0 B17R2.520754 C=C(C)C(=O)Cc1cccc2c1cccc2 1458a_100000185857_100000188474 [0,0,0,0,0,0|3,0,1]=4 1 B17R2.520754 CC(=O)C(C)Oc1cccc2c1cccc2 1458a_100000216494_200000210301 [0,0,0,0,0,0|3,0,0]=3 2 B17R2.520754 CC(=O)C(C)Oc1cccc2c1cccc2 7a_100000210388_100000179758 [0,0,0,0,0,0|3,0,0]=3 3 B17R2.520754 CC(=O)C(C)Oc1cncc2c1cccc2 7a_100000066178_100000179758 [0,0,0,0,0,0|4,0,0]=4 4 B17R2.520754 CC(=O)C(C)Sc1cccc2c1cccc2 62a_100009814033_100000210605 [0,0,0,0,0,0|3,0,0]=3 5 B17R2.520754 CC(=O)C(C)Sc1cccc2c1cccn2 62a_100009814033_100011290932 [0,0,0,0,0,0|4,0,0]=4 6 B17R2.520754 CC(=O)C(C)Sc1cccc2c1cccn2 62a_100011290932_100009814033 [0,0,0,0,0,0|4,0,0]=4 7 B17R2.520754 CC(=O)C(C)Sc1cccc2c1ccnc2 62a_100000186358_100009814033 [0,0,0,0,0,0|4,0,0]=4 8 B17R2.520754 CC(=O)C(C)Sc1cccc2c1ccnc2 62a_100009814033_100000186358 [0,0,0,0,0,0|4,0,0]=4 9 B17R2.520754 CC(=O)C(C)Sc1cccc2c1cncc2 62a_100000685578_100009814033 [0,0,0,0,0,0|4,0,0]=4 10 B17R2.520754 CC(=O)C(C)Sc1cccc2c1cncc2 62a_100009814033_100000685578 [0,0,0,0,0,0|4,0,0]=4 11 B17R2.520754 CC(=O)C(C)Sc1cccc2c1nccc2 62a_100009814033_100011215545 [0,0,0,0,0,0|4,0,0]=4 12 B17R2.520754 CC(=O)C(C)Sc1ccnc2c1cccc2 62a_100009814033_100011215880 [0,0,0,0,0,0|4,0,0]=4 13 B17R2.520754 CC(=O)C(C)Sc1ccnc2c1cccc2 62a_100011458314_100009814033 [0,0,0,0,0,0|4,0,0]=4 14 B17R2.520754 CC(=O)C(C)Sc1cncc2c1cccc2 62a_100000187577_100009814033 [0,0,0,0,0,0|4,0,0]=4 15 B17R2.520754 CC(=O)C(C)Sc1cncc2c1cccc2 62a_100009814033_100000187577 [0,0,0,0,0,0|4,0,0]=4 16 B17R2.520754 CC(=O)C(C)Sc1nccc2c1cccc2 62a_100009814033_100011934041 [0,0,0,0,0,0|4,0,0]=4 17 B17R2.520754 CC(=O)C(C)Sc1nccc2c1cccc2 62a_100011934041_100009814033 [0,0,0,0,0,0|4,0,0]=4 18 B17R2.520754 CC(=O)N(C)Cc1cccc2c1cccc2 11a_100000741213_100015343762 [0,0,0,0,0,0|3,0,0]=3 19 B17R2.520754 CC(=O)N(C)Cc1cccc2c1cccc2 240690a_100000741213_100015343762 [0,0,0,0,0,0|3,0,0]=3 20 B17R2.520754 CC(=O)N(C)Cc1cccc2c1cccc2 527a_100000741213_100103153847 [0,0,0,0,0,0|3,0,0]=3 21 B17R2.520754 CC(=O)N(C)Cc1cccc2c1cccn2 11a_100011647598_100015343762 [0,0,0,0,0,0|4,0,0]=4 22 B17R2.520754 CC(=O)N(C)Cc1cccc2c1cccn2 240690a_100011647598_100015343762 [0,0,0,0,0,0|4,0,0]=4 23 B17R2.520754 CC(=O)N(C)Cc1cccc2c1cccn2 527a_100011647598_100103153847 [0,0,0,0,0,0|4,0,0]=4 24 B17R2.520754 CC(=O)N(C)Cc1cccc2c1ccnc2 11a_100011757366_100015343762 [0,0,0,0,0,0|4,0,0]=4 25 B17R2.520754 CC(=O)N(C)Cc1cccc2c1ccnc2 240690a_100011757366_100015343762 [0,0,0,0,0,0|4,0,0]=4 26 B17R2.520754 CC(=O)N(C)Cc1cccc2c1ccnc2 527a_100011757366_100103153847 [0,0,0,0,0,0|4,0,0]=4 27 B17R2.520754 CC(=O)N(C)Cc1cccc2c1nccc2 11a_102515433035_100015343762 [0,0,0,0,0,0|4,0,0]=4 28 B17R2.520754 CC(=O)N(C)Cc1cccc2c1nccc2 240690a_102515433035_100015343762 [0,0,0,0,0,0|4,0,0]=4 29 B17R2.520754 CC(=O)N(C)Cc1cccc2c1nccc2 527a_102515433035_100103153847 [0,0,0,0,0,0|4,0,0]=4 30 B17R2.520754 CC(=O)N(C)Cc1ccnc2c1cccc2 240690a_100011649695_100015343762 [0,0,0,0,0,0|4,0,0]=4 31 B17R2.520754 CC(=O)N(C)Cc1ccnc2c1cccc2 527a_100011649695_100103153847 [0,0,0,0,0,0|4,0,0]=4 32 B17R2.520754 CC(=O)N(C)Cc1cncc2c1cccc2 11a_114948179032_100015343762 [0,0,0,0,0,0|4,0,0]=4 33 B17R2.520754 CC(=O)N(C)Cc1cncc2c1cccc2 240690a_114948179032_100015343762 [0,0,0,0,0,0|4,0,0]=4 34 B17R2.520754 CC(=O)N(C)Cc1cncc2c1cccc2 527a_114948179032_100103153847 [0,0,0,0,0,0|4,0,0]=4 35 B17R2.520754 CC(Nc1cccc2c1cccc2)C(=O)N 34a_100000185869_100000702099 [0,0,0,0,0,0|3,0,0]=3 36 B17R2.520754 CC(Nc1cccc2c1cccn2)C(=O)N 34a_100000183906_100000702099 [0,0,0,0,0,0|4,0,0]=4 37 B17R2.520754 CC(Nc1cccc2c1nccc2)C(=O)N 34a_100000181377_100000702099 [0,0,0,0,0,0|4,0,0]=4 38 B17R2.520754 CC(Oc1cccc2c1cccc2)C(=O)N 34a_100000210388_100000702099 [0,0,0,0,0,0|3,0,0]=3 39 B17R2.520754 CC(Oc1cccc2c1cccc2)C(=O)N 7a_100000210388_100000702099 [0,0,0,0,0,0|3,0,0]=3 40 B17R2.520754 CC(Oc1cccc2c1cccc2)C(=O)[13CH3] 1458a_100000216494_200025704644 [0,0,0,0,0,0|3,0,0]=3 41 B17R2.520754 CC(Oc1cccc2c1cccn2)C(=O)N 34a_100011197808_100000702099 [0,0,0,0,0,0|4,0,0]=4 42 B17R2.520754 CC(Oc1cccc2c1ccnc2)C(=O)N 34a_100011218533_100000702099 [0,0,0,0,0,0|4,0,0]=4 43 B17R2.520754 CC(Oc1cccc2c1cncc2)C(=O)N 34a_103624766955_100000702099 [0,0,0,0,0,0|4,0,0]=4 44 B17R2.520754 CC(Oc1cccc2c1nccc2)C(=O)N 34a_100000056035_100000702099 [0,0,0,0,0,0|4,0,0]=4 45 B17R2.520754 CC(Oc1cncc2c1cccc2)C(=O)N 34a_100000066178_100000702099 [0,0,0,0,0,0|4,0,0]=4 46 B17R2.520754 CC(Oc1cncc2c1cccc2)C(=O)N 7a_100000066178_100000702099 [0,0,0,0,0,0|4,0,0]=4 47 B17R2.520754 CC(Oc1nccc2c1cccc2)C(=O)N 34a_102531767632_100000702099 [0,0,0,0,0,0|4,0,0]=4 48 B17R2.520754 CC(Sc1cccc2c1cccc2)C(=O)N 62a_100000702099_100000210605 [0,0,0,0,0,0|3,0,0]=3 49 B17R2.520754 CC(Sc1cccc2c1cccn2)C(=O)N 62a_100000702099_100011290932 [0,0,0,0,0,0|4,0,0]=4 50 B17R2.520754 CC(Sc1cccc2c1cccn2)C(=O)N 62a_100011290932_100000702099 [0,0,0,0,0,0|4,0,0]=4 51 B17R2.520754 CC(Sc1cccc2c1ccnc2)C(=O)N 62a_100000186358_100000702099 [0,0,0,0,0,0|4,0,0]=4 52 B17R2.520754 CC(Sc1cccc2c1ccnc2)C(=O)N 62a_100000702099_100000186358 [0,0,0,0,0,0|4,0,0]=4 53 B17R2.520754 CC(Sc1cccc2c1cncc2)C(=O)N 62a_100000685578_100000702099 [0,0,0,0,0,0|4,0,0]=4 54 B17R2.520754 CC(Sc1cccc2c1cncc2)C(=O)N 62a_100000702099_100000685578 [0,0,0,0,0,0|4,0,0]=4 55 B17R2.520754 CC(Sc1cccc2c1nccc2)C(=O)N 62a_100000702099_100011215545 [0,0,0,0,0,0|4,0,0]=4 56 B17R2.520754 CC(Sc1ccnc2c1cccc2)C(=O)N 62a_100000702099_100011215880 [0,0,0,0,0,0|4,0,0]=4 57 B17R2.520754 CC(Sc1ccnc2c1cccc2)C(=O)N 62a_100011458314_100000702099 [0,0,0,0,0,0|4,0,0]=4 58 B17R2.520754 CC(Sc1cncc2c1cccc2)C(=O)N 62a_100000187577_100000702099 [0,0,0,0,0,0|4,0,0]=4 59 B17R2.520754 CC(Sc1cncc2c1cccc2)C(=O)N 62a_100000702099_100000187577 [0,0,0,0,0,0|4,0,0]=4 60 B17R2.520754 CC(Sc1nccc2c1cccc2)C(=O)N 62a_100000702099_100011934041 [0,0,0,0,0,0|4,0,0]=4 61 B17R2.520754 CC(Sc1nccc2c1cccc2)C(=O)N 62a_100011934041_100000702099 [0,0,0,0,0,0|4,0,0]=4 62 B17R2.520754 C[C@@H](Nc1cccc2c1cccn2)C(=O)N 27a_100000119354_100011290932 [0,0,0,0,0,0|4,0,0]=4 63 B17R2.520754 C[C@@H](Nc1ccnc2c1cccc2)C(=O)N 27a_100000119354_100011215880 [0,0,0,0,0,0|4,0,0]=4 64 B17R2.520754 C[C@@H](Nc1nccc2c1cccc2)C(=O)N 27a_100000119354_100011934041 [0,0,0,0,0,0|4,0,0]=4 65 B17R2.520754 C[C@@H](O)C(=O)Cc1cccc2c1cccc2 1458a_100000717761_100000188474 [0,0,0,0,0,0|2,0,2]=4 66 B17R2.520754 C[C@H](O)C(=O)Cc1cccc2c1cccc2 1458a_217856618621_100000188474 [0,0,0,0,0,0|2,0,2]=4 67 B17R2.520754 NC(=O)C(=O)Nc1cccc2c1cccc2 22a_100000185869_100011215815 [0,0,0,0,0,0|3,0,1]=4 68 B17R2.520754 NC(=O)C(F)Nc1cccc2c1cccc2 34a_100000185869_100009813875 [0,0,0,0,0,0|3,0,0]=3 69 B17R2.520754 NC(=O)C(F)Nc1cccc2c1cccn2 34a_100000183906_100009813875 [0,0,0,0,0,0|4,0,0]=4 70 B17R2.520754 NC(=O)C(F)Nc1cccc2c1nccc2 34a_100000181377_100009813875 [0,0,0,0,0,0|4,0,0]=4 71 B17R2.520754 NC(=O)C(F)Oc1cccc2c1cccc2 34a_100000210388_100009813875 [0,0,0,0,0,0|3,0,0]=3 72 B17R2.520754 NC(=O)C(F)Oc1cccc2c1cccc2 7a_100000210388_100009813875 [0,0,0,0,0,0|3,0,0]=3 73 B17R2.520754 NC(=O)C(F)Oc1cccc2c1cccn2 34a_100011197808_100009813875 [0,0,0,0,0,0|4,0,0]=4 74 B17R2.520754 NC(=O)C(F)Oc1cccc2c1ccnc2 34a_100011218533_100009813875 [0,0,0,0,0,0|4,0,0]=4 75 B17R2.520754 NC(=O)C(F)Oc1cccc2c1cncc2 34a_103624766955_100009813875 [0,0,0,0,0,0|4,0,0]=4 76 B17R2.520754 NC(=O)C(F)Oc1cccc2c1nccc2 34a_100000056035_100009813875 [0,0,0,0,0,0|4,0,0]=4 77 B17R2.520754 NC(=O)C(F)Oc1cncc2c1cccc2 34a_100000066178_100009813875 [0,0,0,0,0,0|4,0,0]=4 78 B17R2.520754 NC(=O)C(F)Oc1cncc2c1cccc2 7a_100000066178_100009813875 [0,0,0,0,0,0|4,0,0]=4 79 B17R2.520754 NC(=O)C(F)Oc1nccc2c1cccc2 34a_102531767632_100009813875 [0,0,0,0,0,0|4,0,0]=4 80 B17R2.520754 NC(=O)C(F)Sc1cccc2c1cccc2 62a_100009813875_100000210605 [0,0,0,0,0,0|3,0,0]=3 81 B17R2.520754 NC(=O)C(F)Sc1cccc2c1cccn2 62a_100009813875_100011290932 [0,0,0,0,0,0|4,0,0]=4 82 B17R2.520754 NC(=O)C(F)Sc1cccc2c1cccn2 62a_100011290932_100009813875 [0,0,0,0,0,0|4,0,0]=4 83 B17R2.520754 NC(=O)C(F)Sc1cccc2c1ccnc2 62a_100000186358_100009813875 [0,0,0,0,0,0|4,0,0]=4 84 B17R2.520754 NC(=O)C(F)Sc1cccc2c1ccnc2 62a_100009813875_100000186358 [0,0,0,0,0,0|4,0,0]=4 85 B17R2.520754 NC(=O)C(F)Sc1cccc2c1cncc2 62a_100000685578_100009813875 [0,0,0,0,0,0|4,0,0]=4 86 B17R2.520754 NC(=O)C(F)Sc1cccc2c1cncc2 62a_100009813875_100000685578 [0,0,0,0,0,0|4,0,0]=4 87 B17R2.520754 NC(=O)C(F)Sc1cccc2c1nccc2 62a_100009813875_100011215545 [0,0,0,0,0,0|4,0,0]=4 88 B17R2.520754 NC(=O)C(F)Sc1ccnc2c1cccc2 62a_100009813875_100011215880 [0,0,0,0,0,0|4,0,0]=4 89 B17R2.520754 NC(=O)C(F)Sc1ccnc2c1cccc2 62a_100011458314_100009813875 [0,0,0,0,0,0|4,0,0]=4 90 B17R2.520754 NC(=O)C(F)Sc1cncc2c1cccc2 62a_100000187577_100009813875 [0,0,0,0,0,0|4,0,0]=4 91 B17R2.520754 NC(=O)C(F)Sc1cncc2c1cccc2 62a_100009813875_100000187577 [0,0,0,0,0,0|4,0,0]=4 92 B17R2.520754 NC(=O)C(F)Sc1nccc2c1cccc2 62a_100009813875_100011934041 [0,0,0,0,0,0|4,0,0]=4 93 B17R2.520754 NC(=O)C(F)Sc1nccc2c1cccc2 62a_100011934041_100009813875 [0,0,0,0,0,0|4,0,0]=4 94 B17R2.520754 O=C(Cc1cccc2c1cccc2)C(O)O 1458a_100000233687_100000188474 [0,0,0,0,0,0|1,0,3]=4 95 B17R2.520754 O=C([O-])C(F)Nc1cccc2c1cccc2 34a_100000185869_100020610796 [0,0,0,0,0,0|2,0,1]=3 96 B17R2.520754 O=C([O-])C(F)Nc1cccc2c1cccn2 34a_100000183906_100020610796 [0,0,0,0,0,0|3,0,1]=4 97 B17R2.520754 O=C([O-])C(F)Nc1cccc2c1nccc2 34a_100000181377_100020610796 [0,0,0,0,0,0|3,0,1]=4 98 B17R2.520754 O=C([O-])C(F)Oc1cccc2c1cccc2 34a_100000210388_100020610796 [0,0,0,0,0,0|2,0,1]=3 99 B17R2.520754 O=C([O-])C(F)Oc1cccc2c1cccn2 34a_100011197808_100020610796 [0,0,0,0,0,0|3,0,1]=4 100 B17R2.520754 O=C([O-])C(F)Oc1cccc2c1ccnc2 34a_100011218533_100020610796 [0,0,0,0,0,0|3,0,1]=4 101 B17R2.520754 O=C([O-])C(F)Oc1cccc2c1cncc2 34a_103624766955_100020610796 [0,0,0,0,0,0|3,0,1]=4 102 B17R2.520754 O=C([O-])C(F)Oc1cccc2c1nccc2 34a_100000056035_100020610796 [0,0,0,0,0,0|3,0,1]=4 103 B17R2.520754 O=C([O-])C(F)Oc1cncc2c1cccc2 34a_100000066178_100020610796 [0,0,0,0,0,0|3,0,1]=4 104 B17R2.520754 O=C([O-])C(F)Oc1nccc2c1cccc2 34a_102531767632_100020610796 [0,0,0,0,0,0|3,0,1]=4 105 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1cccc2 62a_100020610796_100000210605 [0,0,0,0,0,0|2,0,1]=3 106 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1cccn2 62a_100011290932_100020610796 [0,0,0,0,0,0|3,0,1]=4 107 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1cccn2 62a_100020610796_100011290932 [0,0,0,0,0,0|3,0,1]=4 108 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1ccnc2 62a_100000186358_100020610796 [0,0,0,0,0,0|3,0,1]=4 109 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1ccnc2 62a_100020610796_100000186358 [0,0,0,0,0,0|3,0,1]=4 110 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1cncc2 62a_100000685578_100020610796 [0,0,0,0,0,0|3,0,1]=4 111 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1cncc2 62a_100020610796_100000685578 [0,0,0,0,0,0|3,0,1]=4 112 B17R2.520754 O=C([O-])C(F)Sc1cccc2c1nccc2 62a_100020610796_100011215545 [0,0,0,0,0,0|3,0,1]=4 113 B17R2.520754 O=C([O-])C(F)Sc1ccnc2c1cccc2 62a_100011458314_100020610796 [0,0,0,0,0,0|3,0,1]=4 114 B17R2.520754 O=C([O-])C(F)Sc1ccnc2c1cccc2 62a_100020610796_100011215880 [0,0,0,0,0,0|3,0,1]=4 115 B17R2.520754 O=C([O-])C(F)Sc1cncc2c1cccc2 62a_100000187577_100020610796 [0,0,0,0,0,0|3,0,1]=4 116 B17R2.520754 O=C([O-])C(F)Sc1cncc2c1cccc2 62a_100020610796_100000187577 [0,0,0,0,0,0|3,0,1]=4 117 B17R2.520754 O=C([O-])C(F)Sc1nccc2c1cccc2 62a_100011934041_100020610796 [0,0,0,0,0,0|3,0,1]=4 118 B17R2.520754 O=C([O-])C(F)Sc1nccc2c1cccc2 62a_100020610796_100011934041 [0,0,0,0,0,0|3,0,1]=4 119 B16R2.170412 C=CC(=O)Cc1cccc2c1cccc2 1458a_100000185746_100000188474 [1,0,0,0,0,0|2,0,1]=4 120 B16R2.170412 C=CC(C)Sc1cccc2c1cccc2 62a_100011215867_100000210605 [1,0,0,0,0,0|3,0,0]=4 121 B16R2.170412 CC(CO)Nc1cccc2c1cccc2 34a_100000185869_100012180447 [1,0,0,0,0,0|2,0,1]=4 122 B16R2.170412 CC(CO)Oc1cccc2c1cccc2 34a_100000210388_100012180447 [1,0,0,0,0,0|2,0,1]=4 123 B16R2.170412 CC(CO)Oc1cccc2c1cccc2 7a_100000210388_100012180447 [1,0,0,0,0,0|2,0,1]=4 124 B16R2.170412 CC(CO)Sc1cccc2c1cccc2 62a_100012180447_100000210605 [1,0,0,0,0,0|2,0,1]=4 125 B16R2.170412 C[C@H](CO)Sc1cccc2c1cccc2 62a_100016084084_100000210605 [1,0,0,0,0,0|2,0,1]=4 126 B16R2.170412 O=C(CO)Cc1cccc2c1cccc2 1458a_100000210174_100000188474 [1,0,0,0,0,0|1,0,2]=4 127 B16R2.179941 C=C(C)CNc1cccc2c1cccc2 34a_100000185869_100000748629 [1,0,0,0,0,0|3,0,0]=4 128 B16R2.179941 C=C(C)COc1cccc2c1cccc2 34a_100000210388_100000748629 [1,0,0,0,0,0|3,0,0]=4 129 B16R2.179941 C=C(C)COc1cccc2c1cccc2 7a_100000210388_100000748629 [1,0,0,0,0,0|3,0,0]=4 130 B16R2.179941 C=C(C)CSc1cccc2c1cccc2 62a_100000748629_100000210605 [1,0,0,0,0,0|3,0,0]=4 131 B16R2.179941 C=C(F)CNc1cccc2c1cccc2 34a_100000185869_100009893438 [1,0,0,0,0,0|3,0,0]=4 132 B16R2.179941 C=C(F)COc1cccc2c1cccc2 34a_100000210388_100009893438 [1,0,0,0,0,0|3,0,0]=4 133 B16R2.179941 C=C(F)COc1cccc2c1cccc2 7a_100000210388_100000042424 [1,0,0,0,0,0|3,0,0]=4 134 B16R2.179941 C=C(F)CSc1cccc2c1cccc2 62a_100000042424_100000210605 [1,0,0,0,0,0|3,0,0]=4 135 B16R2.179941 CC(=O)C=Cc1cccc2c1cccc2 1458a_100000735324_200000210301 [1,0,0,0,0,0|1,0,2]=4 136 B16R2.179941 CC(=O)CCc1cccc2c1cccc2 1458a_100000070787_100011290781 [1,0,0,0,0,0|1,0,0]=2 137 B16R2.179941 CC(=O)CCc1cccc2c1cccc2 1458a_100011218451_200000210301 [1,0,0,0,0,0|1,0,0]=2 138 B16R2.179941 CC(=O)COc1cccc2c1cccc2 1458a_100000183701_200000210301 [1,0,0,0,0,0|2,0,0]=3 139 B16R2.179941 CC(=O)COc1cccc2c1nccc2 1458a_100000182336_200000210301 [1,0,0,0,0,0|3,0,0]=4 140 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 11a_100000753325_100015343762 [1,0,0,0,0,0|2,0,0]=3 141 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 1626a_100000753325_100015343762 [1,0,0,0,0,0|2,0,0]=3 142 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 240690a_100000753325_100015343762 [1,0,0,0,0,0|2,0,0]=3 143 B16R2.179941 CC(=O)NCc1cccc2c1cccc2 527a_100000753325_100103153847 [1,0,0,0,0,0|2,0,0]=3 144 B16R2.179941 CC(=O)NCc1cccc2c1cccn2 11a_100020628785_100015343762 [1,0,0,0,0,0|3,0,0]=4 145 B16R2.179941 CC(=O)NCc1cccc2c1cccn2 1626a_100020628785_100015343762 [1,0,0,0,0,0|3,0,0]=4 146 B16R2.179941 CC(=O)NCc1cccc2c1cccn2 240690a_100020628785_100015343762 [1,0,0,0,0,0|3,0,0]=4 147 B16R2.179941 CC(=O)NCc1cccc2c1cccn2 527a_100020628785_100103153847 [1,0,0,0,0,0|3,0,0]=4 148 B16R2.179941 CC(=O)NCc1cccc2c1ccnc2 11a_100011757365_100015343762 [1,0,0,0,0,0|3,0,0]=4 149 B16R2.179941 CC(=O)NCc1cccc2c1ccnc2 1626a_100011757365_100015343762 [1,0,0,0,0,0|3,0,0]=4 150 B16R2.179941 CC(=O)NCc1cccc2c1ccnc2 240690a_100011757365_100015343762 [1,0,0,0,0,0|3,0,0]=4 151 B16R2.179941 CC(=O)NCc1cccc2c1ccnc2 527a_100011757365_100103153847 [1,0,0,0,0,0|3,0,0]=4 152 B16R2.179941 CC(=O)NCc1cccc2c1nccc2 11a_100011195829_100015343762 [1,0,0,0,0,0|3,0,0]=4 153 B16R2.179941 CC(=O)NCc1cccc2c1nccc2 1626a_100011195829_100015343762 [1,0,0,0,0,0|3,0,0]=4 154 B16R2.179941 CC(=O)NCc1cccc2c1nccc2 240690a_100011195829_100015343762 [1,0,0,0,0,0|3,0,0]=4 155 B16R2.179941 CC(=O)NCc1cccc2c1nccc2 527a_100011195829_100103153847 [1,0,0,0,0,0|3,0,0]=4 156 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 11a_100015187208_100015343762 [1,0,0,0,0,0|3,0,0]=4 157 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 1626a_100015187208_100015343762 [1,0,0,0,0,0|3,0,0]=4 158 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 240690a_100015187208_100015343762 [1,0,0,0,0,0|3,0,0]=4 159 B16R2.179941 CC(=O)NCc1ccnc2c1cccc2 527a_100015187208_100103153847 [1,0,0,0,0,0|3,0,0]=4 160 B16R2.179941 CC(=O)NCc1nccc2c1cccc2 11a_100000735229_100015343762 [1,0,0,0,0,0|3,0,0]=4 161 B16R2.179941 CC(=O)NCc1nccc2c1cccc2 240690a_100000735229_100015343762 [1,0,0,0,0,0|3,0,0]=4 162 B16R2.179941 CC(=O)NCc1nccc2c1cccc2 527a_100000735229_100103153847 [1,0,0,0,0,0|3,0,0]=4 163 B16R2.179941 CC(=O)NNc1cccc2c1cccc2 22a_100000006939_100000070787 [1,0,0,0,0,0|3,0,0]=4 164 B16R2.179941 CC(O)CNc1cccc2c1cccc2 34a_100000185869_100011218427 [1,0,0,0,0,0|2,0,1]=4 165 B16R2.179941 CC(O)COc1cccc2c1cccc2 34a_100000210388_100011218427 [1,0,0,0,0,0|2,0,1]=4 166 B16R2.179941 CC(O)COc1cccc2c1cccc2 7a_100000210388_100011218427 [1,0,0,0,0,0|2,0,1]=4 167 B16R2.179941 CC(O)CSc1cccc2c1cccc2 62a_100011218427_100000210605 [1,0,0,0,0,0|2,0,1]=4 168 B16R2.179941 CN(C)CCc1cccc2c1cccc2 2230a_100102631434_100011290781 [1,0,0,0,0,0|3,0,0]=4 169 B16R2.179941 CN(C)CCc1cccc2c1cccc2 269982a_100102631434_100011290781 [1,0,0,0,0,0|3,0,0]=4 170 B16R2.179941 C[C@@H](O)CNc1cccc2c1cccc2 34a_100000185869_100009817552 [1,0,0,0,0,0|2,0,1]=4 171 B16R2.179941 C[C@@H](O)COc1cccc2c1cccc2 34a_100000210388_100009817552 [1,0,0,0,0,0|2,0,1]=4 172 B16R2.179941 C[C@@H](O)COc1cccc2c1cccc2 7a_100000210388_100009817552 [1,0,0,0,0,0|2,0,1]=4 173 B16R2.179941 C[C@@H](O)CSc1cccc2c1cccc2 62a_100009817552_100000210605 [1,0,0,0,0,0|2,0,1]=4 174 B16R2.179941 NC(=O)CNc1cccc2c1cccc2 34a_100000185869_100000187820 [1,0,0,0,0,0|2,0,0]=3 175 B16R2.179941 NC(=O)CNc1cccc2c1cccn2 34a_100000183906_100000187820 [1,0,0,0,0,0|3,0,0]=4 176 B16R2.179941 NC(=O)CNc1cccc2c1nccc2 34a_100000181377_100000187820 [1,0,0,0,0,0|3,0,0]=4 177 B16R2.179941 NC(=O)COc1cccc2c1cccc2 34a_100000210388_100000187820 [1,0,0,0,0,0|2,0,0]=3 178 B16R2.179941 NC(=O)COc1cccc2c1cccc2 7a_100000210388_100000187820 [1,0,0,0,0,0|2,0,0]=3 179 B16R2.179941 NC(=O)COc1cccc2c1cccn2 34a_100011197808_100000187820 [1,0,0,0,0,0|3,0,0]=4 180 B16R2.179941 NC(=O)COc1cccc2c1ccnc2 34a_100011218533_100000187820 [1,0,0,0,0,0|3,0,0]=4 181 B16R2.179941 NC(=O)COc1cccc2c1cncc2 34a_103624766955_100000187820 [1,0,0,0,0,0|3,0,0]=4 182 B16R2.179941 NC(=O)COc1cccc2c1nccc2 34a_100000056035_100000187820 [1,0,0,0,0,0|3,0,0]=4 183 B16R2.179941 NC(=O)COc1cncc2c1cccc2 34a_100000066178_100000187820 [1,0,0,0,0,0|3,0,0]=4 184 B16R2.179941 NC(=O)COc1cncc2c1cccc2 7a_100000066178_100000187820 [1,0,0,0,0,0|3,0,0]=4 185 B16R2.179941 NC(=O)COc1nccc2c1cccc2 34a_102531767632_100000187820 [1,0,0,0,0,0|3,0,0]=4 186 B16R2.179941 NC(=O)CSc1cccc2c1cccc2 62a_100000747473_100000210605 [1,0,0,0,0,0|2,0,0]=3 187 B16R2.179941 NC(=O)CSc1cccc2c1cccn2 62a_100000747473_100011290932 [1,0,0,0,0,0|3,0,0]=4 188 B16R2.179941 NC(=O)CSc1cccc2c1cccn2 62a_100011290932_100000747473 [1,0,0,0,0,0|3,0,0]=4 189 B16R2.179941 NC(=O)CSc1cccc2c1ccnc2 62a_100000186358_100000747473 [1,0,0,0,0,0|3,0,0]=4 190 B16R2.179941 NC(=O)CSc1cccc2c1ccnc2 62a_100000747473_100000186358 [1,0,0,0,0,0|3,0,0]=4 191 B16R2.179941 NC(=O)CSc1cccc2c1cncc2 62a_100000685578_100000747473 [1,0,0,0,0,0|3,0,0]=4 192 B16R2.179941 NC(=O)CSc1cccc2c1cncc2 62a_100000747473_100000685578 [1,0,0,0,0,0|3,0,0]=4 193 B16R2.179941 NC(=O)CSc1cccc2c1nccc2 62a_100000747473_100011215545 [1,0,0,0,0,0|3,0,0]=4 194 B16R2.179941 NC(=O)CSc1ccnc2c1cccc2 62a_100000747473_100011215880 [1,0,0,0,0,0|3,0,0]=4 195 B16R2.179941 NC(=O)CSc1ccnc2c1cccc2 62a_100011458314_100000747473 [1,0,0,0,0,0|3,0,0]=4 196 B16R2.179941 NC(=O)CSc1cncc2c1cccc2 62a_100000187577_100000747473 [1,0,0,0,0,0|3,0,0]=4 197 B16R2.179941 NC(=O)CSc1cncc2c1cccc2 62a_100000747473_100000187577 [1,0,0,0,0,0|3,0,0]=4 198 B16R2.179941 NC(=O)CSc1nccc2c1cccc2 62a_100000747473_100011934041 [1,0,0,0,0,0|3,0,0]=4 199 B16R2.179941 NC(=O)CSc1nccc2c1cccc2 62a_100011934041_100000747473 [1,0,0,0,0,0|3,0,0]=4 200 B16R2.179941 O=C([O-])CNc1cccc2c1cccc2 34a_100000185869_100020667443 [1,0,0,0,0,0|1,0,1]=3 201 B16R2.179941 O=C([O-])CNc1cccc2c1cccn2 34a_100000183906_100020667443 [1,0,0,0,0,0|2,0,1]=4 202 B16R2.179941 O=C([O-])CNc1cccc2c1nccc2 34a_100000181377_100020667443 [1,0,0,0,0,0|2,0,1]=4 203 B16R2.179941 O=C([O-])COc1cccc2c1cccc2 34a_100000210388_100020667443 [1,0,0,0,0,0|1,0,1]=3 204 B16R2.179941 O=C([O-])COc1cccc2c1cccn2 34a_100011197808_100020667443 [1,0,0,0,0,0|2,0,1]=4 205 B16R2.179941 O=C([O-])COc1cccc2c1ccnc2 34a_100011218533_100020667443 [1,0,0,0,0,0|2,0,1]=4 206 B16R2.179941 O=C([O-])COc1cccc2c1cncc2 34a_103624766955_100020667443 [1,0,0,0,0,0|2,0,1]=4 207 B16R2.179941 O=C([O-])COc1cccc2c1nccc2 34a_100000056035_100020667443 [1,0,0,0,0,0|2,0,1]=4 208 B16R2.179941 O=C([O-])COc1cncc2c1cccc2 34a_100000066178_100020667443 [1,0,0,0,0,0|2,0,1]=4 209 B16R2.179941 O=C([O-])COc1nccc2c1cccc2 34a_102531767632_100020667443 [1,0,0,0,0,0|2,0,1]=4 210 B16R2.179941 O=C([O-])CSc1cccc2c1cccc2 62a_100020667443_100000210605 [1,0,0,0,0,0|1,0,1]=3 211 B16R2.179941 O=C([O-])CSc1cccc2c1cccn2 62a_100011290932_100020667443 [1,0,0,0,0,0|2,0,1]=4 212 B16R2.179941 O=C([O-])CSc1cccc2c1cccn2 62a_100020667443_100011290932 [1,0,0,0,0,0|2,0,1]=4 213 B16R2.179941 O=C([O-])CSc1cccc2c1ccnc2 62a_100000186358_100020667443 [1,0,0,0,0,0|2,0,1]=4 214 B16R2.179941 O=C([O-])CSc1cccc2c1ccnc2 62a_100020667443_100000186358 [1,0,0,0,0,0|2,0,1]=4 215 B16R2.179941 O=C([O-])CSc1cccc2c1cncc2 62a_100000685578_100020667443 [1,0,0,0,0,0|2,0,1]=4 216 B16R2.179941 O=C([O-])CSc1cccc2c1cncc2 62a_100020667443_100000685578 [1,0,0,0,0,0|2,0,1]=4 217 B16R2.179941 O=C([O-])CSc1cccc2c1nccc2 62a_100020667443_100011215545 [1,0,0,0,0,0|2,0,1]=4 218 B16R2.179941 O=C([O-])CSc1ccnc2c1cccc2 62a_100011458314_100020667443 [1,0,0,0,0,0|2,0,1]=4 219 B16R2.179941 O=C([O-])CSc1ccnc2c1cccc2 62a_100020667443_100011215880 [1,0,0,0,0,0|2,0,1]=4 220 B16R2.179941 O=C([O-])CSc1cncc2c1cccc2 62a_100000187577_100020667443 [1,0,0,0,0,0|2,0,1]=4 221 B16R2.179941 O=C([O-])CSc1cncc2c1cccc2 62a_100020667443_100000187577 [1,0,0,0,0,0|2,0,1]=4 222 B16R2.179941 O=C([O-])CSc1nccc2c1cccc2 62a_100011934041_100020667443 [1,0,0,0,0,0|2,0,1]=4 223 B16R2.179941 O=C([O-])CSc1nccc2c1cccc2 62a_100020667443_100011934041 [1,0,0,0,0,0|2,0,1]=4 224 B16R2.179941 O=[N+]([O-])CNc1cccc2c1cccc2 34a_100000185869_100000761209 [1,0,0,0,0,0|2,0,1]=4 225 B16R2.179941 O=[N+]([O-])COc1cccc2c1cccc2 34a_100000210388_100000761209 [1,0,0,0,0,0|2,0,1]=4 226 B16R2.179941 [13CH3]C(=O)C=Cc1cccc2c1cccc2 1458a_100000735324_200025704644 [1,0,0,0,0,0|1,0,2]=4 227 B16R2.179941 [13CH3]C(=O)CCc1cccc2c1cccc2 1458a_100011218451_200025704644 [1,0,0,0,0,0|1,0,0]=2 228 B16R2.179941 [13CH3]C(=O)COc1cccc2c1cccc2 1458a_100000183701_200025704644 [1,0,0,0,0,0|2,0,0]=3 229 B16R2.179941 [13CH3]C(=O)COc1cccc2c1nccc2 1458a_100000182336_200025704644 [1,0,0,0,0,0|3,0,0]=4 230 B18R2.4027 CC(=O)C(C)Oc1cccc2c1ccc(c2)Br 7a_100010202202_100000179758 [0,1,0,0,0,0|3,0,0]=4 231 B18R2.4027 CC(=O)C(C)Oc1cccc2c1ccc(c2)F 7a_100009846233_100000179758 [0,1,0,0,0,0|3,0,0]=4 232 B18R2.4027 CC(Nc1cccc2c1ccc(c2)Br)C(=O)N 34a_100010090037_100000702099 [0,1,0,0,0,0|3,0,0]=4 233 B18R2.4027 CC(Nc1cccc2c1ccc(c2)O)C(=O)N 34a_100000034668_100000702099 [0,1,0,0,0,0|3,0,0]=4 234 B18R2.4027 CC(Oc1cccc2c1ccc(c2)Br)C(=O)N 34a_100010202202_100000702099 [0,1,0,0,0,0|3,0,0]=4 235 B18R2.4027 CC(Oc1cccc2c1ccc(c2)Br)C(=O)N 7a_100010202202_100000702099 [0,1,0,0,0,0|3,0,0]=4 236 B18R2.4027 CC(Oc1cccc2c1ccc(c2)F)C(=O)N 34a_100009846233_100000702099 [0,1,0,0,0,0|3,0,0]=4 237 B18R2.4027 CC(Oc1cccc2c1ccc(c2)F)C(=O)N 7a_100009846233_100000702099 [0,1,0,0,0,0|3,0,0]=4 238 B18R2.4027 CC(Oc1cccc2c1ccc(c2)N)C(=O)N 34a_100000035793_100000702099 [0,1,0,0,0,0|3,0,0]=4 239 B18R2.4027 NC(=O)C(F)Nc1cccc2c1ccc(c2)Br 34a_100010090037_100009813875 [0,1,0,0,0,0|3,0,0]=4 240 B18R2.4027 NC(=O)C(F)Nc1cccc2c1ccc(c2)O 34a_100000034668_100009813875 [0,1,0,0,0,0|3,0,0]=4 241 B18R2.4027 NC(=O)C(F)Oc1cccc2c1ccc(c2)Br 34a_100010202202_100009813875 [0,1,0,0,0,0|3,0,0]=4 242 B18R2.4027 NC(=O)C(F)Oc1cccc2c1ccc(c2)Br 7a_100010202202_100009813875 [0,1,0,0,0,0|3,0,0]=4 243 B18R2.4027 NC(=O)C(F)Oc1cccc2c1ccc(c2)F 34a_100009846233_100009813875 [0,1,0,0,0,0|3,0,0]=4 244 B18R2.4027 NC(=O)C(F)Oc1cccc2c1ccc(c2)F 7a_100009846233_100009813875 [0,1,0,0,0,0|3,0,0]=4 245 B18R2.4027 NC(=O)C(F)Oc1cccc2c1ccc(c2)N 34a_100000035793_100009813875 [0,1,0,0,0,0|3,0,0]=4 246 B18R2.4027 Nc1ccc2c(cccc2c1)OC(F)C(=O)[O-] 34a_100000035793_100020610796 [0,1,0,0,0,0|2,0,1]=4 247 B18R2.4027 O=C([O-])C(F)Nc1cccc2c1ccc(c2)Br 34a_100010090037_100020610796 [0,1,0,0,0,0|2,0,1]=4 248 B18R2.4027 O=C([O-])C(F)Nc1cccc2c1ccc(c2)O 34a_100000034668_100020610796 [0,1,0,0,0,0|2,0,1]=4 249 B18R2.4027 O=C([O-])C(F)Oc1cccc2c1ccc(c2)Br 34a_100010202202_100020610796 [0,1,0,0,0,0|2,0,1]=4 250 B18R2.4027 O=C([O-])C(F)Oc1cccc2c1ccc(c2)F 34a_100009846233_100020610796 [0,1,0,0,0,0|2,0,1]=4 251 B18R2.6164 CC(=O)C(C)Oc1cc(cc2c1cccc2)Br 7a_100010089979_100000179758 [0,1,0,0,0,0|3,0,0]=4 252 B18R2.6164 CC(=O)C(C)Sc1cc(cc2c1cccc2)N 62a_100009814033_100010089974 [0,1,0,0,0,0|3,0,0]=4 253 B18R2.6164 CC(=O)C(C)Sc1cc(cc2c1cccc2)N 62a_100010089974_100009814033 [0,1,0,0,0,0|3,0,0]=4 254 B18R2.6164 CC(=O)C(C)Sc1cc(cc2c1cccc2)O 62a_100009814033_100010001680 [0,1,0,0,0,0|3,0,0]=4 255 B18R2.6164 CC(Nc1cc(cc2c1cccc2)Br)C(=O)N 34a_100010171453_100000702099 [0,1,0,0,0,0|3,0,0]=4 256 B18R2.6164 CC(Oc1cc(cc2c1cccc2)Br)C(=O)N 34a_100010089979_100000702099 [0,1,0,0,0,0|3,0,0]=4 257 B18R2.6164 CC(Oc1cc(cc2c1cccc2)Br)C(=O)N 7a_100010089979_100000702099 [0,1,0,0,0,0|3,0,0]=4 258 B18R2.6164 CC(Sc1cc(cc2c1cccc2)N)C(=O)N 62a_100000702099_100010089974 [0,1,0,0,0,0|3,0,0]=4 259 B18R2.6164 CC(Sc1cc(cc2c1cccc2)N)C(=O)N 62a_100010089974_100000702099 [0,1,0,0,0,0|3,0,0]=4 260 B18R2.6164 CC(Sc1cc(cc2c1cccc2)O)C(=O)N 62a_100000702099_100010001680 [0,1,0,0,0,0|3,0,0]=4 261 B18R2.6164 NC(=O)C(F)Nc1cc(cc2c1cccc2)Br 34a_100010171453_100009813875 [0,1,0,0,0,0|3,0,0]=4 262 B18R2.6164 NC(=O)C(F)Oc1cc(cc2c1cccc2)Br 34a_100010089979_100009813875 [0,1,0,0,0,0|3,0,0]=4 263 B18R2.6164 NC(=O)C(F)Oc1cc(cc2c1cccc2)Br 7a_100010089979_100009813875 [0,1,0,0,0,0|3,0,0]=4 264 B18R2.6164 NC(=O)C(F)Sc1cc(cc2c1cccc2)N 62a_100009813875_100010089974 [0,1,0,0,0,0|3,0,0]=4 265 B18R2.6164 NC(=O)C(F)Sc1cc(cc2c1cccc2)N 62a_100010089974_100009813875 [0,1,0,0,0,0|3,0,0]=4 266 B18R2.6164 NC(=O)C(F)Sc1cc(cc2c1cccc2)O 62a_100009813875_100010001680 [0,1,0,0,0,0|3,0,0]=4 267 B18R2.6164 Nc1cc(c2ccccc2c1)SC(F)C(=O)[O-] 62a_100010089974_100020610796 [0,1,0,0,0,0|2,0,1]=4 268 B18R2.6164 Nc1cc(c2ccccc2c1)SC(F)C(=O)[O-] 62a_100020610796_100010089974 [0,1,0,0,0,0|2,0,1]=4 269 B18R2.6164 O=C([O-])C(F)Nc1cc(cc2c1cccc2)Br 34a_100010171453_100020610796 [0,1,0,0,0,0|2,0,1]=4 270 B18R2.6164 O=C([O-])C(F)Oc1cc(cc2c1cccc2)Br 34a_100010089979_100020610796 [0,1,0,0,0,0|2,0,1]=4 271 B18R2.6164 O=C([O-])C(F)Sc1cc(cc2c1cccc2)O 62a_100020610796_100010001680 [0,1,0,0,0,0|2,0,1]=4 272 B18R2.6551 CC(=O)C(C)Oc1c(ccc2c1cccc2)Br 7a_100009996032_100000179758 [0,1,0,0,0,0|3,0,0]=4 273 B18R2.6551 CC(=O)C(C)Oc1c(ccc2c1cccc2)C 7a_100000039261_100000179758 [0,1,0,0,0,0|3,0,0]=4 274 B18R2.6551 CC(=O)C(C)Sc1c(ccc2c1cccc2)Br 62a_100009814033_100010090040 [0,1,0,0,0,0|3,0,0]=4 275 B18R2.6551 CC(=O)C(C)Sc1c(ccc2c1cccc2)Br 62a_100010090040_100009814033 [0,1,0,0,0,0|3,0,0]=4 276 B18R2.6551 CC(=O)C(C)Sc1c(ccc2c1cccc2)C 62a_100000759710_100009814033 [0,1,0,0,0,0|3,0,0]=4 277 B18R2.6551 CC(=O)C(C)Sc1c(ccc2c1cccc2)C 62a_100009814033_100000759710 [0,1,0,0,0,0|3,0,0]=4 278 B18R2.6551 CC(=O)C(C)Sc1c(ccc2c1cccc2)N 62a_100000705303_100009814033 [0,1,0,0,0,0|3,0,0]=4 279 B18R2.6551 CC(=O)C(C)Sc1c(ccc2c1cccc2)N 62a_100009814033_100000705303 [0,1,0,0,0,0|3,0,0]=4 280 B18R2.6551 CC(=O)C(C)Sc1c(ccc2c1cccc2)O 62a_100009814033_100000183829 [0,1,0,0,0,0|3,0,0]=4 281 B18R2.6551 CC(Nc1c(ccc2c1cccc2)Br)C(=O)N 34a_100009817101_100000702099 [0,1,0,0,0,0|3,0,0]=4 282 B18R2.6551 CC(Nc1c(ccc2c1cccc2)Cl)C(=O)N 34a_200009860907_100000702099 [0,1,0,0,0,0|3,0,0]=4 283 B18R2.6551 CC(Nc1c(ccc2c1cccc2)O)C(=O)N 34a_100000007056_100000702099 [0,1,0,0,0,0|3,0,0]=4 284 B18R2.6551 CC(Oc1c(ccc2c1cccc2)Br)C(=O)N 34a_100009996032_100000702099 [0,1,0,0,0,0|3,0,0]=4 285 B18R2.6551 CC(Oc1c(ccc2c1cccc2)Br)C(=O)N 7a_100009996032_100000702099 [0,1,0,0,0,0|3,0,0]=4 286 B18R2.6551 CC(Oc1c(ccc2c1cccc2)N)C(=O)N 34a_100000007060_100000702099 [0,1,0,0,0,0|3,0,0]=4 287 B18R2.6551 CC(Sc1c(ccc2c1cccc2)Br)C(=O)N 62a_100000702099_100010090040 [0,1,0,0,0,0|3,0,0]=4 288 B18R2.6551 CC(Sc1c(ccc2c1cccc2)Br)C(=O)N 62a_100010090040_100000702099 [0,1,0,0,0,0|3,0,0]=4 289 B18R2.6551 CC(Sc1c(ccc2c1cccc2)N)C(=O)N 62a_100000702099_100000705303 [0,1,0,0,0,0|3,0,0]=4 290 B18R2.6551 CC(Sc1c(ccc2c1cccc2)N)C(=O)N 62a_100000705303_100000702099 [0,1,0,0,0,0|3,0,0]=4 291 B18R2.6551 CC(Sc1c(ccc2c1cccc2)O)C(=O)N 62a_100000702099_100000183829 [0,1,0,0,0,0|3,0,0]=4 292 B18R2.6551 Cc1ccc2ccccc2c1NC(C)C(=O)N 34a_100000688109_100000702099 [0,1,0,0,0,0|3,0,0]=4 293 B18R2.6551 Cc1ccc2ccccc2c1NC(F)C(=O)N 34a_100000688109_100009813875 [0,1,0,0,0,0|3,0,0]=4 294 B18R2.6551 Cc1ccc2ccccc2c1NC(F)C(=O)[O-] 34a_100000688109_100020610796 [0,1,0,0,0,0|2,0,1]=4 295 B18R2.6551 Cc1ccc2ccccc2c1OC(C)C(=O)N 34a_100000039261_100000702099 [0,1,0,0,0,0|3,0,0]=4 296 B18R2.6551 Cc1ccc2ccccc2c1OC(C)C(=O)N 7a_100000039261_100000702099 [0,1,0,0,0,0|3,0,0]=4 297 B18R2.6551 Cc1ccc2ccccc2c1OC(F)C(=O)N 34a_100000039261_100009813875 [0,1,0,0,0,0|3,0,0]=4 298 B18R2.6551 Cc1ccc2ccccc2c1OC(F)C(=O)N 7a_100000039261_100009813875 [0,1,0,0,0,0|3,0,0]=4 299 B18R2.6551 Cc1ccc2ccccc2c1OC(F)C(=O)[O-] 34a_100000039261_100020610796 [0,1,0,0,0,0|2,0,1]=4 300 B18R2.6551 Cc1ccc2ccccc2c1SC(C)C(=O)N 62a_100000702099_100000759710 [0,1,0,0,0,0|3,0,0]=4 301 B18R2.6551 Cc1ccc2ccccc2c1SC(C)C(=O)N 62a_100000759710_100000702099 [0,1,0,0,0,0|3,0,0]=4 302 B18R2.6551 Cc1ccc2ccccc2c1SC(F)C(=O)N 62a_100000759710_100009813875 [0,1,0,0,0,0|3,0,0]=4 303 B18R2.6551 Cc1ccc2ccccc2c1SC(F)C(=O)N 62a_100009813875_100000759710 [0,1,0,0,0,0|3,0,0]=4 304 B18R2.6551 Cc1ccc2ccccc2c1SC(F)C(=O)[O-] 62a_100000759710_100020610796 [0,1,0,0,0,0|2,0,1]=4 305 B18R2.6551 Cc1ccc2ccccc2c1SC(F)C(=O)[O-] 62a_100020610796_100000759710 [0,1,0,0,0,0|2,0,1]=4 306 B18R2.6551 NC(=O)C(F)Nc1c(ccc2c1cccc2)Br 34a_100009817101_100009813875 [0,1,0,0,0,0|3,0,0]=4 307 B18R2.6551 NC(=O)C(F)Nc1c(ccc2c1cccc2)Cl 34a_200009860907_100009813875 [0,1,0,0,0,0|3,0,0]=4 308 B18R2.6551 NC(=O)C(F)Nc1c(ccc2c1cccc2)O 34a_100000007056_100009813875 [0,1,0,0,0,0|3,0,0]=4 309 B18R2.6551 NC(=O)C(F)Oc1c(ccc2c1cccc2)Br 34a_100009996032_100009813875 [0,1,0,0,0,0|3,0,0]=4 310 B18R2.6551 NC(=O)C(F)Oc1c(ccc2c1cccc2)Br 7a_100009996032_100009813875 [0,1,0,0,0,0|3,0,0]=4 311 B18R2.6551 NC(=O)C(F)Oc1c(ccc2c1cccc2)N 34a_100000007060_100009813875 [0,1,0,0,0,0|3,0,0]=4 312 B18R2.6551 NC(=O)C(F)Sc1c(ccc2c1cccc2)Br 62a_100009813875_100010090040 [0,1,0,0,0,0|3,0,0]=4 313 B18R2.6551 NC(=O)C(F)Sc1c(ccc2c1cccc2)Br 62a_100010090040_100009813875 [0,1,0,0,0,0|3,0,0]=4 314 B18R2.6551 NC(=O)C(F)Sc1c(ccc2c1cccc2)N 62a_100000705303_100009813875 [0,1,0,0,0,0|3,0,0]=4 315 B18R2.6551 NC(=O)C(F)Sc1c(ccc2c1cccc2)N 62a_100009813875_100000705303 [0,1,0,0,0,0|3,0,0]=4 316 B18R2.6551 NC(=O)C(F)Sc1c(ccc2c1cccc2)O 62a_100009813875_100000183829 [0,1,0,0,0,0|3,0,0]=4 317 B18R2.6551 Nc1ccc2ccccc2c1OC(F)C(=O)[O-] 34a_100000007060_100020610796 [0,1,0,0,0,0|2,0,1]=4 318 B18R2.6551 Nc1ccc2ccccc2c1SC(F)C(=O)[O-] 62a_100000705303_100020610796 [0,1,0,0,0,0|2,0,1]=4 319 B18R2.6551 Nc1ccc2ccccc2c1SC(F)C(=O)[O-] 62a_100020610796_100000705303 [0,1,0,0,0,0|2,0,1]=4 320 B18R2.6551 O=C([O-])C(F)Nc1c(ccc2c1cccc2)Br 34a_100009817101_100020610796 [0,1,0,0,0,0|2,0,1]=4 321 B18R2.6551 O=C([O-])C(F)Nc1c(ccc2c1cccc2)Cl 34a_200009860907_100020610796 [0,1,0,0,0,0|2,0,1]=4 322 B18R2.6551 O=C([O-])C(F)Nc1c(ccc2c1cccc2)O 34a_100000007056_100020610796 [0,1,0,0,0,0|2,0,1]=4 323 B18R2.6551 O=C([O-])C(F)Oc1c(ccc2c1cccc2)Br 34a_100009996032_100020610796 [0,1,0,0,0,0|2,0,1]=4 324 B18R2.6551 O=C([O-])C(F)Sc1c(ccc2c1cccc2)Br 62a_100010090040_100020610796 [0,1,0,0,0,0|2,0,1]=4 325 B18R2.6551 O=C([O-])C(F)Sc1c(ccc2c1cccc2)Br 62a_100020610796_100010090040 [0,1,0,0,0,0|2,0,1]=4 326 B18R2.6551 O=C([O-])C(F)Sc1c(ccc2c1cccc2)O 62a_100020610796_100000183829 [0,1,0,0,0,0|2,0,1]=4 327 B18R2.31659 CC(=O)C(C)Oc1cccc2c1cc(cc2)Br 7a_100010089991_100000179758 [0,1,0,0,0,0|3,0,0]=4 328 B18R2.31659 CC(=O)C(C)Oc1cccc2c1cc(cc2)C 7a_100000040781_100000179758 [0,1,0,0,0,0|3,0,0]=4 329 B18R2.31659 CC(=O)C(C)Oc1cccc2c1cc(cc2)Cl 7a_100009840344_100000179758 [0,1,0,0,0,0|3,0,0]=4 330 B18R2.31659 CC(=O)C(C)Oc1cccc2c1cc(cc2)F 7a_100009881884_100000179758 [0,1,0,0,0,0|3,0,0]=4 331 B18R2.31659 CC(=O)C(C)Oc1cccc2c1cc(cc2)N 7a_100132313934_100000179758 [0,1,0,0,0,0|3,0,0]=4 332 B18R2.31659 CC(=O)C(C)Sc1cccc2c1cc(cc2)O 62a_100009814033_100010169565 [0,1,0,0,0,0|3,0,0]=4 333 B18R2.31659 CC(Nc1cccc2c1cc(cc2)Br)C(=O)N 34a_100010090012_100000702099 [0,1,0,0,0,0|3,0,0]=4 334 B18R2.31659 CC(Nc1cccc2c1cc(cc2)O)C(=O)N 34a_100000034012_100000702099 [0,1,0,0,0,0|3,0,0]=4 335 B18R2.31659 CC(Oc1cccc2c1cc(cc2)Br)C(=O)N 34a_100010089991_100000702099 [0,1,0,0,0,0|3,0,0]=4 336 B18R2.31659 CC(Oc1cccc2c1cc(cc2)Br)C(=O)N 7a_100010089991_100000702099 [0,1,0,0,0,0|3,0,0]=4 337 B18R2.31659 CC(Oc1cccc2c1cc(cc2)Cl)C(=O)N 34a_100009840344_100000702099 [0,1,0,0,0,0|3,0,0]=4 338 B18R2.31659 CC(Oc1cccc2c1cc(cc2)Cl)C(=O)N 7a_100009840344_100000702099 [0,1,0,0,0,0|3,0,0]=4 339 B18R2.31659 CC(Oc1cccc2c1cc(cc2)F)C(=O)N 34a_100009881884_100000702099 [0,1,0,0,0,0|3,0,0]=4 340 B18R2.31659 CC(Oc1cccc2c1cc(cc2)F)C(=O)N 7a_100009881884_100000702099 [0,1,0,0,0,0|3,0,0]=4 341 B18R2.31659 CC(Oc1cccc2c1cc(cc2)N)C(=O)N 34a_100132313934_100000702099 [0,1,0,0,0,0|3,0,0]=4 342 B18R2.31659 CC(Oc1cccc2c1cc(cc2)N)C(=O)N 7a_100132313934_100000702099 [0,1,0,0,0,0|3,0,0]=4 343 B18R2.31659 CC(Sc1cccc2c1cc(cc2)O)C(=O)N 62a_100000702099_100010169565 [0,1,0,0,0,0|3,0,0]=4 344 B18R2.31659 Cc1ccc2cccc(c2c1)OC(C)C(=O)N 34a_100000040781_100000702099 [0,1,0,0,0,0|3,0,0]=4 345 B18R2.31659 Cc1ccc2cccc(c2c1)OC(C)C(=O)N 7a_100000040781_100000702099 [0,1,0,0,0,0|3,0,0]=4 346 B18R2.31659 Cc1ccc2cccc(c2c1)OC(F)C(=O)N 34a_100000040781_100009813875 [0,1,0,0,0,0|3,0,0]=4 347 B18R2.31659 Cc1ccc2cccc(c2c1)OC(F)C(=O)N 7a_100000040781_100009813875 [0,1,0,0,0,0|3,0,0]=4 348 B18R2.31659 Cc1ccc2cccc(c2c1)OC(F)C(=O)[O-] 34a_100000040781_100020610796 [0,1,0,0,0,0|2,0,1]=4 349 B18R2.31659 NC(=O)C(F)Nc1cccc2c1cc(cc2)Br 34a_100010090012_100009813875 [0,1,0,0,0,0|3,0,0]=4 350 B18R2.31659 NC(=O)C(F)Nc1cccc2c1cc(cc2)O 34a_100000034012_100009813875 [0,1,0,0,0,0|3,0,0]=4 351 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)Br 34a_100010089991_100009813875 [0,1,0,0,0,0|3,0,0]=4 352 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)Br 7a_100010089991_100009813875 [0,1,0,0,0,0|3,0,0]=4 353 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)Cl 34a_100009840344_100009813875 [0,1,0,0,0,0|3,0,0]=4 354 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)Cl 7a_100009840344_100009813875 [0,1,0,0,0,0|3,0,0]=4 355 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)F 34a_100009881884_100009813875 [0,1,0,0,0,0|3,0,0]=4 356 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)F 7a_100009881884_100009813875 [0,1,0,0,0,0|3,0,0]=4 357 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)N 34a_100132313934_100009813875 [0,1,0,0,0,0|3,0,0]=4 358 B18R2.31659 NC(=O)C(F)Oc1cccc2c1cc(cc2)N 7a_100132313934_100009813875 [0,1,0,0,0,0|3,0,0]=4 359 B18R2.31659 NC(=O)C(F)Sc1cccc2c1cc(cc2)O 62a_100009813875_100010169565 [0,1,0,0,0,0|3,0,0]=4 360 B18R2.31659 Nc1ccc2cccc(c2c1)OC(F)C(=O)[O-] 34a_100132313934_100020610796 [0,1,0,0,0,0|2,0,1]=4 361 B18R2.31659 O=C([O-])C(F)Nc1cccc2c1cc(cc2)Br 34a_100010090012_100020610796 [0,1,0,0,0,0|2,0,1]=4 362 B18R2.31659 O=C([O-])C(F)Nc1cccc2c1cc(cc2)O 34a_100000034012_100020610796 [0,1,0,0,0,0|2,0,1]=4 363 B18R2.31659 O=C([O-])C(F)Oc1cccc2c1cc(cc2)Br 34a_100010089991_100020610796 [0,1,0,0,0,0|2,0,1]=4 364 B18R2.31659 O=C([O-])C(F)Oc1cccc2c1cc(cc2)Cl 34a_100009840344_100020610796 [0,1,0,0,0,0|2,0,1]=4 365 B18R2.31659 O=C([O-])C(F)Oc1cccc2c1cc(cc2)F 34a_100009881884_100020610796 [0,1,0,0,0,0|2,0,1]=4 366 B18R2.31659 O=C([O-])C(F)Sc1cccc2c1cc(cc2)O 62a_100020610796_100010169565 [0,1,0,0,0,0|2,0,1]=4 367 B18R2.59628 CC(=O)C(C)Oc1cccc2c1cccc2Br 7a_100010003857_100000179758 [0,1,0,0,0,0|3,0,0]=4 368 B18R2.59628 CC(=O)C(C)Sc1cccc2c1cccc2F 62a_100009814033_100009817034 [0,1,0,0,0,0|3,0,0]=4 369 B18R2.59628 CC(=O)C(C)Sc1cccc2c1cccc2F 62a_100009817034_100009814033 [0,1,0,0,0,0|3,0,0]=4 370 B18R2.59628 CC(=O)C(C)Sc1cccc2c1cccc2N 62a_100009816864_100009814033 [0,1,0,0,0,0|3,0,0]=4 371 B18R2.59628 CC(=O)C(C)Sc1cccc2c1cccc2O 62a_100009814033_100010003857 [0,1,0,0,0,0|3,0,0]=4 372 B18R2.59628 CC(Nc1cccc2c1cccc2Br)C(=O)N 34a_100009816864_100000702099 [0,1,0,0,0,0|3,0,0]=4 373 B18R2.59628 CC(Nc1cccc2c1cccc2Cl)C(=O)N 34a_100000077128_100000702099 [0,1,0,0,0,0|3,0,0]=4 374 B18R2.59628 CC(Nc1cccc2c1cccc2O)C(=O)N 34a_100000210686_100000702099 [0,1,0,0,0,0|3,0,0]=4 375 B18R2.59628 CC(Oc1cccc2c1cccc2Br)C(=O)N 34a_100010003857_100000702099 [0,1,0,0,0,0|3,0,0]=4 376 B18R2.59628 CC(Oc1cccc2c1cccc2Br)C(=O)N 7a_100010003857_100000702099 [0,1,0,0,0,0|3,0,0]=4 377 B18R2.59628 CC(Oc1cccc2c1cccc2N)C(=O)N 34a_100000210686_100000702099 [0,1,0,0,0,0|3,0,0]=4 378 B18R2.59628 CC(Sc1cccc2c1cccc2F)C(=O)N 62a_100000702099_100009817034 [0,1,0,0,0,0|3,0,0]=4 379 B18R2.59628 CC(Sc1cccc2c1cccc2F)C(=O)N 62a_100009817034_100000702099 [0,1,0,0,0,0|3,0,0]=4 380 B18R2.59628 CC(Sc1cccc2c1cccc2N)C(=O)N 62a_100009816864_100000702099 [0,1,0,0,0,0|3,0,0]=4 381 B18R2.59628 CC(Sc1cccc2c1cccc2O)C(=O)N 62a_100000702099_100010003857 [0,1,0,0,0,0|3,0,0]=4 382 B18R2.59628 NC(=O)C(F)Nc1cccc2c1cccc2Br 34a_100009816864_100009813875 [0,1,0,0,0,0|3,0,0]=4 383 B18R2.59628 NC(=O)C(F)Nc1cccc2c1cccc2Cl 34a_100000077128_100009813875 [0,1,0,0,0,0|3,0,0]=4 384 B18R2.59628 NC(=O)C(F)Nc1cccc2c1cccc2O 34a_100000210686_100009813875 [0,1,0,0,0,0|3,0,0]=4 385 B18R2.59628 NC(=O)C(F)Oc1cccc2c1cccc2Br 34a_100010003857_100009813875 [0,1,0,0,0,0|3,0,0]=4 386 B18R2.59628 NC(=O)C(F)Oc1cccc2c1cccc2Br 7a_100010003857_100009813875 [0,1,0,0,0,0|3,0,0]=4 387 B18R2.59628 NC(=O)C(F)Oc1cccc2c1cccc2N 34a_100000210686_100009813875 [0,1,0,0,0,0|3,0,0]=4 388 B18R2.59628 NC(=O)C(F)Sc1cccc2c1cccc2F 62a_100009813875_100009817034 [0,1,0,0,0,0|3,0,0]=4 389 B18R2.59628 NC(=O)C(F)Sc1cccc2c1cccc2F 62a_100009817034_100009813875 [0,1,0,0,0,0|3,0,0]=4 390 B18R2.59628 NC(=O)C(F)Sc1cccc2c1cccc2N 62a_100009816864_100009813875 [0,1,0,0,0,0|3,0,0]=4 391 B18R2.59628 NC(=O)C(F)Sc1cccc2c1cccc2O 62a_100009813875_100010003857 [0,1,0,0,0,0|3,0,0]=4 392 B18R2.59628 Nc1cccc2c1cccc2OC(F)C(=O)[O-] 34a_100000210686_100020610796 [0,1,0,0,0,0|2,0,1]=4 393 B18R2.59628 Nc1cccc2c1cccc2SC(F)C(=O)[O-] 62a_100009816864_100020610796 [0,1,0,0,0,0|2,0,1]=4 394 B18R2.59628 O=C([O-])C(F)Nc1cccc2c1cccc2Br 34a_100009816864_100020610796 [0,1,0,0,0,0|2,0,1]=4 395 B18R2.59628 O=C([O-])C(F)Nc1cccc2c1cccc2Cl 34a_100000077128_100020610796 [0,1,0,0,0,0|2,0,1]=4 396 B18R2.59628 O=C([O-])C(F)Nc1cccc2c1cccc2O 34a_100000210686_100020610796 [0,1,0,0,0,0|2,0,1]=4 397 B18R2.59628 O=C([O-])C(F)Oc1cccc2c1cccc2Br 34a_100010003857_100020610796 [0,1,0,0,0,0|2,0,1]=4 398 B18R2.59628 O=C([O-])C(F)Sc1cccc2c1cccc2F 62a_100009817034_100020610796 [0,1,0,0,0,0|2,0,1]=4 399 B18R2.59628 O=C([O-])C(F)Sc1cccc2c1cccc2F 62a_100020610796_100009817034 [0,1,0,0,0,0|2,0,1]=4 400 B18R2.59628 O=C([O-])C(F)Sc1cccc2c1cccc2O 62a_100020610796_100010003857 [0,1,0,0,0,0|2,0,1]=4 401 B18R2.62416 CC(=O)C(C)Oc1ccc(c2c1cccc2)Br 7a_100000186334_100000179758 [0,1,0,0,0,0|3,0,0]=4 402 B18R2.62416 CC(=O)C(C)Oc1ccc(c2c1cccc2)C 7a_100000074455_100000179758 [0,1,0,0,0,0|3,0,0]=4 403 B18R2.62416 CC(=O)C(C)Oc1ccc(c2c1cccc2)Cl 7a_100000211000_100000179758 [0,1,0,0,0,0|3,0,0]=4 404 B18R2.62416 CC(=O)C(C)Oc1ccc(c2c1cccc2)F 7a_100000100223_100000179758 [0,1,0,0,0,0|3,0,0]=4 405 B18R2.62416 CC(=O)C(C)Oc1ccc(c2c1cccc2)N 7a_100000705857_100000179758 [0,1,0,0,0,0|3,0,0]=4 406 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)Br 62a_100009814033_100012339872 [0,1,0,0,0,0|3,0,0]=4 407 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)Br 62a_100012339872_100009814033 [0,1,0,0,0,0|3,0,0]=4 408 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)C 62a_100009814033_100011215156 [0,1,0,0,0,0|3,0,0]=4 409 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)C 62a_100011215156_100009814033 [0,1,0,0,0,0|3,0,0]=4 410 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)F 62a_100009814033_100011218216 [0,1,0,0,0,0|3,0,0]=4 411 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)F 62a_100011218216_100009814033 [0,1,0,0,0,0|3,0,0]=4 412 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)N 62a_100000766797_100009814033 [0,1,0,0,0,0|3,0,0]=4 413 B18R2.62416 CC(=O)C(C)Sc1ccc(c2c1cccc2)O 62a_100009814033_100000186334 [0,1,0,0,0,0|3,0,0]=4 414 B18R2.62416 CC(Nc1ccc(c2c1cccc2)Br)C(=O)N 34a_100000766797_100000702099 [0,1,0,0,0,0|3,0,0]=4 415 B18R2.62416 CC(Nc1ccc(c2c1cccc2)Cl)C(=O)N 34a_100011216319_100000702099 [0,1,0,0,0,0|3,0,0]=4 416 B18R2.62416 CC(Nc1ccc(c2c1cccc2)F)C(=O)N 34a_100011988692_100000702099 [0,1,0,0,0,0|3,0,0]=4 417 B18R2.62416 CC(Nc1ccc(c2c1cccc2)O)C(=O)N 34a_100000705857_100000702099 [0,1,0,0,0,0|3,0,0]=4 418 B18R2.62416 CC(Oc1ccc(c2c1cccc2)Br)C(=O)N 34a_100000186334_100000702099 [0,1,0,0,0,0|3,0,0]=4 419 B18R2.62416 CC(Oc1ccc(c2c1cccc2)Br)C(=O)N 7a_100000186334_100000702099 [0,1,0,0,0,0|3,0,0]=4 420 B18R2.62416 CC(Oc1ccc(c2c1cccc2)Cl)C(=O)N 34a_100000211000_100000702099 [0,1,0,0,0,0|3,0,0]=4 421 B18R2.62416 CC(Oc1ccc(c2c1cccc2)Cl)C(=O)N 7a_100000211000_100000702099 [0,1,0,0,0,0|3,0,0]=4 422 B18R2.62416 CC(Oc1ccc(c2c1cccc2)F)C(=O)N 34a_100000100223_100000702099 [0,1,0,0,0,0|3,0,0]=4 423 B18R2.62416 CC(Oc1ccc(c2c1cccc2)F)C(=O)N 7a_100000100223_100000702099 [0,1,0,0,0,0|3,0,0]=4 424 B18R2.62416 CC(Oc1ccc(c2c1cccc2)N)C(=O)N 34a_100000705857_100000702099 [0,1,0,0,0,0|3,0,0]=4 425 B18R2.62416 CC(Oc1ccc(c2c1cccc2)N)C(=O)N 7a_100000705857_100000702099 [0,1,0,0,0,0|3,0,0]=4 426 B18R2.62416 CC(Sc1ccc(c2c1cccc2)Br)C(=O)N 62a_100000702099_100012339872 [0,1,0,0,0,0|3,0,0]=4 427 B18R2.62416 CC(Sc1ccc(c2c1cccc2)Br)C(=O)N 62a_100012339872_100000702099 [0,1,0,0,0,0|3,0,0]=4 428 B18R2.62416 CC(Sc1ccc(c2c1cccc2)F)C(=O)N 62a_100000702099_100011218216 [0,1,0,0,0,0|3,0,0]=4 429 B18R2.62416 CC(Sc1ccc(c2c1cccc2)F)C(=O)N 62a_100011218216_100000702099 [0,1,0,0,0,0|3,0,0]=4 430 B18R2.62416 CC(Sc1ccc(c2c1cccc2)N)C(=O)N 62a_100000766797_100000702099 [0,1,0,0,0,0|3,0,0]=4 431 B18R2.62416 CC(Sc1ccc(c2c1cccc2)O)C(=O)N 62a_100000702099_100000186334 [0,1,0,0,0,0|3,0,0]=4 432 B18R2.62416 Cc1ccc(c2c1cccc2)OC(C)C(=O)N 34a_100000074455_100000702099 [0,1,0,0,0,0|3,0,0]=4 433 B18R2.62416 Cc1ccc(c2c1cccc2)OC(C)C(=O)N 7a_100000074455_100000702099 [0,1,0,0,0,0|3,0,0]=4 434 B18R2.62416 Cc1ccc(c2c1cccc2)OC(F)C(=O)N 34a_100000074455_100009813875 [0,1,0,0,0,0|3,0,0]=4 435 B18R2.62416 Cc1ccc(c2c1cccc2)OC(F)C(=O)N 7a_100000074455_100009813875 [0,1,0,0,0,0|3,0,0]=4 436 B18R2.62416 Cc1ccc(c2c1cccc2)OC(F)C(=O)[O-] 34a_100000074455_100020610796 [0,1,0,0,0,0|2,0,1]=4 437 B18R2.62416 Cc1ccc(c2c1cccc2)SC(C)C(=O)N 62a_100000702099_100011215156 [0,1,0,0,0,0|3,0,0]=4 438 B18R2.62416 Cc1ccc(c2c1cccc2)SC(C)C(=O)N 62a_100011215156_100000702099 [0,1,0,0,0,0|3,0,0]=4 439 B18R2.62416 Cc1ccc(c2c1cccc2)SC(F)C(=O)N 62a_100009813875_100011215156 [0,1,0,0,0,0|3,0,0]=4 440 B18R2.62416 Cc1ccc(c2c1cccc2)SC(F)C(=O)N 62a_100011215156_100009813875 [0,1,0,0,0,0|3,0,0]=4 441 B18R2.62416 Cc1ccc(c2c1cccc2)SC(F)C(=O)[O-] 62a_100011215156_100020610796 [0,1,0,0,0,0|2,0,1]=4 442 B18R2.62416 Cc1ccc(c2c1cccc2)SC(F)C(=O)[O-] 62a_100020610796_100011215156 [0,1,0,0,0,0|2,0,1]=4 443 B18R2.62416 NC(=O)C(F)Nc1ccc(c2c1cccc2)Br 34a_100000766797_100009813875 [0,1,0,0,0,0|3,0,0]=4 444 B18R2.62416 NC(=O)C(F)Nc1ccc(c2c1cccc2)Cl 34a_100011216319_100009813875 [0,1,0,0,0,0|3,0,0]=4 445 B18R2.62416 NC(=O)C(F)Nc1ccc(c2c1cccc2)F 34a_100011988692_100009813875 [0,1,0,0,0,0|3,0,0]=4 446 B18R2.62416 NC(=O)C(F)Nc1ccc(c2c1cccc2)O 34a_100000705857_100009813875 [0,1,0,0,0,0|3,0,0]=4 447 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)Br 34a_100000186334_100009813875 [0,1,0,0,0,0|3,0,0]=4 448 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)Br 7a_100000186334_100009813875 [0,1,0,0,0,0|3,0,0]=4 449 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)Cl 34a_100000211000_100009813875 [0,1,0,0,0,0|3,0,0]=4 450 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)Cl 7a_100000211000_100009813875 [0,1,0,0,0,0|3,0,0]=4 451 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)F 34a_100000100223_100009813875 [0,1,0,0,0,0|3,0,0]=4 452 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)F 7a_100000100223_100009813875 [0,1,0,0,0,0|3,0,0]=4 453 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)N 34a_100000705857_100009813875 [0,1,0,0,0,0|3,0,0]=4 454 B18R2.62416 NC(=O)C(F)Oc1ccc(c2c1cccc2)N 7a_100000705857_100009813875 [0,1,0,0,0,0|3,0,0]=4 455 B18R2.62416 NC(=O)C(F)Sc1ccc(c2c1cccc2)Br 62a_100009813875_100012339872 [0,1,0,0,0,0|3,0,0]=4 456 B18R2.62416 NC(=O)C(F)Sc1ccc(c2c1cccc2)Br 62a_100012339872_100009813875 [0,1,0,0,0,0|3,0,0]=4 457 B18R2.62416 NC(=O)C(F)Sc1ccc(c2c1cccc2)F 62a_100009813875_100011218216 [0,1,0,0,0,0|3,0,0]=4 458 B18R2.62416 NC(=O)C(F)Sc1ccc(c2c1cccc2)F 62a_100011218216_100009813875 [0,1,0,0,0,0|3,0,0]=4 459 B18R2.62416 NC(=O)C(F)Sc1ccc(c2c1cccc2)N 62a_100000766797_100009813875 [0,1,0,0,0,0|3,0,0]=4 460 B18R2.62416 NC(=O)C(F)Sc1ccc(c2c1cccc2)O 62a_100009813875_100000186334 [0,1,0,0,0,0|3,0,0]=4 461 B18R2.62416 Nc1ccc(c2c1cccc2)OC(F)C(=O)[O-] 34a_100000705857_100020610796 [0,1,0,0,0,0|2,0,1]=4 462 B18R2.62416 Nc1ccc(c2c1cccc2)SC(F)C(=O)[O-] 62a_100000766797_100020610796 [0,1,0,0,0,0|2,0,1]=4 463 B18R2.62416 O=C([O-])C(F)Nc1ccc(c2c1cccc2)Br 34a_100000766797_100020610796 [0,1,0,0,0,0|2,0,1]=4 464 B18R2.62416 O=C([O-])C(F)Nc1ccc(c2c1cccc2)Cl 34a_100011216319_100020610796 [0,1,0,0,0,0|2,0,1]=4 465 B18R2.62416 O=C([O-])C(F)Nc1ccc(c2c1cccc2)F 34a_100011988692_100020610796 [0,1,0,0,0,0|2,0,1]=4 466 B18R2.62416 O=C([O-])C(F)Nc1ccc(c2c1cccc2)O 34a_100000705857_100020610796 [0,1,0,0,0,0|2,0,1]=4 467 B18R2.62416 O=C([O-])C(F)Oc1ccc(c2c1cccc2)Br 34a_100000186334_100020610796 [0,1,0,0,0,0|2,0,1]=4 468 B18R2.62416 O=C([O-])C(F)Oc1ccc(c2c1cccc2)Cl 34a_100000211000_100020610796 [0,1,0,0,0,0|2,0,1]=4 469 B18R2.62416 O=C([O-])C(F)Oc1ccc(c2c1cccc2)F 34a_100000100223_100020610796 [0,1,0,0,0,0|2,0,1]=4 470 B18R2.62416 O=C([O-])C(F)Sc1ccc(c2c1cccc2)Br 62a_100012339872_100020610796 [0,1,0,0,0,0|2,0,1]=4 471 B18R2.62416 O=C([O-])C(F)Sc1ccc(c2c1cccc2)Br 62a_100020610796_100012339872 [0,1,0,0,0,0|2,0,1]=4 472 B18R2.62416 O=C([O-])C(F)Sc1ccc(c2c1cccc2)F 62a_100011218216_100020610796 [0,1,0,0,0,0|2,0,1]=4 473 B18R2.62416 O=C([O-])C(F)Sc1ccc(c2c1cccc2)F 62a_100020610796_100011218216 [0,1,0,0,0,0|2,0,1]=4 474 B18R2.62416 O=C([O-])C(F)Sc1ccc(c2c1cccc2)O 62a_100020610796_100000186334 [0,1,0,0,0,0|2,0,1]=4 475 B18R2.481233 CC(=O)C(C)Nc1cccc2c1c(ccc2)C 7a_100009841044_100000179758 [0,1,0,0,0,0|3,0,0]=4 476 B18R2.481233 CC(=O)C(C)Nc1cccc2c1c(ccc2)F 7a_100009878580_100000179758 [0,1,0,0,0,0|3,0,0]=4 477 B18R2.481233 CC(=O)C(C)Oc1cccc2c1c(ccc2)Br 7a_100010089961_100000179758 [0,1,0,0,0,0|3,0,0]=4 478 B18R2.481233 CC(=O)C(C)Sc1cccc2c1c(ccc2)Br 62a_100009814033_100010243825 [0,1,0,0,0,0|3,0,0]=4 479 B18R2.481233 CC(=O)C(C)Sc1cccc2c1c(ccc2)Br 62a_100010243825_100009814033 [0,1,0,0,0,0|3,0,0]=4 480 B18R2.481233 CC(=O)C(C)Sc1cccc2c1c(ccc2)C 62a_100009814033_100009995290 [0,1,0,0,0,0|3,0,0]=4 481 B18R2.481233 CC(=O)C(C)Sc1cccc2c1c(ccc2)F 62a_100009814033_100010177852 [0,1,0,0,0,0|3,0,0]=4 482 B18R2.481233 CC(=O)C(C)Sc1cccc2c1c(ccc2)F 62a_100010177852_100009814033 [0,1,0,0,0,0|3,0,0]=4 483 B18R2.481233 CC(=O)C(C)Sc1cccc2c1c(ccc2)N 62a_100010002837_100009814033 [0,1,0,0,0,0|3,0,0]=4 484 B18R2.481233 CC(=O)C(C)Sc1cccc2c1c(ccc2)O 62a_100009814033_100010089961 [0,1,0,0,0,0|3,0,0]=4 485 B18R2.481233 CC(Nc1cccc2c1c(ccc2)Br)C(=O)N 34a_100010002837_100000702099 [0,1,0,0,0,0|3,0,0]=4 486 B18R2.481233 CC(Nc1cccc2c1c(ccc2)Cl)C(=O)N 34a_100009857565_100000702099 [0,1,0,0,0,0|3,0,0]=4 487 B18R2.481233 CC(Nc1cccc2c1c(ccc2)F)C(=O)N 34a_100009878580_100000702099 [0,1,0,0,0,0|3,0,0]=4 488 B18R2.481233 CC(Nc1cccc2c1c(ccc2)F)C(=O)N 7a_100009878580_100000702099 [0,1,0,0,0,0|3,0,0]=4 489 B18R2.481233 CC(Oc1cccc2c1c(ccc2)Br)C(=O)N 34a_100010089961_100000702099 [0,1,0,0,0,0|3,0,0]=4 490 B18R2.481233 CC(Oc1cccc2c1c(ccc2)Br)C(=O)N 7a_100010089961_100000702099 [0,1,0,0,0,0|3,0,0]=4 491 B18R2.481233 CC(Sc1cccc2c1c(ccc2)Br)C(=O)N 62a_100000702099_100010243825 [0,1,0,0,0,0|3,0,0]=4 492 B18R2.481233 CC(Sc1cccc2c1c(ccc2)Br)C(=O)N 62a_100010243825_100000702099 [0,1,0,0,0,0|3,0,0]=4 493 B18R2.481233 CC(Sc1cccc2c1c(ccc2)F)C(=O)N 62a_100000702099_100010177852 [0,1,0,0,0,0|3,0,0]=4 494 B18R2.481233 CC(Sc1cccc2c1c(ccc2)F)C(=O)N 62a_100010177852_100000702099 [0,1,0,0,0,0|3,0,0]=4 495 B18R2.481233 CC(Sc1cccc2c1c(ccc2)N)C(=O)N 62a_100010002837_100000702099 [0,1,0,0,0,0|3,0,0]=4 496 B18R2.481233 CC(Sc1cccc2c1c(ccc2)O)C(=O)N 62a_100000702099_100010089961 [0,1,0,0,0,0|3,0,0]=4 497 B18R2.481233 Cc1cccc2c1c(ccc2)NC(C)C(=O)N 34a_100009841044_100000702099 [0,1,0,0,0,0|3,0,0]=4 498 B18R2.481233 Cc1cccc2c1c(ccc2)NC(C)C(=O)N 7a_100009841044_100000702099 [0,1,0,0,0,0|3,0,0]=4 499 B18R2.481233 Cc1cccc2c1c(ccc2)NC(F)C(=O)N 34a_100009841044_100009813875 [0,1,0,0,0,0|3,0,0]=4 500 B18R2.481233 Cc1cccc2c1c(ccc2)NC(F)C(=O)N 7a_100009841044_100009813875 [0,1,0,0,0,0|3,0,0]=4 501 B18R2.481233 Cc1cccc2c1c(ccc2)NC(F)C(=O)[O-] 34a_100009841044_100020610796 [0,1,0,0,0,0|2,0,1]=4 502 B18R2.481233 Cc1cccc2c1c(ccc2)SC(C)C(=O)N 62a_100000702099_100009995290 [0,1,0,0,0,0|3,0,0]=4 503 B18R2.481233 Cc1cccc2c1c(ccc2)SC(F)C(=O)N 62a_100009813875_100009995290 [0,1,0,0,0,0|3,0,0]=4 504 B18R2.481233 Cc1cccc2c1c(ccc2)SC(F)C(=O)[O-] 62a_100020610796_100009995290 [0,1,0,0,0,0|2,0,1]=4 505 B18R2.481233 NC(=O)C(F)Nc1cccc2c1c(ccc2)Br 34a_100010002837_100009813875 [0,1,0,0,0,0|3,0,0]=4 506 B18R2.481233 NC(=O)C(F)Nc1cccc2c1c(ccc2)Cl 34a_100009857565_100009813875 [0,1,0,0,0,0|3,0,0]=4 507 B18R2.481233 NC(=O)C(F)Nc1cccc2c1c(ccc2)F 34a_100009878580_100009813875 [0,1,0,0,0,0|3,0,0]=4 508 B18R2.481233 NC(=O)C(F)Nc1cccc2c1c(ccc2)F 7a_100009878580_100009813875 [0,1,0,0,0,0|3,0,0]=4 509 B18R2.481233 NC(=O)C(F)Oc1cccc2c1c(ccc2)Br 34a_100010089961_100009813875 [0,1,0,0,0,0|3,0,0]=4 510 B18R2.481233 NC(=O)C(F)Oc1cccc2c1c(ccc2)Br 7a_100010089961_100009813875 [0,1,0,0,0,0|3,0,0]=4 511 B18R2.481233 NC(=O)C(F)Sc1cccc2c1c(ccc2)Br 62a_100009813875_100010243825 [0,1,0,0,0,0|3,0,0]=4 512 B18R2.481233 NC(=O)C(F)Sc1cccc2c1c(ccc2)Br 62a_100010243825_100009813875 [0,1,0,0,0,0|3,0,0]=4 513 B18R2.481233 NC(=O)C(F)Sc1cccc2c1c(ccc2)F 62a_100009813875_100010177852 [0,1,0,0,0,0|3,0,0]=4 514 B18R2.481233 NC(=O)C(F)Sc1cccc2c1c(ccc2)F 62a_100010177852_100009813875 [0,1,0,0,0,0|3,0,0]=4 515 B18R2.481233 NC(=O)C(F)Sc1cccc2c1c(ccc2)N 62a_100010002837_100009813875 [0,1,0,0,0,0|3,0,0]=4 516 B18R2.481233 NC(=O)C(F)Sc1cccc2c1c(ccc2)O 62a_100009813875_100010089961 [0,1,0,0,0,0|3,0,0]=4 517 B18R2.481233 Nc1cccc2c1c(ccc2)SC(F)C(=O)[O-] 62a_100010002837_100020610796 [0,1,0,0,0,0|2,0,1]=4 518 B18R2.481233 O=C([O-])C(F)Nc1cccc2c1c(ccc2)Br 34a_100010002837_100020610796 [0,1,0,0,0,0|2,0,1]=4 519 B18R2.481233 O=C([O-])C(F)Nc1cccc2c1c(ccc2)Cl 34a_100009857565_100020610796 [0,1,0,0,0,0|2,0,1]=4 520 B18R2.481233 O=C([O-])C(F)Nc1cccc2c1c(ccc2)F 34a_100009878580_100020610796 [0,1,0,0,0,0|2,0,1]=4 521 B18R2.481233 O=C([O-])C(F)Oc1cccc2c1c(ccc2)Br 34a_100010089961_100020610796 [0,1,0,0,0,0|2,0,1]=4 522 B18R2.481233 O=C([O-])C(F)Sc1cccc2c1c(ccc2)Br 62a_100010243825_100020610796 [0,1,0,0,0,0|2,0,1]=4 523 B18R2.481233 O=C([O-])C(F)Sc1cccc2c1c(ccc2)Br 62a_100020610796_100010243825 [0,1,0,0,0,0|2,0,1]=4 524 B18R2.481233 O=C([O-])C(F)Sc1cccc2c1c(ccc2)F 62a_100010177852_100020610796 [0,1,0,0,0,0|2,0,1]=4 525 B18R2.481233 O=C([O-])C(F)Sc1cccc2c1c(ccc2)F 62a_100020610796_100010177852 [0,1,0,0,0,0|2,0,1]=4 526 B18R2.481233 O=C([O-])C(F)Sc1cccc2c1c(ccc2)O 62a_100020610796_100010089961 [0,1,0,0,0,0|2,0,1]=4 527 B18R2.904449 C=CC(=O)N(C)Cc1cccc2c1cccc2 240690a_100000741213_200121576911 [0,1,0,0,0,0|3,0,0]=4 528 B18R2.904449 CC(Oc1cccc2c1cccc2)C(=O)CF 1458a_100000216494_100015361967 [0,1,0,0,0,0|3,0,0]=4 529 B18R2.904449 CCC(=O)C(C)Oc1cccc2c1cccc2 1458a_100000216494_100000210202 [0,1,0,0,0,0|3,0,0]=4 530 B18R2.904449 CCC(=O)C(C)Oc1cccc2c1cccc2 7a_100000210388_100000742827 [0,1,0,0,0,0|3,0,0]=4 531 B18R2.904449 CCC(=O)C(C)Sc1cccc2c1cccc2 62a_100000742827_100000210605 [0,1,0,0,0,0|3,0,0]=4 532 B18R2.904449 CCC(=O)N(C)Cc1cccc2c1cccc2 11a_100000741213_100000210414 [0,1,0,0,0,0|3,0,0]=4 533 B18R2.904449 CCC(=O)N(C)Cc1cccc2c1cccc2 240690a_100000741213_100000210414 [0,1,0,0,0,0|3,0,0]=4 534 B18R2.904449 CCC(=O)N(C)Cc1cccc2c1cccc2 527a_100000741213_100000210414 [0,1,0,0,0,0|3,0,0]=4 535 B18R2.904449 CN(Cc1cccc2c1cccc2)C(=O)CO 240690a_100000741213_100000210174 [0,1,0,0,0,0|2,0,0]=3 536 B18R2.904449 CN(Cc1cccc2c1cccc2)C(=O)CO 527a_100000741213_100000210174 [0,1,0,0,0,0|2,0,0]=3 537 B18R2.904449 CN(Cc1cccc2c1cccn2)C(=O)CO 240690a_100011647598_100000210174 [0,1,0,0,0,0|3,0,0]=4 538 B18R2.904449 CN(Cc1cccc2c1cccn2)C(=O)CO 527a_100011647598_100000210174 [0,1,0,0,0,0|3,0,0]=4 539 B18R2.904449 CN(Cc1cccc2c1ccnc2)C(=O)CO 240690a_100011757366_100000210174 [0,1,0,0,0,0|3,0,0]=4 540 B18R2.904449 CN(Cc1cccc2c1ccnc2)C(=O)CO 527a_100011757366_100000210174 [0,1,0,0,0,0|3,0,0]=4 541 B18R2.904449 CN(Cc1cccc2c1nccc2)C(=O)CO 240690a_102515433035_100000210174 [0,1,0,0,0,0|3,0,0]=4 542 B18R2.904449 CN(Cc1cccc2c1nccc2)C(=O)CO 527a_102515433035_100000210174 [0,1,0,0,0,0|3,0,0]=4 543 B18R2.904449 CN(Cc1ccnc2c1cccc2)C(=O)CO 240690a_100011649695_100000210174 [0,1,0,0,0,0|3,0,0]=4 544 B18R2.904449 CN(Cc1ccnc2c1cccc2)C(=O)CO 527a_100011649695_100000210174 [0,1,0,0,0,0|3,0,0]=4 545 B18R2.904449 CN(Cc1cncc2c1cccc2)C(=O)CO 240690a_114948179032_100000210174 [0,1,0,0,0,0|3,0,0]=4 546 B18R2.904449 CN(Cc1cncc2c1cccc2)C(=O)CO 527a_114948179032_100000210174 [0,1,0,0,0,0|3,0,0]=4 547 B18R2.904449 CNC(=O)C(=O)Cc1cccc2c1cccc2 1458a_100011218921_100000188474 [0,1,0,0,0,0|2,0,1]=4 548 B18R2.904449 CNC(=O)C(C)Nc1cccc2c1cccc2 34a_100000185869_100000731044 [0,1,0,0,0,0|3,0,0]=4 549 B18R2.904449 CNC(=O)C(C)Oc1cccc2c1cccc2 11a_106832991635_100000216494 [0,1,0,0,0,0|3,0,0]=4 550 B18R2.904449 CNC(=O)C(C)Oc1cccc2c1cccc2 1626a_100102657272_100000216494 [0,1,0,0,0,0|3,0,0]=4 551 B18R2.904449 CNC(=O)C(C)Oc1cccc2c1cccc2 240690a_100102657272_100000216494 [0,1,0,0,0,0|3,0,0]=4 552 B18R2.904449 CNC(=O)C(C)Oc1cccc2c1cccc2 34a_100000210388_100000731044 [0,1,0,0,0,0|3,0,0]=4 553 B18R2.904449 CNC(=O)C(C)Oc1cccc2c1cccc2 527a_100102657272_100000216494 [0,1,0,0,0,0|3,0,0]=4 554 B18R2.904449 CNC(=O)C(C)Oc1cccc2c1cccc2 7a_100000210388_100000209862 [0,1,0,0,0,0|3,0,0]=4 555 B18R2.904449 CNC(=O)C(C)Sc1cccc2c1cccc2 62a_100000209862_100000210605 [0,1,0,0,0,0|3,0,0]=4 556 B18R2.904449 CNC(=O)C(F)Nc1cccc2c1cccc2 34a_100000185869_100009813575 [0,1,0,0,0,0|3,0,0]=4 557 B18R2.904449 CNC(=O)C(F)Oc1cccc2c1cccc2 34a_100000210388_100009813575 [0,1,0,0,0,0|3,0,0]=4 558 B18R2.904449 CNC(=O)C(F)Oc1cccc2c1cccc2 7a_100000210388_100009813575 [0,1,0,0,0,0|3,0,0]=4 559 B18R2.904449 CNC(=O)C(F)Sc1cccc2c1cccc2 62a_100009813575_100000210605 [0,1,0,0,0,0|3,0,0]=4 560 B18R2.904449 CNC(=O)N(C)Cc1cccc2c1cccc2 2708a_100102657272_100000741213 [0,1,0,0,0,0|3,0,0]=4 561 B18R2.904449 CNC(=O)N(C)Cc1cccc2c1cccc2 273464a_100102657272_100000741213 [0,1,0,0,0,0|3,0,0]=4 562 B18R2.904449 COC(=O)C(=O)Nc1cccc2c1cccc2 11a_100000185869_100000024059 [0,1,0,0,0,0|2,0,1]=4 563 B18R2.904449 COC(=O)C(=O)Nc1cccc2c1cccc2 1626a_100000185869_100000024059 [0,1,0,0,0,0|2,0,1]=4 564 B18R2.904449 COC(=O)C(C)Nc1cccc2c1cccc2 34a_100000185869_100000211248 [0,1,0,0,0,0|2,0,0]=3 565 B18R2.904449 COC(=O)C(C)Nc1cccc2c1cccn2 34a_100000183906_100000211248 [0,1,0,0,0,0|3,0,0]=4 566 B18R2.904449 COC(=O)C(C)Nc1cccc2c1nccc2 34a_100000181377_100000211248 [0,1,0,0,0,0|3,0,0]=4 567 B18R2.904449 COC(=O)C(C)Oc1cccc2c1cccc2 34a_100000210388_100000211248 [0,1,0,0,0,0|2,0,0]=3 568 B18R2.904449 COC(=O)C(C)Oc1cccc2c1cccc2 7a_100000210388_100000211248 [0,1,0,0,0,0|2,0,0]=3 569 B18R2.904449 COC(=O)C(C)Oc1cccc2c1cccn2 34a_100011197808_100000211248 [0,1,0,0,0,0|3,0,0]=4 570 B18R2.904449 COC(=O)C(C)Oc1cccc2c1ccnc2 34a_100011218533_100000211248 [0,1,0,0,0,0|3,0,0]=4 571 B18R2.904449 COC(=O)C(C)Oc1cccc2c1cncc2 34a_103624766955_100000211248 [0,1,0,0,0,0|3,0,0]=4 572 B18R2.904449 COC(=O)C(C)Oc1cccc2c1nccc2 34a_100000056035_100000211248 [0,1,0,0,0,0|3,0,0]=4 573 B18R2.904449 COC(=O)C(C)Oc1cncc2c1cccc2 34a_100000066178_100000211248 [0,1,0,0,0,0|3,0,0]=4 574 B18R2.904449 COC(=O)C(C)Oc1cncc2c1cccc2 7a_100000066178_100000211248 [0,1,0,0,0,0|3,0,0]=4 575 B18R2.904449 COC(=O)C(C)Oc1nccc2c1cccc2 34a_102531767632_100000211248 [0,1,0,0,0,0|3,0,0]=4 576 B18R2.904449 COC(=O)C(C)Sc1cccc2c1cccc2 62a_100000211248_100000210605 [0,1,0,0,0,0|2,0,0]=3 577 B18R2.904449 COC(=O)C(C)Sc1cccc2c1cccn2 62a_100000211248_100011290932 [0,1,0,0,0,0|3,0,0]=4 578 B18R2.904449 COC(=O)C(C)Sc1cccc2c1cccn2 62a_100011290932_100000211248 [0,1,0,0,0,0|3,0,0]=4 579 B18R2.904449 COC(=O)C(C)Sc1cccc2c1ccnc2 62a_100000186358_100000211248 [0,1,0,0,0,0|3,0,0]=4 580 B18R2.904449 COC(=O)C(C)Sc1cccc2c1ccnc2 62a_100000211248_100000186358 [0,1,0,0,0,0|3,0,0]=4 581 B18R2.904449 COC(=O)C(C)Sc1cccc2c1cncc2 62a_100000211248_100000685578 [0,1,0,0,0,0|3,0,0]=4 582 B18R2.904449 COC(=O)C(C)Sc1cccc2c1cncc2 62a_100000685578_100000211248 [0,1,0,0,0,0|3,0,0]=4 583 B18R2.904449 COC(=O)C(C)Sc1cccc2c1nccc2 62a_100000211248_100011215545 [0,1,0,0,0,0|3,0,0]=4 584 B18R2.904449 COC(=O)C(C)Sc1ccnc2c1cccc2 62a_100000211248_100011215880 [0,1,0,0,0,0|3,0,0]=4 585 B18R2.904449 COC(=O)C(C)Sc1ccnc2c1cccc2 62a_100011458314_100000211248 [0,1,0,0,0,0|3,0,0]=4 586 B18R2.904449 COC(=O)C(C)Sc1cncc2c1cccc2 62a_100000187577_100000211248 [0,1,0,0,0,0|3,0,0]=4 587 B18R2.904449 COC(=O)C(C)Sc1cncc2c1cccc2 62a_100000211248_100000187577 [0,1,0,0,0,0|3,0,0]=4 588 B18R2.904449 COC(=O)C(C)Sc1nccc2c1cccc2 62a_100000211248_100011934041 [0,1,0,0,0,0|3,0,0]=4 589 B18R2.904449 COC(=O)C(C)Sc1nccc2c1cccc2 62a_100011934041_100000211248 [0,1,0,0,0,0|3,0,0]=4 590 B18R2.913225 CCC(Nc1cccc2c1cccc2)C(=O)N 34a_100000185869_100000750255 [0,1,0,0,0,0|3,0,0]=4 591 B18R2.913225 CCC(Oc1cccc2c1cccc2)C(=O)N 34a_100000210388_100000750255 [0,1,0,0,0,0|3,0,0]=4 592 B18R2.913225 CCC(Oc1cccc2c1cccc2)C(=O)N 7a_100000210388_100000750255 [0,1,0,0,0,0|3,0,0]=4 593 B18R2.913225 CCC(Sc1cccc2c1cccc2)C(=O)N 62a_100000750255_100000210605 [0,1,0,0,0,0|3,0,0]=4 594 B18R2.1372400 CC(=O)C(C)(C)Oc1cccc2c1cccc2 7a_100000210388_100000075568 [0,1,0,0,0,0|3,0,0]=4 595 B18R2.1372400 CC(=O)C(C)(C)Sc1cccc2c1cccc2 62a_100000075568_100000210605 [0,1,0,0,0,0|3,0,0]=4 596 B18R2.1372400 CC(C)(Nc1cccc2c1cccc2)C(=O)N 34a_100000185869_100000702505 [0,1,0,0,0,0|3,0,0]=4 597 B18R2.1372400 CC(C)(Oc1cccc2c1cccc2)C(=O)N 34a_100000210388_100000702505 [0,1,0,0,0,0|3,0,0]=4 598 B18R2.1372400 CC(C)(Oc1cccc2c1cccc2)C(=O)N 7a_100000210388_100000702505 [0,1,0,0,0,0|3,0,0]=4 599 B18R2.1372400 CC(C)(Sc1cccc2c1cccc2)C(=O)N 62a_100000702505_100000210605 [0,1,0,0,0,0|3,0,0]=4 600 B18R2.1372400 NC(=O)C(F)(F)Oc1cccc2c1cccc2 7a_100000210388_100009811971 [0,1,0,0,0,0|3,0,0]=4 601 B18R2.1372400 NC(=O)C(F)(F)Sc1cccc2c1cccc2 62a_100009811971_100000210605 [0,1,0,0,0,0|3,0,0]=4 602 B18R2.1372400 O=C([O-])C(F)(F)Nc1cccc2c1cccc2 34a_100000185869_100020612412 [0,1,0,0,0,0|2,0,1]=4 603 B18R2.1372400 O=C([O-])C(F)(F)Oc1cccc2c1cccc2 34a_100000210388_100020612412 [0,1,0,0,0,0|2,0,1]=4 604 B18R2.1372400 O=C([O-])C(F)(F)Sc1cccc2c1cccc2 62a_100000745680_100000210605 [0,1,0,0,0,0|2,0,1]=4 605 B18R2.2912343 CC(=O)C(C)C(=O)c1cccc2c1cccc2 1458a_100000210949_100000179758 [0,1,0,0,0,0|2,0,1]=4 606 B18R2.2912343 CC(=O)C(C)N(C)c1cccc2c1cccc2 2230a_100000220138_100009814033 [0,1,0,0,0,0|3,0,0]=4 607 B18R2.2912343 CC(=O)C(C)N(C)c1cccc2c1cccc2 269982a_100000220138_100009814033 [0,1,0,0,0,0|3,0,0]=4 608 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 11a_100009815097_100015343762 [0,1,0,0,0,0|3,0,0]=4 609 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 1626a_100009815097_100015343762 [0,1,0,0,0,0|3,0,0]=4 610 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 240690a_100009815097_100015343762 [0,1,0,0,0,0|3,0,0]=4 611 B18R2.2912343 CC(=O)N(C)[C@H](C)c1cccc2c1cccc2 527a_100009815097_100103153847 [0,1,0,0,0,0|3,0,0]=4 612 B18R2.2912343 CC(C(=O)N)C(=O)c1cccc2c1cccc2 1458a_100000210949_100000702099 [0,1,0,0,0,0|2,0,1]=4 613 B18R2.2912343 CC(C(=O)N)N(C)c1cccc2c1cccc2 2230a_100000220138_100000702099 [0,1,0,0,0,0|3,0,0]=4 614 B18R2.2912343 CC(C(=O)N)N(C)c1cccc2c1cccc2 269982a_100000220138_100000184083 [0,1,0,0,0,0|3,0,0]=4 615 B18R2.2912343 CC(C(=O)N)N(C)c1cccc2c1cccc2 34a_100000220138_100000702099 [0,1,0,0,0,0|3,0,0]=4 616 B18R2.2912343 CN(c1cccc2c1cccc2)C(F)C(=O)N 2230a_100000220138_100009813875 [0,1,0,0,0,0|3,0,0]=4 617 B18R2.2912343 CN(c1cccc2c1cccc2)C(F)C(=O)N 269982a_100000220138_100009813875 [0,1,0,0,0,0|3,0,0]=4 618 B18R2.2912343 CN(c1cccc2c1cccc2)C(F)C(=O)N 34a_100000220138_100009813875 [0,1,0,0,0,0|3,0,0]=4 619 B18R2.2912343 CN(c1cccc2c1cccc2)C(F)C(=O)[O-] 34a_100000220138_100020610796 [0,1,0,0,0,0|2,0,1]=4 620 B18R2.2912343 NC(=O)C(F)C(=O)c1cccc2c1cccc2 1458a_100000210949_100009813875 [0,1,0,0,0,0|2,0,1]=4 621 B18R2.2912343 O=C([O-])C(F)C(=O)c1cccc2c1cccc2 1458a_100000210949_100020610796 [0,1,0,0,0,0|1,0,2]=4 622 B16R1.4131 CC(CNC/C=C/c1ccccc1)C(=O)O 269956a_100000749485_100016265936 [0,0,1,0,0,0|2,0,1]=4 623 B16R1.4131 NC(=O)[C@@H](N)COC/C=C/c1ccccc1 34a_100000729942_100016265936 [0,0,1,0,0,0|2,0,1]=4 624 B16R1.4131 O=C(O)C(F)CNC/C=C/c1ccccc1 269956a_100000084737_100016265936 [0,0,1,0,0,0|2,0,1]=4 625 B18R3.155 O=C1CCC1Nc2cccc3c2cccc3 34a_100000185869_100009892977 [0,0,0,1,0,0|3,0,0]=4 626 B18R3.155 O=C1CCC1Oc2cccc3c2cccc3 34a_100000210388_100009892977 [0,0,0,1,0,0|3,0,0]=4 627 B18R3.155 O=C1CCC1Oc2cccc3c2cccc3 7a_100000210388_100009892977 [0,0,0,1,0,0|3,0,0]=4 628 B18R3.155 O=C1CCC1Sc2cccc3c2cccc3 62a_100009892977_100000210605 [0,0,0,1,0,0|3,0,0]=4 629 B18R3.1005251 CC(=O)N1Cc2cccc3c2c(ccc3)C1 11a_100102583503_100015343762 [0,0,0,1,0,0|3,0,0]=4 630 B18R3.1005251 CC(=O)N1Cc2cccc3c2c(ccc3)C1 1626a_100102583503_100015343762 [0,0,0,1,0,0|3,0,0]=4 631 B18R3.1005251 CC(=O)N1Cc2cccc3c2c(ccc3)C1 240690a_100102583503_100015343762 [0,0,0,1,0,0|3,0,0]=4 632 B18R3.1005251 CC(=O)N1Cc2cccc3c2c(ccc3)C1 527a_100102583503_100103153847 [0,0,0,1,0,0|3,0,0]=4 633 B16R2.244415 CC(=O)N(C)c1cccc2c1cccc2 11a_100000220138_100015343762 [0,0,0,0,1,0|3,0,0]=4 634 B16R2.244415 CC(=O)N(C)c1cccc2c1cccc2 1626a_100000220138_100015343762 [0,0,0,0,1,0|3,0,0]=4 635 B16R2.244415 CC(=O)N(C)c1cccc2c1cccc2 22a_100000220138_100000070787 [0,0,0,0,1,0|3,0,0]=4 636 B18R2.2417296 C=C(C)C(C)NCc1cccc2c1cccc2 269862a_100000753325_100011216138 [0,0,0,0,0,1|3,0,0]=4 637 B18R2.2417296 CC(=O)C(=O)CNc1cccc2c1cccc2 34a_100000185869_100011261029 [0,0,0,0,0,1|2,0,1]=4 638 B18R2.2417296 CC(=O)C(=O)COc1cccc2c1cccc2 34a_100000210388_100011261029 [0,0,0,0,0,1|2,0,1]=4 639 B18R2.2417296 CC(=O)C(=O)CSc1cccc2c1cccc2 62a_100011261029_100000210605 [0,0,0,0,0,1|2,0,1]=4 640 B18R2.2417296 CC(=O)C(C)OCc1cccc2c1cccc2 34a_100000212229_100011261445 [0,0,0,0,0,1|2,0,0]=3 641 B18R2.2417296 CC(=O)C(C)OCc1cccc2c1cccc2 7a_100011216843_100000179758 [0,0,0,0,0,1|2,0,0]=3 642 B18R2.2417296 CC(=O)C(C)OCc1cccc2c1ccnc2 34a_100000212229_100016989825 [0,0,0,0,0,1|3,0,0]=4 643 B18R2.2417296 CC(=O)C(C)OCc1cccc2c1nccc2 34a_100000212229_100000241032 [0,0,0,0,0,1|3,0,0]=4 644 B18R2.2417296 CC(=O)C(C)OCc1ccnc2c1cccc2 34a_100000212229_100015192512 [0,0,0,0,0,1|3,0,0]=4 645 B18R2.2417296 CC(=O)C(C)OCc1nccc2c1cccc2 34a_100000212229_100000033776 [0,0,0,0,0,1|3,0,0]=4 646 B18R2.2417296 CC(=O)C(C)SCc1cccc2c1cccc2 62a_100009814033_100000188474 [0,0,0,0,0,1|2,0,0]=3 647 B18R2.2417296 CC(=O)C(C)SCc1cccc2c1cccc2 62a_100011261445_100009814033 [0,0,0,0,0,1|2,0,0]=3 648 B18R2.2417296 CC(=O)C(C)SCc1cccc2c1ccnc2 62a_100009814033_100016989825 [0,0,0,0,0,1|3,0,0]=4 649 B18R2.2417296 CC(=O)C(C)SCc1cccc2c1ccnc2 62a_100016989825_100009814033 [0,0,0,0,0,1|3,0,0]=4 650 B18R2.2417296 CC(=O)C(C)SCc1cccc2c1nccc2 62a_100009814033_100000241032 [0,0,0,0,0,1|3,0,0]=4 651 B18R2.2417296 CC(=O)C(C)SCc1ccnc2c1cccc2 62a_100009814033_100015192512 [0,0,0,0,0,1|3,0,0]=4 652 B18R2.2417296 CC(=O)C(C)SCc1ccnc2c1cccc2 62a_100015192512_100009814033 [0,0,0,0,0,1|3,0,0]=4 653 B18R2.2417296 CC(=O)C(C)SCc1nccc2c1cccc2 62a_100000033776_100009814033 [0,0,0,0,0,1|3,0,0]=4 654 B18R2.2417296 CC(=O)C(C)SCc1nccc2c1cccc2 62a_100009814033_100000033776 [0,0,0,0,0,1|3,0,0]=4 655 B18R2.2417296 CC(NCc1cccc2c1cccc2)C(=O)N 34a_100000753325_100000702099 [0,0,0,0,0,1|2,0,0]=3 656 B18R2.2417296 CC(OCc1cccc2c1cccc2)C(=O)N 34a_100011216843_100000702099 [0,0,0,0,0,1|2,0,0]=3 657 B18R2.2417296 CC(OCc1cccc2c1cccc2)C(=O)N 7a_100011216843_100000702099 [0,0,0,0,0,1|2,0,0]=3 658 B18R2.2417296 CC(OCc1cccc2c1cccn2)C(=O)N 34a_100000709871_100000702099 [0,0,0,0,0,1|3,0,0]=4 659 B18R2.2417296 CC(OCc1cccc2c1nccc2)C(=O)N 34a_100011303629_100000702099 [0,0,0,0,0,1|3,0,0]=4 660 B18R2.2417296 CC(SCc1cccc2c1cccc2)C(=O)N 62a_100000702099_100000188474 [0,0,0,0,0,1|2,0,0]=3 661 B18R2.2417296 CC(SCc1cccc2c1cccc2)C(=O)N 62a_100011261445_100000702099 [0,0,0,0,0,1|2,0,0]=3 662 B18R2.2417296 CC(SCc1cccc2c1ccnc2)C(=O)N 62a_100000702099_100016989825 [0,0,0,0,0,1|3,0,0]=4 663 B18R2.2417296 CC(SCc1cccc2c1ccnc2)C(=O)N 62a_100016989825_100000702099 [0,0,0,0,0,1|3,0,0]=4 664 B18R2.2417296 CC(SCc1cccc2c1nccc2)C(=O)N 62a_100000702099_100000241032 [0,0,0,0,0,1|3,0,0]=4 665 B18R2.2417296 CC(SCc1ccnc2c1cccc2)C(=O)N 62a_100000702099_100015192512 [0,0,0,0,0,1|3,0,0]=4 666 B18R2.2417296 CC(SCc1ccnc2c1cccc2)C(=O)N 62a_100015192512_100000702099 [0,0,0,0,0,1|3,0,0]=4 667 B18R2.2417296 CC(SCc1nccc2c1cccc2)C(=O)N 62a_100000033776_100000702099 [0,0,0,0,0,1|3,0,0]=4 668 B18R2.2417296 CC(SCc1nccc2c1cccc2)C(=O)N 62a_100000702099_100000033776 [0,0,0,0,0,1|3,0,0]=4 669 B18R2.2417296 C[C@@H](NCc1cccc2c1cccc2)C(=O)N 2230a_100000119354_100011261445 [0,0,0,0,0,1|2,0,0]=3 670 B18R2.2417296 C[C@@H](NCc1cccc2c1cccc2)C(=O)N 270004a_100000119354_100000210074 [0,0,0,0,0,1|2,0,0]=3 671 B18R2.2417296 C[C@@H](NCc1cccc2c1cccc2)C(=O)N 34a_100000119354_100011261445 [0,0,0,0,0,1|2,0,0]=3 672 B18R2.2417296 C[C@@H](NCc1cccc2c1cccn2)C(=O)N 270004a_100000119354_100000708479 [0,0,0,0,0,1|3,0,0]=4 673 B18R2.2417296 C[C@@H](NCc1cccc2c1ccnc2)C(=O)N 2230a_100000119354_100016989825 [0,0,0,0,0,1|3,0,0]=4 674 B18R2.2417296 C[C@@H](NCc1cccc2c1ccnc2)C(=O)N 270004a_100000119354_100000750165 [0,0,0,0,0,1|3,0,0]=4 675 B18R2.2417296 C[C@@H](NCc1cccc2c1ccnc2)C(=O)N 34a_100000119354_100016989825 [0,0,0,0,0,1|3,0,0]=4 676 B18R2.2417296 C[C@@H](NCc1cccc2c1cncc2)C(=O)N 270004a_100000119354_100011934574 [0,0,0,0,0,1|3,0,0]=4 677 B18R2.2417296 C[C@@H](NCc1cccc2c1nccc2)C(=O)N 2230a_100000119354_100000241032 [0,0,0,0,0,1|3,0,0]=4 678 B18R2.2417296 C[C@@H](NCc1cccc2c1nccc2)C(=O)N 270004a_100000119354_100000239888 [0,0,0,0,0,1|3,0,0]=4 679 B18R2.2417296 C[C@@H](NCc1cccc2c1nccc2)C(=O)N 34a_100000119354_100000241032 [0,0,0,0,0,1|3,0,0]=4 680 B18R2.2417296 C[C@@H](NCc1ccnc2c1cccc2)C(=O)N 2230a_100000119354_100015192512 [0,0,0,0,0,1|3,0,0]=4 681 B18R2.2417296 C[C@@H](NCc1ccnc2c1cccc2)C(=O)N 34a_100000119354_100015192512 [0,0,0,0,0,1|3,0,0]=4 682 B18R2.2417296 C[C@@H](NCc1cncc2c1cccc2)C(=O)N 270004a_100000119354_100000684730 [0,0,0,0,0,1|3,0,0]=4 683 B18R2.2417296 C[C@@H](NCc1nccc2c1cccc2)C(=O)N 2230a_100000119354_100000033776 [0,0,0,0,0,1|3,0,0]=4 684 B18R2.2417296 C[C@@H](NCc1nccc2c1cccc2)C(=O)N 270004a_100000119354_100011361464 [0,0,0,0,0,1|3,0,0]=4 685 B18R2.2417296 C[C@@H](NCc1nccc2c1cccc2)C(=O)N 34a_100000119354_100000033776 [0,0,0,0,0,1|3,0,0]=4 686 B18R2.2417296 C[C@@H](OCc1cccc2c1cccc2)C(=O)N 34a_100000731257_100011261445 [0,0,0,0,0,1|2,0,0]=3 687 B18R2.2417296 C[C@@H](OCc1cccc2c1cccc2)C(=O)N 7a_100000731257_100011261445 [0,0,0,0,0,1|2,0,0]=3 688 B18R2.2417296 C[C@@H](OCc1cccc2c1ccnc2)C(=O)N 34a_100000731257_100016989825 [0,0,0,0,0,1|3,0,0]=4 689 B18R2.2417296 C[C@@H](OCc1cccc2c1ccnc2)C(=O)N 7a_100000731257_100016989825 [0,0,0,0,0,1|3,0,0]=4 690 B18R2.2417296 C[C@@H](OCc1cccc2c1nccc2)C(=O)N 34a_100000731257_100000241032 [0,0,0,0,0,1|3,0,0]=4 691 B18R2.2417296 C[C@@H](OCc1cccc2c1nccc2)C(=O)N 7a_100000731257_100000241032 [0,0,0,0,0,1|3,0,0]=4 692 B18R2.2417296 C[C@@H](OCc1ccnc2c1cccc2)C(=O)N 34a_100000731257_100015192512 [0,0,0,0,0,1|3,0,0]=4 693 B18R2.2417296 C[C@@H](OCc1ccnc2c1cccc2)C(=O)N 7a_100000731257_100015192512 [0,0,0,0,0,1|3,0,0]=4 694 B18R2.2417296 C[C@@H](OCc1nccc2c1cccc2)C(=O)N 34a_100000731257_100000033776 [0,0,0,0,0,1|3,0,0]=4 695 B18R2.2417296 C[C@@H](OCc1nccc2c1cccc2)C(=O)N 7a_100000731257_100000033776 [0,0,0,0,0,1|3,0,0]=4 696 B18R2.2417296 C[C@H](NCc1cccc2c1cccc2)C(=O)O 269956a_100000743915_100000188474 [0,0,0,0,0,1|1,0,0]=2 697 B18R2.2417296 C[C@H](NCc1cccc2c1ccnc2)C(=O)O 269956a_100000743915_100016989825 [0,0,0,0,0,1|2,0,0]=3 698 B18R2.2417296 C[C@H](NCc1cccc2c1nccc2)C(=O)O 269956a_100000743915_100000241032 [0,0,0,0,0,1|2,0,0]=3 699 B18R2.2417296 C[C@H](NCc1ccnc2c1cccc2)C(=O)O 269956a_100000743915_100015192512 [0,0,0,0,0,1|2,0,0]=3 700 B18R2.2417296 C[C@H](NCc1nccc2c1cccc2)C(=O)O 269956a_100000743915_100000033776 [0,0,0,0,0,1|2,0,0]=3 701 B18R2.2417296 C[C@H](OCc1cccc2c1cccc2)C(=O)[O-] 7a_217856618621_100011261445 [0,0,0,0,0,1|1,0,1]=3 702 B18R2.2417296 C[C@H](OCc1cccc2c1ccnc2)C(=O)[O-] 7a_217856618621_100016989825 [0,0,0,0,0,1|2,0,1]=4 703 B18R2.2417296 C[C@H](OCc1cccc2c1nccc2)C(=O)[O-] 7a_217856618621_100000241032 [0,0,0,0,0,1|2,0,1]=4 704 B18R2.2417296 C[C@H](OCc1ccnc2c1cccc2)C(=O)[O-] 7a_217856618621_100015192512 [0,0,0,0,0,1|2,0,1]=4 705 B18R2.2417296 C[C@H](OCc1nccc2c1cccc2)C(=O)[O-] 7a_217856618621_100000033776 [0,0,0,0,0,1|2,0,1]=4 706 B18R2.2417296 NC(=O)C(=O)NCc1cccc2c1cccc2 240690a_100000753325_100011215815 [0,0,0,0,0,1|2,0,1]=4 707 B18R2.2417296 NC(=O)C(F)NCc1cccc2c1cccc2 34a_100000753325_100009813875 [0,0,0,0,0,1|2,0,0]=3 708 B18R2.2417296 NC(=O)C(F)OCc1cccc2c1cccc2 34a_100011216843_100009813875 [0,0,0,0,0,1|2,0,0]=3 709 B18R2.2417296 NC(=O)C(F)OCc1cccc2c1cccc2 7a_100011216843_100009813875 [0,0,0,0,0,1|2,0,0]=3 710 B18R2.2417296 NC(=O)C(F)OCc1cccc2c1cccn2 34a_100000709871_100009813875 [0,0,0,0,0,1|3,0,0]=4 711 B18R2.2417296 NC(=O)C(F)OCc1cccc2c1nccc2 34a_100011303629_100009813875 [0,0,0,0,0,1|3,0,0]=4 712 B18R2.2417296 NC(=O)C(F)SCc1cccc2c1cccc2 62a_100009813875_100000188474 [0,0,0,0,0,1|2,0,0]=3 713 B18R2.2417296 NC(=O)C(F)SCc1cccc2c1cccc2 62a_100011261445_100009813875 [0,0,0,0,0,1|2,0,0]=3 714 B18R2.2417296 NC(=O)C(F)SCc1cccc2c1ccnc2 62a_100009813875_100016989825 [0,0,0,0,0,1|3,0,0]=4 715 B18R2.2417296 NC(=O)C(F)SCc1cccc2c1ccnc2 62a_100016989825_100009813875 [0,0,0,0,0,1|3,0,0]=4 716 B18R2.2417296 NC(=O)C(F)SCc1cccc2c1nccc2 62a_100009813875_100000241032 [0,0,0,0,0,1|3,0,0]=4 717 B18R2.2417296 NC(=O)C(F)SCc1ccnc2c1cccc2 62a_100009813875_100015192512 [0,0,0,0,0,1|3,0,0]=4 718 B18R2.2417296 NC(=O)C(F)SCc1ccnc2c1cccc2 62a_100015192512_100009813875 [0,0,0,0,0,1|3,0,0]=4 719 B18R2.2417296 NC(=O)C(F)SCc1nccc2c1cccc2 62a_100000033776_100009813875 [0,0,0,0,0,1|3,0,0]=4 720 B18R2.2417296 NC(=O)C(F)SCc1nccc2c1cccc2 62a_100009813875_100000033776 [0,0,0,0,0,1|3,0,0]=4 721 B18R2.2417296 O=C([O-])C(F)NCc1cccc2c1cccc2 34a_100000753325_100020610796 [0,0,0,0,0,1|1,0,1]=3 722 B18R2.2417296 O=C([O-])C(F)OCc1cccc2c1cccc2 34a_100011216843_100020610796 [0,0,0,0,0,1|1,0,1]=3 723 B18R2.2417296 O=C([O-])C(F)OCc1cccc2c1cccn2 34a_100000709871_100020610796 [0,0,0,0,0,1|2,0,1]=4 724 B18R2.2417296 O=C([O-])C(F)OCc1cccc2c1nccc2 34a_100011303629_100020610796 [0,0,0,0,0,1|2,0,1]=4 725 B18R2.2417296 O=C([O-])C(F)SCc1cccc2c1cccc2 62a_100011261445_100020610796 [0,0,0,0,0,1|1,0,1]=3 726 B18R2.2417296 O=C([O-])C(F)SCc1cccc2c1cccc2 62a_100020610796_100000188474 [0,0,0,0,0,1|1,0,1]=3 727 B18R2.2417296 O=C([O-])C(F)SCc1cccc2c1ccnc2 62a_100016989825_100020610796 [0,0,0,0,0,1|2,0,1]=4 728 B18R2.2417296 O=C([O-])C(F)SCc1cccc2c1ccnc2 62a_100020610796_100016989825 [0,0,0,0,0,1|2,0,1]=4 729 B18R2.2417296 O=C([O-])C(F)SCc1cccc2c1nccc2 62a_100020610796_100000241032 [0,0,0,0,0,1|2,0,1]=4 730 B18R2.2417296 O=C([O-])C(F)SCc1ccnc2c1cccc2 62a_100015192512_100020610796 [0,0,0,0,0,1|2,0,1]=4 731 B18R2.2417296 O=C([O-])C(F)SCc1ccnc2c1cccc2 62a_100020610796_100015192512 [0,0,0,0,0,1|2,0,1]=4 732 B18R2.2417296 O=C([O-])C(F)SCc1nccc2c1cccc2 62a_100000033776_100020610796 [0,0,0,0,0,1|2,0,1]=4 733 B18R2.2417296 O=C([O-])C(F)SCc1nccc2c1cccc2 62a_100020610796_100000033776 [0,0,0,0,0,1|2,0,1]=4 734 B18R2.2880857 CC(=O)OC(C)Sc1cccc2c1cccc2 62a_100009818208_100000210605 [0,0,0,0,0,1|3,0,0]=4 735 B18R2.2880857 CN(CC(=O)N)Cc1cccc2c1cccc2 2230a_100000739694_100011261445 [0,0,0,0,0,1|3,0,0]=4 736 B18R2.2880857 CN(CC(=O)N)Cc1cccc2c1cccc2 2230a_100000741213_100000747473 [0,0,0,0,0,1|3,0,0]=4 737 B18R2.2880857 CN(CC(=O)N)Cc1cccc2c1cccc2 269982a_100000741213_100000187820 [0,0,0,0,0,1|3,0,0]=4 738 B18R2.2880857 CN(CC(=O)N)Cc1cccc2c1cccc2 270004a_100000739694_100000210074 [0,0,0,0,0,1|3,0,0]=4 739 B18R2.2880857 CN(CC(=O)O)Cc1cccc2c1cccc2 269956a_100000746989_100000188474 [0,0,0,0,0,1|2,0,0]=3 740 B18R2.2880857 CN(CC(=O)O)Cc1cccc2c1ccnc2 269956a_100000746989_100016989825 [0,0,0,0,0,1|3,0,0]=4 741 B18R2.2880857 CN(CC(=O)O)Cc1cccc2c1nccc2 269956a_100000746989_100000241032 [0,0,0,0,0,1|3,0,0]=4 742 B18R2.2880857 CN(CC(=O)O)Cc1ccnc2c1cccc2 269956a_100000746989_100015192512 [0,0,0,0,0,1|3,0,0]=4 743 B18R2.2880857 CN(CC(=O)O)Cc1nccc2c1cccc2 269956a_100000746989_100000033776 [0,0,0,0,0,1|3,0,0]=4 744 B18R2.2880857 CN(CC(=O)[O-])Cc1cccc2c1cccc2 269982a_100000741213_100020667443 [0,0,0,0,0,1|2,0,1]=4 745 B18R2.2880857 NC(=O)CC(=O)Cc1cccc2c1cccc2 1458a_100000186155_100000187820 [0,0,0,0,0,1|2,0,1]=4 746 B18R2.2880857 NC(=O)CC(=O)Cc1cccc2c1cccc2 1458a_100134613110_100000188474 [0,0,0,0,0,1|2,0,1]=4 747 B18R2.2880857 O=C([O-])CC(=O)Cc1cccc2c1cccc2 1458a_100000186155_100020667443 [0,0,0,0,0,1|1,0,2]=4 748 B15R2.18471 C=CCNc1cccc2c1cccc2 34a_100000185869_100015514636 [2,0,0,0,0,0|2,0,0]=4 749 B15R2.18471 C=CCOc1cccc2c1cccc2 34a_100000210388_100015514636 [2,0,0,0,0,0|2,0,0]=4 750 B15R2.18471 C=CCOc1cccc2c1cccc2 7a_100000210388_100015514636 [2,0,0,0,0,0|2,0,0]=4 751 B15R2.18471 C=CCSc1cccc2c1cccc2 62a_100000210623_100000210605 [2,0,0,0,0,0|2,0,0]=4 752 B15R2.18471 CCCCc1cccc2c1cccc2 271570a_100020621405_100000210605 [2,0,0,0,0,0|1,0,1]=4 753 B15R2.18471 CNCCc1cccc2c1cccc2 2230a_100000751862_200000210301 [2,0,0,0,0,0|2,0,0]=4 754 B15R2.18471 CNCCc1cccc2c1cccc2 2230a_106832991635_100011290781 [2,0,0,0,0,0|2,0,0]=4 755 B15R2.18471 CNCCc1cccc2c1cccc2 34a_100000751862_200000210301 [2,0,0,0,0,0|2,0,0]=4 756 B15R2.18471 CNCCc1cccc2c1cccc2 34a_100102657272_100011290781 [2,0,0,0,0,0|2,0,0]=4 757 B15R2.18471 CNCCc1cccc2c1cccc2 7a_106832991635_100011290781 [2,0,0,0,0,0|2,0,0]=4 758 B15R2.18471 COCCc1cccc2c1cccc2 34a_100011219628_200000210301 [2,0,0,0,0,0|2,0,0]=4 759 B15R2.18471 COCCc1cccc2c1cccc2 34a_100138415774_100011290781 [2,0,0,0,0,0|2,0,0]=4 760 B15R2.18471 COCCc1cccc2c1cccc2 7a_100011219628_200000210301 [2,0,0,0,0,0|2,0,0]=4 761 B15R2.18471 CSCCc1cccc2c1cccc2 62a_100011290781_200000210301 [2,0,0,0,0,0|2,0,0]=4 762 B15R2.18471 CSCCc1cccc2c1cccc2 62a_200000210301_100011290781 [2,0,0,0,0,0|2,0,0]=4 763 B15R2.18471 O=CCNc1cccc2c1cccc2 34a_100000185869_200009817547 [2,0,0,0,0,0|1,0,0]=3 764 B15R2.18471 O=CCNc1cccc2c1cccn2 34a_100000183906_200009817547 [2,0,0,0,0,0|2,0,0]=4 765 B15R2.18471 O=CCNc1cccc2c1nccc2 34a_100000181377_200009817547 [2,0,0,0,0,0|2,0,0]=4 766 B15R2.18471 O=CCOc1cccc2c1cccc2 34a_100000210388_200009817547 [2,0,0,0,0,0|1,0,0]=3 767 B15R2.18471 O=CCOc1cccc2c1cccc2 7a_100000210388_200015260668 [2,0,0,0,0,0|1,0,0]=3 768 B15R2.18471 O=CCOc1cccc2c1cccn2 34a_100011197808_200009817547 [2,0,0,0,0,0|2,0,0]=4 769 B15R2.18471 O=CCOc1cccc2c1ccnc2 34a_100011218533_200009817547 [2,0,0,0,0,0|2,0,0]=4 770 B15R2.18471 O=CCOc1cccc2c1cncc2 34a_103624766955_200009817547 [2,0,0,0,0,0|2,0,0]=4 771 B15R2.18471 O=CCOc1cccc2c1nccc2 34a_100000056035_200009817547 [2,0,0,0,0,0|2,0,0]=4 772 B15R2.18471 O=CCOc1cncc2c1cccc2 34a_100000066178_200009817547 [2,0,0,0,0,0|2,0,0]=4 773 B15R2.18471 O=CCOc1cncc2c1cccc2 7a_100000066178_200015260668 [2,0,0,0,0,0|2,0,0]=4 774 B15R2.18471 O=CCOc1nccc2c1cccc2 34a_102531767632_200009817547 [2,0,0,0,0,0|2,0,0]=4 775 B15R2.18471 O=CCSc1cccc2c1cccc2 62a_200015260668_100000210605 [2,0,0,0,0,0|1,0,0]=3 776 B15R2.18471 O=CCSc1cccc2c1cccn2 62a_100011290932_200015260668 [2,0,0,0,0,0|2,0,0]=4 777 B15R2.18471 O=CCSc1cccc2c1cccn2 62a_200015260668_100011290932 [2,0,0,0,0,0|2,0,0]=4 778 B15R2.18471 O=CCSc1cccc2c1ccnc2 62a_100000186358_200015260668 [2,0,0,0,0,0|2,0,0]=4 779 B15R2.18471 O=CCSc1cccc2c1ccnc2 62a_200015260668_100000186358 [2,0,0,0,0,0|2,0,0]=4 780 B15R2.18471 O=CCSc1cccc2c1cncc2 62a_100000685578_200015260668 [2,0,0,0,0,0|2,0,0]=4 781 B15R2.18471 O=CCSc1cccc2c1cncc2 62a_200015260668_100000685578 [2,0,0,0,0,0|2,0,0]=4 782 B15R2.18471 O=CCSc1cccc2c1nccc2 62a_200015260668_100011215545 [2,0,0,0,0,0|2,0,0]=4 783 B15R2.18471 O=CCSc1ccnc2c1cccc2 62a_100011458314_200015260668 [2,0,0,0,0,0|2,0,0]=4 784 B15R2.18471 O=CCSc1ccnc2c1cccc2 62a_200015260668_100011215880 [2,0,0,0,0,0|2,0,0]=4 785 B15R2.18471 O=CCSc1cncc2c1cccc2 62a_100000187577_200015260668 [2,0,0,0,0,0|2,0,0]=4 786 B15R2.18471 O=CCSc1cncc2c1cccc2 62a_200015260668_100000187577 [2,0,0,0,0,0|2,0,0]=4 787 B15R2.18471 O=CCSc1nccc2c1cccc2 62a_100011934041_200015260668 [2,0,0,0,0,0|2,0,0]=4 788 B15R2.18471 O=CCSc1nccc2c1cccc2 62a_200015260668_100011934041 [2,0,0,0,0,0|2,0,0]=4 789 B15R2.18471 OCCNc1cccc2c1cccc2 34a_100000185869_100000211926 [2,0,0,0,0,0|1,0,1]=4 790 B15R2.18471 OCCOc1cccc2c1cccc2 34a_100000210388_100000211926 [2,0,0,0,0,0|1,0,1]=4 791 B15R2.18471 OCCOc1cccc2c1cccc2 7a_100000210388_100000211926 [2,0,0,0,0,0|1,0,1]=4 792 B15R2.18471 OCCSc1cccc2c1cccc2 62a_100000211926_100000210605 [2,0,0,0,0,0|1,0,1]=4 793 B15R2.18471 [13CH3]NCCc1cccc2c1cccc2 2230a_100000751862_200025704644 [2,0,0,0,0,0|2,0,0]=4 794 B15R2.18471 [13CH3]NCCc1cccc2c1cccc2 34a_100000751862_200025704644 [2,0,0,0,0,0|2,0,0]=4 795 B15R2.18471 [13CH3]OCCc1cccc2c1cccc2 34a_100011219628_200025704644 [2,0,0,0,0,0|2,0,0]=4 796 B15R2.18471 [13CH3]OCCc1cccc2c1cccc2 7a_100011219628_200025704644 [2,0,0,0,0,0|2,0,0]=4 797 B15R2.18471 [13CH3]SCCc1cccc2c1cccc2 62a_100011290781_200025704644 [2,0,0,0,0,0|2,0,0]=4 798 B15R2.18471 [13CH3]SCCc1cccc2c1cccc2 62a_200025704644_100011290781 [2,0,0,0,0,0|2,0,0]=4 799 B15R2.68122 CC(=O)Cc1cccc2c1cccc2 1458a_100000070787_100000188474 [2,0,0,0,0,0|1,0,1]=4 800 B15R2.68122 CC(=O)Cc1cccc2c1cccc2 1458a_100000186155_200000210301 [2,0,0,0,0,0|1,0,1]=4 801 B15R2.68122 [13CH3]C(=O)Cc1cccc2c1cccc2 1458a_100000186155_200025704644 [2,0,0,0,0,0|1,0,1]=4 802 B17R1.1272 C=CCOc1cccc(c1)C[C@H](N)C(=O)OC 34a_100016991376_100015514636 [0,1,1,0,0,0|1,0,1]=4 803 B17R1.1272 C=CCSc1cccc(c1)CC(N)C(=O)OC 62a_100000210623_100102946621 [0,1,1,0,0,0|1,0,1]=4 804 B17R1.1272 C=CCSc1cccc(c1)CC(N)C(=O)OC 62a_100102946621_100000210623 [0,1,1,0,0,0|1,0,1]=4 805 B17R1.1782 COC(=O)[C@H](N)COC/C=C/c1ccccc1 34a_100000003586_100016265936 [0,1,1,0,0,0|1,0,1]=4 806 B17R2.281293 O=CC(C=O)Nc1cccc2c1cccc2 34a_100000185869_100000736813 [1,1,0,0,0,0|2,0,0]=4 807 B17R2.281293 O=CC(C=O)Oc1cccc2c1cccc2 34a_100000210388_100000736813 [1,1,0,0,0,0|2,0,0]=4 808 B17R2.281293 O=CC(C=O)Sc1cccc2c1cccc2 62a_100000736813_100000210605 [1,1,0,0,0,0|2,0,0]=4 809 B17R2.322318 CN(CC=O)Cc1cccc2c1cccc2 2230a_100000741213_200015260668 [1,1,0,0,0,0|2,0,0]=4 810 B17R2.322318 CN(CC=O)Cc1cccc2c1cccc2 269982a_100000741213_200015260668 [1,1,0,0,0,0|2,0,0]=4 811 B17R2.3462 NC(=O)CNc1cccc2c1ccc(c2)Br 34a_100010090037_100000187820 [1,1,0,0,0,0|2,0,0]=4 812 B17R2.3462 NC(=O)CNc1cccc2c1ccc(c2)O 34a_100000034668_100000187820 [1,1,0,0,0,0|2,0,0]=4 813 B17R2.3462 NC(=O)COc1cccc2c1ccc(c2)Br 34a_100010202202_100000187820 [1,1,0,0,0,0|2,0,0]=4 814 B17R2.3462 NC(=O)COc1cccc2c1ccc(c2)Br 7a_100010202202_100000187820 [1,1,0,0,0,0|2,0,0]=4 815 B17R2.3462 NC(=O)COc1cccc2c1ccc(c2)F 34a_100009846233_100000187820 [1,1,0,0,0,0|2,0,0]=4 816 B17R2.3462 NC(=O)COc1cccc2c1ccc(c2)F 7a_100009846233_100000187820 [1,1,0,0,0,0|2,0,0]=4 817 B17R2.3462 NC(=O)COc1cccc2c1ccc(c2)N 34a_100000035793_100000187820 [1,1,0,0,0,0|2,0,0]=4 818 B17R2.3462 Nc1ccc2c(cccc2c1)OCC(=O)[O-] 34a_100000035793_100020667443 [1,1,0,0,0,0|1,0,1]=4 819 B17R2.3462 O=C([O-])CNc1cccc2c1ccc(c2)Br 34a_100010090037_100020667443 [1,1,0,0,0,0|1,0,1]=4 820 B17R2.3462 O=C([O-])CNc1cccc2c1ccc(c2)O 34a_100000034668_100020667443 [1,1,0,0,0,0|1,0,1]=4 821 B17R2.3462 O=C([O-])COc1cccc2c1ccc(c2)Br 34a_100010202202_100020667443 [1,1,0,0,0,0|1,0,1]=4 822 B17R2.3462 O=C([O-])COc1cccc2c1ccc(c2)F 34a_100009846233_100020667443 [1,1,0,0,0,0|1,0,1]=4 823 B17R2.5014 NC(=O)CNc1cc(cc2c1cccc2)Br 34a_100010171453_100000187820 [1,1,0,0,0,0|2,0,0]=4 824 B17R2.5014 NC(=O)COc1cc(cc2c1cccc2)Br 34a_100010089979_100000187820 [1,1,0,0,0,0|2,0,0]=4 825 B17R2.5014 NC(=O)COc1cc(cc2c1cccc2)Br 7a_100010089979_100000187820 [1,1,0,0,0,0|2,0,0]=4 826 B17R2.5014 NC(=O)CSc1cc(cc2c1cccc2)N 62a_100000747473_100010089974 [1,1,0,0,0,0|2,0,0]=4 827 B17R2.5014 NC(=O)CSc1cc(cc2c1cccc2)N 62a_100010089974_100000747473 [1,1,0,0,0,0|2,0,0]=4 828 B17R2.5014 NC(=O)CSc1cc(cc2c1cccc2)O 62a_100000747473_100010001680 [1,1,0,0,0,0|2,0,0]=4 829 B17R2.5014 Nc1cc(c2ccccc2c1)SCC(=O)[O-] 62a_100010089974_100020667443 [1,1,0,0,0,0|1,0,1]=4 830 B17R2.5014 Nc1cc(c2ccccc2c1)SCC(=O)[O-] 62a_100020667443_100010089974 [1,1,0,0,0,0|1,0,1]=4 831 B17R2.5014 O=C([O-])CNc1cc(cc2c1cccc2)Br 34a_100010171453_100020667443 [1,1,0,0,0,0|1,0,1]=4 832 B17R2.5014 O=C([O-])COc1cc(cc2c1cccc2)Br 34a_100010089979_100020667443 [1,1,0,0,0,0|1,0,1]=4 833 B17R2.5014 O=C([O-])CSc1cc(cc2c1cccc2)O 62a_100020667443_100010001680 [1,1,0,0,0,0|1,0,1]=4 834 B17R2.5385 Cc1ccc2ccccc2c1NCC(=O)N 34a_100000688109_100000187820 [1,1,0,0,0,0|2,0,0]=4 835 B17R2.5385 Cc1ccc2ccccc2c1NCC(=O)[O-] 34a_100000688109_100020667443 [1,1,0,0,0,0|1,0,1]=4 836 B17R2.5385 Cc1ccc2ccccc2c1OCC(=O)N 34a_100000039261_100000187820 [1,1,0,0,0,0|2,0,0]=4 837 B17R2.5385 Cc1ccc2ccccc2c1OCC(=O)N 7a_100000039261_100000187820 [1,1,0,0,0,0|2,0,0]=4 838 B17R2.5385 Cc1ccc2ccccc2c1OCC(=O)[O-] 34a_100000039261_100020667443 [1,1,0,0,0,0|1,0,1]=4 839 B17R2.5385 Cc1ccc2ccccc2c1SCC(=O)N 62a_100000747473_100000759710 [1,1,0,0,0,0|2,0,0]=4 840 B17R2.5385 Cc1ccc2ccccc2c1SCC(=O)N 62a_100000759710_100000747473 [1,1,0,0,0,0|2,0,0]=4 841 B17R2.5385 Cc1ccc2ccccc2c1SCC(=O)[O-] 62a_100000759710_100020667443 [1,1,0,0,0,0|1,0,1]=4 842 B17R2.5385 Cc1ccc2ccccc2c1SCC(=O)[O-] 62a_100020667443_100000759710 [1,1,0,0,0,0|1,0,1]=4 843 B17R2.5385 NC(=O)CNc1c(ccc2c1cccc2)Br 34a_100009817101_100000187820 [1,1,0,0,0,0|2,0,0]=4 844 B17R2.5385 NC(=O)CNc1c(ccc2c1cccc2)Cl 34a_200009860907_100000187820 [1,1,0,0,0,0|2,0,0]=4 845 B17R2.5385 NC(=O)CNc1c(ccc2c1cccc2)O 34a_100000007056_100000187820 [1,1,0,0,0,0|2,0,0]=4 846 B17R2.5385 NC(=O)COc1c(ccc2c1cccc2)Br 34a_100009996032_100000187820 [1,1,0,0,0,0|2,0,0]=4 847 B17R2.5385 NC(=O)COc1c(ccc2c1cccc2)Br 7a_100009996032_100000187820 [1,1,0,0,0,0|2,0,0]=4 848 B17R2.5385 NC(=O)COc1c(ccc2c1cccc2)N 34a_100000007060_100000187820 [1,1,0,0,0,0|2,0,0]=4 849 B17R2.5385 NC(=O)CSc1c(ccc2c1cccc2)Br 62a_100000747473_100010090040 [1,1,0,0,0,0|2,0,0]=4 850 B17R2.5385 NC(=O)CSc1c(ccc2c1cccc2)Br 62a_100010090040_100000747473 [1,1,0,0,0,0|2,0,0]=4 851 B17R2.5385 NC(=O)CSc1c(ccc2c1cccc2)N 62a_100000705303_100000747473 [1,1,0,0,0,0|2,0,0]=4 852 B17R2.5385 NC(=O)CSc1c(ccc2c1cccc2)N 62a_100000747473_100000705303 [1,1,0,0,0,0|2,0,0]=4 853 B17R2.5385 NC(=O)CSc1c(ccc2c1cccc2)O 62a_100000747473_100000183829 [1,1,0,0,0,0|2,0,0]=4 854 B17R2.5385 Nc1ccc2ccccc2c1OCC(=O)[O-] 34a_100000007060_100020667443 [1,1,0,0,0,0|1,0,1]=4 855 B17R2.5385 Nc1ccc2ccccc2c1SCC(=O)[O-] 62a_100000705303_100020667443 [1,1,0,0,0,0|1,0,1]=4 856 B17R2.5385 Nc1ccc2ccccc2c1SCC(=O)[O-] 62a_100020667443_100000705303 [1,1,0,0,0,0|1,0,1]=4 857 B17R2.5385 O=C([O-])CNc1c(ccc2c1cccc2)Br 34a_100009817101_100020667443 [1,1,0,0,0,0|1,0,1]=4 858 B17R2.5385 O=C([O-])CNc1c(ccc2c1cccc2)Cl 34a_200009860907_100020667443 [1,1,0,0,0,0|1,0,1]=4 859 B17R2.5385 O=C([O-])CNc1c(ccc2c1cccc2)O 34a_100000007056_100020667443 [1,1,0,0,0,0|1,0,1]=4 860 B17R2.5385 O=C([O-])COc1c(ccc2c1cccc2)Br 34a_100009996032_100020667443 [1,1,0,0,0,0|1,0,1]=4 861 B17R2.5385 O=C([O-])CSc1c(ccc2c1cccc2)Br 62a_100010090040_100020667443 [1,1,0,0,0,0|1,0,1]=4 862 B17R2.5385 O=C([O-])CSc1c(ccc2c1cccc2)Br 62a_100020667443_100010090040 [1,1,0,0,0,0|1,0,1]=4 863 B17R2.5385 O=C([O-])CSc1c(ccc2c1cccc2)O 62a_100020667443_100000183829 [1,1,0,0,0,0|1,0,1]=4 864 B17R2.19944 Cc1ccc2cccc(c2c1)OCC(=O)N 34a_100000040781_100000187820 [1,1,0,0,0,0|2,0,0]=4 865 B17R2.19944 Cc1ccc2cccc(c2c1)OCC(=O)N 7a_100000040781_100000187820 [1,1,0,0,0,0|2,0,0]=4 866 B17R2.19944 Cc1ccc2cccc(c2c1)OCC(=O)[O-] 34a_100000040781_100020667443 [1,1,0,0,0,0|1,0,1]=4 867 B17R2.19944 NC(=O)CNc1cccc2c1cc(cc2)Br 34a_100010090012_100000187820 [1,1,0,0,0,0|2,0,0]=4 868 B17R2.19944 NC(=O)CNc1cccc2c1cc(cc2)O 34a_100000034012_100000187820 [1,1,0,0,0,0|2,0,0]=4 869 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)Br 34a_100010089991_100000187820 [1,1,0,0,0,0|2,0,0]=4 870 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)Br 7a_100010089991_100000187820 [1,1,0,0,0,0|2,0,0]=4 871 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)Cl 34a_100009840344_100000187820 [1,1,0,0,0,0|2,0,0]=4 872 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)Cl 7a_100009840344_100000187820 [1,1,0,0,0,0|2,0,0]=4 873 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)F 34a_100009881884_100000187820 [1,1,0,0,0,0|2,0,0]=4 874 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)F 7a_100009881884_100000187820 [1,1,0,0,0,0|2,0,0]=4 875 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)N 34a_100132313934_100000187820 [1,1,0,0,0,0|2,0,0]=4 876 B17R2.19944 NC(=O)COc1cccc2c1cc(cc2)N 7a_100132313934_100000187820 [1,1,0,0,0,0|2,0,0]=4 877 B17R2.19944 NC(=O)CSc1cccc2c1cc(cc2)O 62a_100000747473_100010169565 [1,1,0,0,0,0|2,0,0]=4 878 B17R2.19944 Nc1ccc2cccc(c2c1)OCC(=O)[O-] 34a_100132313934_100020667443 [1,1,0,0,0,0|1,0,1]=4 879 B17R2.19944 O=C([O-])CNc1cccc2c1cc(cc2)Br 34a_100010090012_100020667443 [1,1,0,0,0,0|1,0,1]=4 880 B17R2.19944 O=C([O-])CNc1cccc2c1cc(cc2)O 34a_100000034012_100020667443 [1,1,0,0,0,0|1,0,1]=4 881 B17R2.19944 O=C([O-])COc1cccc2c1cc(cc2)Br 34a_100010089991_100020667443 [1,1,0,0,0,0|1,0,1]=4 882 B17R2.19944 O=C([O-])COc1cccc2c1cc(cc2)Cl 34a_100009840344_100020667443 [1,1,0,0,0,0|1,0,1]=4 883 B17R2.19944 O=C([O-])COc1cccc2c1cc(cc2)F 34a_100009881884_100020667443 [1,1,0,0,0,0|1,0,1]=4 884 B17R2.19944 O=C([O-])CSc1cccc2c1cc(cc2)O 62a_100020667443_100010169565 [1,1,0,0,0,0|1,0,1]=4 885 B17R2.37520 NC(=O)CNc1cccc2c1cccc2Br 34a_100009816864_100000187820 [1,1,0,0,0,0|2,0,0]=4 886 B17R2.37520 NC(=O)CNc1cccc2c1cccc2Cl 34a_100000077128_100000187820 [1,1,0,0,0,0|2,0,0]=4 887 B17R2.37520 NC(=O)CNc1cccc2c1cccc2O 34a_100000210686_100000187820 [1,1,0,0,0,0|2,0,0]=4 888 B17R2.37520 NC(=O)COc1cccc2c1cccc2Br 34a_100010003857_100000187820 [1,1,0,0,0,0|2,0,0]=4 889 B17R2.37520 NC(=O)COc1cccc2c1cccc2Br 7a_100010003857_100000187820 [1,1,0,0,0,0|2,0,0]=4 890 B17R2.37520 NC(=O)COc1cccc2c1cccc2N 34a_100000210686_100000187820 [1,1,0,0,0,0|2,0,0]=4 891 B17R2.37520 NC(=O)CSc1cccc2c1cccc2F 62a_100000747473_100009817034 [1,1,0,0,0,0|2,0,0]=4 892 B17R2.37520 NC(=O)CSc1cccc2c1cccc2F 62a_100009817034_100000747473 [1,1,0,0,0,0|2,0,0]=4 893 B17R2.37520 NC(=O)CSc1cccc2c1cccc2N 62a_100009816864_100000747473 [1,1,0,0,0,0|2,0,0]=4 894 B17R2.37520 NC(=O)CSc1cccc2c1cccc2O 62a_100000747473_100010003857 [1,1,0,0,0,0|2,0,0]=4 895 B17R2.37520 Nc1cccc2c1cccc2OCC(=O)[O-] 34a_100000210686_100020667443 [1,1,0,0,0,0|1,0,1]=4 896 B17R2.37520 Nc1cccc2c1cccc2SCC(=O)[O-] 62a_100009816864_100020667443 [1,1,0,0,0,0|1,0,1]=4 897 B17R2.37520 O=C([O-])CNc1cccc2c1cccc2Br 34a_100009816864_100020667443 [1,1,0,0,0,0|1,0,1]=4 898 B17R2.37520 O=C([O-])CNc1cccc2c1cccc2Cl 34a_100000077128_100020667443 [1,1,0,0,0,0|1,0,1]=4 899 B17R2.37520 O=C([O-])CNc1cccc2c1cccc2O 34a_100000210686_100020667443 [1,1,0,0,0,0|1,0,1]=4 900 B17R2.37520 O=C([O-])COc1cccc2c1cccc2Br 34a_100010003857_100020667443 [1,1,0,0,0,0|1,0,1]=4 901 B17R2.37520 O=C([O-])CSc1cccc2c1cccc2F 62a_100009817034_100020667443 [1,1,0,0,0,0|1,0,1]=4 902 B17R2.37520 O=C([O-])CSc1cccc2c1cccc2F 62a_100020667443_100009817034 [1,1,0,0,0,0|1,0,1]=4 903 B17R2.37520 O=C([O-])CSc1cccc2c1cccc2O 62a_100020667443_100010003857 [1,1,0,0,0,0|1,0,1]=4 904 B17R2.39629 CC(=O)CCc1ccc(c2c1cccc2)C 1458a_200010294770_200000210301 [1,1,0,0,0,0|1,0,0]=3 905 B17R2.39629 CC(=O)COc1ccc(c2c1cccc2)Br 1458a_100009812199_200000210301 [1,1,0,0,0,0|2,0,0]=4 906 B17R2.39629 CC(=O)COc1ccc(c2c1cccc2)Cl 1458a_100000191257_200000210301 [1,1,0,0,0,0|2,0,0]=4 907 B17R2.39629 CC(=O)NCc1ccc(c2c1cccc2)Br 11a_100016995114_100015343762 [1,1,0,0,0,0|2,0,0]=4 908 B17R2.39629 CC(=O)NCc1ccc(c2c1cccc2)Br 1626a_100016995114_100015343762 [1,1,0,0,0,0|2,0,0]=4 909 B17R2.39629 CC(=O)NCc1ccc(c2c1cccc2)Br 240690a_100016995114_100015343762 [1,1,0,0,0,0|2,0,0]=4 910 B17R2.39629 CC(=O)NCc1ccc(c2c1cccc2)Br 527a_100016995114_100103153847 [1,1,0,0,0,0|2,0,0]=4 911 B17R2.39629 Cc1ccc(c2c1cccc2)CCC(=O)[13CH3] 1458a_200010294770_200025704644 [1,1,0,0,0,0|1,0,0]=3 912 B17R2.39629 Cc1ccc(c2c1cccc2)OCC(=O)N 34a_100000074455_100000187820 [1,1,0,0,0,0|2,0,0]=4 913 B17R2.39629 Cc1ccc(c2c1cccc2)OCC(=O)N 7a_100000074455_100000187820 [1,1,0,0,0,0|2,0,0]=4 914 B17R2.39629 Cc1ccc(c2c1cccc2)OCC(=O)[O-] 34a_100000074455_100020667443 [1,1,0,0,0,0|1,0,1]=4 915 B17R2.39629 Cc1ccc(c2c1cccc2)SCC(=O)N 62a_100000747473_100011215156 [1,1,0,0,0,0|2,0,0]=4 916 B17R2.39629 Cc1ccc(c2c1cccc2)SCC(=O)N 62a_100011215156_100000747473 [1,1,0,0,0,0|2,0,0]=4 917 B17R2.39629 Cc1ccc(c2c1cccc2)SCC(=O)[O-] 62a_100011215156_100020667443 [1,1,0,0,0,0|1,0,1]=4 918 B17R2.39629 Cc1ccc(c2c1cccc2)SCC(=O)[O-] 62a_100020667443_100011215156 [1,1,0,0,0,0|1,0,1]=4 919 B17R2.39629 NC(=O)CNc1ccc(c2c1cccc2)Br 34a_100000766797_100000187820 [1,1,0,0,0,0|2,0,0]=4 920 B17R2.39629 NC(=O)CNc1ccc(c2c1cccc2)Cl 34a_100011216319_100000187820 [1,1,0,0,0,0|2,0,0]=4 921 B17R2.39629 NC(=O)CNc1ccc(c2c1cccc2)F 34a_100011988692_100000187820 [1,1,0,0,0,0|2,0,0]=4 922 B17R2.39629 NC(=O)CNc1ccc(c2c1cccc2)O 34a_100000705857_100000187820 [1,1,0,0,0,0|2,0,0]=4 923 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)Br 34a_100000186334_100000187820 [1,1,0,0,0,0|2,0,0]=4 924 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)Br 7a_100000186334_100000187820 [1,1,0,0,0,0|2,0,0]=4 925 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)Cl 34a_100000211000_100000187820 [1,1,0,0,0,0|2,0,0]=4 926 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)Cl 7a_100000211000_100000187820 [1,1,0,0,0,0|2,0,0]=4 927 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)F 34a_100000100223_100000187820 [1,1,0,0,0,0|2,0,0]=4 928 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)F 7a_100000100223_100000187820 [1,1,0,0,0,0|2,0,0]=4 929 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)N 34a_100000705857_100000187820 [1,1,0,0,0,0|2,0,0]=4 930 B17R2.39629 NC(=O)COc1ccc(c2c1cccc2)N 7a_100000705857_100000187820 [1,1,0,0,0,0|2,0,0]=4 931 B17R2.39629 NC(=O)CSc1ccc(c2c1cccc2)Br 62a_100000747473_100012339872 [1,1,0,0,0,0|2,0,0]=4 932 B17R2.39629 NC(=O)CSc1ccc(c2c1cccc2)Br 62a_100012339872_100000747473 [1,1,0,0,0,0|2,0,0]=4 933 B17R2.39629 NC(=O)CSc1ccc(c2c1cccc2)F 62a_100000747473_100011218216 [1,1,0,0,0,0|2,0,0]=4 934 B17R2.39629 NC(=O)CSc1ccc(c2c1cccc2)F 62a_100011218216_100000747473 [1,1,0,0,0,0|2,0,0]=4 935 B17R2.39629 NC(=O)CSc1ccc(c2c1cccc2)N 62a_100000766797_100000747473 [1,1,0,0,0,0|2,0,0]=4 936 B17R2.39629 NC(=O)CSc1ccc(c2c1cccc2)O 62a_100000747473_100000186334 [1,1,0,0,0,0|2,0,0]=4 937 B17R2.39629 Nc1ccc(c2c1cccc2)OCC(=O)[O-] 34a_100000705857_100020667443 [1,1,0,0,0,0|1,0,1]=4 938 B17R2.39629 Nc1ccc(c2c1cccc2)SCC(=O)[O-] 62a_100000766797_100020667443 [1,1,0,0,0,0|1,0,1]=4 939 B17R2.39629 O=C([O-])CNc1ccc(c2c1cccc2)Br 34a_100000766797_100020667443 [1,1,0,0,0,0|1,0,1]=4 940 B17R2.39629 O=C([O-])CNc1ccc(c2c1cccc2)Cl 34a_100011216319_100020667443 [1,1,0,0,0,0|1,0,1]=4 941 B17R2.39629 O=C([O-])CNc1ccc(c2c1cccc2)F 34a_100011988692_100020667443 [1,1,0,0,0,0|1,0,1]=4 942 B17R2.39629 O=C([O-])CNc1ccc(c2c1cccc2)O 34a_100000705857_100020667443 [1,1,0,0,0,0|1,0,1]=4 943 B17R2.39629 O=C([O-])COc1ccc(c2c1cccc2)Br 34a_100000186334_100020667443 [1,1,0,0,0,0|1,0,1]=4 944 B17R2.39629 O=C([O-])COc1ccc(c2c1cccc2)Cl 34a_100000211000_100020667443 [1,1,0,0,0,0|1,0,1]=4 945 B17R2.39629 O=C([O-])COc1ccc(c2c1cccc2)F 34a_100000100223_100020667443 [1,1,0,0,0,0|1,0,1]=4 946 B17R2.39629 O=C([O-])CSc1ccc(c2c1cccc2)Br 62a_100012339872_100020667443 [1,1,0,0,0,0|1,0,1]=4 947 B17R2.39629 O=C([O-])CSc1ccc(c2c1cccc2)Br 62a_100020667443_100012339872 [1,1,0,0,0,0|1,0,1]=4 948 B17R2.39629 O=C([O-])CSc1ccc(c2c1cccc2)F 62a_100011218216_100020667443 [1,1,0,0,0,0|1,0,1]=4 949 B17R2.39629 O=C([O-])CSc1ccc(c2c1cccc2)F 62a_100020667443_100011218216 [1,1,0,0,0,0|1,0,1]=4 950 B17R2.39629 O=C([O-])CSc1ccc(c2c1cccc2)O 62a_100020667443_100000186334 [1,1,0,0,0,0|1,0,1]=4 951 B17R2.39629 [13CH3]C(=O)COc1ccc(c2c1cccc2)Br 1458a_100009812199_200025704644 [1,1,0,0,0,0|2,0,0]=4 952 B17R2.39629 [13CH3]C(=O)COc1ccc(c2c1cccc2)Cl 1458a_100000191257_200025704644 [1,1,0,0,0,0|2,0,0]=4 953 B17R2.252033 CC(=O)CSc1cccc2c1c(ccc2)Cl 1458a_100000260843_200000210301 [1,1,0,0,0,0|2,0,0]=4 954 B17R2.252033 Cc1cccc2c1c(ccc2)NCC(=O)N 34a_100009841044_100000187820 [1,1,0,0,0,0|2,0,0]=4 955 B17R2.252033 Cc1cccc2c1c(ccc2)NCC(=O)N 7a_100009841044_100000187820 [1,1,0,0,0,0|2,0,0]=4 956 B17R2.252033 Cc1cccc2c1c(ccc2)NCC(=O)[O-] 34a_100009841044_100020667443 [1,1,0,0,0,0|1,0,1]=4 957 B17R2.252033 Cc1cccc2c1c(ccc2)SCC(=O)N 62a_100000747473_100009995290 [1,1,0,0,0,0|2,0,0]=4 958 B17R2.252033 Cc1cccc2c1c(ccc2)SCC(=O)[O-] 62a_100020667443_100009995290 [1,1,0,0,0,0|1,0,1]=4 959 B17R2.252033 NC(=O)CNc1cccc2c1c(ccc2)Br 34a_100010002837_100000187820 [1,1,0,0,0,0|2,0,0]=4 960 B17R2.252033 NC(=O)CNc1cccc2c1c(ccc2)Cl 34a_100009857565_100000187820 [1,1,0,0,0,0|2,0,0]=4 961 B17R2.252033 NC(=O)CNc1cccc2c1c(ccc2)F 34a_100009878580_100000187820 [1,1,0,0,0,0|2,0,0]=4 962 B17R2.252033 NC(=O)CNc1cccc2c1c(ccc2)F 7a_100009878580_100000187820 [1,1,0,0,0,0|2,0,0]=4 963 B17R2.252033 NC(=O)COc1cccc2c1c(ccc2)Br 34a_100010089961_100000187820 [1,1,0,0,0,0|2,0,0]=4 964 B17R2.252033 NC(=O)COc1cccc2c1c(ccc2)Br 7a_100010089961_100000187820 [1,1,0,0,0,0|2,0,0]=4 965 B17R2.252033 NC(=O)CSc1cccc2c1c(ccc2)Br 62a_100000747473_100010243825 [1,1,0,0,0,0|2,0,0]=4 966 B17R2.252033 NC(=O)CSc1cccc2c1c(ccc2)Br 62a_100010243825_100000747473 [1,1,0,0,0,0|2,0,0]=4 967 B17R2.252033 NC(=O)CSc1cccc2c1c(ccc2)F 62a_100000747473_100010177852 [1,1,0,0,0,0|2,0,0]=4 968 B17R2.252033 NC(=O)CSc1cccc2c1c(ccc2)F 62a_100010177852_100000747473 [1,1,0,0,0,0|2,0,0]=4 969 B17R2.252033 NC(=O)CSc1cccc2c1c(ccc2)N 62a_100010002837_100000747473 [1,1,0,0,0,0|2,0,0]=4 970 B17R2.252033 NC(=O)CSc1cccc2c1c(ccc2)O 62a_100000747473_100010089961 [1,1,0,0,0,0|2,0,0]=4 971 B17R2.252033 Nc1cccc2c1c(ccc2)SCC(=O)[O-] 62a_100010002837_100020667443 [1,1,0,0,0,0|1,0,1]=4 972 B17R2.252033 O=C([O-])CNc1cccc2c1c(ccc2)Br 34a_100010002837_100020667443 [1,1,0,0,0,0|1,0,1]=4 973 B17R2.252033 O=C([O-])CNc1cccc2c1c(ccc2)Cl 34a_100009857565_100020667443 [1,1,0,0,0,0|1,0,1]=4 974 B17R2.252033 O=C([O-])CNc1cccc2c1c(ccc2)F 34a_100009878580_100020667443 [1,1,0,0,0,0|1,0,1]=4 975 B17R2.252033 O=C([O-])COc1cccc2c1c(ccc2)Br 34a_100010089961_100020667443 [1,1,0,0,0,0|1,0,1]=4 976 B17R2.252033 O=C([O-])CSc1cccc2c1c(ccc2)Br 62a_100010243825_100020667443 [1,1,0,0,0,0|1,0,1]=4 977 B17R2.252033 O=C([O-])CSc1cccc2c1c(ccc2)Br 62a_100020667443_100010243825 [1,1,0,0,0,0|1,0,1]=4 978 B17R2.252033 O=C([O-])CSc1cccc2c1c(ccc2)F 62a_100010177852_100020667443 [1,1,0,0,0,0|1,0,1]=4 979 B17R2.252033 O=C([O-])CSc1cccc2c1c(ccc2)F 62a_100020667443_100010177852 [1,1,0,0,0,0|1,0,1]=4 980 B17R2.252033 O=C([O-])CSc1cccc2c1c(ccc2)O 62a_100020667443_100010089961 [1,1,0,0,0,0|1,0,1]=4 981 B17R2.252033 [13CH3]C(=O)CSc1cccc2c1c(ccc2)Cl 1458a_100000260843_200025704644 [1,1,0,0,0,0|2,0,0]=4 982 B17R2.353364 C#CC(=O)CCc1cccc2c1cccc2 1458a_100000211873_100011290781 [1,1,0,0,0,0|1,0,0]=3 983 B17R2.353364 C=CC(=O)CCc1cccc2c1cccc2 1458a_100000185746_100011290781 [1,1,0,0,0,0|1,0,0]=3 984 B17R2.353364 C=CC(=O)NCc1cccc2c1cccc2 1626a_100000753325_100000185746 [1,1,0,0,0,0|2,0,0]=4 985 B17R2.353364 C=CC(=O)NCc1cccc2c1cccc2 240690a_100000753325_200121576911 [1,1,0,0,0,0|2,0,0]=4 986 B17R2.353364 CCC(=O)CCc1cccc2c1cccc2 1458a_100000210414_100011290781 [1,1,0,0,0,0|1,0,0]=3 987 B17R2.353364 CCC(=O)CCc1cccc2c1cccc2 1458a_100011218451_100000210202 [1,1,0,0,0,0|1,0,0]=3 988 B17R2.353364 CCC(=O)COc1cccc2c1cccc2 1458a_100000183701_100000210202 [1,1,0,0,0,0|2,0,0]=4 989 B17R2.353364 CCC(=O)COc1cccc2c1cccc2 7a_100000210388_100000747405 [1,1,0,0,0,0|2,0,0]=4 990 B17R2.353364 CCC(=O)CSc1cccc2c1cccc2 62a_100000747405_100000210605 [1,1,0,0,0,0|2,0,0]=4 991 B17R2.353364 CCC(=O)NCc1cccc2c1cccc2 11a_100000753325_100000210414 [1,1,0,0,0,0|2,0,0]=4 992 B17R2.353364 CCC(=O)NCc1cccc2c1cccc2 1626a_100000753325_100000210414 [1,1,0,0,0,0|2,0,0]=4 993 B17R2.353364 CCC(=O)NCc1cccc2c1cccc2 240690a_100000753325_100000210414 [1,1,0,0,0,0|2,0,0]=4 994 B17R2.353364 CCC(=O)NCc1cccc2c1cccc2 527a_100000753325_100000210414 [1,1,0,0,0,0|2,0,0]=4 995 B17R2.353364 CNC(=O)CCc1cccc2c1cccc2 11a_106832991635_100011218451 [1,1,0,0,0,0|1,0,0]=3 996 B17R2.353364 CNC(=O)CCc1cccc2c1cccc2 1626a_100102657272_100011218451 [1,1,0,0,0,0|1,0,0]=3 997 B17R2.353364 CNC(=O)CCc1cccc2c1cccc2 240690a_100102657272_100011218451 [1,1,0,0,0,0|1,0,0]=3 998 B17R2.353364 CNC(=O)CCc1cccc2c1cccc2 527a_100102657272_100011218451 [1,1,0,0,0,0|1,0,0]=3 999 B17R2.353364 CNC(=O)CNc1cccc2c1cccc2 34a_100000185869_100000183359 [1,1,0,0,0,0|2,0,0]=4 1000 B17R2.353364 CNC(=O)COc1cccc2c1cccc2 11a_106832991635_100000183701 [1,1,0,0,0,0|2,0,0]=4 1001 B17R2.353364 CNC(=O)COc1cccc2c1cccc2 1626a_100102657272_100000183701 [1,1,0,0,0,0|2,0,0]=4 1002 B17R2.353364 CNC(=O)COc1cccc2c1cccc2 240690a_100102657272_100000183701 [1,1,0,0,0,0|2,0,0]=4 1003 B17R2.353364 CNC(=O)COc1cccc2c1cccc2 34a_100000210388_100000183359 [1,1,0,0,0,0|2,0,0]=4 1004 B17R2.353364 CNC(=O)COc1cccc2c1cccc2 527a_100102657272_100000183701 [1,1,0,0,0,0|2,0,0]=4 1005 B17R2.353364 CNC(=O)COc1cccc2c1cccc2 7a_100000210388_100000183359 [1,1,0,0,0,0|2,0,0]=4 1006 B17R2.353364 CNC(=O)CSc1cccc2c1cccc2 62a_100000183359_100000210605 [1,1,0,0,0,0|2,0,0]=4 1007 B17R2.353364 CNC(=O)NCc1cccc2c1cccc2 2708a_100000753325_106832991635 [1,1,0,0,0,0|2,0,0]=4 1008 B17R2.353364 CNC(=O)NCc1cccc2c1cccc2 2708a_100102657272_100000753325 [1,1,0,0,0,0|2,0,0]=4 1009 B17R2.353364 CNC(=O)NCc1cccc2c1cccc2 273464a_100000753325_100102657272 [1,1,0,0,0,0|2,0,0]=4 1010 B17R2.353364 CNC(=O)NCc1cccc2c1cccc2 273464a_100102657272_100000753325 [1,1,0,0,0,0|2,0,0]=4 1011 B17R2.353364 CNC(=O)NCc1cccc2c1cccc2 512a_100000753325_100102657272 [1,1,0,0,0,0|2,0,0]=4 1012 B17R2.353364 CNC(=O)NCc1cccc2c1cccc2 512a_106832991638_100000753325 [1,1,0,0,0,0|2,0,0]=4 1013 B17R2.353364 COC(=O)CNc1cccc2c1cccc2 34a_100000185869_100000747449 [1,1,0,0,0,0|1,0,0]=3 1014 B17R2.353364 COC(=O)CNc1cccc2c1cccn2 34a_100000183906_100000747449 [1,1,0,0,0,0|2,0,0]=4 1015 B17R2.353364 COC(=O)CNc1cccc2c1nccc2 34a_100000181377_100000747449 [1,1,0,0,0,0|2,0,0]=4 1016 B17R2.353364 COC(=O)COc1cccc2c1cccc2 34a_100000210388_100000747449 [1,1,0,0,0,0|1,0,0]=3 1017 B17R2.353364 COC(=O)COc1cccc2c1cccc2 7a_100000210388_100000747449 [1,1,0,0,0,0|1,0,0]=3 1018 B17R2.353364 COC(=O)COc1cccc2c1cccn2 34a_100011197808_100000747449 [1,1,0,0,0,0|2,0,0]=4 1019 B17R2.353364 COC(=O)COc1cccc2c1ccnc2 34a_100011218533_100000747449 [1,1,0,0,0,0|2,0,0]=4 1020 B17R2.353364 COC(=O)COc1cccc2c1cncc2 34a_103624766955_100000747449 [1,1,0,0,0,0|2,0,0]=4 1021 B17R2.353364 COC(=O)COc1cccc2c1nccc2 34a_100000056035_100000747449 [1,1,0,0,0,0|2,0,0]=4 1022 B17R2.353364 COC(=O)COc1cncc2c1cccc2 34a_100000066178_100000747449 [1,1,0,0,0,0|2,0,0]=4 1023 B17R2.353364 COC(=O)COc1cncc2c1cccc2 7a_100000066178_100000747449 [1,1,0,0,0,0|2,0,0]=4 1024 B17R2.353364 COC(=O)COc1nccc2c1cccc2 34a_102531767632_100000747449 [1,1,0,0,0,0|2,0,0]=4 1025 B17R2.353364 COC(=O)CSc1cccc2c1cccc2 62a_100000747449_100000210605 [1,1,0,0,0,0|1,0,0]=3 1026 B17R2.353364 COC(=O)CSc1cccc2c1cccn2 62a_100000747449_100011290932 [1,1,0,0,0,0|2,0,0]=4 1027 B17R2.353364 COC(=O)CSc1cccc2c1cccn2 62a_100011290932_100000747449 [1,1,0,0,0,0|2,0,0]=4 1028 B17R2.353364 COC(=O)CSc1cccc2c1ccnc2 62a_100000186358_100000747449 [1,1,0,0,0,0|2,0,0]=4 1029 B17R2.353364 COC(=O)CSc1cccc2c1ccnc2 62a_100000747449_100000186358 [1,1,0,0,0,0|2,0,0]=4 1030 B17R2.353364 COC(=O)CSc1cccc2c1cncc2 62a_100000685578_100000747449 [1,1,0,0,0,0|2,0,0]=4 1031 B17R2.353364 COC(=O)CSc1cccc2c1cncc2 62a_100000747449_100000685578 [1,1,0,0,0,0|2,0,0]=4 1032 B17R2.353364 COC(=O)CSc1cccc2c1nccc2 62a_100000747449_100011215545 [1,1,0,0,0,0|2,0,0]=4 1033 B17R2.353364 COC(=O)CSc1ccnc2c1cccc2 62a_100000747449_100011215880 [1,1,0,0,0,0|2,0,0]=4 1034 B17R2.353364 COC(=O)CSc1ccnc2c1cccc2 62a_100011458314_100000747449 [1,1,0,0,0,0|2,0,0]=4 1035 B17R2.353364 COC(=O)CSc1cncc2c1cccc2 62a_100000187577_100000747449 [1,1,0,0,0,0|2,0,0]=4 1036 B17R2.353364 COC(=O)CSc1cncc2c1cccc2 62a_100000747449_100000187577 [1,1,0,0,0,0|2,0,0]=4 1037 B17R2.353364 COC(=O)CSc1nccc2c1cccc2 62a_100000747449_100011934041 [1,1,0,0,0,0|2,0,0]=4 1038 B17R2.353364 COC(=O)CSc1nccc2c1cccc2 62a_100011934041_100000747449 [1,1,0,0,0,0|2,0,0]=4 1039 B17R2.353364 O=C(CF)CCc1cccc2c1cccc2 1458a_100011218451_100015361967 [1,1,0,0,0,0|1,0,0]=3 1040 B17R2.353364 O=C(CF)COc1cccc2c1cccc2 1458a_100000183701_100015361967 [1,1,0,0,0,0|2,0,0]=4 1041 B17R2.353364 O=C(CO)CCc1cccc2c1cccc2 1458a_100000210174_100011290781 [1,1,0,0,0,0|0,0,0]=2 1042 B17R2.353364 O=C(CO)NCc1cccc2c1cccc2 240690a_100000753325_100000210174 [1,1,0,0,0,0|1,0,0]=3 1043 B17R2.353364 O=C(CO)NCc1cccc2c1cccc2 527a_100000753325_100000210174 [1,1,0,0,0,0|1,0,0]=3 1044 B17R2.353364 O=C(CO)NCc1cccc2c1cccn2 240690a_100020628785_100000210174 [1,1,0,0,0,0|2,0,0]=4 1045 B17R2.353364 O=C(CO)NCc1cccc2c1cccn2 527a_100020628785_100000210174 [1,1,0,0,0,0|2,0,0]=4 1046 B17R2.353364 O=C(CO)NCc1cccc2c1ccnc2 240690a_100011757365_100000210174 [1,1,0,0,0,0|2,0,0]=4 1047 B17R2.353364 O=C(CO)NCc1cccc2c1ccnc2 527a_100011757365_100000210174 [1,1,0,0,0,0|2,0,0]=4 1048 B17R2.353364 O=C(CO)NCc1cccc2c1nccc2 240690a_100011195829_100000210174 [1,1,0,0,0,0|2,0,0]=4 1049 B17R2.353364 O=C(CO)NCc1cccc2c1nccc2 527a_100011195829_100000210174 [1,1,0,0,0,0|2,0,0]=4 1050 B17R2.353364 O=C(CO)NCc1ccnc2c1cccc2 240690a_100015187208_100000210174 [1,1,0,0,0,0|2,0,0]=4 1051 B17R2.353364 O=C(CO)NCc1ccnc2c1cccc2 527a_100015187208_100000210174 [1,1,0,0,0,0|2,0,0]=4 1052 B17R2.353364 O=C(CO)NCc1nccc2c1cccc2 240690a_100000735229_100000210174 [1,1,0,0,0,0|2,0,0]=4 1053 B17R2.353364 O=C(CO)NCc1nccc2c1cccc2 527a_100000735229_100000210174 [1,1,0,0,0,0|2,0,0]=4 1054 B17R2.353364 O=C(CO)NNc1cccc2c1cccc2 22a_100000006939_100000210174 [1,1,0,0,0,0|2,0,0]=4 1055 B17R2.712041 CC(=O)CC(=O)c1cccc2c1cccc2 1458a_100000070787_100000211450 [1,1,0,0,0,0|1,0,1]=4 1056 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 11a_100011830313_100015343762 [1,1,0,0,0,0|2,0,0]=4 1057 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 1626a_100011830313_100015343762 [1,1,0,0,0,0|2,0,0]=4 1058 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 240690a_100011830313_100015343762 [1,1,0,0,0,0|2,0,0]=4 1059 B17R2.712041 CC(=O)N[C@@H](C)c1cccc2c1cccc2 527a_100011830313_100103153847 [1,1,0,0,0,0|2,0,0]=4 1060 B17R2.712041 CN(CC(=O)N)c1cccc2c1cccc2 2230a_100000220138_100000747473 [1,1,0,0,0,0|2,0,0]=4 1061 B17R2.712041 CN(CC(=O)N)c1cccc2c1cccc2 269982a_100000220138_100000187820 [1,1,0,0,0,0|2,0,0]=4 1062 B17R2.712041 CN(CC(=O)N)c1cccc2c1cccc2 34a_100000220138_100000187820 [1,1,0,0,0,0|2,0,0]=4 1063 B17R2.712041 CN(CC(=O)[O-])c1cccc2c1cccc2 269982a_100000220138_100020667443 [1,1,0,0,0,0|1,0,1]=4 1064 B17R2.712041 CN(CC(=O)[O-])c1cccc2c1cccc2 34a_100000220138_100020667443 [1,1,0,0,0,0|1,0,1]=4 1065 B17R2.712041 NC(=O)CC(=O)c1cccc2c1cccc2 1458a_100000210949_100000187820 [1,1,0,0,0,0|1,0,1]=4 1066 B17R2.712041 O=C([O-])CC(=O)c1cccc2c1cccc2 1458a_100000210949_100020667443 [1,1,0,0,0,0|0,0,2]=4 1067 B17R2.289 CN[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N 2230a_100015190000_200000210301 [0,1,0,0,1,0|2,0,0]=4 1068 B17R2.289 [13CH3]N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N 2230a_100015190000_200025704644 [0,1,0,0,1,0|2,0,0]=4 1069 B17R2.5384 CC(=O)C(O)c1c(ccc2c1cccc2)O 1458a_100000068390_200000210301 [0,1,0,0,1,0|2,0,0]=4 1070 B17R2.5384 [13CH3]C(=O)C(O)c1c(ccc2c1cccc2)O 1458a_100000068390_200025704644 [0,1,0,0,1,0|2,0,0]=4 1071 B17R2.99719 CNC(C(=O)O)c1cccc2c1cccc2 269956a_100025771476_200000210301 [0,1,0,0,1,0|0,0,0]=2 1072 B17R2.99719 [13CH3]NC(C(=O)O)c1cccc2c1cccc2 269956a_100025771476_200025704644 [0,1,0,0,1,0|0,0,0]=2 1073 B17R2.954612 CC(=O)C(C)(C)c1cccc2c1cccc2 1458a_200011667336_200000210301 [0,1,0,0,1,0|2,0,0]=4 1074 B17R2.954612 CC(C)(C(=O)[13CH3])c1cccc2c1cccc2 1458a_200011667336_200025704644 [0,1,0,0,1,0|2,0,0]=4 1075 B19R2.7769 CC(=O)C(C)OCc1c(ccc2c1cccc2)C 34a_100000212229_100000689653 [0,1,0,0,0,1|2,0,0]=4 1076 B19R2.7769 CC(=O)C(C)SCc1c(ccc2c1cccc2)C 62a_100000689653_100009814033 [0,1,0,0,0,1|2,0,0]=4 1077 B19R2.7769 CC(=O)C(C)SCc1c(ccc2c1cccc2)C 62a_100009814033_100000689653 [0,1,0,0,0,1|2,0,0]=4 1078 B19R2.7769 C[C@@H](NCc1c(ccc2c1cccc2)Br)C(=O)N 270004a_100000119354_100010090029 [0,1,0,0,0,1|2,0,0]=4 1079 B19R2.7769 Cc1ccc2ccccc2c1CN[C@@H](C)C(=O)O 269956a_100000743915_100000689653 [0,1,0,0,0,1|1,0,0]=3 1080 B19R2.7769 Cc1ccc2ccccc2c1CN[C@H](C)C(=O)N 2230a_100000119354_100000689653 [0,1,0,0,0,1|2,0,0]=4 1081 B19R2.7769 Cc1ccc2ccccc2c1CN[C@H](C)C(=O)N 270004a_100000119354_100011361466 [0,1,0,0,0,1|2,0,0]=4 1082 B19R2.7769 Cc1ccc2ccccc2c1CN[C@H](C)C(=O)N 34a_100000119354_100000689653 [0,1,0,0,0,1|2,0,0]=4 1083 B19R2.7769 Cc1ccc2ccccc2c1CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000689653 [0,1,0,0,0,1|1,0,1]=4 1084 B19R2.7769 Cc1ccc2ccccc2c1CO[C@H](C)C(=O)N 34a_100000731257_100000689653 [0,1,0,0,0,1|2,0,0]=4 1085 B19R2.7769 Cc1ccc2ccccc2c1CO[C@H](C)C(=O)N 7a_100000731257_100000689653 [0,1,0,0,0,1|2,0,0]=4 1086 B19R2.7769 Cc1ccc2ccccc2c1CSC(C)C(=O)N 62a_100000689653_100000702099 [0,1,0,0,0,1|2,0,0]=4 1087 B19R2.7769 Cc1ccc2ccccc2c1CSC(C)C(=O)N 62a_100000702099_100000689653 [0,1,0,0,0,1|2,0,0]=4 1088 B19R2.7769 Cc1ccc2ccccc2c1CSC(F)C(=O)N 62a_100000689653_100009813875 [0,1,0,0,0,1|2,0,0]=4 1089 B19R2.7769 Cc1ccc2ccccc2c1CSC(F)C(=O)N 62a_100009813875_100000689653 [0,1,0,0,0,1|2,0,0]=4 1090 B19R2.7769 Cc1ccc2ccccc2c1CSC(F)C(=O)[O-] 62a_100000689653_100020610796 [0,1,0,0,0,1|1,0,1]=4 1091 B19R2.7769 Cc1ccc2ccccc2c1CSC(F)C(=O)[O-] 62a_100020610796_100000689653 [0,1,0,0,0,1|1,0,1]=4 1092 B19R2.94809 C[C@H](NCc1cc(nc2c1cccc2)Cl)C(=O)O 269956a_100000743915_200010137201 [0,1,0,0,0,1|2,0,0]=4 1093 B19R2.94809 C[C@H](NCc1cc(nc2c1cccc2)O)C(=O)O 269956a_100000743915_100000187625 [0,1,0,0,0,1|2,0,0]=4 1094 B19R2.878137 C[C@@H](NCc1cccc2c1cccc2F)C(=O)N 270004a_100000119354_200102526217 [0,1,0,0,0,1|2,0,0]=4 1095 B19R2.922500 CC(=O)C(C)OCc1ccc(c2c1cccc2)Br 34a_100000212229_100012352185 [0,1,0,0,0,1|2,0,0]=4 1096 B19R2.922500 CC(=O)C(C)OCc1ccc(c2c1cccc2)C 34a_100000212229_100012073487 [0,1,0,0,0,1|2,0,0]=4 1097 B19R2.922500 CC(=O)C(C)OCc1ccc(c2c1cccc2)C 7a_200011995996_100000179758 [0,1,0,0,0,1|2,0,0]=4 1098 B19R2.922500 CC(=O)C(C)OCc1ccc(c2c1cccc2)F 34a_100000212229_100011988723 [0,1,0,0,0,1|2,0,0]=4 1099 B19R2.922500 CC(=O)C(C)OCc1ccc(c2c1cccc2)F 7a_100011988714_100000179758 [0,1,0,0,0,1|2,0,0]=4 1100 B19R2.922500 CC(=O)C(C)SCc1ccc(c2c1cccc2)Br 62a_100009814033_100012352185 [0,1,0,0,0,1|2,0,0]=4 1101 B19R2.922500 CC(=O)C(C)SCc1ccc(c2c1cccc2)Br 62a_100012352185_100009814033 [0,1,0,0,0,1|2,0,0]=4 1102 B19R2.922500 CC(=O)C(C)SCc1ccc(c2c1cccc2)C 62a_100009814033_100012073487 [0,1,0,0,0,1|2,0,0]=4 1103 B19R2.922500 CC(=O)C(C)SCc1ccc(c2c1cccc2)C 62a_100012073487_100009814033 [0,1,0,0,0,1|2,0,0]=4 1104 B19R2.922500 CC(=O)C(C)SCc1ccc(c2c1cccc2)F 62a_100009814033_100011988723 [0,1,0,0,0,1|2,0,0]=4 1105 B19R2.922500 CC(=O)C(C)SCc1ccc(c2c1cccc2)F 62a_100011988723_100009814033 [0,1,0,0,0,1|2,0,0]=4 1106 B19R2.922500 CC(NCc1ccc(c2c1cccc2)Br)C(=O)N 34a_100016995114_100000702099 [0,1,0,0,0,1|2,0,0]=4 1107 B19R2.922500 CC(OCc1ccc(c2c1cccc2)F)C(=O)N 34a_100011988714_100000702099 [0,1,0,0,0,1|2,0,0]=4 1108 B19R2.922500 CC(OCc1ccc(c2c1cccc2)F)C(=O)N 7a_100011988714_100000702099 [0,1,0,0,0,1|2,0,0]=4 1109 B19R2.922500 CC(SCc1ccc(c2c1cccc2)Br)C(=O)N 62a_100000702099_100012352185 [0,1,0,0,0,1|2,0,0]=4 1110 B19R2.922500 CC(SCc1ccc(c2c1cccc2)Br)C(=O)N 62a_100012352185_100000702099 [0,1,0,0,0,1|2,0,0]=4 1111 B19R2.922500 CC(SCc1ccc(c2c1cccc2)F)C(=O)N 62a_100000702099_100011988723 [0,1,0,0,0,1|2,0,0]=4 1112 B19R2.922500 CC(SCc1ccc(c2c1cccc2)F)C(=O)N 62a_100011988723_100000702099 [0,1,0,0,0,1|2,0,0]=4 1113 B19R2.922500 C[C@@H](NCc1ccc(c2c1cccc2)Br)C(=O)N 2230a_100000119354_100012352185 [0,1,0,0,0,1|2,0,0]=4 1114 B19R2.922500 C[C@@H](NCc1ccc(c2c1cccc2)Br)C(=O)N 270004a_100000119354_100012359940 [0,1,0,0,0,1|2,0,0]=4 1115 B19R2.922500 C[C@@H](NCc1ccc(c2c1cccc2)Br)C(=O)N 34a_100000119354_100012352185 [0,1,0,0,0,1|2,0,0]=4 1116 B19R2.922500 C[C@@H](NCc1ccc(c2c1cccc2)Cl)C(=O)N 270004a_100000119354_100011204464 [0,1,0,0,0,1|2,0,0]=4 1117 B19R2.922500 C[C@@H](NCc1ccc(c2c1cccc2)F)C(=O)N 2230a_100000119354_100011988723 [0,1,0,0,0,1|2,0,0]=4 1118 B19R2.922500 C[C@@H](NCc1ccc(c2c1cccc2)F)C(=O)N 270004a_100000119354_100011934225 [0,1,0,0,0,1|2,0,0]=4 1119 B19R2.922500 C[C@@H](NCc1ccc(c2c1cccc2)F)C(=O)N 34a_100000119354_100011988723 [0,1,0,0,0,1|2,0,0]=4 1120 B19R2.922500 C[C@@H](OCc1ccc(c2c1cccc2)Br)C(=O)N 34a_100000731257_100012352185 [0,1,0,0,0,1|2,0,0]=4 1121 B19R2.922500 C[C@@H](OCc1ccc(c2c1cccc2)Br)C(=O)N 7a_100000731257_100012352185 [0,1,0,0,0,1|2,0,0]=4 1122 B19R2.922500 C[C@@H](OCc1ccc(c2c1cccc2)F)C(=O)N 34a_100000731257_100011988723 [0,1,0,0,0,1|2,0,0]=4 1123 B19R2.922500 C[C@@H](OCc1ccc(c2c1cccc2)F)C(=O)N 7a_100000731257_100011988723 [0,1,0,0,0,1|2,0,0]=4 1124 B19R2.922500 C[C@H](NCc1ccc(c2c1cccc2)Br)C(=O)O 269956a_100000743915_100012352185 [0,1,0,0,0,1|1,0,0]=3 1125 B19R2.922500 C[C@H](NCc1ccc(c2c1cccc2)F)C(=O)O 269956a_100000743915_100011988723 [0,1,0,0,0,1|1,0,0]=3 1126 B19R2.922500 C[C@H](NCc1ccc(c2c1cccn2)O)C(=O)O 269956a_100000743915_100000683097 [0,1,0,0,0,1|2,0,0]=4 1127 B19R2.922500 C[C@H](OCc1ccc(c2c1cccc2)Br)C(=O)[O-] 7a_217856618621_100012352185 [0,1,0,0,0,1|1,0,1]=4 1128 B19R2.922500 C[C@H](OCc1ccc(c2c1cccc2)F)C(=O)[O-] 7a_217856618621_100011988723 [0,1,0,0,0,1|1,0,1]=4 1129 B19R2.922500 Cc1ccc(c2c1cccc2)CN[C@@H](C)C(=O)O 269956a_100000743915_100012073487 [0,1,0,0,0,1|1,0,0]=3 1130 B19R2.922500 Cc1ccc(c2c1cccc2)CN[C@H](C)C(=O)N 2230a_100000119354_100012073487 [0,1,0,0,0,1|2,0,0]=4 1131 B19R2.922500 Cc1ccc(c2c1cccc2)CN[C@H](C)C(=O)N 270004a_100000119354_100000188529 [0,1,0,0,0,1|2,0,0]=4 1132 B19R2.922500 Cc1ccc(c2c1cccc2)CN[C@H](C)C(=O)N 34a_100000119354_100012073487 [0,1,0,0,0,1|2,0,0]=4 1133 B19R2.922500 Cc1ccc(c2c1cccc2)COC(C)C(=O)N 34a_200011995996_100000702099 [0,1,0,0,0,1|2,0,0]=4 1134 B19R2.922500 Cc1ccc(c2c1cccc2)COC(C)C(=O)N 7a_200011995996_100000702099 [0,1,0,0,0,1|2,0,0]=4 1135 B19R2.922500 Cc1ccc(c2c1cccc2)COC(F)C(=O)N 34a_200011995996_100009813875 [0,1,0,0,0,1|2,0,0]=4 1136 B19R2.922500 Cc1ccc(c2c1cccc2)COC(F)C(=O)N 7a_200011995996_100009813875 [0,1,0,0,0,1|2,0,0]=4 1137 B19R2.922500 Cc1ccc(c2c1cccc2)COC(F)C(=O)[O-] 34a_200011995996_100020610796 [0,1,0,0,0,1|1,0,1]=4 1138 B19R2.922500 Cc1ccc(c2c1cccc2)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100012073487 [0,1,0,0,0,1|1,0,1]=4 1139 B19R2.922500 Cc1ccc(c2c1cccc2)CO[C@H](C)C(=O)N 34a_100000731257_100012073487 [0,1,0,0,0,1|2,0,0]=4 1140 B19R2.922500 Cc1ccc(c2c1cccc2)CO[C@H](C)C(=O)N 7a_100000731257_100012073487 [0,1,0,0,0,1|2,0,0]=4 1141 B19R2.922500 Cc1ccc(c2c1cccc2)CSC(C)C(=O)N 62a_100000702099_100012073487 [0,1,0,0,0,1|2,0,0]=4 1142 B19R2.922500 Cc1ccc(c2c1cccc2)CSC(C)C(=O)N 62a_100012073487_100000702099 [0,1,0,0,0,1|2,0,0]=4 1143 B19R2.922500 Cc1ccc(c2c1cccc2)CSC(F)C(=O)N 62a_100009813875_100012073487 [0,1,0,0,0,1|2,0,0]=4 1144 B19R2.922500 Cc1ccc(c2c1cccc2)CSC(F)C(=O)N 62a_100012073487_100009813875 [0,1,0,0,0,1|2,0,0]=4 1145 B19R2.922500 Cc1ccc(c2c1cccc2)CSC(F)C(=O)[O-] 62a_100012073487_100020610796 [0,1,0,0,0,1|1,0,1]=4 1146 B19R2.922500 Cc1ccc(c2c1cccc2)CSC(F)C(=O)[O-] 62a_100020610796_100012073487 [0,1,0,0,0,1|1,0,1]=4 1147 B19R2.922500 NC(=O)C(F)NCc1ccc(c2c1cccc2)Br 34a_100016995114_100009813875 [0,1,0,0,0,1|2,0,0]=4 1148 B19R2.922500 NC(=O)C(F)OCc1ccc(c2c1cccc2)F 34a_100011988714_100009813875 [0,1,0,0,0,1|2,0,0]=4 1149 B19R2.922500 NC(=O)C(F)OCc1ccc(c2c1cccc2)F 7a_100011988714_100009813875 [0,1,0,0,0,1|2,0,0]=4 1150 B19R2.922500 NC(=O)C(F)SCc1ccc(c2c1cccc2)Br 62a_100009813875_100012352185 [0,1,0,0,0,1|2,0,0]=4 1151 B19R2.922500 NC(=O)C(F)SCc1ccc(c2c1cccc2)Br 62a_100012352185_100009813875 [0,1,0,0,0,1|2,0,0]=4 1152 B19R2.922500 NC(=O)C(F)SCc1ccc(c2c1cccc2)F 62a_100009813875_100011988723 [0,1,0,0,0,1|2,0,0]=4 1153 B19R2.922500 NC(=O)C(F)SCc1ccc(c2c1cccc2)F 62a_100011988723_100009813875 [0,1,0,0,0,1|2,0,0]=4 1154 B19R2.922500 O=C([O-])C(F)NCc1ccc(c2c1cccc2)Br 34a_100016995114_100020610796 [0,1,0,0,0,1|1,0,1]=4 1155 B19R2.922500 O=C([O-])C(F)OCc1ccc(c2c1cccc2)F 34a_100011988714_100020610796 [0,1,0,0,0,1|1,0,1]=4 1156 B19R2.922500 O=C([O-])C(F)SCc1ccc(c2c1cccc2)Br 62a_100012352185_100020610796 [0,1,0,0,0,1|1,0,1]=4 1157 B19R2.922500 O=C([O-])C(F)SCc1ccc(c2c1cccc2)Br 62a_100020610796_100012352185 [0,1,0,0,0,1|1,0,1]=4 1158 B19R2.922500 O=C([O-])C(F)SCc1ccc(c2c1cccc2)F 62a_100011988723_100020610796 [0,1,0,0,0,1|1,0,1]=4 1159 B19R2.922500 O=C([O-])C(F)SCc1ccc(c2c1cccc2)F 62a_100020610796_100011988723 [0,1,0,0,0,1|1,0,1]=4 1160 B19R2.1115715 C=C[C@H](NCc1cccc2c1cccc2)C(=O)O 269956a_100016992060_100000188474 [0,1,0,0,0,1|1,0,0]=3 1161 B19R2.1115715 C=C[C@H](NCc1cccc2c1ccnc2)C(=O)O 269956a_100016992060_100016989825 [0,1,0,0,0,1|2,0,0]=4 1162 B19R2.1115715 C=C[C@H](NCc1cccc2c1nccc2)C(=O)O 269956a_100016992060_100000241032 [0,1,0,0,0,1|2,0,0]=4 1163 B19R2.1115715 C=C[C@H](NCc1ccnc2c1cccc2)C(=O)O 269956a_100016992060_100015192512 [0,1,0,0,0,1|2,0,0]=4 1164 B19R2.1115715 C=C[C@H](NCc1nccc2c1cccc2)C(=O)O 269956a_100016992060_100000033776 [0,1,0,0,0,1|2,0,0]=4 1165 B19R2.1115715 CCC(NCc1cccc2c1cccc2)C(=O)N 2230a_100000733705_100011261445 [0,1,0,0,0,1|2,0,0]=4 1166 B19R2.1115715 CCC(NCc1cccc2c1cccc2)C(=O)N 34a_100000733705_100011261445 [0,1,0,0,0,1|2,0,0]=4 1167 B19R2.1115715 CCC(NCc1cccc2c1cccc2)C(=O)N 34a_100000753325_100000750255 [0,1,0,0,0,1|2,0,0]=4 1168 B19R2.1115715 CCC(OCc1cccc2c1cccc2)C(=O)N 34a_100011216843_100000750255 [0,1,0,0,0,1|2,0,0]=4 1169 B19R2.1115715 CCC(OCc1cccc2c1cccc2)C(=O)N 7a_100011216843_100000750255 [0,1,0,0,0,1|2,0,0]=4 1170 B19R2.1115715 CCC(SCc1cccc2c1cccc2)C(=O)N 62a_100000750255_100000188474 [0,1,0,0,0,1|2,0,0]=4 1171 B19R2.1115715 CCC(SCc1cccc2c1cccc2)C(=O)N 62a_100011261445_100000750255 [0,1,0,0,0,1|2,0,0]=4 1172 B19R2.1115715 CC[C@@H](NCc1cccc2c1cccc2)C(=O)O 269956a_100000747097_100000188474 [0,1,0,0,0,1|1,0,0]=3 1173 B19R2.1115715 CC[C@@H](NCc1cccc2c1ccnc2)C(=O)O 269956a_100000747097_100016989825 [0,1,0,0,0,1|2,0,0]=4 1174 B19R2.1115715 CC[C@@H](NCc1cccc2c1nccc2)C(=O)O 269956a_100000747097_100000241032 [0,1,0,0,0,1|2,0,0]=4 1175 B19R2.1115715 CC[C@@H](NCc1ccnc2c1cccc2)C(=O)O 269956a_100000747097_100015192512 [0,1,0,0,0,1|2,0,0]=4 1176 B19R2.1115715 CC[C@@H](NCc1nccc2c1cccc2)C(=O)O 269956a_100000747097_100000033776 [0,1,0,0,0,1|2,0,0]=4 1177 B19R2.1115715 N#CC(NCc1cccc2c1cccc2)C(=O)N 2230a_100000039599_100011261445 [0,1,0,0,0,1|1,0,1]=4 1178 B19R2.1115715 N#CC(NCc1cccc2c1cccc2)C(=O)N 270004a_100000039599_100000210074 [0,1,0,0,0,1|1,0,1]=4 1179 B19R2.1115715 NC(=O)[C@H](CO)NCc1cccc2c1cccc2 2230a_100000729942_100011261445 [0,1,0,0,0,1|2,0,0]=4 1180 B19R2.1115715 NC(=O)[C@H](CO)NCc1cccc2c1cccc2 270004a_100000729942_100000210074 [0,1,0,0,0,1|2,0,0]=4 1181 B19R2.1115715 NC(=O)[C@H](CO)NCc1cccc2c1cccc2 34a_100000729942_100011261445 [0,1,0,0,0,1|2,0,0]=4 1182 B19R2.1115715 O=C(O)C(CO)NCc1cccc2c1cccc2 269956a_100000187304_100000188474 [0,1,0,0,0,1|1,0,0]=3 1183 B19R2.1115715 O=C(O)C(CO)NCc1cccc2c1ccnc2 269956a_100000187304_100016989825 [0,1,0,0,0,1|2,0,0]=4 1184 B19R2.1115715 O=C(O)C(CO)NCc1cccc2c1nccc2 269956a_100000187304_100000241032 [0,1,0,0,0,1|2,0,0]=4 1185 B19R2.1115715 O=C(O)C(CO)NCc1ccnc2c1cccc2 269956a_100000187304_100015192512 [0,1,0,0,0,1|2,0,0]=4 1186 B19R2.1115715 O=C(O)C(CO)NCc1nccc2c1cccc2 269956a_100000187304_100000033776 [0,1,0,0,0,1|2,0,0]=4 1187 B19R2.1727161 C=C(CNc1cccc2c1cccc2)C(=O)OC 34a_100000185869_100009813391 [0,1,0,0,0,1|1,0,1]=4 1188 B19R2.1727161 C=C(COc1cccc2c1cccc2)C(=O)OC 34a_100000210388_100009813391 [0,1,0,0,0,1|1,0,1]=4 1189 B19R2.1727161 C=C(CSc1cccc2c1cccc2)C(=O)OC 62a_100009813391_100000210605 [0,1,0,0,0,1|1,0,1]=4 1190 B19R2.1727161 CC(OCc1cccc2c1cccc2)C(=O)NN 34a_100000725659_100011261445 [0,1,0,0,0,1|2,0,0]=4 1191 B19R2.1727161 CCC(=O)C(C)OCc1cccc2c1cccc2 7a_100011216843_100000742827 [0,1,0,0,0,1|2,0,0]=4 1192 B19R2.1727161 CCC(=O)C(C)SCc1cccc2c1cccc2 62a_100000742827_100000188474 [0,1,0,0,0,1|2,0,0]=4 1193 B19R2.1727161 CCC(=O)C(C)SCc1cccc2c1cccc2 62a_100011261445_100000742827 [0,1,0,0,0,1|2,0,0]=4 1194 B19R2.1727161 CNC(=O)C(C)NCc1cccc2c1cccc2 34a_100000753325_100000731044 [0,1,0,0,0,1|2,0,0]=4 1195 B19R2.1727161 CNC(=O)C(C)OCc1cccc2c1cccc2 34a_100011216843_100000731044 [0,1,0,0,0,1|2,0,0]=4 1196 B19R2.1727161 CNC(=O)C(C)OCc1cccc2c1cccc2 7a_100011216843_100000209862 [0,1,0,0,0,1|2,0,0]=4 1197 B19R2.1727161 CNC(=O)C(C)SCc1cccc2c1cccc2 62a_100000209862_100000188474 [0,1,0,0,0,1|2,0,0]=4 1198 B19R2.1727161 CNC(=O)C(C)SCc1cccc2c1cccc2 62a_100011261445_100000731044 [0,1,0,0,0,1|2,0,0]=4 1199 B19R2.1727161 CNC(=O)C(F)NCc1cccc2c1cccc2 34a_100000753325_100009813575 [0,1,0,0,0,1|2,0,0]=4 1200 B19R2.1727161 CNC(=O)C(F)OCc1cccc2c1cccc2 34a_100011216843_100009813575 [0,1,0,0,0,1|2,0,0]=4 1201 B19R2.1727161 CNC(=O)C(F)OCc1cccc2c1cccc2 7a_100011216843_100009813575 [0,1,0,0,0,1|2,0,0]=4 1202 B19R2.1727161 CNC(=O)C(F)SCc1cccc2c1cccc2 62a_100009813575_100000188474 [0,1,0,0,0,1|2,0,0]=4 1203 B19R2.1727161 CNC(=O)C(F)SCc1cccc2c1cccc2 62a_100011261445_100009813575 [0,1,0,0,0,1|2,0,0]=4 1204 B19R2.1727161 CNC(=O)[C@@H](C)NCc1cccc2c1cccc2 2230a_100000684985_100011261445 [0,1,0,0,0,1|2,0,0]=4 1205 B19R2.1727161 CNC(=O)[C@@H](C)NCc1cccc2c1cccc2 34a_100000684985_100011261445 [0,1,0,0,0,1|2,0,0]=4 1206 B19R2.1727161 COC(=O)C(=O)CNc1cccc2c1cccc2 34a_100000185869_100011610305 [0,1,0,0,0,1|1,0,1]=4 1207 B19R2.1727161 COC(=O)C(=O)COc1cccc2c1cccc2 34a_100000210388_100011610305 [0,1,0,0,0,1|1,0,1]=4 1208 B19R2.1727161 COC(=O)C(=O)CSc1cccc2c1cccc2 62a_100011610305_100000210605 [0,1,0,0,0,1|1,0,1]=4 1209 B19R2.1727161 COC(=O)C(=O)NCc1cccc2c1cccc2 11a_100000753325_100000024059 [0,1,0,0,0,1|1,0,1]=4 1210 B19R2.1727161 COC(=O)C(=O)NCc1cccc2c1cccc2 1626a_100000753325_100000024059 [0,1,0,0,0,1|1,0,1]=4 1211 B19R2.1727161 COC(=O)C(=O)NCc1cccc2c1cccc2 240690a_100000753325_100000024059 [0,1,0,0,0,1|1,0,1]=4 1212 B19R2.1727161 COC(=O)C(=O)NCc1cccc2c1cccc2 527a_100000753325_100000024059 [0,1,0,0,0,1|1,0,1]=4 1213 B19R2.1727161 COC(=O)C(C)CNc1cccc2c1cccc2 34a_100000185869_100000698445 [0,1,0,0,0,1|1,0,0]=3 1214 B19R2.1727161 COC(=O)C(C)CNc1cccc2c1cccn2 34a_100000183906_100000698445 [0,1,0,0,0,1|2,0,0]=4 1215 B19R2.1727161 COC(=O)C(C)CNc1cccc2c1nccc2 34a_100000181377_100000698445 [0,1,0,0,0,1|2,0,0]=4 1216 B19R2.1727161 COC(=O)C(C)COc1cccc2c1cccc2 34a_100000210388_100000698445 [0,1,0,0,0,1|1,0,0]=3 1217 B19R2.1727161 COC(=O)C(C)COc1cccc2c1cccn2 34a_100011197808_100000698445 [0,1,0,0,0,1|2,0,0]=4 1218 B19R2.1727161 COC(=O)C(C)COc1cccc2c1ccnc2 34a_100011218533_100000698445 [0,1,0,0,0,1|2,0,0]=4 1219 B19R2.1727161 COC(=O)C(C)COc1cccc2c1cncc2 34a_103624766955_100000698445 [0,1,0,0,0,1|2,0,0]=4 1220 B19R2.1727161 COC(=O)C(C)COc1cccc2c1nccc2 34a_100000056035_100000698445 [0,1,0,0,0,1|2,0,0]=4 1221 B19R2.1727161 COC(=O)C(C)COc1cncc2c1cccc2 34a_100000066178_100000698445 [0,1,0,0,0,1|2,0,0]=4 1222 B19R2.1727161 COC(=O)C(C)COc1nccc2c1cccc2 34a_102531767632_100000698445 [0,1,0,0,0,1|2,0,0]=4 1223 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1cccc2 62a_100000698445_100000210605 [0,1,0,0,0,1|1,0,0]=3 1224 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1cccn2 62a_100000698445_100011290932 [0,1,0,0,0,1|2,0,0]=4 1225 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1cccn2 62a_100011290932_100000698445 [0,1,0,0,0,1|2,0,0]=4 1226 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1ccnc2 62a_100000186358_100000698445 [0,1,0,0,0,1|2,0,0]=4 1227 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1ccnc2 62a_100000698445_100000186358 [0,1,0,0,0,1|2,0,0]=4 1228 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1cncc2 62a_100000685578_100000698445 [0,1,0,0,0,1|2,0,0]=4 1229 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1cncc2 62a_100000698445_100000685578 [0,1,0,0,0,1|2,0,0]=4 1230 B19R2.1727161 COC(=O)C(C)CSc1cccc2c1nccc2 62a_100000698445_100011215545 [0,1,0,0,0,1|2,0,0]=4 1231 B19R2.1727161 COC(=O)C(C)CSc1ccnc2c1cccc2 62a_100000698445_100011215880 [0,1,0,0,0,1|2,0,0]=4 1232 B19R2.1727161 COC(=O)C(C)CSc1ccnc2c1cccc2 62a_100011458314_100000698445 [0,1,0,0,0,1|2,0,0]=4 1233 B19R2.1727161 COC(=O)C(C)CSc1cncc2c1cccc2 62a_100000187577_100000698445 [0,1,0,0,0,1|2,0,0]=4 1234 B19R2.1727161 COC(=O)C(C)CSc1cncc2c1cccc2 62a_100000698445_100000187577 [0,1,0,0,0,1|2,0,0]=4 1235 B19R2.1727161 COC(=O)C(C)CSc1nccc2c1cccc2 62a_100000698445_100011934041 [0,1,0,0,0,1|2,0,0]=4 1236 B19R2.1727161 COC(=O)C(C)CSc1nccc2c1cccc2 62a_100011934041_100000698445 [0,1,0,0,0,1|2,0,0]=4 1237 B19R2.1727161 COC(=O)C(C)NCc1cccc2c1cccc2 34a_100000753325_100000211248 [0,1,0,0,0,1|1,0,0]=3 1238 B19R2.1727161 COC(=O)C(C)OCc1cccc2c1cccc2 34a_100011215400_100011261445 [0,1,0,0,0,1|1,0,0]=3 1239 B19R2.1727161 COC(=O)C(C)OCc1cccc2c1cccc2 34a_100011216843_100000211248 [0,1,0,0,0,1|1,0,0]=3 1240 B19R2.1727161 COC(=O)C(C)OCc1cccc2c1cccc2 7a_100011216843_100000211248 [0,1,0,0,0,1|1,0,0]=3 1241 B19R2.1727161 COC(=O)C(C)OCc1cccc2c1cccn2 34a_100000709871_100000211248 [0,1,0,0,0,1|2,0,0]=4 1242 B19R2.1727161 COC(=O)C(C)OCc1cccc2c1ccnc2 34a_100011215400_100016989825 [0,1,0,0,0,1|2,0,0]=4 1243 B19R2.1727161 COC(=O)C(C)OCc1cccc2c1nccc2 34a_100011215400_100000241032 [0,1,0,0,0,1|2,0,0]=4 1244 B19R2.1727161 COC(=O)C(C)OCc1cccc2c1nccc2 34a_100011303629_100000211248 [0,1,0,0,0,1|2,0,0]=4 1245 B19R2.1727161 COC(=O)C(C)OCc1ccnc2c1cccc2 34a_100011215400_100015192512 [0,1,0,0,0,1|2,0,0]=4 1246 B19R2.1727161 COC(=O)C(C)OCc1nccc2c1cccc2 34a_100011215400_100000033776 [0,1,0,0,0,1|2,0,0]=4 1247 B19R2.1727161 COC(=O)C(C)SCc1cccc2c1cccc2 62a_100000211248_100000188474 [0,1,0,0,0,1|1,0,0]=3 1248 B19R2.1727161 COC(=O)C(C)SCc1cccc2c1cccc2 62a_100011261445_100000211248 [0,1,0,0,0,1|1,0,0]=3 1249 B19R2.1727161 COC(=O)C(C)SCc1cccc2c1ccnc2 62a_100000211248_100016989825 [0,1,0,0,0,1|2,0,0]=4 1250 B19R2.1727161 COC(=O)C(C)SCc1cccc2c1ccnc2 62a_100016989825_100000211248 [0,1,0,0,0,1|2,0,0]=4 1251 B19R2.1727161 COC(=O)C(C)SCc1cccc2c1nccc2 62a_100000211248_100000241032 [0,1,0,0,0,1|2,0,0]=4 1252 B19R2.1727161 COC(=O)C(C)SCc1ccnc2c1cccc2 62a_100000211248_100015192512 [0,1,0,0,0,1|2,0,0]=4 1253 B19R2.1727161 COC(=O)C(C)SCc1ccnc2c1cccc2 62a_100015192512_100000211248 [0,1,0,0,0,1|2,0,0]=4 1254 B19R2.1727161 COC(=O)C(C)SCc1nccc2c1cccc2 62a_100000033776_100000211248 [0,1,0,0,0,1|2,0,0]=4 1255 B19R2.1727161 COC(=O)C(C)SCc1nccc2c1cccc2 62a_100000211248_100000033776 [0,1,0,0,0,1|2,0,0]=4 1256 B19R2.4485174 CC(=O)C(C)C(=O)Cc1cccc2c1cccc2 1458a_100000186155_100000179758 [0,1,0,0,0,1|2,0,0]=4 1257 B19R2.4485174 CC(=O)C(C)N(C)Cc1cccc2c1cccc2 2230a_100000741213_100009814033 [0,1,0,0,0,1|2,0,0]=4 1258 B19R2.4485174 CC(=O)C(C)N(C)Cc1cccc2c1cccc2 269982a_100000741213_100009814033 [0,1,0,0,0,1|2,0,0]=4 1259 B19R2.4485174 CC(C(=O)N)C(=O)Cc1cccc2c1cccc2 1458a_100000186155_100000702099 [0,1,0,0,0,1|2,0,0]=4 1260 B19R2.4485174 CC(C(=O)N)N(C)Cc1cccc2c1cccc2 2230a_100000741213_100000702099 [0,1,0,0,0,1|2,0,0]=4 1261 B19R2.4485174 CC(C(=O)N)N(C)Cc1cccc2c1cccc2 269982a_100000741213_100000184083 [0,1,0,0,0,1|2,0,0]=4 1262 B19R2.4485174 CC(C(=O)O)N(C)Cc1cccc2c1cccc2 269956a_100000749554_100000188474 [0,1,0,0,0,1|1,0,0]=3 1263 B19R2.4485174 CC(C(=O)O)N(C)Cc1cccc2c1ccnc2 269956a_100000749554_100016989825 [0,1,0,0,0,1|2,0,0]=4 1264 B19R2.4485174 CC(C(=O)O)N(C)Cc1cccc2c1nccc2 269956a_100000749554_100000241032 [0,1,0,0,0,1|2,0,0]=4 1265 B19R2.4485174 CC(C(=O)O)N(C)Cc1ccnc2c1cccc2 269956a_100000749554_100015192512 [0,1,0,0,0,1|2,0,0]=4 1266 B19R2.4485174 CC(C(=O)O)N(C)Cc1nccc2c1cccc2 269956a_100000749554_100000033776 [0,1,0,0,0,1|2,0,0]=4 1267 B19R2.4485174 CN(Cc1cccc2c1cccc2)C(F)C(=O)N 2230a_100000741213_100009813875 [0,1,0,0,0,1|2,0,0]=4 1268 B19R2.4485174 CN(Cc1cccc2c1cccc2)C(F)C(=O)N 269982a_100000741213_100009813875 [0,1,0,0,0,1|2,0,0]=4 1269 B19R2.4485174 NC(=O)C(F)C(=O)Cc1cccc2c1cccc2 1458a_100000186155_100009813875 [0,1,0,0,0,1|2,0,0]=4 1270 B19R2.4485174 O=C([O-])C(F)C(=O)Cc1cccc2c1cccc2 1458a_100000186155_100020610796 [0,1,0,0,0,1|1,0,1]=4 1271 B19R2.5644310 CC(=O)C(C)OCc1cccc2c1c(ccc2)Br 7a_200009814114_100000179758 [0,1,0,0,0,1|2,0,0]=4 1272 B19R2.5644310 CC(OCc1cccc2c1c(ccc2)Br)C(=O)N 34a_200009814114_100000702099 [0,1,0,0,0,1|2,0,0]=4 1273 B19R2.5644310 CC(OCc1cccc2c1c(ccc2)Br)C(=O)N 7a_200009814114_100000702099 [0,1,0,0,0,1|2,0,0]=4 1274 B19R2.5644310 C[C@@H](NCc1cccc2c1c(ccc2)Cl)C(=O)N 270004a_100000119354_100009850064 [0,1,0,0,0,1|2,0,0]=4 1275 B19R2.5644310 Cc1cccc2c1c(ccc2)CN[C@H](C)C(=O)N 270004a_100000119354_100009842862 [0,1,0,0,0,1|2,0,0]=4 1276 B19R2.5644310 NC(=O)C(F)OCc1cccc2c1c(ccc2)Br 34a_200009814114_100009813875 [0,1,0,0,0,1|2,0,0]=4 1277 B19R2.5644310 NC(=O)C(F)OCc1cccc2c1c(ccc2)Br 7a_200009814114_100009813875 [0,1,0,0,0,1|2,0,0]=4 1278 B19R2.5644310 O=C([O-])C(F)OCc1cccc2c1c(ccc2)Br 34a_200009814114_100020610796 [0,1,0,0,0,1|1,0,1]=4 1279 B19R2.6032385 CC(=O)C(C)(C)OCc1cccc2c1cccc2 34a_100000747739_100011261445 [0,1,0,0,0,1|2,0,0]=4 1280 B19R2.6032385 CC(=O)C(C)(C)OCc1cccc2c1cccc2 7a_100000747739_100011261445 [0,1,0,0,0,1|2,0,0]=4 1281 B19R2.6032385 CC(=O)C(C)(C)OCc1cccc2c1cccc2 7a_100011216843_100000075568 [0,1,0,0,0,1|2,0,0]=4 1282 B19R2.6032385 CC(=O)C(C)(C)SCc1cccc2c1cccc2 62a_100000075568_100000188474 [0,1,0,0,0,1|2,0,0]=4 1283 B19R2.6032385 CC(=O)C(C)(C)SCc1cccc2c1cccc2 62a_100011261445_100000075568 [0,1,0,0,0,1|2,0,0]=4 1284 B19R2.6032385 CC(C)(CNc1cccc2c1cccc2)C(=O)N 34a_100000185869_200009895572 [0,1,0,0,0,1|2,0,0]=4 1285 B19R2.6032385 CC(C)(COc1cccc2c1cccc2)C(=O)N 34a_100000210388_200009895572 [0,1,0,0,0,1|2,0,0]=4 1286 B19R2.6032385 CC(C)(CSc1cccc2c1cccc2)C(=O)N 62a_200009895572_100000210605 [0,1,0,0,0,1|2,0,0]=4 1287 B19R2.6032385 CC(C)(NCc1cccc2c1cccc2)C(=O)N 2230a_100000743658_100011261445 [0,1,0,0,0,1|2,0,0]=4 1288 B19R2.6032385 CC(C)(NCc1cccc2c1cccc2)C(=O)N 34a_100000743658_100011261445 [0,1,0,0,0,1|2,0,0]=4 1289 B19R2.6032385 CC(C)(NCc1cccc2c1cccc2)C(=O)N 34a_100000753325_100000702505 [0,1,0,0,0,1|2,0,0]=4 1290 B19R2.6032385 CC(C)(OCc1cccc2c1cccc2)C(=O)N 34a_100011216843_100000702505 [0,1,0,0,0,1|2,0,0]=4 1291 B19R2.6032385 CC(C)(OCc1cccc2c1cccc2)C(=O)N 34a_100011626353_100011261445 [0,1,0,0,0,1|2,0,0]=4 1292 B19R2.6032385 CC(C)(OCc1cccc2c1cccc2)C(=O)N 7a_100011216843_100000702505 [0,1,0,0,0,1|2,0,0]=4 1293 B19R2.6032385 CC(C)(OCc1cccc2c1cccc2)C(=O)N 7a_100011626353_100011261445 [0,1,0,0,0,1|2,0,0]=4 1294 B19R2.6032385 CC(C)(SCc1cccc2c1cccc2)C(=O)N 62a_100000702505_100000188474 [0,1,0,0,0,1|2,0,0]=4 1295 B19R2.6032385 CC(C)(SCc1cccc2c1cccc2)C(=O)N 62a_100011261445_100000702505 [0,1,0,0,0,1|2,0,0]=4 1296 B19R2.6032385 NC(=O)C(F)(F)OCc1cccc2c1cccc2 7a_100011216843_100009811971 [0,1,0,0,0,1|2,0,0]=4 1297 B19R2.6032385 NC(=O)C(F)(F)SCc1cccc2c1cccc2 62a_100009811971_100000188474 [0,1,0,0,0,1|2,0,0]=4 1298 B19R2.6032385 NC(=O)C(F)(F)SCc1cccc2c1cccc2 62a_100011261445_100009811971 [0,1,0,0,0,1|2,0,0]=4 1299 B19R2.6032385 O=C([O-])C(F)(F)NCc1cccc2c1cccc2 34a_100000753325_100020612412 [0,1,0,0,0,1|1,0,1]=4 1300 B19R2.6032385 O=C([O-])C(F)(F)OCc1cccc2c1cccc2 34a_100011216843_100020612412 [0,1,0,0,0,1|1,0,1]=4 1301 B19R2.6032385 O=C([O-])C(F)(F)SCc1cccc2c1cccc2 62a_100000745680_100000188474 [0,1,0,0,0,1|1,0,1]=4 1302 B19R2.6032385 O=C([O-])C(F)(F)SCc1cccc2c1cccc2 62a_100011261445_100000745680 [0,1,0,0,0,1|1,0,1]=4 1303 B19R2.6041306 CC(=O)C(C)N[C@@H](C)c1cccc2c1cccc2 2230a_100011830313_100009814033 [0,1,0,0,0,1|2,0,0]=4 1304 B19R2.6041306 CC(=O)C(C)O[C@@H](C)c1cccc2c1cccc2 7a_100011852130_100000179758 [0,1,0,0,0,1|2,0,0]=4 1305 B19R2.6041306 CC(N[C@@H](C)c1cccc2c1cccc2)C(=O)N 2230a_100011830313_100000702099 [0,1,0,0,0,1|2,0,0]=4 1306 B19R2.6041306 CC(O[C@@H](C)c1cccc2c1cccc2)C(=O)N 34a_100011852130_100000702099 [0,1,0,0,0,1|2,0,0]=4 1307 B19R2.6041306 CC(O[C@@H](C)c1cccc2c1cccc2)C(=O)N 7a_100011852130_100000702099 [0,1,0,0,0,1|2,0,0]=4 1308 B19R2.6041306 C[C@H](NC(F)C(=O)N)c1cccc2c1cccc2 2230a_100011830313_100009813875 [0,1,0,0,0,1|2,0,0]=4 1309 B19R2.6041306 C[C@H](OC(F)C(=O)N)c1cccc2c1cccc2 34a_100011852130_100009813875 [0,1,0,0,0,1|2,0,0]=4 1310 B19R2.6041306 C[C@H](OC(F)C(=O)N)c1cccc2c1cccc2 7a_100011852130_100009813875 [0,1,0,0,0,1|2,0,0]=4 1311 B19R2.6041306 C[C@H](OC(F)C(=O)[O-])c1cccc2c1cccc2 34a_100011852130_100020610796 [0,1,0,0,0,1|1,0,1]=4 1312 B19R2.103716 Cc1ccc2ccccc2c1CN(C)CC(=O)O 269956a_100000746989_100000689653 [0,1,0,0,0,1|2,0,0]=4 1313 B19R2.922499 CN(CC(=O)O)Cc1ccc(c2c1cccc2)Br 269956a_100000746989_100012352185 [0,1,0,0,0,1|2,0,0]=4 1314 B19R2.922499 CN(CC(=O)O)Cc1ccc(c2c1cccc2)F 269956a_100000746989_100011988723 [0,1,0,0,0,1|2,0,0]=4 1315 B19R2.922499 Cc1ccc(c2c1cccc2)CN(C)CC(=O)O 269956a_100000746989_100012073487 [0,1,0,0,0,1|2,0,0]=4 1316 B19R2.1133990 COC(=O)CC(=O)Cc1cccc2c1cccc2 1458a_100000186155_100000747449 [0,1,0,0,0,1|1,0,1]=4 1317 B19R2.1133990 COC(=O)CC(=O)Cc1cccc2c1cccc2 1458a_100000211351_100000188474 [0,1,0,0,0,1|1,0,1]=4 1318 B19R2.1133990 COC(=O)CC(C)Nc1cccc2c1cccc2 34a_100000185869_100009817358 [0,1,0,0,0,1|2,0,0]=4 1319 B19R2.1133990 COC(=O)CC(C)Oc1cccc2c1cccc2 34a_100000210388_100009817358 [0,1,0,0,0,1|2,0,0]=4 1320 B19R2.1133990 COC(=O)CC(C)Oc1cccc2c1cccc2 7a_100000210388_100009817358 [0,1,0,0,0,1|2,0,0]=4 1321 B19R2.1133990 COC(=O)CC(C)Sc1cccc2c1cccc2 62a_100009817358_100000210605 [0,1,0,0,0,1|2,0,0]=4 1322 B19R2.1133990 COC(=O)CN(C)Cc1cccc2c1cccc2 2230a_100000198492_100011261445 [0,1,0,0,0,1|2,0,0]=4 1323 B19R2.1133990 COC(=O)CN(C)Cc1cccc2c1cccc2 2230a_100000741213_100000747449 [0,1,0,0,0,1|2,0,0]=4 1324 B19R2.1133990 COC(=O)CN(C)Cc1cccc2c1cccc2 269982a_100000741213_100000747449 [0,1,0,0,0,1|2,0,0]=4 1325 B19R2.1133990 COC(=O)CN(C)Cc1cccc2c1cccc2 270004a_100000198492_100000210074 [0,1,0,0,0,1|2,0,0]=4 1326 B19R2.1742922 CCN(CC(=O)O)Cc1cccc2c1cccc2 269956a_100000746405_100000188474 [0,1,0,0,0,1|2,0,0]=4 1327 B19R2.205193 COC(=O)C(C)Nc1cccc2c1ccc(c2)Br 34a_100010090037_100000211248 [0,2,0,0,0,0|2,0,0]=4 1328 B19R2.205193 COC(=O)C(C)Nc1cccc2c1ccc(c2)O 34a_100000034668_100000211248 [0,2,0,0,0,0|2,0,0]=4 1329 B19R2.205193 COC(=O)C(C)Oc1cccc2c1ccc(c2)Br 34a_100010202202_100000211248 [0,2,0,0,0,0|2,0,0]=4 1330 B19R2.205193 COC(=O)C(C)Oc1cccc2c1ccc(c2)Br 7a_100010202202_100000211248 [0,2,0,0,0,0|2,0,0]=4 1331 B19R2.205193 COC(=O)C(C)Oc1cccc2c1ccc(c2)F 34a_100009846233_100000211248 [0,2,0,0,0,0|2,0,0]=4 1332 B19R2.205193 COC(=O)C(C)Oc1cccc2c1ccc(c2)F 7a_100009846233_100000211248 [0,2,0,0,0,0|2,0,0]=4 1333 B19R2.205193 COC(=O)C(C)Oc1cccc2c1ccc(c2)N 34a_100000035793_100000211248 [0,2,0,0,0,0|2,0,0]=4 1334 B19R2.470437 COC(=O)C(C)Nc1cc(cc2c1cccc2)Br 34a_100010171453_100000211248 [0,2,0,0,0,0|2,0,0]=4 1335 B19R2.470437 COC(=O)C(C)Oc1cc(cc2c1cccc2)Br 34a_100010089979_100000211248 [0,2,0,0,0,0|2,0,0]=4 1336 B19R2.470437 COC(=O)C(C)Oc1cc(cc2c1cccc2)Br 7a_100010089979_100000211248 [0,2,0,0,0,0|2,0,0]=4 1337 B19R2.470437 COC(=O)C(C)Sc1cc(cc2c1cccc2)N 62a_100000211248_100010089974 [0,2,0,0,0,0|2,0,0]=4 1338 B19R2.470437 COC(=O)C(C)Sc1cc(cc2c1cccc2)N 62a_100010089974_100000211248 [0,2,0,0,0,0|2,0,0]=4 1339 B19R2.470437 COC(=O)C(C)Sc1cc(cc2c1cccc2)O 62a_100000211248_100010001680 [0,2,0,0,0,0|2,0,0]=4 1340 B19R2.1724139 COC(=O)C(C)Nc1c(ccc2c1cccc2)Br 34a_100009817101_100000211248 [0,2,0,0,0,0|2,0,0]=4 1341 B19R2.1724139 COC(=O)C(C)Nc1c(ccc2c1cccc2)C 34a_100000688109_100000211248 [0,2,0,0,0,0|2,0,0]=4 1342 B19R2.1724139 COC(=O)C(C)Nc1c(ccc2c1cccc2)Cl 34a_200009860907_100000211248 [0,2,0,0,0,0|2,0,0]=4 1343 B19R2.1724139 COC(=O)C(C)Nc1c(ccc2c1cccc2)O 34a_100000007056_100000211248 [0,2,0,0,0,0|2,0,0]=4 1344 B19R2.1724139 COC(=O)C(C)Oc1c(ccc2c1cccc2)Br 34a_100009996032_100000211248 [0,2,0,0,0,0|2,0,0]=4 1345 B19R2.1724139 COC(=O)C(C)Oc1c(ccc2c1cccc2)Br 7a_100009996032_100000211248 [0,2,0,0,0,0|2,0,0]=4 1346 B19R2.1724139 COC(=O)C(C)Oc1c(ccc2c1cccc2)C 34a_100000039261_100000211248 [0,2,0,0,0,0|2,0,0]=4 1347 B19R2.1724139 COC(=O)C(C)Oc1c(ccc2c1cccc2)C 7a_100000039261_100000211248 [0,2,0,0,0,0|2,0,0]=4 1348 B19R2.1724139 COC(=O)C(C)Oc1c(ccc2c1cccc2)N 34a_100000007060_100000211248 [0,2,0,0,0,0|2,0,0]=4 1349 B19R2.1724139 COC(=O)C(C)Sc1c(ccc2c1cccc2)Br 62a_100000211248_100010090040 [0,2,0,0,0,0|2,0,0]=4 1350 B19R2.1724139 COC(=O)C(C)Sc1c(ccc2c1cccc2)Br 62a_100010090040_100000211248 [0,2,0,0,0,0|2,0,0]=4 1351 B19R2.1724139 COC(=O)C(C)Sc1c(ccc2c1cccc2)C 62a_100000211248_100000759710 [0,2,0,0,0,0|2,0,0]=4 1352 B19R2.1724139 COC(=O)C(C)Sc1c(ccc2c1cccc2)C 62a_100000759710_100000211248 [0,2,0,0,0,0|2,0,0]=4 1353 B19R2.1724139 COC(=O)C(C)Sc1c(ccc2c1cccc2)N 62a_100000211248_100000705303 [0,2,0,0,0,0|2,0,0]=4 1354 B19R2.1724139 COC(=O)C(C)Sc1c(ccc2c1cccc2)N 62a_100000705303_100000211248 [0,2,0,0,0,0|2,0,0]=4 1355 B19R2.1724139 COC(=O)C(C)Sc1c(ccc2c1cccc2)O 62a_100000211248_100000183829 [0,2,0,0,0,0|2,0,0]=4 1356 B19R2.1725181 COC(=O)C(C)Nc1cccc2c1cc(cc2)Br 34a_100010090012_100000211248 [0,2,0,0,0,0|2,0,0]=4 1357 B19R2.1725181 COC(=O)C(C)Nc1cccc2c1cc(cc2)O 34a_100000034012_100000211248 [0,2,0,0,0,0|2,0,0]=4 1358 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)Br 34a_100010089991_100000211248 [0,2,0,0,0,0|2,0,0]=4 1359 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)Br 7a_100010089991_100000211248 [0,2,0,0,0,0|2,0,0]=4 1360 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)C 34a_100000040781_100000211248 [0,2,0,0,0,0|2,0,0]=4 1361 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)C 7a_100000040781_100000211248 [0,2,0,0,0,0|2,0,0]=4 1362 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)Cl 34a_100009840344_100000211248 [0,2,0,0,0,0|2,0,0]=4 1363 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)Cl 7a_100009840344_100000211248 [0,2,0,0,0,0|2,0,0]=4 1364 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)F 34a_100009881884_100000211248 [0,2,0,0,0,0|2,0,0]=4 1365 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)F 7a_100009881884_100000211248 [0,2,0,0,0,0|2,0,0]=4 1366 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)N 34a_100132313934_100000211248 [0,2,0,0,0,0|2,0,0]=4 1367 B19R2.1725181 COC(=O)C(C)Oc1cccc2c1cc(cc2)N 7a_100132313934_100000211248 [0,2,0,0,0,0|2,0,0]=4 1368 B19R2.1725181 COC(=O)C(C)Sc1cccc2c1cc(cc2)O 62a_100000211248_100010169565 [0,2,0,0,0,0|2,0,0]=4 1369 B19R2.205197 COC(=O)C(C)Nc1cccc2c1cccc2Br 34a_100009816864_100000211248 [0,2,0,0,0,0|2,0,0]=4 1370 B19R2.205197 COC(=O)C(C)Nc1cccc2c1cccc2Cl 34a_100000077128_100000211248 [0,2,0,0,0,0|2,0,0]=4 1371 B19R2.205197 COC(=O)C(C)Nc1cccc2c1cccc2O 34a_100000210686_100000211248 [0,2,0,0,0,0|2,0,0]=4 1372 B19R2.205197 COC(=O)C(C)Oc1cccc2c1cccc2Br 34a_100010003857_100000211248 [0,2,0,0,0,0|2,0,0]=4 1373 B19R2.205197 COC(=O)C(C)Oc1cccc2c1cccc2Br 7a_100010003857_100000211248 [0,2,0,0,0,0|2,0,0]=4 1374 B19R2.205197 COC(=O)C(C)Oc1cccc2c1cccc2N 34a_100000210686_100000211248 [0,2,0,0,0,0|2,0,0]=4 1375 B19R2.205197 COC(=O)C(C)Sc1cccc2c1cccc2F 62a_100000211248_100009817034 [0,2,0,0,0,0|2,0,0]=4 1376 B19R2.205197 COC(=O)C(C)Sc1cccc2c1cccc2F 62a_100009817034_100000211248 [0,2,0,0,0,0|2,0,0]=4 1377 B19R2.205197 COC(=O)C(C)Sc1cccc2c1cccc2N 62a_100009816864_100000211248 [0,2,0,0,0,0|2,0,0]=4 1378 B19R2.205197 COC(=O)C(C)Sc1cccc2c1cccc2O 62a_100000211248_100010003857 [0,2,0,0,0,0|2,0,0]=4 1379 B19R2.470430 COC(=O)C(C)Nc1ccc(c2c1cccc2)Br 34a_100000766797_100000211248 [0,2,0,0,0,0|2,0,0]=4 1380 B19R2.470430 COC(=O)C(C)Nc1ccc(c2c1cccc2)Cl 34a_100011216319_100000211248 [0,2,0,0,0,0|2,0,0]=4 1381 B19R2.470430 COC(=O)C(C)Nc1ccc(c2c1cccc2)F 34a_100011988692_100000211248 [0,2,0,0,0,0|2,0,0]=4 1382 B19R2.470430 COC(=O)C(C)Nc1ccc(c2c1cccc2)O 34a_100000705857_100000211248 [0,2,0,0,0,0|2,0,0]=4 1383 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)Br 34a_100000186334_100000211248 [0,2,0,0,0,0|2,0,0]=4 1384 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)Br 7a_100000186334_100000211248 [0,2,0,0,0,0|2,0,0]=4 1385 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)C 34a_100000074455_100000211248 [0,2,0,0,0,0|2,0,0]=4 1386 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)C 7a_100000074455_100000211248 [0,2,0,0,0,0|2,0,0]=4 1387 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)Cl 34a_100000211000_100000211248 [0,2,0,0,0,0|2,0,0]=4 1388 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)Cl 7a_100000211000_100000211248 [0,2,0,0,0,0|2,0,0]=4 1389 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)F 34a_100000100223_100000211248 [0,2,0,0,0,0|2,0,0]=4 1390 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)F 7a_100000100223_100000211248 [0,2,0,0,0,0|2,0,0]=4 1391 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)N 34a_100000705857_100000211248 [0,2,0,0,0,0|2,0,0]=4 1392 B19R2.470430 COC(=O)C(C)Oc1ccc(c2c1cccc2)N 7a_100000705857_100000211248 [0,2,0,0,0,0|2,0,0]=4 1393 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)Br 62a_100000211248_100012339872 [0,2,0,0,0,0|2,0,0]=4 1394 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)Br 62a_100012339872_100000211248 [0,2,0,0,0,0|2,0,0]=4 1395 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)C 62a_100000211248_100011215156 [0,2,0,0,0,0|2,0,0]=4 1396 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)C 62a_100011215156_100000211248 [0,2,0,0,0,0|2,0,0]=4 1397 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)F 62a_100000211248_100011218216 [0,2,0,0,0,0|2,0,0]=4 1398 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)F 62a_100011218216_100000211248 [0,2,0,0,0,0|2,0,0]=4 1399 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)N 62a_100000766797_100000211248 [0,2,0,0,0,0|2,0,0]=4 1400 B19R2.470430 COC(=O)C(C)Sc1ccc(c2c1cccc2)O 62a_100000211248_100000186334 [0,2,0,0,0,0|2,0,0]=4 1401 B19R2.1725139 COC(=O)C(C)Nc1cccc2c1c(ccc2)Br 34a_100010002837_100000211248 [0,2,0,0,0,0|2,0,0]=4 1402 B19R2.1725139 COC(=O)C(C)Nc1cccc2c1c(ccc2)C 34a_100009841044_100000211248 [0,2,0,0,0,0|2,0,0]=4 1403 B19R2.1725139 COC(=O)C(C)Nc1cccc2c1c(ccc2)C 7a_100009841044_100000211248 [0,2,0,0,0,0|2,0,0]=4 1404 B19R2.1725139 COC(=O)C(C)Nc1cccc2c1c(ccc2)Cl 34a_100009857565_100000211248 [0,2,0,0,0,0|2,0,0]=4 1405 B19R2.1725139 COC(=O)C(C)Nc1cccc2c1c(ccc2)F 34a_100009878580_100000211248 [0,2,0,0,0,0|2,0,0]=4 1406 B19R2.1725139 COC(=O)C(C)Nc1cccc2c1c(ccc2)F 7a_100009878580_100000211248 [0,2,0,0,0,0|2,0,0]=4 1407 B19R2.1725139 COC(=O)C(C)Oc1cccc2c1c(ccc2)Br 34a_100010089961_100000211248 [0,2,0,0,0,0|2,0,0]=4 1408 B19R2.1725139 COC(=O)C(C)Oc1cccc2c1c(ccc2)Br 7a_100010089961_100000211248 [0,2,0,0,0,0|2,0,0]=4 1409 B19R2.1725139 COC(=O)C(C)Sc1cccc2c1c(ccc2)Br 62a_100000211248_100010243825 [0,2,0,0,0,0|2,0,0]=4 1410 B19R2.1725139 COC(=O)C(C)Sc1cccc2c1c(ccc2)Br 62a_100010243825_100000211248 [0,2,0,0,0,0|2,0,0]=4 1411 B19R2.1725139 COC(=O)C(C)Sc1cccc2c1c(ccc2)C 62a_100000211248_100009995290 [0,2,0,0,0,0|2,0,0]=4 1412 B19R2.1725139 COC(=O)C(C)Sc1cccc2c1c(ccc2)F 62a_100000211248_100010177852 [0,2,0,0,0,0|2,0,0]=4 1413 B19R2.1725139 COC(=O)C(C)Sc1cccc2c1c(ccc2)F 62a_100010177852_100000211248 [0,2,0,0,0,0|2,0,0]=4 1414 B19R2.1725139 COC(=O)C(C)Sc1cccc2c1c(ccc2)N 62a_100010002837_100000211248 [0,2,0,0,0,0|2,0,0]=4 1415 B19R2.1725139 COC(=O)C(C)Sc1cccc2c1c(ccc2)O 62a_100000211248_100010089961 [0,2,0,0,0,0|2,0,0]=4 1416 B19R2.3030928 COC(=O)C(C)(C)Sc1cccc2c1cccc2 62a_100000689032_100000210605 [0,2,0,0,0,0|2,0,0]=4 1417 B19R2.3030928 COC(=O)C(C)(F)Nc1cccc2c1cccc2 34a_100000185869_200009867631 [0,2,0,0,0,0|2,0,0]=4 1418 B19R2.3030928 COC(=O)C(C)(F)Oc1cccc2c1cccc2 34a_100000210388_200009867631 [0,2,0,0,0,0|2,0,0]=4 1419 B19R2.3030928 COC(=O)C(C)(F)Sc1cccc2c1cccc2 62a_200009867631_100000210605 [0,2,0,0,0,0|2,0,0]=4 1420 B19R2.3030928 COC(=O)C(F)(F)Nc1cccc2c1cccc2 34a_100000185869_100000211177 [0,2,0,0,0,0|2,0,0]=4 1421 B19R2.3030928 COC(=O)C(F)(F)Oc1cccc2c1cccc2 34a_100000210388_100000211177 [0,2,0,0,0,0|2,0,0]=4 1422 B19R2.3030928 COC(=O)C(F)(F)Oc1cccc2c1cccc2 7a_100000210388_100000211177 [0,2,0,0,0,0|2,0,0]=4 1423 B19R2.3030928 COC(=O)C(F)(F)Sc1cccc2c1cccc2 62a_100000211177_100000210605 [0,2,0,0,0,0|2,0,0]=4 1424 B19R2.3470687 CC(Oc1cccc2c1cccc2)C(=O)CCO 1458a_100000216494_100000211926 [0,2,0,0,0,0|2,0,0]=4 1425 B19R2.3470687 CCOC(=O)C(C)Nc1cccc2c1cccc2 34a_100000185869_100011216346 [0,2,0,0,0,0|2,0,0]=4 1426 B19R2.3470687 CCOC(=O)C(C)Oc1cccc2c1cccc2 34a_100000210388_100011216346 [0,2,0,0,0,0|2,0,0]=4 1427 B19R2.3470687 CCOC(=O)C(C)Oc1cccc2c1cccc2 7a_100000210388_100011216346 [0,2,0,0,0,0|2,0,0]=4 1428 B19R2.3470687 CCOC(=O)C(C)Sc1cccc2c1cccc2 62a_100011216346_100000210605 [0,2,0,0,0,0|2,0,0]=4 1429 B19R2.3470687 CCOC(=O)C(F)Nc1cccc2c1cccc2 34a_100000185869_100000760018 [0,2,0,0,0,0|2,0,0]=4 1430 B19R2.3470687 CCOC(=O)C(F)Oc1cccc2c1cccc2 34a_100000210388_100000760018 [0,2,0,0,0,0|2,0,0]=4 1431 B19R2.3470687 CCOC(=O)C(F)Oc1cccc2c1cccc2 7a_100000210388_100000040065 [0,2,0,0,0,0|2,0,0]=4 1432 B19R2.3470687 CCOC(=O)C(F)Sc1cccc2c1cccc2 62a_100000760018_100000210605 [0,2,0,0,0,0|2,0,0]=4 1433 B19R2.3470687 CN(Cc1cccc2c1cccc2)C(=O)CCO 240690a_100000741213_100011216618 [0,2,0,0,0,0|2,0,0]=4 1434 B19R2.3470687 COCC(=O)N(C)Cc1cccc2c1cccc2 11a_100000741213_100000210968 [0,2,0,0,0,0|2,0,0]=4 1435 B19R2.3470687 COCC(=O)N(C)Cc1cccc2c1cccc2 240690a_100000741213_100000210968 [0,2,0,0,0,0|2,0,0]=4 1436 B19R2.3470687 COCC(=O)N(C)Cc1cccc2c1cccc2 527a_100000741213_100000210968 [0,2,0,0,0,0|2,0,0]=4 1437 B19R2.3680245 COC(=O)C(C)C(=O)c1cccc2c1cccc2 1458a_100000210949_100000211248 [0,2,0,0,0,0|1,0,1]=4 1438 B19R2.3680245 COC(=O)C(C)N(C)c1cccc2c1cccc2 2230a_100000220138_100000211248 [0,2,0,0,0,0|2,0,0]=4 1439 B19R2.3680245 COC(=O)C(C)N(C)c1cccc2c1cccc2 269982a_100000220138_100000211248 [0,2,0,0,0,0|2,0,0]=4 1440 B19R2.3680245 COC(=O)C(C)N(C)c1cccc2c1cccc2 34a_100000220138_100000211248 [0,2,0,0,0,0|2,0,0]=4 1441 B19R2.3680245 C[C@H](c1cccc2c1cccc2)N(C)C(=O)CO 240690a_100009815097_100000210174 [0,2,0,0,0,0|2,0,0]=4 1442 B19R2.3680245 C[C@H](c1cccc2c1cccc2)N(C)C(=O)CO 527a_100009815097_100000210174 [0,2,0,0,0,0|2,0,0]=4 1443 B19R2.7042453 CCC(Nc1cccc2c1cccc2)C(=O)OC 34a_100000185869_100000235869 [0,2,0,0,0,0|2,0,0]=4 1444 B19R2.7042453 CCC(Oc1cccc2c1cccc2)C(=O)OC 34a_100000210388_100000235869 [0,2,0,0,0,0|2,0,0]=4 1445 B19R2.7042453 CCC(Oc1cccc2c1cccc2)C(=O)OC 7a_100000210388_100000742303 [0,2,0,0,0,0|2,0,0]=4 1446 B19R2.7042453 CCC(Sc1cccc2c1cccc2)C(=O)OC 62a_100000235869_100000210605 [0,2,0,0,0,0|2,0,0]=4 1447 B19R2.7042453 COC(=O)C(C=O)Nc1cccc2c1cccc2 34a_100000185869_100000046368 [0,2,0,0,0,0|2,0,0]=4 1448 B19R2.7042453 COC(=O)C(C=O)Oc1cccc2c1cccc2 34a_100000210388_100000046368 [0,2,0,0,0,0|2,0,0]=4 1449 B19R2.7042453 COC(=O)C(C=O)Sc1cccc2c1cccc2 62a_100000046368_100000210605 [0,2,0,0,0,0|2,0,0]=4 1450 B19R2.7042453 COC(=O)C(CO)Nc1cccc2c1cccc2 34a_100000185869_100012276630 [0,2,0,0,0,0|2,0,0]=4 1451 B19R2.7042453 COC(=O)C(CO)Oc1cccc2c1cccc2 34a_100000210388_100012276630 [0,2,0,0,0,0|2,0,0]=4 1452 B19R2.7042453 COC(=O)C(CO)Sc1cccc2c1cccc2 62a_100012276630_100000210605 [0,2,0,0,0,0|2,0,0]=4 1453 B19R2.7042453 COC(=O)C(Nc1cccc2c1cccc2)OC 34a_100000185869_100000101307 [0,2,0,0,0,0|2,0,0]=4 1454 B19R2.7042453 COC(=O)C(OC)Oc1cccc2c1cccc2 34a_100000210388_100000101307 [0,2,0,0,0,0|2,0,0]=4 1455 B19R2.7042453 COC(=O)C(OC)Sc1cccc2c1cccc2 62a_100000101307_100000210605 [0,2,0,0,0,0|2,0,0]=4 1456 B19R3.175 O=C1CCC1NCc2cccc3c2cccc3 34a_100000753325_100009892977 [0,0,0,1,0,1|2,0,0]=4 1457 B19R3.175 O=C1CCC1OCc2cccc3c2cccc3 34a_100011216843_100009892977 [0,0,0,1,0,1|2,0,0]=4 1458 B19R3.175 O=C1CCC1OCc2cccc3c2cccc3 7a_100011216843_100009892977 [0,0,0,1,0,1|2,0,0]=4 1459 B19R3.175 O=C1CCC1SCc2cccc3c2cccc3 62a_100009892977_100000188474 [0,0,0,1,0,1|2,0,0]=4 1460 B19R3.175 O=C1CCC1SCc2cccc3c2cccc3 62a_100011261445_100009892977 [0,0,0,1,0,1|2,0,0]=4 1461 B19R3.83 O=C1OCC(O1)Nc2cccc3c2cccc3 34a_100000185869_100000032252 [0,0,0,1,0,1|2,0,0]=4 1462 B19R3.83 O=C1OCC(O1)Oc2cccc3c2cccc3 34a_100000210388_100000032252 [0,0,0,1,0,1|2,0,0]=4 1463 B19R3.163 O=C1OCCC1Nc2cccc3c2cccc3 34a_100000185869_100000211211 [0,1,0,1,0,0|2,0,0]=4 1464 B19R3.163 O=C1OCCC1Oc2cccc3c2cccc3 34a_100000210388_100000211211 [0,1,0,1,0,0|2,0,0]=4 1465 B19R3.163 O=C1OCCC1Oc2cccc3c2cccc3 7a_100000210388_100000211211 [0,1,0,1,0,0|2,0,0]=4 1466 B19R3.163 O=C1OCCC1Sc2cccc3c2cccc3 62a_100000211211_100000210605 [0,1,0,1,0,0|2,0,0]=4 1467 B19R3.1022158 O=C(CO)N1Cc2cccc3c2c(ccc3)C1 240690a_100102583503_100000210174 [0,1,0,1,0,0|2,0,0]=4 1468 B19R3.1022158 O=C(CO)N1Cc2cccc3c2c(ccc3)C1 527a_100102583503_100000210174 [0,1,0,1,0,0|2,0,0]=4 1469 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000070787_100011218569 [1,0,0,0,1,0|2,0,0]=4 1470 B15R2.6 CC(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200000210301 [1,0,0,0,1,0|2,0,0]=4 1471 B15R2.6 CC(=O)CCn1ccc2c1cccc2 1458a_100000186764_200000210301 [1,0,0,0,1,0|2,0,0]=4 1472 B15R2.6 [13CH3]C(=O)CCc1c[nH]c2c1cccc2 1458a_100000211458_200025704644 [1,0,0,0,1,0|2,0,0]=4 1473 B15R2.6 [13CH3]C(=O)CCn1ccc2c1cccc2 1458a_100000186764_200025704644 [1,0,0,0,1,0|2,0,0]=4 1474 B17R2.291558 C=C(C)CCNc1cccc2c1cccc2 34a_100000185869_100000730704 [1,0,0,0,0,1|2,0,0]=4 1475 B17R2.291558 C=C(C)CCOc1cccc2c1cccc2 34a_100000210388_100000730704 [1,0,0,0,0,1|2,0,0]=4 1476 B17R2.291558 C=C(C)CCOc1cccc2c1cccc2 7a_100000210388_100000730704 [1,0,0,0,0,1|2,0,0]=4 1477 B17R2.291558 C=C(C)CCSc1cccc2c1cccc2 62a_100000730704_100000210605 [1,0,0,0,0,1|2,0,0]=4 1478 B17R2.291558 C=C(C)CNCc1cccc2c1cccc2 34a_100000753325_100000748629 [1,0,0,0,0,1|2,0,0]=4 1479 B17R2.291558 C=C(C)COCc1cccc2c1cccc2 34a_100000210245_100011261445 [1,0,0,0,0,1|2,0,0]=4 1480 B17R2.291558 C=C(C)COCc1cccc2c1cccc2 34a_100011216843_100000748629 [1,0,0,0,0,1|2,0,0]=4 1481 B17R2.291558 C=C(C)COCc1cccc2c1cccc2 7a_100011216843_100000748629 [1,0,0,0,0,1|2,0,0]=4 1482 B17R2.291558 C=C(C)CSCc1cccc2c1cccc2 62a_100000748629_100000188474 [1,0,0,0,0,1|2,0,0]=4 1483 B17R2.291558 C=C(C)CSCc1cccc2c1cccc2 62a_100011261445_100000211660 [1,0,0,0,0,1|2,0,0]=4 1484 B17R2.291558 C=C(F)CNCc1cccc2c1cccc2 34a_100000753325_100009893438 [1,0,0,0,0,1|2,0,0]=4 1485 B17R2.291558 C=C(F)COCc1cccc2c1cccc2 34a_100011216843_100009893438 [1,0,0,0,0,1|2,0,0]=4 1486 B17R2.291558 C=C(F)COCc1cccc2c1cccc2 34a_200010262243_100011261445 [1,0,0,0,0,1|2,0,0]=4 1487 B17R2.291558 C=C(F)COCc1cccc2c1cccc2 7a_100011216843_100000042424 [1,0,0,0,0,1|2,0,0]=4 1488 B17R2.291558 C=C(F)CSCc1cccc2c1cccc2 62a_100000042424_100000188474 [1,0,0,0,0,1|2,0,0]=4 1489 B17R2.291558 C=C(F)CSCc1cccc2c1cccc2 62a_100011261445_100000042424 [1,0,0,0,0,1|2,0,0]=4 1490 B17R2.291558 CC(=O)CCOc1cccc2c1cccc2 1458a_100000070787_100000745918 [1,0,0,0,0,1|1,0,0]=3 1491 B17R2.291558 CC(=O)CCOc1cccc2c1cccc2 1458a_100000737181_200000210301 [1,0,0,0,0,1|1,0,0]=3 1492 B17R2.291558 CC(=O)CCOc1cccc2c1cccc2 7a_100000210388_100000053229 [1,0,0,0,0,1|1,0,0]=3 1493 B17R2.291558 CC(=O)CCOc1cncc2c1cccc2 7a_100000066178_100000053229 [1,0,0,0,0,1|2,0,0]=4 1494 B17R2.291558 CC(=O)CCSc1cccc2c1cccc2 62a_100000053229_100000210605 [1,0,0,0,0,1|1,0,0]=3 1495 B17R2.291558 CC(=O)CCSc1cccc2c1cccn2 62a_100000053229_100011290932 [1,0,0,0,0,1|2,0,0]=4 1496 B17R2.291558 CC(=O)CCSc1cccc2c1cccn2 62a_100011290932_100000053229 [1,0,0,0,0,1|2,0,0]=4 1497 B17R2.291558 CC(=O)CCSc1cccc2c1ccnc2 62a_100000053229_100000186358 [1,0,0,0,0,1|2,0,0]=4 1498 B17R2.291558 CC(=O)CCSc1cccc2c1ccnc2 62a_100000186358_100000053229 [1,0,0,0,0,1|2,0,0]=4 1499 B17R2.291558 CC(=O)CCSc1cccc2c1cncc2 62a_100000053229_100000685578 [1,0,0,0,0,1|2,0,0]=4 1500 B17R2.291558 CC(=O)CCSc1cccc2c1cncc2 62a_100000685578_100000053229 [1,0,0,0,0,1|2,0,0]=4 1501 B17R2.291558 CC(=O)CCSc1cccc2c1nccc2 62a_100000053229_100011215545 [1,0,0,0,0,1|2,0,0]=4 1502 B17R2.291558 CC(=O)CCSc1ccnc2c1cccc2 62a_100000053229_100011215880 [1,0,0,0,0,1|2,0,0]=4 1503 B17R2.291558 CC(=O)CCSc1ccnc2c1cccc2 62a_100011458314_100000053229 [1,0,0,0,0,1|2,0,0]=4 1504 B17R2.291558 CC(=O)CCSc1cncc2c1cccc2 62a_100000053229_100000187577 [1,0,0,0,0,1|2,0,0]=4 1505 B17R2.291558 CC(=O)CCSc1cncc2c1cccc2 62a_100000187577_100000053229 [1,0,0,0,0,1|2,0,0]=4 1506 B17R2.291558 CC(=O)CCSc1nccc2c1cccc2 62a_100000053229_100011934041 [1,0,0,0,0,1|2,0,0]=4 1507 B17R2.291558 CC(=O)CCSc1nccc2c1cccc2 62a_100011934041_100000053229 [1,0,0,0,0,1|2,0,0]=4 1508 B17R2.291558 CC(=O)COCc1cccc2c1cccc2 34a_100000211253_100011261445 [1,0,0,0,0,1|1,0,0]=3 1509 B17R2.291558 CC(=O)COCc1cccc2c1ccnc2 34a_100000211253_100016989825 [1,0,0,0,0,1|2,0,0]=4 1510 B17R2.291558 CC(=O)COCc1cccc2c1nccc2 34a_100000211253_100000241032 [1,0,0,0,0,1|2,0,0]=4 1511 B17R2.291558 CC(=O)COCc1ccnc2c1cccc2 34a_100000211253_100015192512 [1,0,0,0,0,1|2,0,0]=4 1512 B17R2.291558 CC(=O)COCc1nccc2c1cccc2 34a_100000211253_100000033776 [1,0,0,0,0,1|2,0,0]=4 1513 B17R2.291558 CC(=O)CSCc1cccc2c1cccc2 1458a_200000150182_200000210301 [1,0,0,0,0,1|1,0,0]=3 1514 B17R2.291558 CC(=O)NCCc1cccc2c1cccc2 11a_100000751862_100015343762 [1,0,0,0,0,1|1,0,0]=3 1515 B17R2.291558 CC(=O)NCCc1cccc2c1cccc2 1626a_100000751862_100015343762 [1,0,0,0,0,1|1,0,0]=3 1516 B17R2.291558 CC(=O)NCCc1cccc2c1cccc2 240690a_100000751862_100015343762 [1,0,0,0,0,1|1,0,0]=3 1517 B17R2.291558 CC(=O)NCCc1cccc2c1cccc2 527a_100000751862_100103153847 [1,0,0,0,0,1|1,0,0]=3 1518 B17R2.291558 CC(=O)NNCc1cccc2c1cccc2 22a_100025742020_100000070787 [1,0,0,0,0,1|2,0,0]=4 1519 B17R2.291558 CC(=O)OCNc1cccc2c1cccc2 34a_100000185869_100009813279 [1,0,0,0,0,1|2,0,0]=4 1520 B17R2.291558 CC(=O)OCOc1cccc2c1cccc2 34a_100000210388_100009813279 [1,0,0,0,0,1|2,0,0]=4 1521 B17R2.291558 CC(=O)OCSc1cccc2c1cccc2 62a_100000076356_100000210605 [1,0,0,0,0,1|2,0,0]=4 1522 B17R2.291558 CC(O)CCNc1cccc2c1cccc2 34a_100000185869_100012276601 [1,0,0,0,0,1|1,0,1]=4 1523 B17R2.291558 CC(O)CCOc1cccc2c1cccc2 34a_100000210388_100012276601 [1,0,0,0,0,1|1,0,1]=4 1524 B17R2.291558 CC(O)CCOc1cccc2c1cccc2 7a_100000210388_100012276601 [1,0,0,0,0,1|1,0,1]=4 1525 B17R2.291558 CC(O)CCSc1cccc2c1cccc2 62a_100012276601_100000210605 [1,0,0,0,0,1|1,0,1]=4 1526 B17R2.291558 CC(O)CNCc1cccc2c1cccc2 207a_100000210904_100000210074 [1,0,0,0,0,1|1,0,1]=4 1527 B17R2.291558 CC(O)CNCc1cccc2c1cccc2 2230a_100000210904_100011261445 [1,0,0,0,0,1|1,0,1]=4 1528 B17R2.291558 CC(O)CNCc1cccc2c1cccc2 270004a_100000210904_100000210074 [1,0,0,0,0,1|1,0,1]=4 1529 B17R2.291558 CC(O)CNCc1cccc2c1cccc2 34a_100000210904_100011261445 [1,0,0,0,0,1|1,0,1]=4 1530 B17R2.291558 CC(O)CNCc1cccc2c1cccc2 34a_100000753325_100011218427 [1,0,0,0,0,1|1,0,1]=4 1531 B17R2.291558 CC(O)COCc1cccc2c1cccc2 34a_100011216843_100011218427 [1,0,0,0,0,1|1,0,1]=4 1532 B17R2.291558 CC(O)COCc1cccc2c1cccc2 7a_100011216843_100011218427 [1,0,0,0,0,1|1,0,1]=4 1533 B17R2.291558 CC(O)CSCc1cccc2c1cccc2 62a_100011218427_100000188474 [1,0,0,0,0,1|1,0,1]=4 1534 B17R2.291558 CC(O)CSCc1cccc2c1cccc2 62a_100011261445_100011218427 [1,0,0,0,0,1|1,0,1]=4 1535 B17R2.291558 C[C@@H](O)CNCc1cccc2c1cccc2 34a_100000753325_100009817552 [1,0,0,0,0,1|1,0,1]=4 1536 B17R2.291558 C[C@@H](O)COCc1cccc2c1cccc2 34a_100011216843_100009817552 [1,0,0,0,0,1|1,0,1]=4 1537 B17R2.291558 C[C@@H](O)COCc1cccc2c1cccc2 7a_100011216843_100009817552 [1,0,0,0,0,1|1,0,1]=4 1538 B17R2.291558 C[C@@H](O)CSCc1cccc2c1cccc2 62a_100009817552_100000188474 [1,0,0,0,0,1|1,0,1]=4 1539 B17R2.291558 C[C@@H](O)CSCc1cccc2c1cccc2 62a_100011261445_100009817552 [1,0,0,0,0,1|1,0,1]=4 1540 B17R2.291558 NC(=O)CCNc1cccc2c1cccc2 34a_100000185869_100000731001 [1,0,0,0,0,1|1,0,0]=3 1541 B17R2.291558 NC(=O)CCNc1cccc2c1cccn2 27a_100000740010_100011290932 [1,0,0,0,0,1|2,0,0]=4 1542 B17R2.291558 NC(=O)CCNc1cccc2c1cccn2 34a_100000183906_100000731001 [1,0,0,0,0,1|2,0,0]=4 1543 B17R2.291558 NC(=O)CCNc1cccc2c1nccc2 34a_100000181377_100000731001 [1,0,0,0,0,1|2,0,0]=4 1544 B17R2.291558 NC(=O)CCNc1ccnc2c1cccc2 27a_100000740010_100011215880 [1,0,0,0,0,1|2,0,0]=4 1545 B17R2.291558 NC(=O)CCNc1nccc2c1cccc2 27a_100000740010_100011934041 [1,0,0,0,0,1|2,0,0]=4 1546 B17R2.291558 NC(=O)CCOc1cccc2c1cccc2 34a_100000210388_100000731001 [1,0,0,0,0,1|1,0,0]=3 1547 B17R2.291558 NC(=O)CCOc1cccc2c1cccc2 7a_100000210388_100000744528 [1,0,0,0,0,1|1,0,0]=3 1548 B17R2.291558 NC(=O)CCOc1cccc2c1cccn2 34a_100011197808_100000731001 [1,0,0,0,0,1|2,0,0]=4 1549 B17R2.291558 NC(=O)CCOc1cccc2c1ccnc2 34a_100011218533_100000731001 [1,0,0,0,0,1|2,0,0]=4 1550 B17R2.291558 NC(=O)CCOc1cccc2c1cncc2 34a_103624766955_100000731001 [1,0,0,0,0,1|2,0,0]=4 1551 B17R2.291558 NC(=O)CCOc1cccc2c1nccc2 34a_100000056035_100000731001 [1,0,0,0,0,1|2,0,0]=4 1552 B17R2.291558 NC(=O)CCOc1cncc2c1cccc2 34a_100000066178_100000731001 [1,0,0,0,0,1|2,0,0]=4 1553 B17R2.291558 NC(=O)CCOc1cncc2c1cccc2 7a_100000066178_100000744528 [1,0,0,0,0,1|2,0,0]=4 1554 B17R2.291558 NC(=O)CCOc1nccc2c1cccc2 34a_102531767632_100000731001 [1,0,0,0,0,1|2,0,0]=4 1555 B17R2.291558 NC(=O)CCSc1cccc2c1cccc2 62a_100000744528_100000210605 [1,0,0,0,0,1|1,0,0]=3 1556 B17R2.291558 NC(=O)CCSc1cccc2c1cccn2 62a_100000744528_100011290932 [1,0,0,0,0,1|2,0,0]=4 1557 B17R2.291558 NC(=O)CCSc1cccc2c1cccn2 62a_100011290932_100000744528 [1,0,0,0,0,1|2,0,0]=4 1558 B17R2.291558 NC(=O)CCSc1cccc2c1ccnc2 62a_100000186358_100000744528 [1,0,0,0,0,1|2,0,0]=4 1559 B17R2.291558 NC(=O)CCSc1cccc2c1ccnc2 62a_100000744528_100000186358 [1,0,0,0,0,1|2,0,0]=4 1560 B17R2.291558 NC(=O)CCSc1cccc2c1cncc2 62a_100000685578_100000744528 [1,0,0,0,0,1|2,0,0]=4 1561 B17R2.291558 NC(=O)CCSc1cccc2c1cncc2 62a_100000744528_100000685578 [1,0,0,0,0,1|2,0,0]=4 1562 B17R2.291558 NC(=O)CCSc1cccc2c1nccc2 62a_100000744528_100011215545 [1,0,0,0,0,1|2,0,0]=4 1563 B17R2.291558 NC(=O)CCSc1ccnc2c1cccc2 62a_100000744528_100011215880 [1,0,0,0,0,1|2,0,0]=4 1564 B17R2.291558 NC(=O)CCSc1ccnc2c1cccc2 62a_100011458314_100000744528 [1,0,0,0,0,1|2,0,0]=4 1565 B17R2.291558 NC(=O)CCSc1cncc2c1cccc2 62a_100000187577_100000744528 [1,0,0,0,0,1|2,0,0]=4 1566 B17R2.291558 NC(=O)CCSc1cncc2c1cccc2 62a_100000744528_100000187577 [1,0,0,0,0,1|2,0,0]=4 1567 B17R2.291558 NC(=O)CCSc1nccc2c1cccc2 62a_100000744528_100011934041 [1,0,0,0,0,1|2,0,0]=4 1568 B17R2.291558 NC(=O)CCSc1nccc2c1cccc2 62a_100011934041_100000744528 [1,0,0,0,0,1|2,0,0]=4 1569 B17R2.291558 NC(=O)CNCc1cccc2c1cccc2 2230a_100000711301_100011261445 [1,0,0,0,0,1|1,0,0]=3 1570 B17R2.291558 NC(=O)CNCc1cccc2c1cccc2 34a_100000753325_100000187820 [1,0,0,0,0,1|1,0,0]=3 1571 B17R2.291558 NC(=O)CNCc1cccc2c1ccnc2 2230a_100000711301_100016989825 [1,0,0,0,0,1|2,0,0]=4 1572 B17R2.291558 NC(=O)CNCc1cccc2c1nccc2 2230a_100000711301_100000241032 [1,0,0,0,0,1|2,0,0]=4 1573 B17R2.291558 NC(=O)CNCc1ccnc2c1cccc2 2230a_100000711301_100015192512 [1,0,0,0,0,1|2,0,0]=4 1574 B17R2.291558 NC(=O)CNCc1nccc2c1cccc2 2230a_100000711301_100000033776 [1,0,0,0,0,1|2,0,0]=4 1575 B17R2.291558 NC(=O)COCc1cccc2c1cccc2 34a_100011216843_100000187820 [1,0,0,0,0,1|1,0,0]=3 1576 B17R2.291558 NC(=O)COCc1cccc2c1cccc2 7a_100011216843_100000187820 [1,0,0,0,0,1|1,0,0]=3 1577 B17R2.291558 NC(=O)COCc1cccc2c1cccn2 34a_100000709871_100000187820 [1,0,0,0,0,1|2,0,0]=4 1578 B17R2.291558 NC(=O)COCc1cccc2c1nccc2 34a_100011303629_100000187820 [1,0,0,0,0,1|2,0,0]=4 1579 B17R2.291558 NC(=O)CSCc1cccc2c1cccc2 62a_100000747473_100000188474 [1,0,0,0,0,1|1,0,0]=3 1580 B17R2.291558 NC(=O)CSCc1cccc2c1cccc2 62a_100011261445_100000747473 [1,0,0,0,0,1|1,0,0]=3 1581 B17R2.291558 NC(=O)CSCc1cccc2c1ccnc2 62a_100000747473_100016989825 [1,0,0,0,0,1|2,0,0]=4 1582 B17R2.291558 NC(=O)CSCc1cccc2c1ccnc2 62a_100016989825_100000747473 [1,0,0,0,0,1|2,0,0]=4 1583 B17R2.291558 NC(=O)CSCc1cccc2c1nccc2 62a_100000747473_100000241032 [1,0,0,0,0,1|2,0,0]=4 1584 B17R2.291558 NC(=O)CSCc1ccnc2c1cccc2 62a_100000747473_100015192512 [1,0,0,0,0,1|2,0,0]=4 1585 B17R2.291558 NC(=O)CSCc1ccnc2c1cccc2 62a_100015192512_100000747473 [1,0,0,0,0,1|2,0,0]=4 1586 B17R2.291558 NC(=O)CSCc1nccc2c1cccc2 62a_100000033776_100000747473 [1,0,0,0,0,1|2,0,0]=4 1587 B17R2.291558 NC(=O)CSCc1nccc2c1cccc2 62a_100000747473_100000033776 [1,0,0,0,0,1|2,0,0]=4 1588 B17R2.291558 O=C(O)CNCc1cccc2c1cccc2 269956a_100016091260_100000188474 [1,0,0,0,0,1|0,0,0]=2 1589 B17R2.291558 O=C(O)CNCc1cccc2c1ccnc2 269956a_100016091260_100016989825 [1,0,0,0,0,1|1,0,0]=3 1590 B17R2.291558 O=C(O)CNCc1cccc2c1nccc2 269956a_100016091260_100000241032 [1,0,0,0,0,1|1,0,0]=3 1591 B17R2.291558 O=C(O)CNCc1ccnc2c1cccc2 269956a_100016091260_100015192512 [1,0,0,0,0,1|1,0,0]=3 1592 B17R2.291558 O=C(O)CNCc1nccc2c1cccc2 269956a_100016091260_100000033776 [1,0,0,0,0,1|1,0,0]=3 1593 B17R2.291558 O=C([O-])CNCc1cccc2c1cccc2 34a_100000753325_100020667443 [1,0,0,0,0,1|0,0,1]=3 1594 B17R2.291558 O=C([O-])COCc1cccc2c1cccc2 34a_100011216843_100020667443 [1,0,0,0,0,1|0,0,1]=3 1595 B17R2.291558 O=C([O-])COCc1cccc2c1cccn2 34a_100000709871_100020667443 [1,0,0,0,0,1|1,0,1]=4 1596 B17R2.291558 O=C([O-])COCc1cccc2c1nccc2 34a_100011303629_100020667443 [1,0,0,0,0,1|1,0,1]=4 1597 B17R2.291558 O=C([O-])CSCc1cccc2c1cccc2 62a_100011261445_100020667443 [1,0,0,0,0,1|0,0,1]=3 1598 B17R2.291558 O=C([O-])CSCc1cccc2c1cccc2 62a_100020667443_100000188474 [1,0,0,0,0,1|0,0,1]=3 1599 B17R2.291558 O=C([O-])CSCc1cccc2c1ccnc2 62a_100016989825_100020667443 [1,0,0,0,0,1|1,0,1]=4 1600 B17R2.291558 O=C([O-])CSCc1cccc2c1ccnc2 62a_100020667443_100016989825 [1,0,0,0,0,1|1,0,1]=4 1601 B17R2.291558 O=C([O-])CSCc1cccc2c1nccc2 62a_100020667443_100000241032 [1,0,0,0,0,1|1,0,1]=4 1602 B17R2.291558 O=C([O-])CSCc1ccnc2c1cccc2 62a_100015192512_100020667443 [1,0,0,0,0,1|1,0,1]=4 1603 B17R2.291558 O=C([O-])CSCc1ccnc2c1cccc2 62a_100020667443_100015192512 [1,0,0,0,0,1|1,0,1]=4 1604 B17R2.291558 O=C([O-])CSCc1nccc2c1cccc2 62a_100000033776_100020667443 [1,0,0,0,0,1|1,0,1]=4 1605 B17R2.291558 O=C([O-])CSCc1nccc2c1cccc2 62a_100020667443_100000033776 [1,0,0,0,0,1|1,0,1]=4 1606 B17R2.291558 O=[N+]([O-])CNCc1cccc2c1cccc2 34a_100000753325_100000761209 [1,0,0,0,0,1|1,0,1]=4 1607 B17R2.291558 O=[N+]([O-])COCc1cccc2c1cccc2 34a_100011216843_100000761209 [1,0,0,0,0,1|1,0,1]=4 1608 B17R2.291558 O=[N+]([O-])CSCc1cccc2c1cccc2 62a_100011261445_100000761209 [1,0,0,0,0,1|1,0,1]=4 1609 B17R2.291558 [13CH3]C(=O)CCOc1cccc2c1cccc2 1458a_100000737181_200025704644 [1,0,0,0,0,1|1,0,0]=3 1610 B17R2.291558 [13CH3]C(=O)CSCc1cccc2c1cccc2 1458a_200000150182_200025704644 [1,0,0,0,0,1|1,0,0]=3 1611 B19R2.6063385 CC(=O)OC(C)SCc1cccc2c1cccc2 62a_100009818208_100000188474 [0,0,0,0,0,2|2,0,0]=4 1612 B19R2.6063385 CC(=O)OC(C)SCc1cccc2c1cccc2 62a_100011261445_100009818208 [0,0,0,0,0,2|2,0,0]=4 1613 B19R2.6063385 CN(CCc1cccc2c1cccc2)CC(=O)O 269956a_100000746989_100011290781 [0,0,0,0,0,2|2,0,0]=4 1614 B19R2.6098775 CC(=O)C(C)COCc1cccc2c1cccc2 34a_100000032740_100011261445 [0,0,0,0,0,2|2,0,0]=4 1615 B19R2.6098775 CC(=O)C(C)COCc1cccc2c1cccc2 7a_100000032740_100011261445 [0,0,0,0,0,2|2,0,0]=4 1616 B19R2.6098775 CC(=O)C(C)NCCc1cccc2c1cccc2 2230a_100000751862_100009814033 [0,0,0,0,0,2|2,0,0]=4 1617 B19R2.6098775 CC(=O)C(C)OCCc1cccc2c1cccc2 34a_100000212229_100011290781 [0,0,0,0,0,2|2,0,0]=4 1618 B19R2.6098775 CC(=O)C(C)OCCc1cccc2c1cccc2 7a_100011219628_100000179758 [0,0,0,0,0,2|2,0,0]=4 1619 B19R2.6098775 CC(=O)C(C)SCCc1cccc2c1cccc2 62a_100009814033_100011290781 [0,0,0,0,0,2|2,0,0]=4 1620 B19R2.6098775 CC(=O)C(C)SCCc1cccc2c1cccc2 62a_100011290781_100009814033 [0,0,0,0,0,2|2,0,0]=4 1621 B19R2.6098775 CC(CNCc1cccc2c1cccc2)C(=O)O 269956a_100000749485_100000188474 [0,0,0,0,0,2|1,0,0]=3 1622 B19R2.6098775 CC(CNCc1cccc2c1ccnc2)C(=O)O 269956a_100000749485_100016989825 [0,0,0,0,0,2|2,0,0]=4 1623 B19R2.6098775 CC(CNCc1cccc2c1nccc2)C(=O)O 269956a_100000749485_100000241032 [0,0,0,0,0,2|2,0,0]=4 1624 B19R2.6098775 CC(CNCc1ccnc2c1cccc2)C(=O)O 269956a_100000749485_100015192512 [0,0,0,0,0,2|2,0,0]=4 1625 B19R2.6098775 CC(CNCc1nccc2c1cccc2)C(=O)O 269956a_100000749485_100000033776 [0,0,0,0,0,2|2,0,0]=4 1626 B19R2.6098775 CC(NCCc1cccc2c1cccc2)C(=O)N 2230a_100000751862_100000702099 [0,0,0,0,0,2|2,0,0]=4 1627 B19R2.6098775 CC(NCCc1cccc2c1cccc2)C(=O)N 34a_100000751862_100000702099 [0,0,0,0,0,2|2,0,0]=4 1628 B19R2.6098775 CC(OCCc1cccc2c1cccc2)C(=O)N 34a_100011219628_100000702099 [0,0,0,0,0,2|2,0,0]=4 1629 B19R2.6098775 CC(OCCc1cccc2c1cccc2)C(=O)N 7a_100011219628_100000702099 [0,0,0,0,0,2|2,0,0]=4 1630 B19R2.6098775 CC(SCCc1cccc2c1cccc2)C(=O)N 62a_100000702099_100011290781 [0,0,0,0,0,2|2,0,0]=4 1631 B19R2.6098775 CC(SCCc1cccc2c1cccc2)C(=O)N 62a_100011290781_100000702099 [0,0,0,0,0,2|2,0,0]=4 1632 B19R2.6098775 C[C@@H](NCCc1cccc2c1cccc2)C(=O)N 2230a_100000119354_100011290781 [0,0,0,0,0,2|2,0,0]=4 1633 B19R2.6098775 C[C@@H](NCCc1cccc2c1cccc2)C(=O)N 34a_100000119354_100011290781 [0,0,0,0,0,2|2,0,0]=4 1634 B19R2.6098775 C[C@@H](OCCc1cccc2c1cccc2)C(=O)N 34a_100000731257_100011290781 [0,0,0,0,0,2|2,0,0]=4 1635 B19R2.6098775 C[C@@H](OCCc1cccc2c1cccc2)C(=O)N 7a_100000731257_100011290781 [0,0,0,0,0,2|2,0,0]=4 1636 B19R2.6098775 C[C@H](NCCc1cccc2c1cccc2)C(=O)O 269956a_100000743915_100011290781 [0,0,0,0,0,2|1,0,0]=3 1637 B19R2.6098775 C[C@H](OCCc1cccc2c1cccc2)C(=O)[O-] 7a_217856618621_100011290781 [0,0,0,0,0,2|1,0,1]=4 1638 B19R2.6098775 NC(=O)C(F)NCCc1cccc2c1cccc2 2230a_100000751862_100009813875 [0,0,0,0,0,2|2,0,0]=4 1639 B19R2.6098775 NC(=O)C(F)NCCc1cccc2c1cccc2 34a_100000751862_100009813875 [0,0,0,0,0,2|2,0,0]=4 1640 B19R2.6098775 NC(=O)C(F)OCCc1cccc2c1cccc2 34a_100011219628_100009813875 [0,0,0,0,0,2|2,0,0]=4 1641 B19R2.6098775 NC(=O)C(F)OCCc1cccc2c1cccc2 7a_100011219628_100009813875 [0,0,0,0,0,2|2,0,0]=4 1642 B19R2.6098775 NC(=O)C(F)SCCc1cccc2c1cccc2 62a_100009813875_100011290781 [0,0,0,0,0,2|2,0,0]=4 1643 B19R2.6098775 NC(=O)C(F)SCCc1cccc2c1cccc2 62a_100011290781_100009813875 [0,0,0,0,0,2|2,0,0]=4 1644 B19R2.6098775 NC(=O)[C@@H](N)COCc1cccc2c1cccc2 34a_100000729942_100011261445 [0,0,0,0,0,2|1,0,0]=3 1645 B19R2.6098775 NC(=O)[C@@H](N)COCc1cccc2c1ccnc2 34a_100000729942_100016989825 [0,0,0,0,0,2|2,0,0]=4 1646 B19R2.6098775 NC(=O)[C@@H](N)COCc1cccc2c1nccc2 34a_100000729942_100000241032 [0,0,0,0,0,2|2,0,0]=4 1647 B19R2.6098775 NC(=O)[C@@H](N)COCc1ccnc2c1cccc2 34a_100000729942_100015192512 [0,0,0,0,0,2|2,0,0]=4 1648 B19R2.6098775 NC(=O)[C@@H](N)COCc1nccc2c1cccc2 34a_100000729942_100000033776 [0,0,0,0,0,2|2,0,0]=4 1649 B19R2.6098775 O=C(O)C(F)CNCc1cccc2c1cccc2 269956a_100000084737_100000188474 [0,0,0,0,0,2|1,0,0]=3 1650 B19R2.6098775 O=C(O)C(F)CNCc1cccc2c1ccnc2 269956a_100000084737_100016989825 [0,0,0,0,0,2|2,0,0]=4 1651 B19R2.6098775 O=C(O)C(F)CNCc1cccc2c1nccc2 269956a_100000084737_100000241032 [0,0,0,0,0,2|2,0,0]=4 1652 B19R2.6098775 O=C(O)C(F)CNCc1ccnc2c1cccc2 269956a_100000084737_100015192512 [0,0,0,0,0,2|2,0,0]=4 1653 B19R2.6098775 O=C(O)C(F)CNCc1nccc2c1cccc2 269956a_100000084737_100000033776 [0,0,0,0,0,2|2,0,0]=4 1654 B19R2.6098775 O=C([O-])C(F)NCCc1cccc2c1cccc2 34a_100000751862_100020610796 [0,0,0,0,0,2|1,0,1]=4 1655 B19R2.6098775 O=C([O-])C(F)OCCc1cccc2c1cccc2 34a_100011219628_100020610796 [0,0,0,0,0,2|1,0,1]=4 1656 B19R2.6098775 O=C([O-])C(F)SCCc1cccc2c1cccc2 62a_100011290781_100020610796 [0,0,0,0,0,2|1,0,1]=4 1657 B19R2.6098775 O=C([O-])C(F)SCCc1cccc2c1cccc2 62a_100020610796_100011290781 [0,0,0,0,0,2|1,0,1]=4