0,1]=4 55 B16R1.6948 CCC(C)C(=O)NC(CC)c1ccccc1 240690a_100000737752_100011192722 [0,0,1,0,0,0|2,0,1]=4 56 B16R1.6948 CCC(C)C(=O)NC(CC)c1ccccc1 527a_100000737752_100011192722 [0,0,1,0,0,0|2,0,1]=4 57 B16R1.6948 CCC(NC(=O)C(C)C#N)c1ccccc1 11a_100000737752_100000753662 [0,0,1,0,0,0|2,0,1]=4 58 B16R1.6948 CCC(NC(=O)C(C)C#N)c1ccccc1 1626a_100000737752_100000753662 [0,0,1,0,0,0|2,0,1]=4 59 B16R1.6948 CCC(NC(=O)C(C)C#N)c1ccccc1 240690a_100000737752_100000753662 [0,0,1,0,0,0|2,0,1]=4 60 B16R1.6948 CCC(NC(=O)C(C)C#N)c1ccccc1 527a_100000737752_100000753662 [0,0,1,0,0,0|2,0,1]=4 61 B16R1.6948 CCC(NC(=O)C(C)OC)c1ccccc1 11a_100000737752_100000743197 [0,0,1,0,0,0|3,0,0]=4 62 B16R1.6948 CCC(NC(=O)C(C)OC)c1ccccc1 1626a_100000737752_100000743197 [0,0,1,0,0,0|3,0,0]=4 63 B16R1.6948 CCC(NC(=O)C(C)OC)c1ccccc1 240690a_100000737752_100000743197 [0,0,1,0,0,0|3,0,0]=4 64 B16R1.6948 CCC(NC(=O)C(C)OC)c1ccccc1 527a_100000737752_100000743197 [0,0,1,0,0,0|3,0,0]=4 65 B16R1.6948 CCC(NC(=O)C(C)SC)c1ccccc1 11a_100000737752_100000149566 [0,0,1,0,0,0|3,0,0]=4 66 B16R1.6948 CCC(NC(=O)C(C)SC)c1ccccc1 1626a_100000737752_100000149566 [0,0,1,0,0,0|3,0,0]=4 67 B16R1.6948 CCC(NC(=O)C(C)SC)c1ccccc1 240690a_100000737752_100000149566 [0,0,1,0,0,0|3,0,0]=4 68 B16R1.6948 CCC(NC(=O)C(C)SC)c1ccccc1 527a_100000737752_100000149566 [0,0,1,0,0,0|3,0,0]=4 69 B16R1.6948 CCC(NC(=O)N(C)CC)c1ccccc1 2708a_100000737752_100000225621 [0,0,1,0,0,0|1,0,1]=3 70 B16R1.6948 CCC(NC(=O)N(C)CC)c1ccccc1 273464a_100000737752_100000225621 [0,0,1,0,0,0|1,0,1]=3 71 B16R1.6948 CCC(NC(=O)N(C)CC)c1ccccn1 2708a_100015186561_100000225621 [0,0,1,0,0,0|2,0,1]=4 72 B16R1.6948 CCC(NC(=O)N(C)CC)c1ccccn1 273464a_100015186561_100000225621 [0,0,1,0,0,0|2,0,1]=4 73 B16R1.6948 CCC(NC(=O)N(C)CC)c1cccnc1 2708a_100000246009_100000225621 [0,0,1,0,0,0|2,0,1]=4 74 B16R1.6948 CCC(NC(=O)N(C)CC)c1cccnc1 273464a_100000246009_100000225621 [0,0,1,0,0,0|2,0,1]=4 75 B16R1.6948 CCC(NC(=O)N(C)CC)c1ccncc1 2708a_100000246010_100000225621 [0,0,1,0,0,0|2,0,1]=4 76 B16R1.6948 CCC(NC(=O)N(C)CC)c1ccncc1 273464a_100000246010_100000225621 [0,0,1,0,0,0|2,0,1]=4 77 B16R1.6948 CCN(C)C(=O)N[C@H](CO)c1ccccc1 273464a_100000751927_100000225621 [0,0,1,0,0,0|2,0,1]=4 78 B15R1.502 CC(=O)C(C)C(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000179758 [1,0,1,0,0,0|2,0,0]=4 79 B15R1.502 CC(C(=O)N)C(=O)C(C)c1ccccn1 1458a_100000722050_100000702099 [1,0,1,0,0,0|2,0,0]=4 80 B15R1.502 CC(C(=O)N)C(=O)C(F)c1ccccc1 1458a_100000698975_100000702099 [1,0,1,0,0,0|2,0,0]=4 81 B15R1.502 CC(C(=O)N)C(=O)[C@@H](C)c1ccccc1 1458a_100000751047_100000702099 [1,0,1,0,0,0|1,0,0]=3 82 B15R1.502 CC(C(=O)N)C(=O)[C@H](O)c1ccccc1 1458a_100000684486_100000702099 [1,0,1,0,0,0|2,0,0]=4 83 B15R1.502 C[C@H](C(=O)C(F)C(=O)N)c1ccccc1 1458a_100000751047_100009813875 [1,0,1,0,0,0|2,0,0]=4 84 B15R1.523 C=C(Br)C(=O)NC(CC)c1ccccc1 11a_100000737752_100009813364 [1,0,1,0,0,0|2,0,0]=4 85 B15R1.523 C=C(Br)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100009813364 [1,0,1,0,0,0|2,0,0]=4 86 B15R1.523 C=C(C)C(=O)NC(CC)c1ccccc1 11a_100000737752_100000185857 [1,0,1,0,0,0|1,0,0]=3 87 B15R1.523 C=C(C)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100000185857 [1,0,1,0,0,0|1,0,0]=3 88 B15R1.523 C=C(C)C(=O)NC(CC)c1ccccn1 11a_100015186561_100000185857 [1,0,1,0,0,0|2,0,0]=4 89 B15R1.523 C=C(C)C(=O)NC(CC)c1ccccn1 1626a_100015186561_100000185857 [1,0,1,0,0,0|2,0,0]=4 90 B15R1.523 C=C(C)C(=O)NC(CC)c1cccnc1 11a_100000246009_100000185857 [1,0,1,0,0,0|2,0,0]=4 91 B15R1.523 C=C(C)C(=O)NC(CC)c1cccnc1 1626a_100000246009_100000185857 [1,0,1,0,0,0|2,0,0]=4 92 B15R1.523 C=C(C)C(=O)NC(CC)c1ccncc1 11a_100000246010_100000185857 [1,0,1,0,0,0|2,0,0]=4 93 B15R1.523 C=C(C)C(=O)NC(CC)c1ccncc1 1626a_100000246010_100000185857 [1,0,1,0,0,0|2,0,0]=4 94 B15R1.523 C=C(Cl)C(=O)NC(CC)c1ccccc1 11a_100000737752_100000039160 [1,0,1,0,0,0|2,0,0]=4 95 B15R1.523 C=C(Cl)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100000039160 [1,0,1,0,0,0|2,0,0]=4 96 B15R1.523 C=C(F)C(=O)NC(CC)c1ccccc1 11a_100000737752_100000036797 [1,0,1,0,0,0|2,0,0]=4 97 B15R1.523 C=C(F)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100000036797 [1,0,1,0,0,0|2,0,0]=4 98 B15R1.523 CCC(NC(=O)C(=O)N)c1ccccc1 240690a_100000737752_100011215815 [1,0,1,0,0,0|2,0,0]=4 99 B15R1.523 CCC(NC(=O)C(C)C)c1ccccc1 11a_100000737752_100000210198 [1,0,1,0,0,0|1,0,1]=4 100 B15R1.523 CCC(NC(=O)C(C)C)c1ccccc1 1626a_100000737752_100000210198 [1,0,1,0,0,0|1,0,1]=4 101 B15R1.523 CCC(NC(=O)C(C)C)c1ccccc1 240690a_100000737752_100000210198 [1,0,1,0,0,0|1,0,1]=4 102 B15R1.523 CCC(NC(=O)C(C)C)c1ccccc1 527a_100000737752_100000210198 [1,0,1,0,0,0|1,0,1]=4 103 B15R1.523 CCC(NC(=O)C(C)F)c1ccccc1 11a_100000737752_100000062450 [1,0,1,0,0,0|2,0,0]=4 104 B15R1.523 CCC(NC(=O)C(C)F)c1ccccc1 1626a_100000737752_100000062450 [1,0,1,0,0,0|2,0,0]=4 105 B15R1.523 CCC(NC(=O)C(C)F)c1ccccc1 240690a_100000737752_100000062450 [1,0,1,0,0,0|2,0,0]=4 106 B15R1.523 CCC(NC(=O)C(C)F)c1ccccc1 527a_100000737752_100000062450 [1,0,1,0,0,0|2,0,0]=4 107 B15R1.523 CCC(NC(=O)N(C)C)c1ccccc1 2708a_100000737752_100102631434 [1,0,1,0,0,0|0,0,1]=3 108 B15R1.523 CCC(NC(=O)N(C)C)c1ccccn1 2708a_100015186561_100102631434 [1,0,1,0,0,0|1,0,1]=4 109 B15R1.523 CCC(NC(=O)N(C)C)c1cccnc1 2708a_100000246009_100102631434 [1,0,1,0,0,0|1,0,1]=4 110 B15R1.523 CCC(NC(=O)N(C)C)c1ccncc1 2708a_100000246010_100102631434 [1,0,1,0,0,0|1,0,1]=4 111 B15R1.523 CCC(NC(=O)[C@@H](C)O)c1ccccc1 240690a_100000737752_100000717761 [1,0,1,0,0,0|1,0,1]=4 112 B15R1.523 CCC(NC(=O)[C@H](C)O)c1ccccc1 1626a_100000737752_217856618621 [1,0,1,0,0,0|1,0,1]=4 113 B15R1.523 CCC(NC(=O)[C@H](C)O)c1ccccc1 240690a_100000737752_217856618621 [1,0,1,0,0,0|1,0,1]=4 114 B15R1.523 CCC(NC(C)C(=O)N)c1ccccc1 2230a_100000737752_100000702099 [1,0,1,0,0,0|2,0,0]=4 115 B15R1.523 CCC(OC(C)C(=O)N)c1ccccc1 34a_100000698172_100000702099 [1,0,1,0,0,0|2,0,0]=4 116 B15R1.523 CCC(OC(C)C(=O)N)c1ccccc1 7a_100000698172_100000702099 [1,0,1,0,0,0|2,0,0]=4 117 B15R1.1329 CCC(C(=O)N(C)CC)c1ccccc1 11a_100000225621_100000211302 [1,0,1,0,0,0|1,0,1]=4 118 B15R1.1329 CCC(C(=O)N(C)CC)c1ccccc1 1626a_100000225621_100000211302 [1,0,1,0,0,0|1,0,1]=4 119 B15R1.1329 CCC(C(=O)N(C)CC)c1ccccc1 240690a_100000225621_100000211302 [1,0,1,0,0,0|1,0,1]=4 120 B15R1.1329 CCC(C(=O)N(C)CC)c1ccccc1 527a_100000225621_100000211302 [1,0,1,0,0,0|1,0,1]=4 121 B15R1.1350 CCC(C(=O)CC(=O)N)c1ccccc1 1458a_100000211302_100000187820 [1,0,1,0,0,0|1,0,0]=3 122 B15R1.1350 CCC(C(=O)CC(=O)[O-])c1ccccc1 1458a_100000211302_100020667443 [1,0,1,0,0,0|2,0,0]=4 123 B15R1.1350 CCN(C(=O)CC(=O)N)c1ccccc1 22a_100000210013_100134613110 [1,0,1,0,0,0|2,0,0]=4 124 B15R1.1350 CNC(C(=O)NC(=O)N)c1ccccc1 2230a_106832991635_100000010812 [1,0,1,0,0,0|1,0,0]=3 125 B15R1.1350 CO[C@@H](C(=O)CC(=O)N)c1ccccc1 1458a_100000698336_100000187820 [1,0,1,0,0,0|2,0,0]=4 126 B15R1.1350 CSC(C(=O)NC(=O)N)c1ccccc1 62a_100000010812_200000210301 [1,0,1,0,0,0|1,0,0]=3 127 B15R1.1350 CSC(C(=O)NC(=O)N)c1ccccc1 62a_200000210301_100000010812 [1,0,1,0,0,0|1,0,0]=3 128 B15R1.1350 NC(=O)CC(=O)C(CO)c1ccccc1 1458a_100011218805_100000187820 [1,0,1,0,0,0|2,0,0]=4 129 B15R1.1350 [13CH3]SC(C(=O)NC(=O)N)c1ccccc1 62a_100000010812_200025704644 [1,0,1,0,0,0|1,0,0]=3 130 B15R1.1350 [13CH3]SC(C(=O)NC(=O)N)c1ccccc1 62a_200025704644_100000010812 [1,0,1,0,0,0|1,0,0]=3 131 B15R1.4682 CCC(CC)(C(=O)NC)c1ccccc1 11a_106832991635_100000765338 [1,0,1,0,0,0|1,0,1]=4 132 B15R1.4682 CCC(CC)(C(=O)NC)c1ccccc1 240690a_100102657272_100000765338 [1,0,1,0,0,0|1,0,1]=4 133 B15R1.4682 CCC(CC)(C(=O)NC)c1ccccc1 527a_100102657272_100000765338 [1,0,1,0,0,0|1,0,1]=4 134 B15R1.4505 CCC(O)(C(=O)N(C)C)c1ccccc1 240690a_100102631434_100011434905 [1,0,1,0,0,0|1,0,1]=4 135 B15R1.9958 CCC(CC)(NC(=O)C)c1ccccc1 11a_100020617177_100015343762 [1,0,1,0,0,0|1,0,1]=4 136 B15R1.9958 CCC(CC)(NC(=O)C)c1ccccc1 1626a_100020617177_100015343762 [1,0,1,0,0,0|1,0,1]=4 137 B15R1.9958 CCC(CC)(NC(=O)C)c1ccccc1 240690a_100020617177_100015343762 [1,0,1,0,0,0|1,0,1]=4 138 B15R1.9958 CCC(CC)(NC(=O)C)c1ccccc1 527a_100020617177_100103153847 [1,0,1,0,0,0|1,0,1]=4 139 B15R1.947 C/C=C(\C)/C(=O)N[C@H](C)c1ccccc1 11a_100000751104_100020587367 [1,0,1,0,0,0|2,0,0]=4 140 B15R1.947 C/C=C(\C)/C(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100020587367 [1,0,1,0,0,0|2,0,0]=4 141 B15R1.947 C=CC(C)C(=O)N[C@H](C)c1ccccc1 11a_100000751104_100011216780 [1,0,1,0,0,0|2,0,0]=4 142 B15R1.947 C=CC(C)C(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100011216780 [1,0,1,0,0,0|2,0,0]=4 143 B15R1.947 C=CC(C)C(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100011216780 [1,0,1,0,0,0|2,0,0]=4 144 B15R1.947 C=CC(C)C(=O)N[C@H](C)c1ccccc1 527a_100000751104_100011216780 [1,0,1,0,0,0|2,0,0]=4 145 B15R1.947 CCN(C)C(=O)N[C@H](C)c1ccccc1 2708a_100000751104_100000225621 [1,0,1,0,0,0|1,0,1]=4 146 B15R1.947 CCN(C)C(=O)N[C@H](C)c1ccccc1 273464a_100000751104_100000225621 [1,0,1,0,0,0|1,0,1]=4 147 B15R1.1257 C=CCC(=O)NC(CC)c1ccccc1 11a_100000737752_100000210193 [1,0,1,0,0,0|2,0,0]=4 148 B15R1.1257 C=CCC(=O)NC(CC)c1ccccc1 1626a_100000737752_100000210193 [1,0,1,0,0,0|2,0,0]=4 149 B15R1.1257 C=CCC(=O)NC(CC)c1ccccc1 240690a_100000737752_100000210193 [1,0,1,0,0,0|2,0,0]=4 150 B15R1.1257 C=CCC(=O)NC(CC)c1ccccc1 527a_100000737752_100000210193 [1,0,1,0,0,0|2,0,0]=4 151 B15R1.1257 CC=CC(=O)NC(CC)c1ccccc1 11a_100000737752_100000210699 [1,0,1,0,0,0|2,0,0]=4 152 B15R1.1257 CC=CC(=O)NC(CC)c1ccccc1 1626a_100000737752_100000210699 [1,0,1,0,0,0|2,0,0]=4 153 B15R1.1257 CC=CC(=O)NC(CC)c1ccccc1 240690a_100000737752_100000210699 [1,0,1,0,0,0|2,0,0]=4 154 B15R1.1257 CCC(NC(=O)C=CBr)c1ccccc1 1626a_100000737752_100016273825 [1,0,1,0,0,0|2,0,0]=4 155 B15R1.1257 CCC(NC(=O)C=CBr)c1ccccc1 240690a_100000737752_100016273825 [1,0,1,0,0,0|2,0,0]=4 156 B15R1.1257 CCC(NC(=O)C=CCl)c1ccccc1 11a_100000737752_200016279998 [1,0,1,0,0,0|2,0,0]=4 157 B15R1.1257 CCC(NC(=O)C=CCl)c1ccccc1 1626a_100000737752_200016279998 [1,0,1,0,0,0|2,0,0]=4 158 B15R1.1257 CCC(NC(=O)C=CCl)c1ccccc1 240690a_100000737752_200016279998 [1,0,1,0,0,0|2,0,0]=4 159 B15R1.1257 CCC(NC(=O)C=CI)c1ccccc1 1626a_100000737752_100016256311 [1,0,1,0,0,0|2,0,0]=4 160 B15R1.1257 CCC(NC(=O)NNC)c1ccccc1 273464a_100000737752_100016993582 [1,0,1,0,0,0|2,0,0]=4 161 B15R1.1257 CCC(NC(=O)NNC)c1ccccc1 512a_100000737752_100016993582 [1,0,1,0,0,0|2,0,0]=4 162 B15R1.1257 CCC(NC(=O)NNC)c1ccccc1 512a_100016993582_100000737752 [1,0,1,0,0,0|2,0,0]=4 163 B15R1.1257 CCNC(=O)NC(CC)c1ccccc1 2708a_100000737752_100015525214 [1,0,1,0,0,0|1,0,1]=4 164 B15R1.1257 CCNC(=O)NC(CC)c1ccccc1 2708a_100015525214_100000737752 [1,0,1,0,0,0|1,0,1]=4 165 B15R1.1257 CCNC(=O)NC(CC)c1ccccc1 273464a_100000737752_100015525214 [1,0,1,0,0,0|1,0,1]=4 166 B15R1.1257 CCNC(=O)NC(CC)c1ccccc1 273464a_100015525214_100000737752 [1,0,1,0,0,0|1,0,1]=4 167 B15R1.1257 CCNC(=O)NC(CC)c1ccccc1 512a_100000737752_100015525214 [1,0,1,0,0,0|1,0,1]=4 168 B15R1.1257 CCNC(=O)NC(CC)c1ccccc1 512a_100015525214_100000737752 [1,0,1,0,0,0|1,0,1]=4 169 B17R1.2597 CCC(C(=O)C(C)C(=O)C)c1ccc(cc1)Br 1458a_100011934198_100000179758 [0,1,1,0,0,0|2,0,0]=4 170 B17R1.2597 CCC(C(=O)C(C)C(=O)N)c1ccc(cc1)Br 1458a_100011934198_100000702099 [0,1,1,0,0,0|1,0,0]=3 171 B17R1.2597 CCC(C(=O)C(F)C(=O)N)c1ccc(cc1)Br 1458a_100011934198_100009813875 [0,1,1,0,0,0|2,0,0]=4 172 B17R1.2597 COC(C(=O)C(C)C(=O)N)c1ccc(cc1)Cl 1458a_100012350483_100000702099 [0,1,1,0,0,0|2,0,0]=4 173 B17R1.2943 COC(C(=O)C(C)C(=O)N)c1cccc(c1)Cl 1458a_100012350482_100000702099 [0,1,1,0,0,0|2,0,0]=4 174 B17R1.3107 CCC(C(=O)N)C(=O)C(CC)c1ccccc1 1458a_100000211302_100000750255 [0,1,1,0,0,0|1,0,0]=3 175 B17R1.3107 CCC(C(=O)N)C(=O)C(CO)c1ccccc1 1458a_100011218805_100000750255 [0,1,1,0,0,0|2,0,0]=4 176 B17R1.3107 CCC(C(=O)N)C(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000750255 [0,1,1,0,0,0|2,0,0]=4 177 B17R1.3110 CCC(C(=O)C(C)C(=O)C)c1ccccc1Cl 1458a_100011667493_100000179758 [0,1,1,0,0,0|2,0,0]=4 178 B17R1.3110 CCC(C(=O)C(C)C(=O)N)c1ccccc1Cl 1458a_100011667493_100000702099 [0,1,1,0,0,0|1,0,0]=3 179 B17R1.3110 CCC(C(=O)C(F)C(=O)N)c1ccccc1Cl 1458a_100011667493_100009813875 [0,1,1,0,0,0|2,0,0]=4 180 B17R1.3110 COC(C(=O)C(C)C(=O)N)c1ccccc1C 1458a_100012277922_100000702099 [0,1,1,0,0,0|2,0,0]=4 181 B17R1.3110 COC(C(=O)C(C)C(=O)N)c1ccccc1F 1458a_100012277919_100000702099 [0,1,1,0,0,0|2,0,0]=4 182 B17R1.6319 CCC(=O)C(C)C(=O)C(CC)c1ccccc1 1458a_100000211302_100000742827 [0,1,1,0,0,0|2,0,0]=4 183 B17R1.6319 CCC(C(=O)C(C)C(=O)NC)c1ccccc1 1458a_100000211302_100000209862 [0,1,1,0,0,0|1,0,0]=3 184 B17R1.6319 CCC(C(=O)C(C)C(=O)OC)c1ccccc1 1458a_100000211302_100000211248 [0,1,1,0,0,0|2,0,0]=4 185 B17R1.6319 CCC(C(=O)C(F)C(=O)NC)c1ccccc1 1458a_100000211302_100009813575 [0,1,1,0,0,0|2,0,0]=4 186 B17R1.6319 CNC(=O)C(C)C(=O)C(CO)c1ccccc1 1458a_100011218805_100000209862 [0,1,1,0,0,0|2,0,0]=4 187 B17R1.6319 CNC(=O)C(C)C(=O)[C@H](OC)c1ccccc1 1458a_100000698336_100000209862 [0,1,1,0,0,0|2,0,0]=4 188 B17R1.6454 CCC(O)(C(=O)C(C)C(=O)C)c1ccccc1 1458a_100011434905_100000179758 [0,1,1,0,0,0|2,0,0]=4 189 B17R1.6454 CCC(O)(C(=O)C(C)C(=O)N)c1ccccc1 1458a_100011434905_100000702099 [0,1,1,0,0,0|1,0,0]=3 190 B17R1.6454 CCC(O)(C(=O)C(F)C(=O)N)c1ccccc1 1458a_100011434905_100009813875 [0,1,1,0,0,0|2,0,0]=4 191 B17R1.64476 CC(=O)C(C)C(=O)C(c1ccccc1)C(C)C 1458a_100000764467_100000179758 [0,1,1,0,0,0|2,0,0]=4 192 B17R1.64476 CC(C(=O)N)C(=O)C(c1ccccc1)C(C)C 1458a_100000764467_100000702099 [0,1,1,0,0,0|1,0,0]=3 193 B17R1.64476 CC(C(=O)N)C(=O)C(c1ccccc1)N(C)C 1458a_100000743987_100000702099 [0,1,1,0,0,0|2,0,0]=4 194 B17R1.64476 CC(C)C(C(=O)C(F)C(=O)N)c1ccccc1 1458a_100000764467_100009813875 [0,1,1,0,0,0|2,0,0]=4 195 B17R1.183779 CCC(C(=O)C(F)(F)C(=O)N)c1ccccc1 1458a_100000211302_100009811971 [0,1,1,0,0,0|2,0,0]=4 196 B17R1.119094 C=CCN(C)C(=O)C(O)(CC)c1ccccc1 240690a_100000225617_100011434905 [0,1,1,0,0,0|2,0,0]=4 197 B17R1.5383 CCC(CC)(NC(=O)NNC)c1ccccc1 273464a_100020617177_100016993582 [0,1,1,0,0,0|1,0,1]=4 198 B17R1.5383 CCC(CC)(NC(=O)NNC)c1ccccc1 512a_100016993582_100020617177 [0,1,1,0,0,0|1,0,1]=4 199 B17R1.5383 CCC(CC)(NC(=O)NNC)c1ccccc1 512a_100020617177_100016993582 [0,1,1,0,0,0|1,0,1]=4 200 B17R1.5383 CCNC(=O)NC(CC)(CC)c1ccccc1 2708a_100015525214_100020617177 [0,1,1,0,0,0|1,0,1]=4 201 B17R1.5383 CCNC(=O)NC(CC)(CC)c1ccccc1 273464a_100015525214_100020617177 [0,1,1,0,0,0|1,0,1]=4 202 B17R1.5383 CCNC(=O)NC(CC)(CC)c1ccccc1 273464a_100020617177_100015525214 [0,1,1,0,0,0|1,0,1]=4 203 B17R1.5383 CCNC(=O)NC(CC)(CC)c1ccccc1 512a_100015525214_100020617177 [0,1,1,0,0,0|1,0,1]=4 204 B17R1.5383 CCNC(=O)NC(CC)(CC)c1ccccc1 512a_100020617177_100015525214 [0,1,1,0,0,0|1,0,1]=4 205 B17R1.2977 C/C=C(\C)/C(=O)N[C@@H](c1ccccc1)[C@H](C)O 11a_100134616770_100020587367 [0,1,1,0,0,0|2,0,0]=4 206 B17R1.2977 C/C=C(\C)/C(=O)N[C@H](c1ccccc1)C(C)C 11a_100015186014_100020587367 [0,1,1,0,0,0|2,0,0]=4 207 B17R1.2977 C/C=C(\C)/C(=O)N[C@H](c1ccccc1)C(C)C 1626a_100015186014_100020587367 [0,1,1,0,0,0|2,0,0]=4 208 B17R1.2977 C=CC(C)C(=O)N[C@@H](c1ccccc1)[C@H](C)O 11a_100134616770_100011216780 [0,1,1,0,0,0|2,0,0]=4 209 B17R1.2977 C=CC(C)C(=O)N[C@@H](c1ccccc1)[C@H](C)O 240690a_100134616770_100011216780 [0,1,1,0,0,0|2,0,0]=4 210 B17R1.2977 C=CC(C)C(=O)N[C@@H](c1ccccc1)[C@H](C)O 527a_100134616770_100011216780 [0,1,1,0,0,0|2,0,0]=4 211 B17R1.2977 C=CC(C)C(=O)N[C@H](c1ccccc1)C(C)C 11a_100015186014_100011216780 [0,1,1,0,0,0|2,0,0]=4 212 B17R1.2977 C=CC(C)C(=O)N[C@H](c1ccccc1)C(C)C 1626a_100015186014_100011216780 [0,1,1,0,0,0|2,0,0]=4 213 B17R1.2977 C=CC(C)C(=O)N[C@H](c1ccccc1)C(C)C 240690a_100015186014_100011216780 [0,1,1,0,0,0|2,0,0]=4 214 B17R1.2977 C=CC(C)C(=O)N[C@H](c1ccccc1)C(C)C 527a_100015186014_100011216780 [0,1,1,0,0,0|2,0,0]=4 215 B17R1.2977 CCN(C)C(=O)N[C@H](c1ccccc1)C(C)C 2708a_100015186014_100000225621 [0,1,1,0,0,0|1,0,1]=4 216 B17R1.2977 CCN(C)C(=O)N[C@H](c1ccccc1)C(C)C 273464a_100015186014_100000225621 [0,1,1,0,0,0|1,0,1]=4 217 B17R1.5677 C#CCN(C)C(=O)NC(CC)c1ccccc1 2708a_100000737752_100000225692 [0,1,1,0,0,0|1,0,1]=4 218 B17R1.5677 C#CCN(C)C(=O)NC(CC)c1ccccc1 273464a_100000737752_100000225692 [0,1,1,0,0,0|1,0,1]=4 219 B17R1.5677 C=CCC(C)C(=O)NC(CC)c1ccccc1 11a_100000737752_100011216819 [0,1,1,0,0,0|2,0,0]=4 220 B17R1.5677 C=CCC(C)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100011216819 [0,1,1,0,0,0|2,0,0]=4 221 B17R1.5677 C=CCC(C)C(=O)NC(CC)c1ccccc1 240690a_100000737752_100011216819 [0,1,1,0,0,0|2,0,0]=4 222 B17R1.5677 C=CCC(C)C(=O)NC(CC)c1ccccc1 527a_100000737752_100011216819 [0,1,1,0,0,0|2,0,0]=4 223 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1ccccc1 2708a_100000737752_100000225617 [0,1,1,0,0,0|1,0,0]=3 224 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1ccccc1 273464a_100000737752_100000225617 [0,1,1,0,0,0|1,0,0]=3 225 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1ccccn1 2708a_100015186561_100000225617 [0,1,1,0,0,0|2,0,0]=4 226 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1ccccn1 273464a_100015186561_100000225617 [0,1,1,0,0,0|2,0,0]=4 227 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1cccnc1 2708a_100000246009_100000225617 [0,1,1,0,0,0|2,0,0]=4 228 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1cccnc1 273464a_100000246009_100000225617 [0,1,1,0,0,0|2,0,0]=4 229 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1ccncc1 2708a_100000246010_100000225617 [0,1,1,0,0,0|2,0,0]=4 230 B17R1.5677 C=CCN(C)C(=O)NC(CC)c1ccncc1 273464a_100000246010_100000225617 [0,1,1,0,0,0|2,0,0]=4 231 B17R1.5677 C=CCN(C)C(=O)N[C@H](CO)c1ccccc1 273464a_100000751927_100000225617 [0,1,1,0,0,0|2,0,0]=4 232 B17R1.5677 CC/C=C(\C)/C(=O)NC(CC)c1ccccc1 11a_100000737752_100016988807 [0,1,1,0,0,0|2,0,0]=4 233 B17R1.5677 CC/C=C(\C)/C(=O)NC(CC)c1ccccc1 1626a_100000737752_100016988807 [0,1,1,0,0,0|2,0,0]=4 234 B17R1.5677 CC/C=C(\C)/C(=O)NC(CC)c1ccccc1 240690a_100000737752_100016988807 [0,1,1,0,0,0|2,0,0]=4 235 B17R1.5677 CC/C=C(\C)/C(=O)NC(CC)c1ccccc1 527a_100000737752_100016988807 [0,1,1,0,0,0|2,0,0]=4 236 B17R1.5677 CCC(NC(=O)N(C)CC#N)c1ccccc1 273464a_100000737752_100000748184 [0,1,1,0,0,0|1,0,1]=4 237 B17R1.5677 CCC(NC(=O)N(C)CCO)c1ccccc1 2708a_100000737752_100000210263 [0,1,1,0,0,0|0,0,2]=4 238 B17R1.5677 CCC(NC(=O)N(C)CCO)c1ccccc1 273464a_100000737752_100000210263 [0,1,1,0,0,0|0,0,2]=4 239 B17R1.5677 CCCN(C)C(=O)NC(CC)c1ccccc1 2708a_100000737752_100000747261 [0,1,1,0,0,0|1,0,1]=4 240 B17R1.5677 CCCN(C)C(=O)NC(CC)c1ccccc1 273464a_100000737752_100000747261 [0,1,1,0,0,0|1,0,1]=4 241 B17R1.8322 C/C=C(\C)/C(=O)NC(CC)c1ccc(cc1)C 11a_100000749201_100020587367 [0,1,1,0,0,0|2,0,0]=4 242 B17R1.8322 C/C=C(\C)/C(=O)NC(CC)c1ccc(cc1)C 1626a_100000749201_100020587367 [0,1,1,0,0,0|2,0,0]=4 243 B17R1.8322 C/C=C(\C)/C(=O)NC(CC)c1ccc(cc1)F 11a_100011191751_100020587367 [0,1,1,0,0,0|2,0,0]=4 244 B17R1.8322 C/C=C(\C)/C(=O)NC(CC)c1ccc(cc1)F 1626a_100011191751_100020587367 [0,1,1,0,0,0|2,0,0]=4 245 B17R1.8322 C/C=C(\C)/C(=O)NC(CC)c1ccc(cc1)O 1626a_100015187210_100020587367 [0,1,1,0,0,0|2,0,0]=4 246 B17R1.8322 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccc(cc1)Br 11a_100025736560_100020587367 [0,1,1,0,0,0|2,0,0]=4 247 B17R1.8322 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccc(cc1)Br 1626a_100025736560_100020587367 [0,1,1,0,0,0|2,0,0]=4 248 B17R1.8322 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccc(cc1)Cl 11a_100015186824_100020587367 [0,1,1,0,0,0|2,0,0]=4 249 B17R1.8322 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccc(cc1)Cl 1626a_100015186824_100020587367 [0,1,1,0,0,0|2,0,0]=4 250 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)C 11a_100000749201_100011216780 [0,1,1,0,0,0|2,0,0]=4 251 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)C 1626a_100000749201_100011216780 [0,1,1,0,0,0|2,0,0]=4 252 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)C 240690a_100000749201_100011216780 [0,1,1,0,0,0|2,0,0]=4 253 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)C 527a_100000749201_100011216780 [0,1,1,0,0,0|2,0,0]=4 254 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)F 11a_100011191751_100011216780 [0,1,1,0,0,0|2,0,0]=4 255 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)F 1626a_100011191751_100011216780 [0,1,1,0,0,0|2,0,0]=4 256 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)F 240690a_100011191751_100011216780 [0,1,1,0,0,0|2,0,0]=4 257 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)F 527a_100011191751_100011216780 [0,1,1,0,0,0|2,0,0]=4 258 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)O 1626a_100015187210_100011216780 [0,1,1,0,0,0|2,0,0]=4 259 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)O 240690a_100015187210_100011216780 [0,1,1,0,0,0|2,0,0]=4 260 B17R1.8322 C=CC(C)C(=O)NC(CC)c1ccc(cc1)O 527a_100015187210_100011216780 [0,1,1,0,0,0|2,0,0]=4 261 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Br 11a_100025736560_100011216780 [0,1,1,0,0,0|2,0,0]=4 262 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Br 1626a_100025736560_100011216780 [0,1,1,0,0,0|2,0,0]=4 263 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Br 240690a_100025736560_100011216780 [0,1,1,0,0,0|2,0,0]=4 264 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Br 527a_100025736560_100011216780 [0,1,1,0,0,0|2,0,0]=4 265 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Cl 11a_100015186824_100011216780 [0,1,1,0,0,0|2,0,0]=4 266 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Cl 1626a_100015186824_100011216780 [0,1,1,0,0,0|2,0,0]=4 267 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Cl 240690a_100015186824_100011216780 [0,1,1,0,0,0|2,0,0]=4 268 B17R1.8322 C=CC(C)C(=O)N[C@@H](CC)c1ccc(cc1)Cl 527a_100015186824_100011216780 [0,1,1,0,0,0|2,0,0]=4 269 B17R1.8322 CCC(NC(=O)N(C)CC)c1ccc(cc1)C 2708a_100000749201_100000225621 [0,1,1,0,0,0|1,0,1]=4 270 B17R1.8322 CCC(NC(=O)N(C)CC)c1ccc(cc1)C 273464a_100000749201_100000225621 [0,1,1,0,0,0|1,0,1]=4 271 B17R1.8322 CCC(NC(=O)N(C)CC)c1ccc(cc1)F 2708a_100011191751_100000225621 [0,1,1,0,0,0|1,0,1]=4 272 B17R1.8322 CCC(NC(=O)N(C)CC)c1ccc(cc1)F 273464a_100011191751_100000225621 [0,1,1,0,0,0|1,0,1]=4 273 B17R1.8322 CCC(NC(=O)N(C)CC)c1ccc(cc1)O 2708a_100015187210_100000225621 [0,1,1,0,0,0|1,0,1]=4 274 B17R1.8322 CCC(NC(=O)N(C)CC)c1ccc(cc1)O 273464a_100015187210_100000225621 [0,1,1,0,0,0|1,0,1]=4 275 B17R1.8322 CC[C@H](NC(=O)N(C)CC)c1ccc(cc1)Br 2708a_100025736560_100000225621 [0,1,1,0,0,0|1,0,1]=4 276 B17R1.8322 CC[C@H](NC(=O)N(C)CC)c1ccc(cc1)Br 273464a_100025736560_100000225621 [0,1,1,0,0,0|1,0,1]=4 277 B17R1.8322 CC[C@H](NC(=O)N(C)CC)c1ccc(cc1)Cl 2708a_100015186824_100000225621 [0,1,1,0,0,0|1,0,1]=4 278 B17R1.8322 CC[C@H](NC(=O)N(C)CC)c1ccc(cc1)Cl 273464a_100015186824_100000225621 [0,1,1,0,0,0|1,0,1]=4 279 B17R1.8323 C/C=C(\C)/C(=O)NC(CC)c1cccc(c1)Cl 11a_100000737531_100020587367 [0,1,1,0,0,0|2,0,0]=4 280 B17R1.8323 C/C=C(\C)/C(=O)NC(CC)c1cccc(c1)Cl 1626a_100000737531_100020587367 [0,1,1,0,0,0|2,0,0]=4 281 B17R1.8323 C/C=C(\C)/C(=O)NC(CC)c1cccc(c1)F 11a_100159265421_100020587367 [0,1,1,0,0,0|2,0,0]=4 282 B17R1.8323 C/C=C(\C)/C(=O)NC(CC)c1cccc(c1)F 1626a_100159265421_100020587367 [0,1,1,0,0,0|2,0,0]=4 283 B17R1.8323 C/C=C(\C)/C(=O)NC(CC)c1cccc(c1)O 1626a_100159312145_100020587367 [0,1,1,0,0,0|2,0,0]=4 284 B17R1.8323 C/C=C(\C)/C(=O)N[C@@H](CC)c1cccc(c1)Br 11a_100102422761_100020587367 [0,1,1,0,0,0|2,0,0]=4 285 B17R1.8323 C/C=C(\C)/C(=O)N[C@@H](CC)c1cccc(c1)Br 1626a_100102422761_100020587367 [0,1,1,0,0,0|2,0,0]=4 286 B17R1.8323 C/C=C(\C)/C(=O)N[C@H](CC)c1cccc(c1)C 11a_200016991486_100020587367 [0,1,1,0,0,0|2,0,0]=4 287 B17R1.8323 C/C=C(\C)/C(=O)N[C@H](CC)c1cccc(c1)C 1626a_200016991486_100020587367 [0,1,1,0,0,0|2,0,0]=4 288 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)Cl 11a_100000737531_100011216780 [0,1,1,0,0,0|2,0,0]=4 289 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)Cl 1626a_100000737531_100011216780 [0,1,1,0,0,0|2,0,0]=4 290 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)Cl 240690a_100000737531_100011216780 [0,1,1,0,0,0|2,0,0]=4 291 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)Cl 527a_100000737531_100011216780 [0,1,1,0,0,0|2,0,0]=4 292 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)F 11a_100159265421_100011216780 [0,1,1,0,0,0|2,0,0]=4 293 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)F 1626a_100159265421_100011216780 [0,1,1,0,0,0|2,0,0]=4 294 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)F 240690a_100159265421_100011216780 [0,1,1,0,0,0|2,0,0]=4 295 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)F 527a_100159265421_100011216780 [0,1,1,0,0,0|2,0,0]=4 296 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)O 1626a_100159312145_100011216780 [0,1,1,0,0,0|2,0,0]=4 297 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)O 240690a_100159312145_100011216780 [0,1,1,0,0,0|2,0,0]=4 298 B17R1.8323 C=CC(C)C(=O)NC(CC)c1cccc(c1)O 527a_100159312145_100011216780 [0,1,1,0,0,0|2,0,0]=4 299 B17R1.8323 C=CC(C)C(=O)N[C@@H](CC)c1cccc(c1)Br 11a_100102422761_100011216780 [0,1,1,0,0,0|2,0,0]=4 300 B17R1.8323 C=CC(C)C(=O)N[C@@H](CC)c1cccc(c1)Br 1626a_100102422761_100011216780 [0,1,1,0,0,0|2,0,0]=4 301 B17R1.8323 C=CC(C)C(=O)N[C@@H](CC)c1cccc(c1)Br 240690a_100102422761_100011216780 [0,1,1,0,0,0|2,0,0]=4 302 B17R1.8323 C=CC(C)C(=O)N[C@@H](CC)c1cccc(c1)Br 527a_100102422761_100011216780 [0,1,1,0,0,0|2,0,0]=4 303 B17R1.8323 C=CC(C)C(=O)N[C@H](CC)c1cccc(c1)C 11a_200016991486_100011216780 [0,1,1,0,0,0|2,0,0]=4 304 B17R1.8323 C=CC(C)C(=O)N[C@H](CC)c1cccc(c1)C 1626a_200016991486_100011216780 [0,1,1,0,0,0|2,0,0]=4 305 B17R1.8323 C=CC(C)C(=O)N[C@H](CC)c1cccc(c1)C 240690a_200016991486_100011216780 [0,1,1,0,0,0|2,0,0]=4 306 B17R1.8323 C=CC(C)C(=O)N[C@H](CC)c1cccc(c1)C 527a_200016991486_100011216780 [0,1,1,0,0,0|2,0,0]=4 307 B17R1.8323 CCC(NC(=O)N(C)CC)c1cccc(c1)Cl 2708a_100000737531_100000225621 [0,1,1,0,0,0|1,0,1]=4 308 B17R1.8323 CCC(NC(=O)N(C)CC)c1cccc(c1)Cl 273464a_100000737531_100000225621 [0,1,1,0,0,0|1,0,1]=4 309 B17R1.8323 CCC(NC(=O)N(C)CC)c1cccc(c1)F 2708a_100159265421_100000225621 [0,1,1,0,0,0|1,0,1]=4 310 B17R1.8323 CCC(NC(=O)N(C)CC)c1cccc(c1)F 273464a_100159265421_100000225621 [0,1,1,0,0,0|1,0,1]=4 311 B17R1.8323 CCC(NC(=O)N(C)CC)c1cccc(c1)O 2708a_100159312145_100000225621 [0,1,1,0,0,0|1,0,1]=4 312 B17R1.8323 CCC(NC(=O)N(C)CC)c1cccc(c1)O 273464a_100159312145_100000225621 [0,1,1,0,0,0|1,0,1]=4 313 B17R1.8323 CC[C@@H](NC(=O)N(C)CC)c1cccc(c1)C 2708a_200016991486_100000225621 [0,1,1,0,0,0|1,0,1]=4 314 B17R1.8323 CC[C@@H](NC(=O)N(C)CC)c1cccc(c1)C 273464a_200016991486_100000225621 [0,1,1,0,0,0|1,0,1]=4 315 B17R1.8323 CC[C@H](NC(=O)N(C)CC)c1cccc(c1)Br 2708a_100102422761_100000225621 [0,1,1,0,0,0|1,0,1]=4 316 B17R1.8323 CC[C@H](NC(=O)N(C)CC)c1cccc(c1)Br 273464a_100102422761_100000225621 [0,1,1,0,0,0|1,0,1]=4 317 B17R1.16795 C=CC(C)(C)C(=O)NC(CC)c1ccccc1 11a_100000737752_100012027013 [0,1,1,0,0,0|2,0,0]=4 318 B17R1.16795 C=CC(C)(C)C(=O)NC(CC)c1ccccc1 1626a_100000737752_100012027013 [0,1,1,0,0,0|2,0,0]=4 319 B17R1.16795 C=CC(C)(C)C(=O)NC(CC)c1ccccc1 240690a_100000737752_100012027013 [0,1,1,0,0,0|2,0,0]=4 320 B17R1.16795 C=CC(C)(C)C(=O)NC(CC)c1ccccc1 527a_100000737752_100012027013 [0,1,1,0,0,0|2,0,0]=4 321 B17R1.16842 CCC(NC(=O)N(C)C(C)C)c1ccccc1 2708a_100000737752_200000211004 [0,1,1,0,0,0|1,0,1]=4 322 B17R1.16842 CCC(NC(=O)N(C)C(C)C)c1ccccc1 273464a_100000737752_200000211004 [0,1,1,0,0,0|1,0,1]=4 323 B17R1.18850 C/C=C(\C)/C(=O)NC(CCC)c1ccccc1 11a_100000189686_100020587367 [0,1,1,0,0,0|2,0,0]=4 324 B17R1.18850 C/C=C(\C)/C(=O)NC(CCC)c1ccccc1 1626a_100000189686_100020587367 [0,1,1,0,0,0|2,0,0]=4 325 B17R1.18850 C/C=C(\C)/C(=O)N[C@H](COC)c1ccccc1 11a_103619048568_100020587367 [0,1,1,0,0,0|2,0,0]=4 326 B17R1.18850 C/C=C(\C)/C(=O)N[C@H](COC)c1ccccc1 1626a_103619048568_100020587367 [0,1,1,0,0,0|2,0,0]=4 327 B17R1.18850 C=CC(C)C(=O)NC(CCC)c1ccccc1 11a_100000189686_100011216780 [0,1,1,0,0,0|2,0,0]=4 328 B17R1.18850 C=CC(C)C(=O)NC(CCC)c1ccccc1 1626a_100000189686_100011216780 [0,1,1,0,0,0|2,0,0]=4 329 B17R1.18850 C=CC(C)C(=O)NC(CCC)c1ccccc1 240690a_100000189686_100011216780 [0,1,1,0,0,0|2,0,0]=4 330 B17R1.18850 C=CC(C)C(=O)NC(CCC)c1ccccc1 527a_100000189686_100011216780 [0,1,1,0,0,0|2,0,0]=4 331 B17R1.18850 C=CC(C)C(=O)N[C@@H](CCO)c1ccccc1 240690a_100025705951_100011216780 [0,1,1,0,0,0|2,0,0]=4 332 B17R1.18850 C=CC(C)C(=O)N[C@@H](CCO)c1ccccc1 527a_100025705951_100011216780 [0,1,1,0,0,0|2,0,0]=4 333 B17R1.18850 C=CC(C)C(=O)N[C@H](COC)c1ccccc1 11a_103619048568_100011216780 [0,1,1,0,0,0|2,0,0]=4 334 B17R1.18850 C=CC(C)C(=O)N[C@H](COC)c1ccccc1 1626a_103619048568_100011216780 [0,1,1,0,0,0|2,0,0]=4 335 B17R1.18850 C=CC(C)C(=O)N[C@H](COC)c1ccccc1 240690a_103619048568_100011216780 [0,1,1,0,0,0|2,0,0]=4 336 B17R1.18850 C=CC(C)C(=O)N[C@H](COC)c1ccccc1 527a_103619048568_100011216780 [0,1,1,0,0,0|2,0,0]=4 337 B17R1.18850 CCCC(NC(=O)N(C)CC)c1ccccc1 2708a_100000189686_100000225621 [0,1,1,0,0,0|1,0,1]=4 338 B17R1.18850 CCCC(NC(=O)N(C)CC)c1ccccc1 273464a_100000189686_100000225621 [0,1,1,0,0,0|1,0,1]=4 339 B17R1.18850 CCN(C)C(=O)N[C@@H](CCO)c1ccccc1 273464a_100025705951_100000225621 [0,1,1,0,0,0|1,0,1]=4 340 B17R1.18850 CCN(C)C(=O)N[C@H](COC)c1ccccc1 2708a_103619048568_100000225621 [0,1,1,0,0,0|1,0,1]=4 341 B17R1.18850 CCN(C)C(=O)N[C@H](COC)c1ccccc1 273464a_103619048568_100000225621 [0,1,1,0,0,0|1,0,1]=4 342 B17R1.19446 CCC(NC(=O)N(CC)CC)c1ccccc1 2708a_100000737752_100000724800 [0,1,1,0,0,0|1,0,1]=4 343 B17R1.19446 CCC(NC(=O)N(CC)CC)c1ccccc1 273464a_100000737752_100000724800 [0,1,1,0,0,0|1,0,1]=4 344 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1Cl 11a_200016987949_100020587367 [0,1,1,0,0,0|2,0,0]=4 345 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1Cl 1626a_200016987949_100020587367 [0,1,1,0,0,0|2,0,0]=4 346 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1F 11a_100015190424_100020587367 [0,1,1,0,0,0|2,0,0]=4 347 B17R1.178255 C/C=C(\C)/C(=O)N[C@@H](CC)c1ccccc1F 1626a_100015190424_100020587367 [0,1,1,0,0,0|2,0,0]=4 348 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1Cl 11a_200016987949_100011216780 [0,1,1,0,0,0|2,0,0]=4 349 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1Cl 1626a_200016987949_100011216780 [0,1,1,0,0,0|2,0,0]=4 350 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1Cl 240690a_200016987949_100011216780 [0,1,1,0,0,0|2,0,0]=4 351 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1Cl 527a_200016987949_100011216780 [0,1,1,0,0,0|2,0,0]=4 352 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1F 11a_100015190424_100011216780 [0,1,1,0,0,0|2,0,0]=4 353 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1F 1626a_100015190424_100011216780 [0,1,1,0,0,0|2,0,0]=4 354 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1F 240690a_100015190424_100011216780 [0,1,1,0,0,0|2,0,0]=4 355 B17R1.178255 C=CC(C)C(=O)N[C@@H](CC)c1ccccc1F 527a_100015190424_100011216780 [0,1,1,0,0,0|2,0,0]=4 356 B17R1.178255 CC[C@H](NC(=O)N(C)CC)c1ccccc1Cl 2708a_200016987949_100000225621 [0,1,1,0,0,0|1,0,1]=4 357 B17R1.178255 CC[C@H](NC(=O)N(C)CC)c1ccccc1Cl 273464a_200016987949_100000225621 [0,1,1,0,0,0|1,0,1]=4 358 B17R1.178255 CC[C@H](NC(=O)N(C)CC)c1ccccc1F 2708a_100015190424_100000225621 [0,1,1,0,0,0|1,0,1]=4 359 B17R1.178255 CC[C@H](NC(=O)N(C)CC)c1ccccc1F 273464a_100015190424_100000225621 [0,1,1,0,0,0|1,0,1]=4 360 B17R2.7860 CCC(C(=O)C1CCC1=O)c2ccccc2 1458a_100000211302_100009892977 [0,0,1,1,0,0|2,0,0]=4 361 B17R2.20021 CC(=O)C(C)C(=O)C1(CC1)c2ccccc2 1458a_100000211650_100000179758 [0,0,1,1,0,0|2,0,0]=4 362 B17R2.20021 CC(C(=O)N)C(=O)C1(CC1)c2ccccc2 1458a_100000211650_100000702099 [0,0,1,1,0,0|1,0,0]=3 363 B17R2.20021 CC(C(=O)N)C(=O)C1(CC1)c2ccccn2 1458a_106256046498_100000702099 [0,0,1,1,0,0|2,0,0]=4 364 B17R2.20021 CC(C(=O)N)C(=O)C1(CC1)c2cccnc2 1458a_100000717079_100000702099 [0,0,1,1,0,0|2,0,0]=4 365 B17R2.20021 NC(=O)C(F)C(=O)C1(CC1)c2ccccc2 1458a_100000211650_100009813875 [0,0,1,1,0,0|2,0,0]=4 366 B17R2.45515 CC(=O)C(C)C(=O)C1CCc2c1cccc2 1458a_100000750891_100000179758 [0,0,1,1,0,0|2,0,0]=4 367 B17R2.45515 CC(C(=O)N)C(=O)C1CCc2c1cccc2 1458a_100000750891_100000702099 [0,0,1,1,0,0|1,0,0]=3 368 B17R2.45515 NC(=O)C(F)C(=O)C1CCc2c1cccc2 1458a_100000750891_100009813875 [0,0,1,1,0,0|2,0,0]=4 369 B17R2.59111 CNC(=O)NC1(CCCC1)c2ccccc2 2708a_100102657272_100025739779 [0,0,1,1,0,0|1,0,1]=4 370 B17R2.59111 CNC(=O)NC1(CCCC1)c2ccccc2 273464a_100025739779_100102657272 [0,0,1,1,0,0|1,0,1]=4 371 B17R2.59111 CNC(=O)NC1(CCCC1)c2ccccc2 273464a_100102657272_100025739779 [0,0,1,1,0,0|1,0,1]=4 372 B17R2.59111 CNC(=O)NC1(CCCC1)c2ccccc2 512a_106832991638_100025739779 [0,0,1,1,0,0|1,0,1]=4 373 B17R2.7 C/C=C(\C)/C(=O)N[C@H]1CCc2c1cccc2 11a_100016989578_100020587367 [0,0,1,1,0,0|2,0,0]=4 374 B17R2.7 C/C=C(\C)/C(=O)N[C@H]1CCc2c1cccc2 1626a_100016989578_100020587367 [0,0,1,1,0,0|2,0,0]=4 375 B17R2.7 C=CC(C)C(=O)N[C@H]1CCc2c1cccc2 11a_100016989578_100011216780 [0,0,1,1,0,0|2,0,0]=4 376 B17R2.7 C=CC(C)C(=O)N[C@H]1CCc2c1cccc2 1626a_100016989578_100011216780 [0,0,1,1,0,0|2,0,0]=4 377 B17R2.7 C=CC(C)C(=O)N[C@H]1CCc2c1cccc2 240690a_100016989578_100011216780 [0,0,1,1,0,0|2,0,0]=4 378 B17R2.7 C=CC(C)C(=O)N[C@H]1CCc2c1cccc2 527a_100016989578_100011216780 [0,0,1,1,0,0|2,0,0]=4 379 B17R2.7 CCN(C)C(=O)N[C@H]1CCc2c1cccc2 2708a_100016989578_100000225621 [0,0,1,1,0,0|1,0,1]=4 380 B17R2.7 CCN(C)C(=O)N[C@H]1CCc2c1cccc2 273464a_100016989578_100000225621 [0,0,1,1,0,0|1,0,1]=4 381 B17R2.2237 C/C=C(\C)/C(=O)N1CCC1c2ccccc2 11a_100000739605_100020587367 [0,0,1,1,0,0|2,0,0]=4 382 B17R2.2237 C/C=C(\C)/C(=O)N1CCC1c2ccccc2 1626a_100000739605_100020587367 [0,0,1,1,0,0|2,0,0]=4 383 B17R2.2237 C=CC(C)C(=O)N1CCC1c2ccccc2 11a_100000739605_100011216780 [0,0,1,1,0,0|2,0,0]=4 384 B17R2.2237 C=CC(C)C(=O)N1CCC1c2ccccc2 1626a_100000739605_100011216780 [0,0,1,1,0,0|2,0,0]=4 385 B17R2.2237 C=CC(C)C(=O)N1CCC1c2ccccc2 240690a_100000739605_100011216780 [0,0,1,1,0,0|2,0,0]=4 386 B17R2.2237 C=CC(C)C(=O)N1CCC1c2ccccc2 527a_100000739605_100011216780 [0,0,1,1,0,0|2,0,0]=4 387 B17R2.5736 CCC(NC(=O)N1CCC1)c2ccccc2 2708a_100000737752_100000754969 [0,0,1,1,0,0|1,0,1]=4 388 B17R2.5736 CCC(NC(=O)N1CCC1)c2ccccc2 273464a_100000737752_100000754969 [0,0,1,1,0,0|1,0,1]=4 389 B17R2.18990 C/C=C(\C)/C(=O)NC1(CC1)c2ccccc2 11a_100000749958_100020587367 [0,0,1,1,0,0|2,0,0]=4 390 B17R2.18990 C/C=C(\C)/C(=O)NC1(CC1)c2ccccc2 1626a_100000749958_100020587367 [0,0,1,1,0,0|2,0,0]=4 391 B17R2.18990 C=CC(C)C(=O)NC1(CC1)c2ccccc2 11a_100000749958_100011216780 [0,0,1,1,0,0|2,0,0]=4 392 B17R2.18990 C=CC(C)C(=O)NC1(CC1)c2ccccc2 1626a_100000749958_100011216780 [0,0,1,1,0,0|2,0,0]=4 393 B17R2.18990 C=CC(C)C(=O)NC1(CC1)c2ccccc2 240690a_100000749958_100011216780 [0,0,1,1,0,0|2,0,0]=4 394 B17R2.18990 C=CC(C)C(=O)NC1(CC1)c2ccccc2 527a_100000749958_100011216780 [0,0,1,1,0,0|2,0,0]=4 395 B17R2.18990 CCN(C)C(=O)NC1(CC1)c2ccccc2 273464a_100000749958_100000225621 [0,0,1,1,0,0|1,0,1]=4 396 B17R1.787 CCC(Oc1ccccc1)C(=O)C(C)C(=O)C 1458a_100000211556_100000179758 [0,0,1,0,0,1|2,0,0]=4 397 B17R1.787 CCC(Oc1ccccc1)C(=O)C(C)C(=O)N 1458a_100000211556_100000702099 [0,0,1,0,0,1|1,0,0]=3 398 B17R1.787 CCC(Oc1ccccc1)C(=O)C(F)C(=O)N 1458a_100000211556_100009813875 [0,0,1,0,0,1|2,0,0]=4 399 B17R1.787 CCC(Sc1ccccc1)C(=O)C(C)C(=O)C 1458a_100000230495_100000179758 [0,0,1,0,0,1|2,0,0]=4 400 B17R1.787 CCC(Sc1ccccc1)C(=O)C(C)C(=O)N 1458a_100000230495_100000702099 [0,0,1,0,0,1|1,0,0]=3 401 B17R1.787 CCC(Sc1ccccc1)C(=O)C(F)C(=O)N 1458a_100000230495_100009813875 [0,0,1,0,0,1|2,0,0]=4 402 B17R1.3104 C=C(C)CN(C)C(=O)C(CC)c1ccccc1 11a_100000225649_100000211302 [0,0,1,0,0,1|2,0,0]=4 403 B17R1.3104 C=C(C)CN(C)C(=O)C(CC)c1ccccc1 1626a_100000225649_100000211302 [0,0,1,0,0,1|2,0,0]=4 404 B17R1.3104 C=C(C)CN(C)C(=O)C(CC)c1ccccc1 527a_100000225649_100000211302 [0,0,1,0,0,1|2,0,0]=4 405 B17R1.3104 CCC(C(=O)C(C)OC(=O)C)c1ccccc1 1458a_100000211302_100009818208 [0,0,1,0,0,1|2,0,0]=4 406 B17R1.3104 CCC(C(=O)N(C)CC(=O)N)c1ccccc1 11a_100000739694_100000211302 [0,0,1,0,0,1|0,0,0]=2 407 B17R1.3104 CCC(C(=O)N(C)CC(=O)N)c1ccccc1 527a_100000739694_100000211302 [0,0,1,0,0,1|0,0,0]=2 408 B17R1.3104 CO[C@@H](C(=O)N(C)CC(=O)N)c1ccccc1 11a_100000739694_100000698336 [0,0,1,0,0,1|1,0,0]=3 409 B17R1.3104 CO[C@@H](C(=O)N(C)CC(=O)N)c1ccccc1 527a_100000739694_100000698336 [0,0,1,0,0,1|1,0,0]=3 410 B17R1.3105 CCC(C(=O)N[C@H](C)C(=O)N)c1ccccc1 11a_100000119354_100000211302 [0,0,1,0,0,1|1,0,0]=3 411 B17R1.3105 CCC(C(=O)N[C@H](C)C(=O)N)c1ccccc1 240690a_100000119354_100000211302 [0,0,1,0,0,1|1,0,0]=3 412 B17R1.3105 CCC(C(=O)N[C@H](C)C(=O)N)c1ccccc1 527a_100000119354_100000211302 [0,0,1,0,0,1|1,0,0]=3 413 B17R1.3105 CCN(C(=O)CN(C)C(=O)C)c1ccccc1 11a_100000210013_100000194957 [0,0,1,0,0,1|2,0,0]=4 414 B17R1.3105 CCN(C(=O)CN(C)C(=O)C)c1ccccc1 1626a_100000210013_100000194957 [0,0,1,0,0,1|2,0,0]=4 415 B17R1.3105 CCN(C(=O)CN(C)C(=O)C)c1ccccc1 22a_100000210013_100000194957 [0,0,1,0,0,1|2,0,0]=4 416 B17R1.3105 CCN(C(=O)CN(C)C(=O)N)c1ccccc1 22a_100000210013_100000218718 [0,0,1,0,0,1|1,0,0]=3 417 B17R1.3105 CO[C@@H](C(=O)N[C@H](C)C(=O)N)c1ccccc1 11a_100000119354_100000698336 [0,0,1,0,0,1|2,0,0]=4 418 B17R1.3105 CO[C@@H](C(=O)N[C@H](C)C(=O)N)c1ccccc1 240690a_100000119354_100000698336 [0,0,1,0,0,1|2,0,0]=4 419 B17R1.3105 CO[C@@H](C(=O)N[C@H](C)C(=O)N)c1ccccc1 527a_100000119354_100000698336 [0,0,1,0,0,1|2,0,0]=4 420 B17R1.3105 C[C@@H](NC(=O)C(CO)c1ccccc1)C(=O)N 240690a_100000119354_100011218805 [0,0,1,0,0,1|2,0,0]=4 421 B17R1.24100 CCC(CC)(NCC(=O)NC)c1ccccc1 2230a_100020617177_100000183359 [0,0,1,0,0,1|1,0,1]=4 422 B17R1.24760 C=CC(C)CC(=O)NC(CC)c1ccccc1 11a_100000737752_100011934298 [0,0,1,0,0,1|2,0,0]=4 423 B17R1.24760 C=CC(C)CC(=O)NC(CC)c1ccccc1 1626a_100000737752_100011934298 [0,0,1,0,0,1|2,0,0]=4 424 B17R1.24760 C=CC(C)CC(=O)NC(CC)c1ccccc1 240690a_100000737752_100011934298 [0,0,1,0,0,1|2,0,0]=4 425 B17R1.24760 C=CC(C)CC(=O)NC(CC)c1ccccc1 527a_100000737752_100011934298 [0,0,1,0,0,1|2,0,0]=4 426 B17R1.24760 CCC(NC(=O)CN(C)CC)c1ccccc1 240690a_100000737752_100116209913 [0,0,1,0,0,1|1,0,1]=4 427 B17R1.24760 CCC(NC(=O)CN(C)CC)c1ccccc1 527a_100000737752_100116209913 [0,0,1,0,0,1|1,0,1]=4 428 B17R1.25025 CCC(NCC(=O)N(C)CC)c1ccccc1 2230a_100000737752_100000738999 [0,0,1,0,0,1|1,0,1]=4 429 B17R1.25025 CCC(NCC(=O)N(C)OC)c1ccccc1 2230a_100000737752_100000764215 [0,0,1,0,0,1|2,0,0]=4