0 B12R1.43 C=C(Br)C(=O)Nc1ccccn1 837b6e5809a8952df3a3444275bcdb6b [0,0,1,0,0,0|3,0,0]=4 1 B12R1.43 C=C(Br)C(=O)Nc1cccnc1 7703550a52540abf80908b775ec3d804 [0,0,1,0,0,0|1,0,0]=2 2 B12R1.43 C=C(Br)C(=O)Nc1ccncc1 b32327489673a9cd42907dfbbaa6efb2 [0,0,1,0,0,0|3,0,0]=4 3 B12R1.43 C=C(C)C(=O)Nc1ccccn1 52fd6fecf3a1135fc9da6c596542358b [0,0,1,0,0,0|3,0,0]=4 4 B12R1.43 C=C(C)C(=O)Nc1cccnc1 7ddd3f9f95ca11bda147a3d3eae678d2 [0,0,1,0,0,0|1,0,0]=2 5 B12R1.43 C=C(C)C(=O)Nc1cccnn1 fcae44a2146e38311aa392919478e83e [0,0,1,0,0,0|2,0,0]=3 6 B12R1.43 C=C(C)C(=O)Nc1ccncc1 a6503895f463ead4cfde686cd1ac4ab0 [0,0,1,0,0,0|3,0,0]=4 7 B12R1.43 C=C(C)C(=O)Nc1cnccn1 cedb6d20af8aab6b4c238dbbd13ba1e6 [0,0,1,0,0,0|2,0,0]=3 8 B12R1.43 C=C(F)C(=O)Nc1ccccn1 18214a0ba3e5d2127a3f4d1134aae0ce [0,0,1,0,0,0|3,0,0]=4 9 B12R1.43 C=C(F)C(=O)Nc1cccnc1 654c8aa2035026b72d0c4da71b3cd2c4 [0,0,1,0,0,0|1,0,0]=2 10 B12R1.43 C=C(F)C(=O)Nc1cccnn1 3318cabddaf54b311001a5fb6abac846 [0,0,1,0,0,0|2,0,0]=3 11 B12R1.43 C=C(F)C(=O)Nc1ccncc1 8eceac6429ef0db5763c47674ca9097d [0,0,1,0,0,0|3,0,0]=4 12 B12R1.43 C=C(F)C(=O)Nc1ccnnc1 8d6ebfa90d280cbba3beed0a80d80d39 [0,0,1,0,0,0|2,0,0]=3 13 B12R1.43 C=C(F)C(=O)Nc1cnccn1 73d300d27f27eacfc9a75de15d765b33 [0,0,1,0,0,0|2,0,0]=3 14 B12R1.43 CC(=O)C(=O)Nc1cccnc1 086af3aba20ae365b3dec827ae002166 [0,0,1,0,0,0|0,0,2]=3 15 B12R1.43 CC(=O)C(=O)Nc1cccnn1 03d73d47e03de6389b5660c0e914c68b [0,0,1,0,0,0|1,0,2]=4 16 B12R1.43 CC(=O)C(=O)Nc1ccncc1 3e894dd89d9bd96b684380f99830dbca [0,0,1,0,0,0|2,0,1]=4 17 B12R1.43 CC(=O)C(=O)Nc1ccnnc1 ea0ce4872a0280f863f757952ba7597a [0,0,1,0,0,0|1,0,2]=4 18 B12R1.43 CC(=O)C(=O)Nc1cnccn1 4079872281b1e0923b9bee3a5245755c [0,0,1,0,0,0|1,0,2]=4 19 B12R1.43 CC(F)C(=O)Nc1cccnc1 8e06904db02f28f8551a4c62cdb0567e [0,0,1,0,0,0|1,0,2]=4 20 B12R1.43 CC(Nc1cccnc1)C(=O)O 659dd80270551d27c639c95faafb6472 [0,0,1,0,0,0|2,0,1]=4 21 B12R1.43 CC(Nc1ccncc1)C(=O)N ba90507220ccfe6fc756bda09ed3e108 [0,0,1,0,0,0|2,0,1]=4 22 B12R1.43 CC(O)C(=O)Nc1cccnc1 a6d8461b9d4871e9e14a4c125c563fab [0,0,1,0,0,0|0,0,2]=3 23 B12R1.43 CC(O)C(=O)Nc1cccnn1 9d973a0ccb62a093bf7e2efcc145a7fd [0,0,1,0,0,0|1,0,2]=4 24 B12R1.43 CC(O)C(=O)Nc1ccnnc1 16732e308900cbf980136c71509d43c5 [0,0,1,0,0,0|1,0,2]=4 25 B12R1.43 CC(O)C(=O)Nc1cnccn1 09a3eee9ee9d3b4cb2b03366f1f096de [0,0,1,0,0,0|1,0,2]=4 26 B12R1.43 CC(S)C(=O)Nc1cccnc1 b6b76bef58796b77c7a1a29b3613d6b6 [0,0,1,0,0,0|0,1,2]=4 27 B12R1.43 C[C@@H](F)C(=O)Nc1cccnc1 b1353115539c393aa2db2fafcea74748 [0,0,1,0,0,0|1,0,2]=4 28 B12R1.43 C[C@@H](Nc1cccnc1)C(=O)O f725611cd196ecb4e3173ce596f108d5 [0,0,1,0,0,0|2,0,1]=4 29 B12R1.43 C[C@@H](Nc1ccncc1)C(=O)N 1f374cd009e907959e7de09765803968 [0,0,1,0,0,0|2,0,1]=4 30 B12R1.43 C[C@@H](O)C(=O)Nc1cccnc1 1f46b38a6f9fc93718ab3b927f346130 [0,0,1,0,0,0|0,0,2]=3 31 B12R1.43 C[C@@H](O)C(=O)Nc1cccnn1 b6fb2ba99fce7adf17b291fccd43651e [0,0,1,0,0,0|1,0,2]=4 32 B12R1.43 C[C@@H](O)C(=O)Nc1ccnnc1 c6d57670365a7f3e6b206e2ee10f2131 [0,0,1,0,0,0|1,0,2]=4 33 B12R1.43 C[C@@H](O)C(=O)Nc1cnccn1 90687336be88fd338cea7d708b491a0a [0,0,1,0,0,0|1,0,2]=4 34 B12R1.43 C[C@H](F)C(=O)Nc1cccnc1 83b362882ee5612e2ec945e60b0e5b9c [0,0,1,0,0,0|1,0,2]=4 35 B12R1.43 C[C@H](Nc1cccnc1)C(=O)O dd8df90e032283b8c6411ff1e3f5a98a [0,0,1,0,0,0|2,0,1]=4 36 B12R1.43 C[C@H](Nc1ccncc1)C(=O)N ad266badea115df3b4f5bccb0d59b70d [0,0,1,0,0,0|2,0,1]=4 37 B12R1.43 C[C@H](O)C(=O)Nc1cccnc1 ec61428d6808a30af6e5a1bbccc688ed [0,0,1,0,0,0|0,0,2]=3 38 B12R1.43 C[C@H](O)C(=O)Nc1cccnn1 0796fe9ad9bc463d54d976b23ecff82d [0,0,1,0,0,0|1,0,2]=4 39 B12R1.43 C[C@H](O)C(=O)Nc1ccnnc1 983965256937dfb8a1a6b99941fae0db [0,0,1,0,0,0|1,0,2]=4 40 B12R1.43 C[C@H](O)C(=O)Nc1cnccn1 b4c16ec85d2d2e678257ff853913be21 [0,0,1,0,0,0|1,0,2]=4 41 B12R1.43 NC(=O)C(=O)Nc1cccnc1 511412fcdd7fe0c2e939ebfd9abf8912 [0,0,1,0,0,0|1,0,1]=3 42 B12R1.43 NC(=O)C(=O)Nc1cccnn1 9206a76275bb1c28dd9af43b44126134 [0,0,1,0,0,0|2,0,1]=4 43 B12R1.43 NC(=O)C(=O)Nc1ccncc1 dd57be4da7b5a03a89564a942e16c4be [0,0,1,0,0,0|1,0,1]=3 44 B12R1.43 NC(=O)C(=O)Nc1ccncn1 059b8336ff2d5027d4fae35948d8de21 [0,0,1,0,0,0|2,0,1]=4 45 B12R1.43 NC(=O)C(F)Nc1ccncc1 73eaf17db5fb10a743046b642b6f8c1a [0,0,1,0,0,0|2,0,1]=4 46 B12R1.43 NC(=O)C(F)Oc1ccncc1 93a645f8833b59068068eba402f7e9b2 [0,0,1,0,0,0|2,0,1]=4 47 B12R1.43 O=C(Nc1cccnc1)C(F)F 4099328f97a505d292d466595e33e940 [0,0,1,0,0,0|2,0,1]=4 48 B12R1.43 O=C(Nc1cccnc1)C(O)O 129b065edb6d07fc3a55f4fc062e7027 [0,0,1,0,0,0|1,0,1]=3 49 B12R1.43 O=C(Nc1cccnn1)C(O)O 37ad28023dd74fd3b7e06151b75a522b [0,0,1,0,0,0|2,0,1]=4 50 B12R1.43 O=C(Nc1ccnnc1)C(O)O 90b09787fbddc9fd15a4d41e834f671f [0,0,1,0,0,0|2,0,1]=4 51 B12R1.43 O=C(Nc1cnccn1)C(O)O 634aaf42ca32c4572535c75ac8cc4dca [0,0,1,0,0,0|2,0,1]=4 52 B12R1.43 O=C(O)C(F)Nc1cccnc1 455dc6c2ef68afd5d880209c8fe5a542 [0,0,1,0,0,0|2,0,1]=4 53 B12R1.43 O=C(O)[C@H](F)Nc1cccnc1 c741dd412e598c70d825973c9bcdacf7 [0,0,1,0,0,0|2,0,1]=4 54 B12R1.169 CCOc1ccncc1NC=O 536d814e545ecc87347c857cf2e56b49 [0,0,1,0,0,0|2,0,1]=4 55 B12R1.169 N#CCc1ccncc1NC=O 68f972294e28adb9524e8d97db4ea252 [0,0,1,0,0,0|1,0,2]=4 56 B12R1.169 O=CNc1ccccc1CCO c92dc30b57c13638df27621efe7922c6 [0,0,1,0,0,0|1,0,2]=4 57 B12R1.371 C#CC(=O)Nc1cnccc1Br 489c33a665a1a289d2d7608ef6350b5c [0,0,1,0,0,0|2,0,1]=4 58 B12R1.371 C#CC(=O)Nc1cnccc1C 794ba5d5e7386a093fa08bf564c99147 [0,0,1,0,0,0|1,0,2]=4 59 B12R1.371 C#CC(=O)Nc1cnccc1F 7663d305598c0919004302189b887282 [0,0,1,0,0,0|2,0,1]=4 60 B12R1.371 C#CC(=O)Nc1cnccc1I 9b1b391ce341059fdf29633bfcab7695 [0,0,1,0,0,0|2,0,1]=4 61 B12R1.371 C#CC(=O)Nc1cnccc1O c9b7590ed607ebcd9bc0decdde391b66 [0,0,1,0,0,0|2,0,1]=4 62 B12R1.371 C#CC(=O)Nc1cnccc1S 886d0681fa907af78aca5e03f59e9699 [0,0,1,0,0,0|2,0,1]=4 63 B12R1.371 C=CC(=O)Nc1ccccc1Br e5d1f40bbb3972cd234b3d1559f149fb [0,0,1,0,0,0|3,0,0]=4 64 B12R1.371 C=CC(=O)Nc1ccccc1C acb3e10026991d61c64ba4069b9746f5 [0,0,1,0,0,0|2,0,1]=4 65 B12R1.371 C=CC(=O)Nc1ccccc1Cl 4977f0e6a6edb54dfe74c87f87185b5c [0,0,1,0,0,0|3,0,0]=4 66 B12R1.371 C=CC(=O)Nc1ccccc1F dbb2194c0b6b7ae61906b5bef156a80b [0,0,1,0,0,0|3,0,0]=4 67 B12R1.371 C=CC(=O)Nc1ccccc1I 1d2658ab33296a9656a08882644409fe [0,0,1,0,0,0|3,0,0]=4 68 B12R1.371 C=CC(=O)Nc1ccccc1O 9447ec7b0f9e158ab19bcffe70be1362 [0,0,1,0,0,0|3,0,0]=4 69 B12R1.371 C=CC(=O)Nc1ccccc1S 2b5292e4efc934dbb57e5219724c1b78 [0,0,1,0,0,0|3,0,0]=4 70 B12R1.371 C=CC(=O)Nc1cnccc1Br 6d45363fc115404e9ae20c2caf5ff294 [0,0,1,0,0,0|2,0,0]=3 71 B12R1.371 C=CC(=O)Nc1cnccc1C ba4aeb5205e9cf91dade9f8eaa7d2a0f [0,0,1,0,0,0|1,0,1]=3 72 B12R1.371 C=CC(=O)Nc1cnccc1F 113841a3f1777cb1304ca09f1d4be12a [0,0,1,0,0,0|2,0,0]=3 73 B12R1.371 C=CC(=O)Nc1cnccc1I 2b45d3c6a4ab7ebafde06258e548fc61 [0,0,1,0,0,0|2,0,0]=3 74 B12R1.371 C=CC(=O)Nc1cnccc1O 05b2037b2bd2f5c811b13aa1ef46e505 [0,0,1,0,0,0|2,0,0]=3 75 B12R1.371 C=CC(=O)Nc1cnccc1S 6571b5976adc8ab7105f2e37941e773a [0,0,1,0,0,0|2,0,0]=3 76 B12R1.371 C=CC(=O)Nc1cncnc1C c674c5703ff28433adde360629ecc527 [0,0,1,0,0,0|2,0,1]=4 77 B12R1.371 C=CC(=O)Nc1cncnc1I f5e6e7b140c3d894b97487927ba56cc4 [0,0,1,0,0,0|3,0,0]=4 78 B12R1.371 C=CC(=O)Nc1cnncc1Cl 90ebad02b622cf97d573e469cc734b54 [0,0,1,0,0,0|3,0,0]=4 79 B12R1.371 C=CC(=O)Nc1nnccc1C 876455158c30183f84f99acace912319 [0,0,1,0,0,0|2,0,1]=4 80 B12R1.371 C=CC(=O)Nc1nnccc1O 700ee5f65feeb8caadd481aacdbd9247 [0,0,1,0,0,0|3,0,0]=4 81 B12R1.371 CCC(=O)Nc1cnccc1Br 2240966fc3891303f48effa49314790d [0,0,1,0,0,0|2,0,1]=4 82 B12R1.371 CCC(=O)Nc1cnccc1C 822967991038a28cb81ff791ee4b01f5 [0,0,1,0,0,0|1,0,2]=4 83 B12R1.371 CCC(=O)Nc1cnccc1F c62e530a992b49fefb4884ec1a4eae0b [0,0,1,0,0,0|2,0,1]=4 84 B12R1.371 CCC(=O)Nc1cnccc1I 292ea2d8a1c3a71cd590b6a4235753ef [0,0,1,0,0,0|2,0,1]=4 85 B12R1.371 CCC(=O)Nc1cnccc1O 77450b4559bbbe6b1eb49213492a6811 [0,0,1,0,0,0|2,0,1]=4 86 B12R1.371 Cc1ccccc1NC(=O)C=O c48e8fd2ba5e58f34d83735c8fa1debf [0,0,1,0,0,0|1,0,2]=4 87 B12R1.371 Cc1ccccc1NC(=O)CO 8d990dc3b3796a0c64c8b86b8490eb78 [0,0,1,0,0,0|1,0,2]=4 88 B12R1.371 Cc1ccncc1NC(=O)C=O ebf7d0ff6ebe2c20d9b379ab1f797db2 [0,0,1,0,0,0|0,0,2]=3 89 B12R1.371 Cc1ccnnc1NC(=O)C=O f5efd5a096d8ce3bb7792ba773c18cb0 [0,0,1,0,0,0|1,0,2]=4 90 B12R1.371 Cc1ccnnc1NC(=O)CO 9e2fc460d8467942d76538d0703c4079 [0,0,1,0,0,0|1,0,2]=4 91 B12R1.371 Cc1cnccc1NC(=O)C=O d371e040c7962bbba87a9c7b8bc33715 [0,0,1,0,0,0|2,0,1]=4 92 B12R1.371 Cc1ncncc1NC(=O)C=O aa6f953e7eb70e0fb65b679f26d61ab2 [0,0,1,0,0,0|1,0,2]=4 93 B12R1.371 O=C(CF)Nc1cnccc1F 42e8d2f6164cce13b227da4861a1ed83 [0,0,1,0,0,0|2,0,1]=4 94 B12R1.371 O=C(CF)Nc1cnccc1I 4e0a2f0a7788b079e47de8a36a960e17 [0,0,1,0,0,0|2,0,1]=4 95 B12R1.371 O=C(CF)Nc1cnccc1O f87c7646246e4ce6a64d66183797d5c2 [0,0,1,0,0,0|2,0,1]=4 96 B12R1.371 O=C(CO)Nc1ccccc1F d20a35cb403e68671e72a0dd460c0485 [0,0,1,0,0,0|2,0,1]=4 97 B12R1.371 O=C(CO)Nc1ccccc1I 209ecbfb2e84cc7bc62f1762ecc4331e [0,0,1,0,0,0|2,0,1]=4 98 B12R1.371 O=C(CO)Nc1ccccc1O e8a188e3771eae8a4a1eca1b4e42b466 [0,0,1,0,0,0|2,0,1]=4 99 B12R1.371 O=C(CO)Nc1ccccc1S e3384ae87fb80eb0958c847fa331a653 [0,0,1,0,0,0|2,0,1]=4 100 B12R1.371 O=C(CO)Nc1cnccc1F c14a87bba50aa7dfa1b07af2d7dd3d7b [0,0,1,0,0,0|1,0,1]=3 101 B12R1.371 O=C(CO)Nc1cnccc1I d156adf54711d75d90b4ad07aec9cca9 [0,0,1,0,0,0|1,0,1]=3 102 B12R1.371 O=C(CS)Nc1cnccc1F 90de8f36b1f56a5fcfc1fb26f72ebeb7 [0,0,1,0,0,0|1,1,1]=4 103 B12R1.371 O=C(CS)Nc1cnccc1I d3333dcd8c2ffaa75eb002266dcc2b35 [0,0,1,0,0,0|1,1,1]=4 104 B12R1.371 O=CC(=O)Nc1ccccc1Br 7058336679ba69d39674b3c86c28e3f9 [0,0,1,0,0,0|2,0,1]=4 105 B12R1.371 O=CC(=O)Nc1ccccc1Cl 9a72d75ca46083d23b6f52a31e240aa0 [0,0,1,0,0,0|2,0,1]=4 106 B12R1.371 O=CC(=O)Nc1ccccc1F 1f81a01759afe8571b5912fad33207bb [0,0,1,0,0,0|2,0,1]=4 107 B12R1.371 O=CC(=O)Nc1ccccc1I 673328a9d4095e886bbc6b7e908b5522 [0,0,1,0,0,0|2,0,1]=4 108 B12R1.371 O=CC(=O)Nc1ccccc1O e415f0146d0743efb0d7d2314f6f490f [0,0,1,0,0,0|2,0,1]=4 109 B12R1.371 O=CC(=O)Nc1ccccc1S 26651d9294816246534bfb73b52fa2e9 [0,0,1,0,0,0|2,0,1]=4 110 B12R1.371 O=CC(=O)Nc1ccncc1Cl 3d92952ab7f8dc54bd6d1270b5303f29 [0,0,1,0,0,0|2,0,1]=4 111 B12R1.371 O=CC(=O)Nc1ccncc1F fc07c5d03e7c77d21e4368571ef59323 [0,0,1,0,0,0|2,0,1]=4 112 B12R1.371 O=CC(=O)Nc1ccncc1I e719b160974ef13cceec000b9064d7ae [0,0,1,0,0,0|2,0,1]=4 113 B12R1.371 O=CC(=O)Nc1cnccc1Br 544e5a1beaef8f49f001e082ed085100 [0,0,1,0,0,0|1,0,1]=3 114 B12R1.371 O=CC(=O)Nc1cnccc1F 89efa6cd3f12faaf6d12ff5b32069922 [0,0,1,0,0,0|1,0,1]=3 115 B12R1.371 O=CC(=O)Nc1cnccc1I 86868fe7e2091d1c6164f6ebb91140bc [0,0,1,0,0,0|1,0,1]=3 116 B12R1.371 O=CC(=O)Nc1cnccc1O 328d9074164ddecb14f57ebdd55ed8b8 [0,0,1,0,0,0|1,0,1]=3 117 B12R1.371 O=CC(=O)Nc1cnccc1S e11604f1f4594f2a4868347d4af3e208 [0,0,1,0,0,0|1,0,1]=3 118 B12R1.371 O=CC(=O)Nc1cncnc1I fedeeaa4e47c0cc8e7dbf9a600efc4e5 [0,0,1,0,0,0|2,0,1]=4 119 B12R1.371 O=CC(=O)Nc1cnncc1Cl f10456e4a2ebef8e336788587fe17b60 [0,0,1,0,0,0|2,0,1]=4 120 B12R1.371 O=CC(=O)Nc1nnccc1O a30d7d393d8c2e5d1ca50529a0fc5a03 [0,0,1,0,0,0|2,0,1]=4 121 B11R1.40 C#CC(=O)Nc1cccnc1 fede9ede802accf01a2dd7068bdd2f92 [1,0,1,0,0,0|0,0,2]=4 122 B11R1.40 C=CC(=O)Nc1ccccc1 5f69a60f76bf8d4845a783c3048b2563 [1,0,1,0,0,0|1,0,0]=3 123 B11R1.40 C=CC(=O)Nc1ccccn1 34fef90711dfcaefc277492e72bbe936 [1,0,1,0,0,0|2,0,0]=4 124 B11R1.40 C=CC(=O)Nc1cccnc1 de5c772a8cda94a68da43551d49c0fce [1,0,1,0,0,0|0,0,0]=2 125 B11R1.40 C=CC(=O)Nc1cccnn1 b0c331c7674c74b9a074ca9d88d52bd4 [1,0,1,0,0,0|1,0,0]=3 126 B11R1.40 C=CC(=O)Nc1ccncc1 415f0c78f33533c78fc6ab46a82fb4b2 [1,0,1,0,0,0|2,0,0]=4 127 B11R1.40 C=CC(=O)Nc1ccnnc1 bb65c517049238b0258f3b8f2eeaa12d [1,0,1,0,0,0|1,0,0]=3 128 B11R1.40 C=CC(=O)Nc1cnccn1 0750844e1718f30f6356a67d8d5f5dcf [1,0,1,0,0,0|1,0,0]=3 129 B11R1.40 C=CC(=O)Nc1cncnc1 9b4072e0da3d142f1e2f8a7c131946f9 [1,0,1,0,0,0|1,0,0]=3 130 B11R1.40 C=CC(=O)Nc1cnncn1 477a08f5c3fff0e6fa8330a98c5556cd [1,0,1,0,0,0|2,0,0]=4 131 B11R1.40 C=CC(C)Nc1cccnc1 103a7e1883d7a333825583600980cdee [1,0,1,0,0,0|1,0,1]=4 132 B11R1.40 CCC(=O)Nc1cccnc1 3f3732eaee579e7903ad30638bf6459b [1,0,1,0,0,0|0,0,2]=4 133 B11R1.40 O=C(CF)Nc1cccnc1 5e2dc67f59a0ee35b818f3c738a2672a [1,0,1,0,0,0|1,0,1]=4 134 B11R1.40 O=C(CO)Nc1cccnc1 c1618f12da4bc6c07033d2147d5e05a1 [1,0,1,0,0,0|0,0,1]=3 135 B11R1.40 O=C(CO)Nc1cccnn1 e2ead558693a8d15dba073147810db17 [1,0,1,0,0,0|1,0,1]=4 136 B11R1.40 O=C(CO)Nc1cnccn1 48cd2c8639e0b4dc6a2e8e8ea59a849d [1,0,1,0,0,0|1,0,1]=4 137 B11R1.40 O=CC(=O)Nc1ccccc1 d69489ae088f523aa236921a313e92a5 [1,0,1,0,0,0|1,0,1]=4 138 B11R1.40 O=CC(=O)Nc1cccnc1 4483235651c46310384ecdfb83cf0459 [1,0,1,0,0,0|0,0,1]=3 139 B11R1.40 O=CC(=O)Nc1cccnn1 b30b17eef6f779e83d53fbee2dd15d57 [1,0,1,0,0,0|1,0,1]=4 140 B11R1.40 O=CC(=O)Nc1ccncc1 4b5bab6fe314b5f2251f228c60250dcd [1,0,1,0,0,0|1,0,1]=4 141 B11R1.40 O=CC(=O)Nc1ccnnc1 478bc45f9e8b5f84f0b4c7f1d8dd1618 [1,0,1,0,0,0|1,0,1]=4 142 B11R1.40 O=CC(=O)Nc1cnccn1 1b4db28b2217e8524dd00b0444a0d0b1 [1,0,1,0,0,0|1,0,1]=4 143 B11R1.91 C=C(Br)CNc1cccnc1 a11cf5f6d9b1fac244d28cac011d2a32 [1,0,1,0,0,0|1,0,1]=4 144 B11R1.91 C=C(C)CNc1cccnc1 8810dec0d1b93ae6f2f50fc532118fa0 [1,0,1,0,0,0|1,0,1]=4 145 B11R1.91 C=C(Cl)CNc1cccnc1 54e242eb426763e91578db67448c885f [1,0,1,0,0,0|1,0,1]=4 146 B11R1.91 C=C(F)CNc1cccnc1 ba2b2cb51023d183dfda83785e392235 [1,0,1,0,0,0|1,0,1]=4 147 B11R1.91 NC(=O)CNc1ccncc1 088a2b77d25846775d03ac6d25fcda03 [1,0,1,0,0,0|1,0,1]=4 148 B11R1.91 NC(=O)COc1ccncc1 791f490da6d45f1fafaa0833ecefe913 [1,0,1,0,0,0|1,0,1]=4 149 B11R1.91 O=C(O)CNc1cccnc1 4378235c0fca8603764c85f64c571ed0 [1,0,1,0,0,0|1,0,1]=4 150 B11R1.41 C#Cc1ccncc1NC=O fcf4d5d5e66e3a099035e3806566d6b8 [1,0,1,0,0,0|0,0,2]=4 151 B11R1.41 C=Cc1ccccc1NC=O 318fa617b79be5fa4723a8d8c79b7c87 [1,0,1,0,0,0|1,0,0]=3 152 B11R1.41 C=Cc1ncccc1NC=O f06ac0d926f03852ca9c2a478204d4b9 [1,0,1,0,0,0|2,0,0]=4 153 B11R1.41 COc1ccncc1NC=O 1075d96dc7fef24a106c7d7c0e4ea902 [1,0,1,0,0,0|1,0,1]=4 154 B11R1.41 N#Cc1ccncc1NC=O bca246ead1e61fdc433cc1799fc07c00 [1,0,1,0,0,0|1,0,1]=4 155 B11R1.41 O=CNc1ccccc1C=O 497f54404d9bc48b9253f4f69faf4a1b [1,0,1,0,0,0|1,0,1]=4 156 B11R1.41 O=CNc1ccccc1CO bc6eb11e23bc211022f1c9b04c7ae372 [1,0,1,0,0,0|1,0,1]=4 157 B11R1.41 O=CNc1cnccc1C=O c67256f0f71abd6e591f2dd7746963ad [1,0,1,0,0,0|0,0,1]=3 158 B11R1.41 O=CNc1cnccc1CO 5d3bcd006493ffa7af142861bb81be1a [1,0,1,0,0,0|0,0,1]=3 159 B11R1.41 O=CNc1cncnc1C=O 321d8862a3f7814147f405d0a2ad9979 [1,0,1,0,0,0|1,0,1]=4 160 B11R1.41 O=Cc1cnccc1NCO c301e5445ae4f8a92716bab9e79edc95 [1,0,1,0,0,0|1,0,1]=4 161 B11R1.86 CC(=O)Nc1cnccc1C 008c73bad38e7c0ad3042f8c5e2eeef6 [1,0,1,0,0,0|0,0,2]=4 162 B11R1.86 CC(=O)Nc1cnccc1F fb86cc23bed5784da517c22693fa424f [1,0,1,0,0,0|1,0,1]=4 163 B11R1.86 CC(=O)Nc1cnccc1I f9bbe3b48c30df8d0dae6d2447ab7b64 [1,0,1,0,0,0|1,0,1]=4 164 B11R1.86 CC(=O)Nc1cnccc1O 026ebb27f2a3ead3d67bfa6a1c65cef8 [1,0,1,0,0,0|1,0,1]=4 165 B11R1.24 C=CCOc1cccc(=O)[nH]1 69c34e7e3b660c44d6d1f251a5a25411 [1,0,1,0,0,0|2,0,0]=4 166 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)F f1d1168377b5461695f92ea341af0bc1 [0,1,1,0,0,0|2,0,0]=4 167 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)S 454a9b859808ed6ff1cc8d4805a2edf2 [0,1,1,0,0,0|2,0,0]=4 168 B13R1.133 C=C(Br)C(=O)Nc1ccc(nn1)O fd67dd7af4edf91ac061daae1607766a [0,1,1,0,0,0|2,0,0]=4 169 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 9e24fdfeceb66a471f038074e6650c09 [0,1,1,0,0,0|2,0,0]=4 170 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F ed1119f2322c1e38fda08671bd6f51bb [0,1,1,0,0,0|2,0,0]=4 171 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I a06a440e48068ac7768066ed0ec08008 [0,1,1,0,0,0|2,0,0]=4 172 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)O 101ad976a47de10bd52fab7f8096fa28 [0,1,1,0,0,0|2,0,0]=4 173 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)S b304a991041eec50c5816fe46dc86828 [0,1,1,0,0,0|2,0,0]=4 174 B13R1.133 C=C(C)C(=O)Nc1ccc(nc1)C 74e199a14a61e4033583cc0b9e81c5a2 [0,1,1,0,0,0|1,0,0]=3 175 B13R1.133 C=C(C)C(=O)Nc1ccc(nc1)F 717035d4a258f6095c7552e8d43f073a [0,1,1,0,0,0|1,0,0]=3 176 B13R1.133 C=C(C)C(=O)Nc1ccc(nc1)I e1398c93c0fbdf1160d43d3b9bc0dfcf [0,1,1,0,0,0|1,0,0]=3 177 B13R1.133 C=C(C)C(=O)Nc1ccc(nn1)C 6f81816e3e943e93e51be102903ea230 [0,1,1,0,0,0|2,0,0]=4 178 B13R1.133 C=C(C)C(=O)Nc1ccc(nn1)F 5c9a540cdaaa676005712c98fc2d66d7 [0,1,1,0,0,0|2,0,0]=4 179 B13R1.133 C=C(C)C(=O)Nc1ccc(nn1)I 35f4acf8a8cf82af4b0cbec97463d515 [0,1,1,0,0,0|2,0,0]=4 180 B13R1.133 C=C(C)C(=O)Nc1ccc(nn1)O 5e7852a38ef5a3e596d5790ebd82d137 [0,1,1,0,0,0|2,0,0]=4 181 B13R1.133 C=C(C)C(=O)Nc1cnc(cn1)C da60d347f308249f3b39be68f2ee3e92 [0,1,1,0,0,0|2,0,0]=4 182 B13R1.133 C=C(C)C(=O)Nc1cnc(cn1)I 615dcdab1370c5bda0b80cf16ef8df5b [0,1,1,0,0,0|2,0,0]=4 183 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)C e2a4986263ef1aaa248d1cf86af35fda [0,1,1,0,0,0|2,0,0]=4 184 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)F 8823c251c857848e0e37057b85f22ab7 [0,1,1,0,0,0|2,0,0]=4 185 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)S f825e46e1b0f1bb5f55d3d03f336c8bd [0,1,1,0,0,0|2,0,0]=4 186 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)C 08c19ef1b1ddf94f6ce183e837de52a1 [0,1,1,0,0,0|2,0,0]=4 187 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)F 321e92cf38980950d0e93ec0036a1fb1 [0,1,1,0,0,0|2,0,0]=4 188 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)I 3c65422f67f150ca360db53a70d4a48e [0,1,1,0,0,0|2,0,0]=4 189 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)O cb22ff43dffe8c6606709eac7c284b21 [0,1,1,0,0,0|2,0,0]=4 190 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)S 7e471df7355da36c6505d4b7852f0efe [0,1,1,0,0,0|2,0,0]=4 191 B13R1.133 C=C(F)C(=O)Nc1ccc(nc1)F de8e75330263b0d80740a6b25a29b515 [0,1,1,0,0,0|1,0,0]=3 192 B13R1.133 C=C(F)C(=O)Nc1ccc(nc1)I cb55e8413f07775c9884e7bcdd104319 [0,1,1,0,0,0|1,0,0]=3 193 B13R1.133 C=C(F)C(=O)Nc1ccc(nn1)C d15b4eb0a29948b57cb5d6e8ae829498 [0,1,1,0,0,0|2,0,0]=4 194 B13R1.133 C=C(F)C(=O)Nc1ccc(nn1)F 993c93aec2748032971e9e948b7d3f53 [0,1,1,0,0,0|2,0,0]=4 195 B13R1.133 C=C(F)C(=O)Nc1ccc(nn1)I c34b51323e7d419d787c49a8c9f93192 [0,1,1,0,0,0|2,0,0]=4 196 B13R1.133 C=C(F)C(=O)Nc1ccc(nn1)O e79ea974c2f71f609a8cfd4202db963b [0,1,1,0,0,0|2,0,0]=4 197 B13R1.133 CC(=O)C(=O)Nc1ccc(nc1)Br 7b5b125e9b951794d0c0c2aeb5b42687 [0,1,1,0,0,0|0,0,2]=4 198 B13R1.133 CC(=O)C(=O)Nc1ccc(nc1)C 5ae748d3a44cebed3192e1230221a495 [0,1,1,0,0,0|0,0,2]=4 199 B13R1.133 CC(=O)C(=O)Nc1ccc(nc1)Cl 404c79c545bf33eea9a55b2796a9ab25 [0,1,1,0,0,0|0,0,2]=4 200 B13R1.133 CC(=O)C(=O)Nc1ccc(nc1)F 605c66720403cc9baa1eefd2bed2af34 [0,1,1,0,0,0|0,0,2]=4 201 B13R1.133 CC(=O)C(=O)Nc1ccc(nc1)I b43f55aceb990ae5bd636aedc217fb05 [0,1,1,0,0,0|0,0,2]=4 202 B13R1.133 CC(O)C(=O)Nc1ccc(nc1)Cl f9fd7549e432984e7a860d711cdfb238 [0,1,1,0,0,0|0,0,2]=4 203 B13R1.133 CC(O)C(=O)Nc1ccc(nc1)F 5203b26844c98c6317393615ef4ed41b [0,1,1,0,0,0|0,0,2]=4 204 B13R1.133 CC(O)C(=O)Nc1ccc(nc1)I d986a311eb4d921333a4fb02b5e9590a [0,1,1,0,0,0|0,0,2]=4 205 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(nc1)Cl 67104f39065171b4cf44c43b73edddf7 [0,1,1,0,0,0|0,0,2]=4 206 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(nc1)F e5e2b55efa9da4b97717c004cc847452 [0,1,1,0,0,0|0,0,2]=4 207 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(nc1)I e07456806a8596c5b76f5e73aa197a4d [0,1,1,0,0,0|0,0,2]=4 208 B13R1.133 C[C@H](O)C(=O)Nc1ccc(nc1)Cl 754a256f7d0ead1acd9fa7329d95cf68 [0,1,1,0,0,0|0,0,2]=4 209 B13R1.133 C[C@H](O)C(=O)Nc1ccc(nc1)F 898736d45f99f124ba0896f4fd555e00 [0,1,1,0,0,0|0,0,2]=4 210 B13R1.133 C[C@H](O)C(=O)Nc1ccc(nc1)I b8234766ee9d7e33baa0d4d828c544b1 [0,1,1,0,0,0|0,0,2]=4 211 B13R1.133 Cc1ccc(cn1)NC(=O)C(C)O 201adef8ca579644a7a066efe5d9e865 [0,1,1,0,0,0|0,0,2]=4 212 B13R1.133 Cc1ccc(cn1)NC(=O)C(O)O f42452e8e0584ffad73c865aac383112 [0,1,1,0,0,0|1,0,1]=4 213 B13R1.133 Cc1ccc(cn1)NC(=O)[C@@H](C)O 94cdc6ba0d7496c76489ee9bc5ab8a14 [0,1,1,0,0,0|0,0,2]=4 214 B13R1.133 Cc1ccc(cn1)NC(=O)[C@H](C)O 3396765ce235aa3b3b5721b5b1aa6737 [0,1,1,0,0,0|0,0,2]=4 215 B13R1.133 NC(=O)C(=O)Nc1ccc(nc1)F ef7b544a2dc21a15ad3a9eb36477dbc2 [0,1,1,0,0,0|1,0,1]=4 216 B13R1.133 O=C(Nc1ccc(nc1)Cl)C(O)O ee7a43cac938ca6940ee1cf0cd97b4f4 [0,1,1,0,0,0|1,0,1]=4 217 B13R1.133 O=C(Nc1ccc(nc1)F)C(O)O f1a8dad75bd68dcde3495382af4d244f [0,1,1,0,0,0|1,0,1]=4 218 B13R1.133 O=C(Nc1ccc(nc1)I)C(O)O c9b6cab35b96f2f6d55eaaaf904f0b54 [0,1,1,0,0,0|1,0,1]=4 219 B13R1.135 C#CC(O)C(=O)Nc1cccnc1 8d6eca16c7830788c83daa1fce92ef22 [0,1,1,0,0,0|0,0,2]=4 220 B13R1.135 C/C=C(/C)\C(=O)Nc1ccccc1 36d3be3979b4bfcf091d02ede04c695b [0,1,1,0,0,0|2,0,0]=4 221 B13R1.135 C/C=C(/C)\C(=O)Nc1cccnc1 fded5881c60726efaf5e32aa33bebdb0 [0,1,1,0,0,0|1,0,0]=3 222 B13R1.135 C/C=C(/C)\C(=O)Nc1cccnn1 a46dc4069c44684b13d5a9d3b66293e1 [0,1,1,0,0,0|2,0,0]=4 223 B13R1.135 C/C=C(/C)\C(=O)Nc1ccnnc1 20550702b0d5679e31a1c5a98c93c005 [0,1,1,0,0,0|2,0,0]=4 224 B13R1.135 C/C=C(/C)\C(=O)Nc1cnccn1 766faa2c19135ac9e0c82e2397d3133e [0,1,1,0,0,0|2,0,0]=4 225 B13R1.135 C/C=C(\Br)/C(=O)Nc1ccccc1 4bd6d72546a8dc929e0a44f63e4546b6 [0,1,1,0,0,0|2,0,0]=4 226 B13R1.135 C/C=C(\Br)/C(=O)Nc1cccnc1 1af06aa43b72bdbe37f1a0cd7fdeec77 [0,1,1,0,0,0|1,0,0]=3 227 B13R1.135 C/C=C(\Br)/C(=O)Nc1cccnn1 b1602ab91e0aee63820792560accae6d [0,1,1,0,0,0|2,0,0]=4 228 B13R1.135 C/C=C(\Br)/C(=O)Nc1ccnnc1 a914fac5e33ef404ac46b9f0e67a9292 [0,1,1,0,0,0|2,0,0]=4 229 B13R1.135 C/C=C(\Br)/C(=O)Nc1cnccn1 2963ce07e934d1dcd388c2ea0a844049 [0,1,1,0,0,0|2,0,0]=4 230 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 6f6f562818865fa03f3d70f022ad24cf [0,1,1,0,0,0|2,0,0]=4 231 B13R1.135 C/C=C(\C)/C(=O)Nc1cccnc1 8b92ade4ea51d78d36eb3953a831e2ce [0,1,1,0,0,0|1,0,0]=3 232 B13R1.135 C/C=C(\C)/C(=O)Nc1cccnn1 34b0dc829424f5eb03cdf73fa5370071 [0,1,1,0,0,0|2,0,0]=4 233 B13R1.135 C/C=C(\C)/C(=O)Nc1ccnnc1 07a608a5d369e2b6e8c00a19e250906b [0,1,1,0,0,0|2,0,0]=4 234 B13R1.135 C/C=C(\C)/C(=O)Nc1cnccn1 88acfd8acbcbfdc2d5d49b1dc68c43bb [0,1,1,0,0,0|2,0,0]=4 235 B13R1.135 C/C=C(\Cl)/C(=O)Nc1cccnc1 86fa793438e113b00104ebc33ea5cc4b [0,1,1,0,0,0|1,0,0]=3 236 B13R1.135 C/C=C(\Cl)/C(=O)Nc1cccnn1 aa4a227d6f03cb93492754e1305bd44b [0,1,1,0,0,0|2,0,0]=4 237 B13R1.135 C/C=C(\Cl)/C(=O)Nc1ccnnc1 88f78a0ff724f4f6bb6e8996cf0bd579 [0,1,1,0,0,0|2,0,0]=4 238 B13R1.135 C/C=C(\Cl)/C(=O)Nc1cnccn1 34314c6c27eabf445d83d993428a540a [0,1,1,0,0,0|2,0,0]=4 239 B13R1.135 C/C=C(\O)/C(=O)Nc1ccccc1 eee0e1ff497f724ce424d80b97609a0c [0,1,1,0,0,0|1,0,0]=3 240 B13R1.135 C/C=C(\O)/C(=O)Nc1ccccn1 853aa20a0b52ecc933726a0911569e75 [0,1,1,0,0,0|2,0,0]=4 241 B13R1.135 C/C=C(\O)/C(=O)Nc1cccnc1 bd1b7b8d46cffa579aaa5834856667a5 [0,1,1,0,0,0|0,0,0]=2 242 B13R1.135 C/C=C(\O)/C(=O)Nc1cccnn1 3b235d58eb5bc8ebace03297e33cbca7 [0,1,1,0,0,0|1,0,0]=3 243 B13R1.135 C/C=C(\O)/C(=O)Nc1ccncc1 40f0f1669f35edfd9bb536394fb83d76 [0,1,1,0,0,0|2,0,0]=4 244 B13R1.135 C/C=C(\O)/C(=O)Nc1ccnnc1 6a2ba9957934c5b1d42c5eb0d0d99be1 [0,1,1,0,0,0|1,0,0]=3 245 B13R1.135 C/C=C(\O)/C(=O)Nc1cnccn1 182861e4367a1c924286609199f0cf76 [0,1,1,0,0,0|1,0,0]=3 246 B13R1.135 C=C(CC)C(=O)Nc1cccnc1 e9bfdfbadb2a9de24fd50948d2304e3d [0,1,1,0,0,0|1,0,0]=3 247 B13R1.135 C=C(CC)C(=O)Nc1cccnn1 f0ed3139c9c8dcec2a053c3180aea476 [0,1,1,0,0,0|2,0,0]=4 248 B13R1.135 C=C(CC)C(=O)Nc1ccnnc1 7f73bef803174b46219052948d64ba3a [0,1,1,0,0,0|2,0,0]=4 249 B13R1.135 C=C(CC)C(=O)Nc1cnccn1 43d61d2c4663c74251d7c4c3081770e3 [0,1,1,0,0,0|2,0,0]=4 250 B13R1.135 C=C(CO)C(=O)Nc1ccccn1 65dc75ca6f904ebaa5df74afe459184e [0,1,1,0,0,0|2,0,0]=4 251 B13R1.135 C=C(CO)C(=O)Nc1cccnc1 2694463cd123b76b3774011a528ccdc1 [0,1,1,0,0,0|0,0,0]=2 252 B13R1.135 C=C(CO)C(=O)Nc1cccnn1 c1339293a7ef954a9eb9239f5d4a86f1 [0,1,1,0,0,0|1,0,0]=3 253 B13R1.135 C=C(CO)C(=O)Nc1ccncc1 b693347d522e30aaccf0eed3a939b915 [0,1,1,0,0,0|2,0,0]=4 254 B13R1.135 C=C(CO)C(=O)Nc1ccnnc1 1802b3d22eb267640b4e59669a8f2450 [0,1,1,0,0,0|1,0,0]=3 255 B13R1.135 C=C(CO)C(=O)Nc1cnccn1 a0771700bf6514b2e2ab5e84ef09ffed [0,1,1,0,0,0|1,0,0]=3 256 B13R1.135 C=CC(=O)C(=O)Nc1ccccc1 cea5efc407a0553f9473edaa659ae4e0 [0,1,1,0,0,0|1,0,1]=4 257 B13R1.135 C=CC(=O)C(=O)Nc1cccnc1 3887617fe529648c65a3e5d4916ccb1b [0,1,1,0,0,0|0,0,1]=3 258 B13R1.135 C=CC(=O)C(=O)Nc1cccnn1 a51315c6ef4e2c73448e2d719e4f1354 [0,1,1,0,0,0|1,0,1]=4 259 B13R1.135 C=CC(=O)C(=O)Nc1ccnnc1 106e90d1fa94a298673620f5ed57d0c0 [0,1,1,0,0,0|1,0,1]=4 260 B13R1.135 C=CC(=O)C(=O)Nc1cnccn1 74ec0465840bd904854eb245a6acf548 [0,1,1,0,0,0|1,0,1]=4 261 B13R1.135 C=CC(=O)C(=O)Nc1cncnc1 672b248d8d53463fbfc095ee53e48b1e [0,1,1,0,0,0|1,0,1]=4 262 B13R1.135 CC=C(C)C(=O)Nc1ccccc1 fbe8483b5219b345554dc8c93d5e7765 [0,1,1,0,0,0|2,0,0]=4 263 B13R1.135 CC=C(C)C(=O)Nc1cccnc1 2889d3ff84e3ad8ba0c93c4d3f0a6966 [0,1,1,0,0,0|1,0,0]=3 264 B13R1.135 CC=C(C)C(=O)Nc1cccnn1 98303a9fd2f3b73e2b08150547b0c8ab [0,1,1,0,0,0|2,0,0]=4 265 B13R1.135 CC=C(C)C(=O)Nc1ccnnc1 d0da9444fab85e8fee2f37cd9d078095 [0,1,1,0,0,0|2,0,0]=4 266 B13R1.135 CC=C(C)C(=O)Nc1cnccn1 bfe8195b0b63624ba27f7726371839e1 [0,1,1,0,0,0|2,0,0]=4 267 B13R1.135 CCC(=O)C(=O)Nc1cccnc1 b46310e5fe8c0001ccb33e445e63d19d [0,1,1,0,0,0|0,0,2]=4 268 B13R1.135 CCC(O)C(=O)Nc1cccnc1 7669b8bc3eb0a21eefa32dd1fc66a83e [0,1,1,0,0,0|0,0,2]=4 269 B13R1.135 CC[C@@H](O)C(=O)Nc1cccnc1 793ce8925eabeda07d59ce0af3fc4bf7 [0,1,1,0,0,0|0,0,2]=4 270 B13R1.135 CC[C@H](O)C(=O)Nc1cccnc1 329600d9bf3b923918a68725ed95b196 [0,1,1,0,0,0|0,0,2]=4 271 B13R1.135 CNC(=O)C(=O)Nc1cccnc1 7bbbbfc6570ebc4c9e5848d493b9ee9a [0,1,1,0,0,0|0,0,2]=4 272 B13R1.135 CNC(=O)C(=O)Nc1ccncc1 c8889c99052321d3f59cfabd029e8d98 [0,1,1,0,0,0|1,0,1]=4 273 B13R1.135 COC(=O)C(=O)Nc1cccnc1 1ef20381f4f6676d9bc0c040a78ca811 [0,1,1,0,0,0|1,0,0]=3 274 B13R1.135 COC(=O)C(=O)Nc1cccnn1 7ff375c917301f71f21f9d35a893e106 [0,1,1,0,0,0|2,0,0]=4 275 B13R1.135 COC(=O)C(=O)Nc1ccnnc1 1bca4d5cc30173b316cf05e334c47f39 [0,1,1,0,0,0|2,0,0]=4 276 B13R1.135 COC(=O)C(=O)Nc1cnccn1 258cfa69d19166e96ce735efa2e05f8d [0,1,1,0,0,0|2,0,0]=4 277 B13R1.135 COC(C)C(=O)Nc1cccnc1 971061a1b7dccc74259244dbf5ffa86b [0,1,1,0,0,0|0,0,2]=4 278 B13R1.135 CO[C@@H](C)C(=O)Nc1cccnc1 7ff899b54d7a0c0e8132924615321a5b [0,1,1,0,0,0|0,0,2]=4 279 B13R1.135 CO[C@H](C)C(=O)Nc1cccnc1 f251716e7834e6672c8b5470ea210b8d [0,1,1,0,0,0|0,0,2]=4 280 B13R1.135 O=C(CS)C(=O)Nc1cccnc1 5199958b4ba2ea14360b442e7fba2687 [0,1,1,0,0,0|0,0,2]=4 281 B13R1.135 O=C(Nc1cccnc1)C(O)CO 2cdd606feb26b8938b742187ddd37123 [0,1,1,0,0,0|0,0,2]=4 282 B13R1.135 O=C(Nc1cccnc1)[C@@H](O)CO 7410841478681bc547668be93b643ab0 [0,1,1,0,0,0|0,0,2]=4 283 B13R1.135 O=C(Nc1cccnc1)[C@H](O)CF c6222f9c19fd82b2175a03cbb5fb9b44 [0,1,1,0,0,0|0,0,2]=4 284 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)Cl 9712925cf50d290c5ca581255e4e0850 [0,1,1,0,0,0|2,0,0]=4 285 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)F 7c5572dd8b40ece3ffd44256a3d23cac [0,1,1,0,0,0|2,0,0]=4 286 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)I 1fd8f2e0a0175535b5e3ca97ac504802 [0,1,1,0,0,0|2,0,0]=4 287 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)O 3fa0a2b47d1a8340058249733b775855 [0,1,1,0,0,0|2,0,0]=4 288 B13R1.148 C=C(Br)C(=O)Nc1cncc(c1)C 3e052ba27ce227ae8c90cb1bf581e4ba [0,1,1,0,0,0|1,0,0]=3 289 B13R1.148 C=C(Br)C(=O)Nc1cncc(c1)F d8042d20c1950a6240b214fdbf88e5d9 [0,1,1,0,0,0|1,0,0]=3 290 B13R1.148 C=C(Br)C(=O)Nc1cncc(c1)I 45665a0f6895968f002064ba72e407ca [0,1,1,0,0,0|1,0,0]=3 291 B13R1.148 C=C(Br)C(=O)Nc1cncc(n1)F 0b45dd0d96fcc80f919936f2b802e85c [0,1,1,0,0,0|2,0,0]=4 292 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C d7f0adab9362f6757e3932b5ed64a44f [0,1,1,0,0,0|2,0,0]=4 293 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl f7d6c5fdab9be2fbed6349d3d89935f2 [0,1,1,0,0,0|2,0,0]=4 294 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 055b0209d7e74cbc13bc26c296e20c44 [0,1,1,0,0,0|2,0,0]=4 295 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I a730820077bdd3488e4e1534e08ac4df [0,1,1,0,0,0|2,0,0]=4 296 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O f6f332a64537754086a9578583de733f [0,1,1,0,0,0|2,0,0]=4 297 B13R1.148 C=C(C)C(=O)Nc1cncc(c1)C e84afb6d51549811ab7b2175a5970b25 [0,1,1,0,0,0|1,0,0]=3 298 B13R1.148 C=C(C)C(=O)Nc1cncc(c1)F dd626c158e72c95967ea5abe4f912911 [0,1,1,0,0,0|1,0,0]=3 299 B13R1.148 C=C(C)C(=O)Nc1cncc(c1)I 17f48b03ae52d71e16aff9623f9b1c0d [0,1,1,0,0,0|1,0,0]=3 300 B13R1.148 C=C(C)C(=O)Nc1cncc(c1)O b8f6e53b127bbf6fa581ebd81faae51d [0,1,1,0,0,0|1,0,0]=3 301 B13R1.148 C=C(C)C(=O)Nc1cncc(n1)C 78008e54f3b122d18edeee3339d47a30 [0,1,1,0,0,0|2,0,0]=4 302 B13R1.148 C=C(C)C(=O)Nc1cncc(n1)Cl c22bac2ba16982a9d4edf6a55c718dd0 [0,1,1,0,0,0|2,0,0]=4 303 B13R1.148 C=C(C)C(=O)Nc1cncc(n1)F d7a758919ea4321e7e4883d1fc3e5cf6 [0,1,1,0,0,0|2,0,0]=4 304 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)C 9a8c0fdb0047244854f39689c116b6d1 [0,1,1,0,0,0|2,0,0]=4 305 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)F 462bd4d72ad8e4a4f9cdb07265f2cfd7 [0,1,1,0,0,0|2,0,0]=4 306 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)I 7081b87d451027cef22f039a44d11fcc [0,1,1,0,0,0|2,0,0]=4 307 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)O a365fd9b8d1ca6e67102923b86b991bd [0,1,1,0,0,0|2,0,0]=4 308 B13R1.148 C=C(Cl)C(=O)Nc1cncc(c1)C b64a73cf95d4bccb2adc3cd115272a35 [0,1,1,0,0,0|1,0,0]=3 309 B13R1.148 C=C(Cl)C(=O)Nc1cncc(c1)F 67e4793fc93322e117f1fe7bbe7f604a [0,1,1,0,0,0|1,0,0]=3 310 B13R1.148 C=C(F)C(=O)Nc1cc(cnn1)C c85f9f0915b7fcb5325fcb9261e1cb03 [0,1,1,0,0,0|2,0,0]=4 311 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)C 9498899bf230f2146ac73cfd9f88398a [0,1,1,0,0,0|2,0,0]=4 312 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)Cl 8c5ea72c1bfc7d066dd58ac1e412fca1 [0,1,1,0,0,0|2,0,0]=4 313 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)F f9ea813bdc8f60db354e6c55b082d3db [0,1,1,0,0,0|2,0,0]=4 314 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)I 18785552453513751edbbe6d33269fd9 [0,1,1,0,0,0|2,0,0]=4 315 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)O ca6c3cab665038a39d2547d06073ac9b [0,1,1,0,0,0|2,0,0]=4 316 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)S f9382276575a379b00ad4d8ba8f35750 [0,1,1,0,0,0|2,0,0]=4 317 B13R1.148 C=C(F)C(=O)Nc1cncc(c1)C 41f888b6ce9da4f27530ff644bfd74d6 [0,1,1,0,0,0|1,0,0]=3 318 B13R1.148 C=C(F)C(=O)Nc1cncc(c1)F e69f2bfe4c85758864c7c72f93daa5fe [0,1,1,0,0,0|1,0,0]=3 319 B13R1.148 C=C(F)C(=O)Nc1cncc(c1)I d187d0c924e78818d433d58294788abc [0,1,1,0,0,0|1,0,0]=3 320 B13R1.148 C=C(F)C(=O)Nc1cncc(c1)O 350c522e9402fd00bd3eebbceec007f3 [0,1,1,0,0,0|1,0,0]=3 321 B13R1.148 C=C(F)C(=O)Nc1cncc(n1)F 62aeba4f42efbef3aefca47bbe18640d [0,1,1,0,0,0|2,0,0]=4 322 B13R1.148 CC(=O)C(=O)Nc1cncc(c1)C 585b60644b0296214248ea462dc75b0f [0,1,1,0,0,0|0,0,2]=4 323 B13R1.148 CC(=O)C(=O)Nc1cncc(c1)F 74e7e42c2b0fc21498ec9ff45e9ec445 [0,1,1,0,0,0|0,0,2]=4 324 B13R1.148 CC(=O)C(=O)Nc1cncc(c1)I 0eabe9dac427911921786b683144e19c [0,1,1,0,0,0|0,0,2]=4 325 B13R1.148 CC(=O)C(=O)Nc1cncc(c1)O 255d3980a72b0a5bc28499a7c0141990 [0,1,1,0,0,0|0,0,2]=4 326 B13R1.148 CC(O)C(=O)Nc1cncc(c1)F 5364ed686b66d8604c6063d5355a1b00 [0,1,1,0,0,0|0,0,2]=4 327 B13R1.148 CC(O)C(=O)Nc1cncc(c1)I 3861cc3225c751aedeafa5f8c0a77387 [0,1,1,0,0,0|0,0,2]=4 328 B13R1.148 CC(O)C(=O)Nc1cncc(c1)O ae3558ccc46a02aa403c1a7208c7b19d [0,1,1,0,0,0|0,0,2]=4 329 B13R1.148 C[C@@H](O)C(=O)Nc1cncc(c1)F 4bbce81468d241f3520358e7113e299b [0,1,1,0,0,0|0,0,2]=4 330 B13R1.148 C[C@@H](O)C(=O)Nc1cncc(c1)I 22fcd3ae30c645dc507d3e383ad7fecb [0,1,1,0,0,0|0,0,2]=4 331 B13R1.148 C[C@@H](O)C(=O)Nc1cncc(c1)O bcd1b7e01f90d773975db1dd28f9f22a [0,1,1,0,0,0|0,0,2]=4 332 B13R1.148 C[C@H](O)C(=O)Nc1cncc(c1)F 375f5ae418f994f9616de3de83af0612 [0,1,1,0,0,0|0,0,2]=4 333 B13R1.148 C[C@H](O)C(=O)Nc1cncc(c1)I 064262bda3bc135c6362a5bbee04fb16 [0,1,1,0,0,0|0,0,2]=4 334 B13R1.148 C[C@H](O)C(=O)Nc1cncc(c1)O 4fd12f99997e8ff61a4cc1a7d4894ce6 [0,1,1,0,0,0|0,0,2]=4 335 B13R1.148 Cc1cncc(c1)NC(=O)C(=O)N ee287b40c4977ec42e0a2c8d555f3901 [0,1,1,0,0,0|1,0,1]=4 336 B13R1.148 Cc1cncc(c1)NC(=O)C(C)O 9abfd1a93b7ab49c8b8d30cde9f44607 [0,1,1,0,0,0|0,0,2]=4 337 B13R1.148 Cc1cncc(c1)NC(=O)C(O)O c75911988e1de97c57e3e3ba09850c5e [0,1,1,0,0,0|1,0,1]=4 338 B13R1.148 Cc1cncc(c1)NC(=O)[C@@H](C)O dbee5280f3d85356953347c8bfcc6dda [0,1,1,0,0,0|0,0,2]=4 339 B13R1.148 Cc1cncc(c1)NC(=O)[C@H](C)O 1b14016de73acb1898de4903cedacd88 [0,1,1,0,0,0|0,0,2]=4 340 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)Br 48f69f146366bd037609503ce6edbc56 [0,1,1,0,0,0|1,0,1]=4 341 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)Cl 8b2b3f2e7ee96b17388f44798612113b [0,1,1,0,0,0|1,0,1]=4 342 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)F 8edba9cdb2a2a9c7e3d8e61c4a8ac780 [0,1,1,0,0,0|1,0,1]=4 343 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)O eacf14a4fd21705c1f276a081b371f80 [0,1,1,0,0,0|1,0,1]=4 344 B13R1.148 NC(=O)C(=O)Nc1cncc(c1)F f209fb4add714d2fdbce4df4d7347ca8 [0,1,1,0,0,0|1,0,1]=4 345 B13R1.148 NC(=O)C(=O)Nc1cncc(c1)I 683448d0e798fa024748685596df01ab [0,1,1,0,0,0|1,0,1]=4 346 B13R1.148 NC(=O)C(=O)Nc1cncc(c1)O 7f63aa5aeb965d43cbba2325a2da5638 [0,1,1,0,0,0|1,0,1]=4 347 B13R1.148 O=C(Nc1cncc(c1)F)C(O)O 04c0cb877fa0c3bd3cc41e31291d35ca [0,1,1,0,0,0|1,0,1]=4 348 B13R1.148 O=C(Nc1cncc(c1)I)C(O)O 7e610b5aa051335442ca20896b5655b2 [0,1,1,0,0,0|1,0,1]=4 349 B13R1.148 O=C(Nc1cncc(c1)O)C(O)O 585faa47065823074f95449b593e89e1 [0,1,1,0,0,0|1,0,1]=4 350 B13R1.152 C=C(Br)C(=O)N(C)c1cccnc1 4d549d6d9fe688a53e2d4d1de89c1e31 [0,1,1,0,0,0|1,0,0]=3 351 B13R1.152 C=C(Br)C(=O)N(C)c1cccnn1 a76a56cb591a78337a0b05b1b54251e7 [0,1,1,0,0,0|2,0,0]=4 352 B13R1.152 C=C(Br)C(=O)N(C)c1ccnnc1 40b844365c9adeaa3046132d0a1aa91d [0,1,1,0,0,0|2,0,0]=4 353 B13R1.152 C=C(C)C(=O)N(C)c1cccnc1 0ec8125b9638dc84a38c1b43565675ac [0,1,1,0,0,0|1,0,0]=3 354 B13R1.152 C=C(C)C(=O)N(C)c1cccnn1 bca09867c0c41ceba217a84bc3ad5536 [0,1,1,0,0,0|2,0,0]=4 355 B13R1.152 C=C(C)C(=O)N(C)c1ccnnc1 df5073d2f68f47b59773a5b234022045 [0,1,1,0,0,0|2,0,0]=4 356 B13R1.152 C=C(C)C(=O)N(C)c1cnccn1 b544076e317ff52e57531a0897870409 [0,1,1,0,0,0|2,0,0]=4 357 B13R1.152 C=C(C)C(=O)N(C)c1cncnc1 1f4c7c3de6104582df03b153c652840e [0,1,1,0,0,0|2,0,0]=4 358 B13R1.152 C=C(Cl)C(=O)N(C)c1cccnc1 a34bae0503cbf8ccab7ac4bc13c098f5 [0,1,1,0,0,0|1,0,0]=3 359 B13R1.152 C=C(Cl)C(=O)N(C)c1cccnn1 cf21c86bd944f3ce5f082053d8865c25 [0,1,1,0,0,0|2,0,0]=4 360 B13R1.152 C=C(Cl)C(=O)N(C)c1ccnnc1 a2e973e136ceb0f7bb9f7a1474e167ce [0,1,1,0,0,0|2,0,0]=4 361 B13R1.152 C=C(F)C(=O)N(C)c1cccnc1 67d4cce662735b3736b4f63c08c3c7a5 [0,1,1,0,0,0|1,0,0]=3 362 B13R1.152 C=C(F)C(=O)N(C)c1cccnn1 25b68a8c39d6608bd3912e7bd43ee779 [0,1,1,0,0,0|2,0,0]=4 363 B13R1.152 C=C(F)C(=O)N(C)c1ccnnc1 253012367cb76d8ba1945b0ca3a44802 [0,1,1,0,0,0|2,0,0]=4 364 B13R1.152 C=C(F)C(=O)N(C)c1cnccn1 4897ff11258f05f960ff571a190f02f0 [0,1,1,0,0,0|2,0,0]=4 365 B13R1.152 C=C(F)C(=O)N(C)c1cncnc1 b4aecd17954e8f44240c8d7396b71ff1 [0,1,1,0,0,0|2,0,0]=4 366 B13R1.152 CC(=O)C(=O)N(C)c1cccnc1 a411c965d2ab87d140aa16ffb3bd6543 [0,1,1,0,0,0|0,0,2]=4 367 B13R1.152 CC(O)C(=O)N(C)c1cccnc1 bb0df43d02233ec4fb0e9e0a760790fe [0,1,1,0,0,0|0,0,2]=4 368 B13R1.152 CN(C(=O)C(=O)N)c1cccnc1 1e8596a2bf3637cd0cf3b9c801553053 [0,1,1,0,0,0|1,0,1]=4 369 B13R1.152 CN(C(=O)C(=O)N)c1ccncc1 5d38c09e96523db743a9f3745ec32517 [0,1,1,0,0,0|1,0,1]=4 370 B13R1.152 CN(C(=O)C(O)O)c1cccnc1 1b3e5de1c9ae6d2687d95f66b31c3543 [0,1,1,0,0,0|1,0,1]=4 371 B13R1.152 C[C@@H](O)C(=O)N(C)c1cccnc1 168664f62454a8d6b330f6732e45fd60 [0,1,1,0,0,0|0,0,2]=4 372 B13R1.152 C[C@H](O)C(=O)N(C)c1cccnc1 b38ce02da86e32465e31915b3368440d [0,1,1,0,0,0|0,0,2]=4 373 B13R1.202 C=C(Br)C(=O)Nc1ccccc1F 13604416a3c4da70844667aefe20ef90 [0,1,1,0,0,0|2,0,0]=4 374 B13R1.202 C=C(Br)C(=O)Nc1ccccc1I 1726313c329b9d628e3ad935a53840e6 [0,1,1,0,0,0|2,0,0]=4 375 B13R1.202 C=C(Br)C(=O)Nc1ccccc1O 743b42194db7ef352787bc2efb428586 [0,1,1,0,0,0|2,0,0]=4 376 B13R1.202 C=C(Br)C(=O)Nc1ccccc1S 0dd4a6d8a3c58e5e13f3c81c9bb17be3 [0,1,1,0,0,0|2,0,0]=4 377 B13R1.202 C=C(Br)C(=O)Nc1cccnc1C 8fe4fe4b2d01b8353921de41ec415040 [0,1,1,0,0,0|1,0,0]=3 378 B13R1.202 C=C(Br)C(=O)Nc1cccnc1F fe05e310b53e93e27b43a7a819094553 [0,1,1,0,0,0|1,0,0]=3 379 B13R1.202 C=C(Br)C(=O)Nc1cccnc1I 523c797bc3a246cbfcd235d7359a1030 [0,1,1,0,0,0|1,0,0]=3 380 B13R1.202 C=C(Br)C(=O)Nc1cccnc1O 96639612efef29f964432e6e5851ece3 [0,1,1,0,0,0|1,0,0]=3 381 B13R1.202 C=C(Br)C(=O)Nc1cnccc1F 647c01dea0f7c934d1fa7628f410d77a [0,1,1,0,0,0|1,0,0]=3 382 B13R1.202 C=C(Br)C(=O)Nc1cnccc1I bb0f62af2f4a8c9f10bab25c77f00a96 [0,1,1,0,0,0|1,0,0]=3 383 B13R1.202 C=C(Br)C(=O)Nc1nccnc1I 7315120b139068a0714b8fd4bae51a5c [0,1,1,0,0,0|2,0,0]=4 384 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 0576d9c026bd55a99b880e0285d0af3a [0,1,1,0,0,0|2,0,0]=4 385 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 9a5a7d5e77293719e5a41cbf540141f2 [0,1,1,0,0,0|2,0,0]=4 386 B13R1.202 C=C(C)C(=O)Nc1ccccc1I cd91cd8d201b261e3018d57456c9eb63 [0,1,1,0,0,0|2,0,0]=4 387 B13R1.202 C=C(C)C(=O)Nc1ccccc1O a32baba90d61f6c17232f9c526339ac7 [0,1,1,0,0,0|2,0,0]=4 388 B13R1.202 C=C(C)C(=O)Nc1ccccc1S d7455653a2beaffe9b65441f63d45072 [0,1,1,0,0,0|2,0,0]=4 389 B13R1.202 C=C(C)C(=O)Nc1cccnc1C 1d465eb51d426b7342da755177f09339 [0,1,1,0,0,0|1,0,0]=3 390 B13R1.202 C=C(C)C(=O)Nc1cccnc1F add30627e273e12e6c8a849e92e45f30 [0,1,1,0,0,0|1,0,0]=3 391 B13R1.202 C=C(C)C(=O)Nc1cccnc1I b0e3facd312615db110a0faa2a6e3d8c [0,1,1,0,0,0|1,0,0]=3 392 B13R1.202 C=C(C)C(=O)Nc1cccnc1O bd846738cdc51cdfc2846684f16dec59 [0,1,1,0,0,0|1,0,0]=3 393 B13R1.202 C=C(C)C(=O)Nc1cnccc1F 584eb36231327301132548386a47aaca [0,1,1,0,0,0|1,0,0]=3 394 B13R1.202 C=C(C)C(=O)Nc1cnccc1I c981fa654c9c77e877bb0cd0048a2b3c [0,1,1,0,0,0|1,0,0]=3 395 B13R1.202 C=C(C)C(=O)Nc1nccnc1C 85a883df96bb13f772a4db9d6e82c160 [0,1,1,0,0,0|2,0,0]=4 396 B13R1.202 C=C(C)C(=O)Nc1nccnc1I dd6389b3cf5414a81c2b7e17478cd6d3 [0,1,1,0,0,0|2,0,0]=4 397 B13R1.202 C=C(C)C(=O)Nc1nccnc1O 858819aca2d22113db8151c847659e04 [0,1,1,0,0,0|2,0,0]=4 398 B13R1.202 C=C(C)C(=O)Nc1nnccc1C 7925201608893e6edb767361d5f362d3 [0,1,1,0,0,0|2,0,0]=4 399 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1F 0058ea394a422f7bb45be91cf4d8a57a [0,1,1,0,0,0|2,0,0]=4 400 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1I a0ad1bc9ff3f2e2a480b76fa2fd1c647 [0,1,1,0,0,0|2,0,0]=4 401 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1O 976ca127a4110954beef8e675fca6537 [0,1,1,0,0,0|2,0,0]=4 402 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1S 8b38f4b23dcd92c8c6b4834e3361ca8e [0,1,1,0,0,0|2,0,0]=4 403 B13R1.202 C=C(Cl)C(=O)Nc1cccnc1C cc0261ced0a4feb4f42580cbce9c5cb1 [0,1,1,0,0,0|1,0,0]=3 404 B13R1.202 C=C(Cl)C(=O)Nc1cccnc1F a3e0f65c4ac192aaa1dd4162ba5427b9 [0,1,1,0,0,0|1,0,0]=3 405 B13R1.202 C=C(Cl)C(=O)Nc1cccnc1O e742fe5b2f70343e4d40a943327756c5 [0,1,1,0,0,0|1,0,0]=3 406 B13R1.202 C=C(Cl)C(=O)Nc1cnccc1F 2192fdd2838200e78cbe55efeb391e54 [0,1,1,0,0,0|1,0,0]=3 407 B13R1.202 C=C(Cl)C(=O)Nc1cnccc1I e717131923df51db940c4bcba8d5d00f [0,1,1,0,0,0|1,0,0]=3 408 B13R1.202 C=C(Cl)C(=O)Nc1nccnc1C 20c660f755b9b30179ebb84b0a609067 [0,1,1,0,0,0|2,0,0]=4 409 B13R1.202 C=C(Cl)C(=O)Nc1nccnc1I e9f265d0c73f25591e426be93e4e6a93 [0,1,1,0,0,0|2,0,0]=4 410 B13R1.202 C=C(F)C(=O)Nc1ccccc1C d2f8686140d32c62732dd523ad2018cf [0,1,1,0,0,0|2,0,0]=4 411 B13R1.202 C=C(F)C(=O)Nc1ccccc1F 0beb145d350ef96e3ed7bb89676ddb15 [0,1,1,0,0,0|2,0,0]=4 412 B13R1.202 C=C(F)C(=O)Nc1ccccc1I dd38d16bfaff542a418b65cb8d8b1100 [0,1,1,0,0,0|2,0,0]=4 413 B13R1.202 C=C(F)C(=O)Nc1ccccc1O 0b3a0696a4057480e92c278aff0cafc3 [0,1,1,0,0,0|2,0,0]=4 414 B13R1.202 C=C(F)C(=O)Nc1ccccc1S bb5e77292b8d5d15539377fa3cf500f9 [0,1,1,0,0,0|2,0,0]=4 415 B13R1.202 C=C(F)C(=O)Nc1cccnc1C 69d5d9ebbfed88b2d8f0ee3bbc45f151 [0,1,1,0,0,0|1,0,0]=3 416 B13R1.202 C=C(F)C(=O)Nc1cccnc1F d0165dd30f6c7720f3f4aba192385144 [0,1,1,0,0,0|1,0,0]=3 417 B13R1.202 C=C(F)C(=O)Nc1cccnc1I f0277aa0cf151849acc4721e34b05f02 [0,1,1,0,0,0|1,0,0]=3 418 B13R1.202 C=C(F)C(=O)Nc1cccnc1O 541867b0570162e0a3cc0235abe32c72 [0,1,1,0,0,0|1,0,0]=3 419 B13R1.202 C=C(F)C(=O)Nc1cnccc1F 0a06c127e7f344aae476299525e11be5 [0,1,1,0,0,0|1,0,0]=3 420 B13R1.202 C=C(F)C(=O)Nc1cnccc1I f703fe304461a97189b2ec2c3b6ba64b [0,1,1,0,0,0|1,0,0]=3 421 B13R1.202 C=C(F)C(=O)Nc1cnccc1O 3f8915428ff329374d456ff1004efd47 [0,1,1,0,0,0|1,0,0]=3 422 B13R1.202 C=C(F)C(=O)Nc1nccnc1C 42199cf6bca54175e09663ca38afbd98 [0,1,1,0,0,0|2,0,0]=4 423 B13R1.202 C=C(F)C(=O)Nc1nccnc1Cl b4bb1ec2683ea0145a4b5ea0b748ec61 [0,1,1,0,0,0|2,0,0]=4 424 B13R1.202 C=C(F)C(=O)Nc1nccnc1I 400afb8a4b8096209384904d64a02fc7 [0,1,1,0,0,0|2,0,0]=4 425 B13R1.202 C=C(F)C(=O)Nc1nccnc1O f1925dbdf2b4adb10f97918d898c2fe6 [0,1,1,0,0,0|2,0,0]=4 426 B13R1.202 C=C(F)C(=O)Nc1nnccc1C b99d92a778c78c93a8dd7d95eb1a6daa [0,1,1,0,0,0|2,0,0]=4 427 B13R1.202 C=C(F)C(=O)Nc1nnccc1O ad532dcdb575474f07b5289d0f19464a [0,1,1,0,0,0|2,0,0]=4 428 B13R1.202 CC(=O)C(=O)Nc1cccnc1C c2cd60610ca3bc0a90b07a4cf25c7130 [0,1,1,0,0,0|0,0,2]=4 429 B13R1.202 CC(=O)C(=O)Nc1cccnc1F 43dcf0ca25f667233bc49a6e3e58392d [0,1,1,0,0,0|0,0,2]=4 430 B13R1.202 CC(=O)C(=O)Nc1cccnc1I c9b4786d95bc7736cd35a1d3be88d1cd [0,1,1,0,0,0|0,0,2]=4 431 B13R1.202 CC(=O)C(=O)Nc1cccnc1O dd9eb1aa997c84f8c696bd1564d145f5 [0,1,1,0,0,0|0,0,2]=4 432 B13R1.202 CC(=O)C(=O)Nc1cnccc1C 585f37304248b5c9435b2d13a3351f6f [0,1,1,0,0,0|0,0,2]=4 433 B13R1.202 CC(=O)C(=O)Nc1cnccc1F c60895e83fe81279acfaae1afc393f75 [0,1,1,0,0,0|0,0,2]=4 434 B13R1.202 CC(=O)C(=O)Nc1cnccc1I e2a221dd4b43adbb4d1773566edb3e0a [0,1,1,0,0,0|0,0,2]=4 435 B13R1.202 CC(=O)C(=O)Nc1cnccc1O aca5eed85b13031fe418bc741b437852 [0,1,1,0,0,0|0,0,2]=4 436 B13R1.202 CC(O)C(=O)Nc1cccnc1Cl 84c6f15f7b40c53934f6ce65b7a8861e [0,1,1,0,0,0|0,0,2]=4 437 B13R1.202 CC(O)C(=O)Nc1cccnc1F 278e55f6bb54bd998920095764cd457b [0,1,1,0,0,0|0,0,2]=4 438 B13R1.202 CC(O)C(=O)Nc1cccnc1I a2c69c8198c994d6d6114842b80508d8 [0,1,1,0,0,0|0,0,2]=4 439 B13R1.202 CC(O)C(=O)Nc1cccnc1O 91d824406455d29b8fa7ef6538af7f21 [0,1,1,0,0,0|0,0,2]=4 440 B13R1.202 CC(O)C(=O)Nc1cnccc1F 14a1daded658c423c37170193d930d8f [0,1,1,0,0,0|0,0,2]=4 441 B13R1.202 CC(O)C(=O)Nc1cnccc1I f92f2064735249e3e3f0a892e5700593 [0,1,1,0,0,0|0,0,2]=4 442 B13R1.202 C[C@@H](O)C(=O)Nc1cccnc1Cl f377b040d616de5c86a3a349db2ad9fc [0,1,1,0,0,0|0,0,2]=4 443 B13R1.202 C[C@@H](O)C(=O)Nc1cccnc1F 62b6bc18b2bf2f220a1d41689e5ab5c9 [0,1,1,0,0,0|0,0,2]=4 444 B13R1.202 C[C@@H](O)C(=O)Nc1cccnc1I 0e6611fa93f10d0861c096b838b00c7e [0,1,1,0,0,0|0,0,2]=4 445 B13R1.202 C[C@@H](O)C(=O)Nc1cccnc1O 5bfc9a0ca2bde47c67b041be076e46ce [0,1,1,0,0,0|0,0,2]=4 446 B13R1.202 C[C@@H](O)C(=O)Nc1cnccc1F 86a129ceab3307998064408091a6c826 [0,1,1,0,0,0|0,0,2]=4 447 B13R1.202 C[C@@H](O)C(=O)Nc1cnccc1I ab8f570237198154d6c9e5dba887c3ee [0,1,1,0,0,0|0,0,2]=4 448 B13R1.202 C[C@H](O)C(=O)Nc1cccnc1Cl 71db1db896a8a3464b33f8fb27310053 [0,1,1,0,0,0|0,0,2]=4 449 B13R1.202 C[C@H](O)C(=O)Nc1cccnc1F 208526a1b428a9c6135c77cec91ed9ab [0,1,1,0,0,0|0,0,2]=4 450 B13R1.202 C[C@H](O)C(=O)Nc1cccnc1I 24330d1345f3c0d638e6f25a62986f1f [0,1,1,0,0,0|0,0,2]=4 451 B13R1.202 C[C@H](O)C(=O)Nc1cccnc1O 6bad80145d5526a989ad47e29de07d0c [0,1,1,0,0,0|0,0,2]=4 452 B13R1.202 C[C@H](O)C(=O)Nc1cnccc1F 39e6c67f18e0dd7aea252c44df245ddd [0,1,1,0,0,0|0,0,2]=4 453 B13R1.202 C[C@H](O)C(=O)Nc1cnccc1I f7a593d1553b9c567a074011658031ad [0,1,1,0,0,0|0,0,2]=4 454 B13R1.202 Cc1ncccc1NC(=O)C(=O)N f89abea17adb2d63c07cec9641c51703 [0,1,1,0,0,0|1,0,1]=4 455 B13R1.202 Cc1ncccc1NC(=O)C(C)O 513365752372d29ce740ac5b365fc415 [0,1,1,0,0,0|0,0,2]=4 456 B13R1.202 Cc1ncccc1NC(=O)C(O)O 0aaf386cea027a1ced760e06d44f3176 [0,1,1,0,0,0|1,0,1]=4 457 B13R1.202 Cc1ncccc1NC(=O)[C@@H](C)O 37d861bf13f768a15a6591870d1ac156 [0,1,1,0,0,0|0,0,2]=4 458 B13R1.202 Cc1ncccc1NC(=O)[C@H](C)O c35b82cd8474b953c9e62cbd221208ee [0,1,1,0,0,0|0,0,2]=4 459 B13R1.202 NC(=O)C(=O)Nc1cccnc1F 463d8e11e8427197bc514be7c58bd478 [0,1,1,0,0,0|1,0,1]=4 460 B13R1.202 NC(=O)C(=O)Nc1cccnc1I 1813a6d59c27b112eac2ddcbea0ea42e [0,1,1,0,0,0|1,0,1]=4 461 B13R1.202 NC(=O)C(=O)Nc1cccnc1O df4516c1121714c4e74f3e967fd27c6b [0,1,1,0,0,0|1,0,1]=4 462 B13R1.202 NC(=O)C(=O)Nc1ccncc1I d71c00f2cba7d73c25b64ad59b9c5fc4 [0,1,1,0,0,0|1,0,1]=4 463 B13R1.202 NC(=O)C(=O)Nc1cnccc1F a7564c4f287ea4e3f23997a3db954652 [0,1,1,0,0,0|1,0,1]=4 464 B13R1.202 NC(=O)C(=O)Nc1cnccc1I 317108323b49dae6f97001ec515f317e [0,1,1,0,0,0|1,0,1]=4 465 B13R1.202 O=C(Nc1cccnc1Br)C(O)O c4166468edb38b233e8168116d01a083 [0,1,1,0,0,0|1,0,1]=4 466 B13R1.202 O=C(Nc1cccnc1Cl)C(O)O 8dfe5c938aee7ecf06f1bbc43abc2a0e [0,1,1,0,0,0|1,0,1]=4 467 B13R1.202 O=C(Nc1cccnc1F)C(O)O e43d7043c70998b4647f0ad152b96212 [0,1,1,0,0,0|1,0,1]=4 468 B13R1.202 O=C(Nc1cccnc1I)C(O)O 6d25379db725580f28a3664eda4917de [0,1,1,0,0,0|1,0,1]=4 469 B13R1.202 O=C(Nc1cccnc1O)C(O)O 88794a864f8fa18cf603f7d610f291bf [0,1,1,0,0,0|1,0,1]=4 470 B13R1.202 O=C(Nc1cnccc1F)C(O)O 0f190271a2ec5a28b59467940f437575 [0,1,1,0,0,0|1,0,1]=4 471 B13R1.202 O=C(Nc1cnccc1I)C(O)O 5bf7ab815c0c5984559b31af14191a37 [0,1,1,0,0,0|1,0,1]=4 472 B13R1.418 NC(=O)C(CO)Nc1ccncc1 cd6b2dd9275725cf7eb0771114ebd371 [0,1,1,0,0,0|1,0,1]=4 473 B13R1.418 NC(=O)[C@H](CO)Nc1ccncc1 f79ebfab4e9b210402b757395facee19 [0,1,1,0,0,0|1,0,1]=4 474 B13R1.380 O=CNc1ccccc1C=C(Br)Br 08df6cadb64b93d24dbf911ef81f1ecf [0,1,1,0,0,0|2,0,0]=4 475 B13R1.380 O=CNc1ccccc1C=C(F)F 3556a8dc3a74ccd07ce636f81ac7cb8d [0,1,1,0,0,0|2,0,0]=4 476 B13R1.382 CNC(=O)c1ccncc1NC=O 4051efef63bfbd8d44cf173716348722 [0,1,1,0,0,0|2,0,0]=4 477 B13R1.382 COC(=O)c1ccncc1NC=O b6b0fd6adddb0c21f94b21a06cb69fe2 [0,1,1,0,0,0|2,0,0]=4 478 B13R1.382 O=CNc1ccccc1C(=O)NO 99ae6c68024bc8640d811ad122d1cfb4 [0,1,1,0,0,0|2,0,0]=4 479 B13R1.485 O=CNc1cnccc1OCCO fa03df89792a46eb918d86a672e92dcc [0,1,1,0,0,0|0,0,2]=4 480 B13R1.40 C=CC(=O)Nc1cncc(c1Br)Cl ad59d4b1b0c5d22da8ddd4e8c4e0473f [0,1,1,0,0,0|2,0,0]=4 481 B13R1.40 C=CC(=O)Nc1cncc(c1C)Br 52337621ab19f1e49934e6df611698b4 [0,1,1,0,0,0|1,0,1]=4 482 B13R1.40 C=CC(=O)Nc1cncc(c1C)Cl bd0ad4313158c4cf90ce9d0f3ccf444a [0,1,1,0,0,0|1,0,1]=4 483 B13R1.40 C=CC(=O)Nc1cncc(c1C)F 8aa028a5eed703c18c32c77558d1b22e [0,1,1,0,0,0|1,0,1]=4 484 B13R1.40 C=CC(=O)Nc1cncc(c1Cl)Cl 1a2414fc99be508d3c9bf480178270eb [0,1,1,0,0,0|2,0,0]=4 485 B13R1.40 C=CC(=O)Nc1cncc(c1Cl)F c48cba9a630228bc05b967b82f842b12 [0,1,1,0,0,0|2,0,0]=4 486 B13R1.40 C=CC(=O)Nc1cncc(c1F)Cl 87eb9547a31ea8fab7982b35c0126818 [0,1,1,0,0,0|2,0,0]=4 487 B13R1.40 C=CC(=O)Nc1cncc(c1I)F 42695551224c30042ae710105c201905 [0,1,1,0,0,0|2,0,0]=4 488 B13R1.40 C=CC(=O)Nc1cncc(c1O)Br 9258d105d2a6349c3f344cff770bbef0 [0,1,1,0,0,0|2,0,0]=4 489 B13R1.40 C=CC(=O)Nc1cncc(c1O)I 8de5e0b6ac26351e72d64e50e19b3d9c [0,1,1,0,0,0|2,0,0]=4 490 B13R1.40 Cc1c(cncc1NC(=O)C=O)Br 80ba3bb2d89db89cbd72103449f53b2c [0,1,1,0,0,0|0,0,2]=4 491 B13R1.40 Cc1c(cncc1NC(=O)C=O)Cl 3d89fc93f13cd276ea7ffc4ed46a7141 [0,1,1,0,0,0|0,0,2]=4 492 B13R1.40 Cc1c(cncc1NC(=O)C=O)F 61c3475633915838bbcbff68e41c310e [0,1,1,0,0,0|0,0,2]=4 493 B13R1.40 O=CC(=O)Nc1cncc(c1Br)Cl 0da7d1be8ca11daf6ce9a0b71005393a [0,1,1,0,0,0|1,0,1]=4 494 B13R1.40 O=CC(=O)Nc1cncc(c1Cl)Cl 1c33704f2385bba6351e37b7db97805f [0,1,1,0,0,0|1,0,1]=4 495 B13R1.40 O=CC(=O)Nc1cncc(c1Cl)F 0db10f1523c62015b516a21cfca9d311 [0,1,1,0,0,0|1,0,1]=4 496 B13R1.40 O=CC(=O)Nc1cncc(c1F)Cl 7fd42ad6c8c8ee9dc0acda08c04a61dd [0,1,1,0,0,0|1,0,1]=4 497 B13R1.40 O=CC(=O)Nc1cncc(c1I)Cl 38567ce47ebb62e71ffcd3200607b50f [0,1,1,0,0,0|1,0,1]=4 498 B13R1.40 O=CC(=O)Nc1cncc(c1I)F 0a32b25b3c7696947b64205415bd7775 [0,1,1,0,0,0|1,0,1]=4 499 B13R1.40 O=CC(=O)Nc1cncc(c1O)Br 653dc8296761e9d4f8eb1d91e984fec9 [0,1,1,0,0,0|1,0,1]=4 500 B13R1.40 O=CC(=O)Nc1cncc(c1O)I 141f5a8faf8cb69c27ca8be9af4475cd [0,1,1,0,0,0|1,0,1]=4 501 B13R1.91 C#CC(=O)Nc1cnccc1C=O 535137e9735ddf45bf77541120c8c9ff [0,1,1,0,0,0|1,0,1]=4 502 B13R1.91 C#Cc1ccncc1NC(=O)C=C cddf445997d600be781da130ba2c97e4 [0,1,1,0,0,0|1,0,1]=4 503 B13R1.91 C#Cc1ccncc1NC(=O)C=O de6562d589d4684a785e274807e3b756 [0,1,1,0,0,0|0,0,2]=4 504 B13R1.91 C=CC(=O)Nc1ccccc1C=C 1ac12ee3c174ef750808d5edc13a2beb [0,1,1,0,0,0|2,0,0]=4 505 B13R1.91 C=CC(=O)Nc1ccccc1C=O 65d86af96122000defc423a660e8803f [0,1,1,0,0,0|2,0,0]=4 506 B13R1.91 C=CC(=O)Nc1cnccc1C#N ba314d563cc552c9992ad83c00f7a45e [0,1,1,0,0,0|1,0,1]=4 507 B13R1.91 C=CC(=O)Nc1cnccc1C=O 0db98dce66765c5b46d0a302d1ce9cac [0,1,1,0,0,0|1,0,0]=3 508 B13R1.91 C=CC(=O)Nc1cnccc1CO 9cc20ac42ba64d5f8ebfa8b0c5a27cb9 [0,1,1,0,0,0|1,0,1]=4 509 B13R1.91 C=CC(=O)Nc1cnccc1OC ee9d24f7bc23cc91aae8cb672ddec5ac [0,1,1,0,0,0|1,0,1]=4 510 B13R1.91 C=CC(=O)Nc1cncnc1C=O 985fd902dd51f697a4c05399ca793e35 [0,1,1,0,0,0|2,0,0]=4 511 B13R1.91 C=Cc1ccccc1NC(=O)C=O b3ac91db34e65fc91e84e9e88eac0332 [0,1,1,0,0,0|1,0,1]=4 512 B13R1.91 C=Cc1ccccc1NC(=O)CO 2020884169c76c360969f1dcc2d335df [0,1,1,0,0,0|1,0,1]=4 513 B13R1.91 CCC(=O)Nc1cnccc1C=O a5c2f676a06e7ec6f720a3748dcb7eee [0,1,1,0,0,0|1,0,1]=4 514 B13R1.91 COc1ccncc1NC(=O)C=O a20049229c95a11d20b0d39cda3608da [0,1,1,0,0,0|0,0,2]=4 515 B13R1.91 N#Cc1ccncc1NC(=O)C=O 9fd42a2044008cbfb2367f62700e728b [0,1,1,0,0,0|0,0,2]=4 516 B13R1.91 O=C(CO)Nc1cnccc1CO e98d7f7edd1854b5d5f49107b4c6f44f [0,1,1,0,0,0|0,0,2]=4 517 B13R1.91 O=CC(=O)Nc1ccccc1C=O 0f4e468224165ad763b0a079aa0b05e7 [0,1,1,0,0,0|1,0,1]=4 518 B13R1.91 O=CC(=O)Nc1cnccc1C=O 7545c75fd7bc6360d0a4eee83a7e6cb9 [0,1,1,0,0,0|0,0,1]=3 519 B13R1.91 O=CC(=O)Nc1cnccc1CO 5200c13ad5b1a7021bd200e0d8efc164 [0,1,1,0,0,0|0,0,2]=4 520 B13R1.91 O=CC(=O)Nc1cncnc1C=O de76542358b68ace93f280ae5e718871 [0,1,1,0,0,0|1,0,1]=4 521 B13R1.91 O=Cc1ccccc1NC(=O)CO 13697760a4b753718875d6dbb7f000ad [0,1,1,0,0,0|1,0,1]=4 522 B13R1.91 O=Cc1ccncc1NC(=O)CF 3f96244233cf885dcb3ce90f83b08000 [0,1,1,0,0,0|1,0,1]=4 523 B13R1.91 O=Cc1ccncc1NC(=O)CO 2b7bb517b77f2dbda02470cf90153617 [0,1,1,0,0,0|0,0,1]=3 524 B13R1.91 O=Cc1ccncc1NC(=O)CS cad3bcd7a3800ffcf76b8e7726fb2a65 [0,1,1,0,0,0|0,1,1]=4 525 B13R1.91 O=Cc1ncncc1NC(=O)CO 0ca831ec6fd997ed3ef279b9ea93104b [0,1,1,0,0,0|1,0,1]=4 526 B13R1.470 C/C=C/C(=O)Nc1cnccc1Br 0b32ec2a05769394166ab67b9b1f3c54 [0,1,1,0,0,0|2,0,0]=4 527 B13R1.470 C/C=C/C(=O)Nc1cnccc1C 8ffa383b52fcfb4eaa180f7747a52735 [0,1,1,0,0,0|1,0,1]=4 528 B13R1.470 C/C=C/C(=O)Nc1cnccc1F bed03739360d2775bdf887620fa5f7b5 [0,1,1,0,0,0|2,0,0]=4 529 B13R1.470 C/C=C/C(=O)Nc1cnccc1I 356ae4cd0f85cddb8bfa1c2eb3ab1aa8 [0,1,1,0,0,0|2,0,0]=4 530 B13R1.470 C/C=C/C(=O)Nc1cnccc1O e6aebbe7eef67e7b2f1d6eb45664de55 [0,1,1,0,0,0|2,0,0]=4 531 B13R1.470 C/C=C/C(=O)Nc1cnccc1S 1437f5d1287f786b434d04b3f9a88ae0 [0,1,1,0,0,0|2,0,0]=4 532 B13R1.470 C=CCC(=O)Nc1cnccc1Br 9da670aa0003abd93119b8584c32c979 [0,1,1,0,0,0|2,0,0]=4 533 B13R1.470 C=CCC(=O)Nc1cnccc1C 55ca035835ea3ea839d1f20b43e291c5 [0,1,1,0,0,0|1,0,1]=4 534 B13R1.470 C=CCC(=O)Nc1cnccc1F 73cc26a88e166e7c183e426f1848e77b [0,1,1,0,0,0|2,0,0]=4 535 B13R1.470 C=CCC(=O)Nc1cnccc1I 90befdfbb4dfc4a0acb4d6a342089302 [0,1,1,0,0,0|2,0,0]=4 536 B13R1.470 C=CCC(=O)Nc1cnccc1O b9195ad4c130936a33eb9901985666a5 [0,1,1,0,0,0|2,0,0]=4 537 B13R1.470 C=CCC(=O)Nc1cnccc1S a3120587758d213ea3e3befcd76c9974 [0,1,1,0,0,0|2,0,0]=4 538 B13R1.470 COCC(=O)Nc1cnccc1Br 3bba7d714cde782ce7528b9fbade052f [0,1,1,0,0,0|1,0,1]=4 539 B13R1.470 COCC(=O)Nc1cnccc1C bb348ecbb6de85d3ab0b5799ca114200 [0,1,1,0,0,0|0,0,2]=4 540 B13R1.470 COCC(=O)Nc1cnccc1F eb1329326ddacc98ee2a8d3b1bc99248 [0,1,1,0,0,0|1,0,1]=4 541 B13R1.470 COCC(=O)Nc1cnccc1I e1a006521b0b62089805a453f6d1e985 [0,1,1,0,0,0|1,0,1]=4 542 B13R1.470 COCC(=O)Nc1cnccc1O fc43c55f280edddc246a8dae894e6fd2 [0,1,1,0,0,0|1,0,1]=4 543 B13R1.470 COCC(=O)Nc1cnccc1S 64cf0019a7d6faeb6182d30dd2192d2c [0,1,1,0,0,0|1,0,1]=4 544 B13R1.470 Cc1ccncc1NC(=O)/C=C/Br 37c6fb2566cc9637b35362df1e1f1f27 [0,1,1,0,0,0|1,0,1]=4 545 B13R1.470 Cc1ccncc1NC(=O)/C=C/Cl ea6d66bb5687262234ef771b09807c8f [0,1,1,0,0,0|1,0,1]=4 546 B13R1.470 Cc1ccncc1NC(=O)/C=C/I 8be4105b2dd438d25035424d13df6468 [0,1,1,0,0,0|1,0,1]=4 547 B13R1.470 Cc1ccncc1NC(=O)/C=C\Br c01d4a2281aa6192361b1a6d463a03e5 [0,1,1,0,0,0|1,0,1]=4 548 B13R1.470 Cc1ccncc1NC(=O)/C=C\Cl 8c8c7bd2d82513a5b223f28f2067b535 [0,1,1,0,0,0|1,0,1]=4 549 B13R1.470 Cc1ccncc1NC(=O)/C=C\I 33b941b113ec4a6569abe1cddbcb7ddf [0,1,1,0,0,0|1,0,1]=4 550 B13R1.470 Cc1ccncc1NC(=O)C=CBr 58a6ae521e43725317410c752ba07867 [0,1,1,0,0,0|1,0,1]=4 551 B13R1.470 Cc1ccncc1NC(=O)C=CI a030f9c145b127d76601acee50ea7ce0 [0,1,1,0,0,0|1,0,1]=4 552 B13R1.470 Cc1ccncc1NC(=O)CC=O 8b482d43fa5898564956575490e5fe7a [0,1,1,0,0,0|0,0,2]=4 553 B13R1.470 Cc1ccncc1NC(=O)CON ed60cb55fa1f7ddab60e9eca52b7c209 [0,1,1,0,0,0|0,0,2]=4 554 B13R1.470 NOCC(=O)Nc1cnccc1Br c0dac6283bea16bd5ee3f862abf9fda7 [0,1,1,0,0,0|1,0,1]=4 555 B13R1.470 NOCC(=O)Nc1cnccc1Cl 1b59fcef6579b796305f9673d425df66 [0,1,1,0,0,0|1,0,1]=4 556 B13R1.470 NOCC(=O)Nc1cnccc1F bc2f29133089c544a89c1149d6071a8c [0,1,1,0,0,0|1,0,1]=4 557 B13R1.470 NOCC(=O)Nc1cnccc1I a102eb3f8267f3420b712d3454a697d6 [0,1,1,0,0,0|1,0,1]=4 558 B13R1.470 NOCC(=O)Nc1cnccc1O da54d63c391a8e834c391cab7c8d10c4 [0,1,1,0,0,0|1,0,1]=4 559 B13R1.470 NOCC(=O)Nc1cnccc1S 86c1c831922fb3ae78c44ef6c6d93472 [0,1,1,0,0,0|1,0,1]=4 560 B13R1.470 O=C(/C=C/Br)Nc1cnccc1Br b0a6511529c3428dd9b3cc51bcc83c55 [0,1,1,0,0,0|2,0,0]=4 561 B13R1.470 O=C(/C=C/Br)Nc1cnccc1F 2b53750127e37386aad2b3995a277db0 [0,1,1,0,0,0|2,0,0]=4 562 B13R1.470 O=C(/C=C/Br)Nc1cnccc1I e1529a8cf0d008b2318ce45fb6c50916 [0,1,1,0,0,0|2,0,0]=4 563 B13R1.470 O=C(/C=C/Br)Nc1cnccc1O bb4a9fb222491a9b5537d6e6a765ea32 [0,1,1,0,0,0|2,0,0]=4 564 B13R1.470 O=C(/C=C/Br)Nc1cnccc1S 34a9d67bfb8ff23f8a46cac21216c64f [0,1,1,0,0,0|2,0,0]=4 565 B13R1.470 O=C(/C=C/Cl)Nc1cnccc1Br 394c0f20c352dac9c5728e7cc02392d2 [0,1,1,0,0,0|2,0,0]=4 566 B13R1.470 O=C(/C=C/Cl)Nc1cnccc1F 334c89676ae315d1f664c7b3e818a899 [0,1,1,0,0,0|2,0,0]=4 567 B13R1.470 O=C(/C=C/Cl)Nc1cnccc1I 56bb9c0d4442ffb111b0f1c03118005d [0,1,1,0,0,0|2,0,0]=4 568 B13R1.470 O=C(/C=C/Cl)Nc1cnccc1O 1d1124e1acf1687a5c534ae16b2f7179 [0,1,1,0,0,0|2,0,0]=4 569 B13R1.470 O=C(/C=C/Cl)Nc1cnccc1S 9f1f5473efa42cd9c49ce02c7c80499d [0,1,1,0,0,0|2,0,0]=4 570 B13R1.470 O=C(/C=C/I)Nc1cnccc1Br c12397c6dfd23f00c2d66a9755b0a9f2 [0,1,1,0,0,0|2,0,0]=4 571 B13R1.470 O=C(/C=C/I)Nc1cnccc1Cl 35ea246d90e8745b8fdcc15a504344a5 [0,1,1,0,0,0|2,0,0]=4 572 B13R1.470 O=C(/C=C/I)Nc1cnccc1F a185818ab69091b8626febd968d60ce1 [0,1,1,0,0,0|2,0,0]=4 573 B13R1.470 O=C(/C=C/I)Nc1cnccc1I 5872318ed184211071562c6c87882d4d [0,1,1,0,0,0|2,0,0]=4 574 B13R1.470 O=C(/C=C/I)Nc1cnccc1O ade7889cbd84d17dae4036bdf99e36b8 [0,1,1,0,0,0|2,0,0]=4 575 B13R1.470 O=C(/C=C/I)Nc1cnccc1S 41664d30f97efd00cbe0c62467e59c1e [0,1,1,0,0,0|2,0,0]=4 576 B13R1.470 O=C(/C=C\Br)Nc1cnccc1Br aae4d70b28f1bf3831c20ae034946bfe [0,1,1,0,0,0|2,0,0]=4 577 B13R1.470 O=C(/C=C\Br)Nc1cnccc1F 268152008c0d6aca22defff24b830ef4 [0,1,1,0,0,0|2,0,0]=4 578 B13R1.470 O=C(/C=C\Br)Nc1cnccc1I 4dc4dcd09c464ed7299ba2501c0dd53f [0,1,1,0,0,0|2,0,0]=4 579 B13R1.470 O=C(/C=C\Br)Nc1cnccc1O 65dc6b67ae09e3dcef7afa8a245a134c [0,1,1,0,0,0|2,0,0]=4 580 B13R1.470 O=C(/C=C\Br)Nc1cnccc1S 760b85311897e8657769541e5db58fcb [0,1,1,0,0,0|2,0,0]=4 581 B13R1.470 O=C(/C=C\Cl)Nc1cnccc1Br e60cc896e1922636762695d219318e58 [0,1,1,0,0,0|2,0,0]=4 582 B13R1.470 O=C(/C=C\Cl)Nc1cnccc1F 9977a1b2a66efc3e7e99e40e4d139feb [0,1,1,0,0,0|2,0,0]=4 583 B13R1.470 O=C(/C=C\Cl)Nc1cnccc1I 46a3781e34c8b07de20114d4f0892264 [0,1,1,0,0,0|2,0,0]=4 584 B13R1.470 O=C(/C=C\Cl)Nc1cnccc1O 8bb5b3618a769502e437a0d87fc8f548 [0,1,1,0,0,0|2,0,0]=4 585 B13R1.470 O=C(/C=C\Cl)Nc1cnccc1S ef8f570e5eb9b6c87412d7a7b235dfb6 [0,1,1,0,0,0|2,0,0]=4 586 B13R1.470 O=C(/C=C\I)Nc1cnccc1Br 23567fc4c44e8987a88ffb9a90595547 [0,1,1,0,0,0|2,0,0]=4 587 B13R1.470 O=C(/C=C\I)Nc1cnccc1Cl c56d0f494c48b20637cb7767e4329b15 [0,1,1,0,0,0|2,0,0]=4 588 B13R1.470 O=C(/C=C\I)Nc1cnccc1F bcfd6e9c4dbd1f9102db5995e71ba4d3 [0,1,1,0,0,0|2,0,0]=4 589 B13R1.470 O=C(/C=C\I)Nc1cnccc1I 535133a44e3c18a32ea2268b87935d27 [0,1,1,0,0,0|2,0,0]=4 590 B13R1.470 O=C(/C=C\I)Nc1cnccc1O c381cdd3b931eb4599592fd85ad2aaf4 [0,1,1,0,0,0|2,0,0]=4 591 B13R1.470 O=C(/C=C\I)Nc1cnccc1S b1303b227575cf96a3b04476384f42d7 [0,1,1,0,0,0|2,0,0]=4 592 B13R1.470 O=C(C=CBr)Nc1cnccc1Br 2113935f90ac103010e53e90438cdde2 [0,1,1,0,0,0|2,0,0]=4 593 B13R1.470 O=C(C=CBr)Nc1cnccc1F 9d6ef17b4d508cb86268577920bbb29b [0,1,1,0,0,0|2,0,0]=4 594 B13R1.470 O=C(C=CBr)Nc1cnccc1I c7279e88c4dc7cfe1980b266c01854ce [0,1,1,0,0,0|2,0,0]=4 595 B13R1.470 O=C(C=CBr)Nc1cnccc1O 161b9db658dad4d0144e1dd96d2f3b48 [0,1,1,0,0,0|2,0,0]=4 596 B13R1.470 O=C(C=CBr)Nc1cnccc1S 488249c98649391b6a82d59d399217ee [0,1,1,0,0,0|2,0,0]=4 597 B13R1.470 O=C(C=CI)Nc1cnccc1Br 0a0ad27ac883922601663480f7c1d847 [0,1,1,0,0,0|2,0,0]=4 598 B13R1.470 O=C(C=CI)Nc1cnccc1Cl 4f6285884ae5e223b60ae12041c568f7 [0,1,1,0,0,0|2,0,0]=4 599 B13R1.470 O=C(C=CI)Nc1cnccc1F e262b778785150cd1729cedf6b9a7375 [0,1,1,0,0,0|2,0,0]=4 600 B13R1.470 O=C(C=CI)Nc1cnccc1I 4b9a7a325ff7cd987c7bb3c45adfe5ce [0,1,1,0,0,0|2,0,0]=4 601 B13R1.470 O=C(C=CI)Nc1cnccc1O aea42980b5ce8a220ccbdc30b2adfd91 [0,1,1,0,0,0|2,0,0]=4 602 B13R1.470 O=C(C=CI)Nc1cnccc1S 1851a4400a3df20fa5bb276e54b1bad2 [0,1,1,0,0,0|2,0,0]=4 603 B13R1.470 O=C(CCO)Nc1cnccc1F 4f2bb8b99d1c640caccd379406a8b940 [0,1,1,0,0,0|1,0,1]=4 604 B13R1.470 O=C(CCO)Nc1cnccc1I a41151deaf94629eb688d999ec5c14b3 [0,1,1,0,0,0|1,0,1]=4 605 B13R1.470 O=C(CCO)Nc1cnccc1O bdf52232d6aac53cb92dc5d904fadad1 [0,1,1,0,0,0|1,0,1]=4 606 B13R1.470 O=CCC(=O)Nc1cnccc1Br 75112e52ab748aa4fc071d57ecf71c6e [0,1,1,0,0,0|1,0,1]=4 607 B13R1.470 O=CCC(=O)Nc1cnccc1F c80878bf002795afd559f2f890c98398 [0,1,1,0,0,0|1,0,1]=4 608 B13R1.470 O=CCC(=O)Nc1cnccc1I 9b0ba37358839c14da9796a2f62bad2a [0,1,1,0,0,0|1,0,1]=4 609 B13R1.470 O=CCC(=O)Nc1cnccc1O 3c90804c91348d15f97df0ec77403c5e [0,1,1,0,0,0|1,0,1]=4 610 B13R1.470 O=CCC(=O)Nc1cnccc1S 70807b00cf3c0d0820dc851f35ce5bd9 [0,1,1,0,0,0|1,0,1]=4 611 B13R1.696 C=CC(=O)N(C)c1cnccc1C bc142ef0362de2fc1ce07b7790137019 [0,1,1,0,0,0|1,0,1]=4 612 B13R1.696 C=CC(=O)N(C)c1cnccc1Cl 0049552350316822e061ee48c4df8009 [0,1,1,0,0,0|2,0,0]=4 613 B13R1.696 C=CC(=O)N(C)c1cnccc1F 62abf490b004f292482ffc33fa9db253 [0,1,1,0,0,0|2,0,0]=4 614 B13R1.696 CN(C(=O)C=O)c1cnccc1Cl 47a88b6b54b0e86c01dda66b9e7fa475 [0,1,1,0,0,0|1,0,1]=4 615 B13R1.696 CN(C(=O)C=O)c1cnccc1F 1c24671b88e5c82d56bd8cb268fb6071 [0,1,1,0,0,0|1,0,1]=4 616 B13R1.696 CN(C(=O)CO)c1cnccc1Cl a0211080ee993ff8217a181e8a8f4c95 [0,1,1,0,0,0|1,0,1]=4 617 B13R1.696 CN(C(=O)CO)c1cnccc1F e25fe787d8af7877733b4a09ca462db1 [0,1,1,0,0,0|1,0,1]=4 618 B13R1.696 Cc1ccncc1N(C)C(=O)C=O 8333315a5234f051929d8b60577da50b [0,1,1,0,0,0|0,0,2]=4 619 B13R1.696 Cc1ccncc1N(C)C(=O)CO b3b5aa11d1f7448ca17b84f6e41ca06c [0,1,1,0,0,0|0,0,2]=4 620 B13R1.2679 C=CC(=O)Nc1cnc(cc1C)C 1afc80da6f8f42b86d79c53b0ad7a10e [0,1,1,0,0,0|1,0,1]=4 621 B13R1.2679 C=CC(=O)Nc1cnc(cc1C)F 7faf764c5f34549cc7bfb15b464d2046 [0,1,1,0,0,0|1,0,1]=4 622 B13R1.2679 C=CC(=O)Nc1cnc(cc1C)O f49f73f0ec429c2220bf82317500cea5 [0,1,1,0,0,0|1,0,1]=4 623 B13R1.2679 C=CC(=O)Nc1cnc(cc1F)Cl d8409635fa6253b0777a16ba22192633 [0,1,1,0,0,0|2,0,0]=4 624 B13R1.2679 C=CC(=O)Nc1cnc(cc1F)F ce3c59f2f76eaabcf29898a40ffd972a [0,1,1,0,0,0|2,0,0]=4 625 B13R1.2679 C=CC(=O)Nc1cnc(cc1I)Br bdec4aa3618b89951bf0eb5342130916 [0,1,1,0,0,0|2,0,0]=4 626 B13R1.2679 C=CC(=O)Nc1cnc(cc1I)Cl b85d014a91b17ebf03b050867186802d [0,1,1,0,0,0|2,0,0]=4 627 B13R1.2679 Cc1cc(c(cn1)NC(=O)C=O)C b6922e1ca180ff104c2ee8b8d4a9b495 [0,1,1,0,0,0|0,0,2]=4 628 B13R1.2679 Cc1cc(c(cn1)NC(=O)C=O)Cl 45d12026902e81134b15360996358cda [0,1,1,0,0,0|1,0,1]=4 629 B13R1.2679 Cc1cc(ncc1NC(=O)C=O)Br 905b10a027e9543e932585ed8b34546f [0,1,1,0,0,0|0,0,2]=4 630 B13R1.2679 Cc1cc(ncc1NC(=O)C=O)Cl 7525aed2dabc438c43414895736c8e03 [0,1,1,0,0,0|0,0,2]=4 631 B13R1.2679 Cc1cc(ncc1NC(=O)C=O)F bcb00ce33911754288e67742a6ae3096 [0,1,1,0,0,0|0,0,2]=4 632 B13R1.2679 Cc1cc(ncc1NC(=O)C=O)O a251454a8bb598c2a4919b4807e717a0 [0,1,1,0,0,0|0,0,2]=4 633 B13R1.2679 O=C(CO)Nc1cnc(cc1F)F 0b6ac98567c3d2c8cec0bff4c3591f09 [0,1,1,0,0,0|1,0,1]=4 634 B13R1.2679 O=CC(=O)Nc1cnc(cc1F)Cl d4bb2002f8a6eb85b108c325a0cfa836 [0,1,1,0,0,0|1,0,1]=4 635 B13R1.2679 O=CC(=O)Nc1cnc(cc1F)F bed5ee75d787dbe31d60bc5a94ad5741 [0,1,1,0,0,0|1,0,1]=4 636 B13R1.2679 O=CC(=O)Nc1cnc(cc1I)Br d10db9e6df2f6a5e8a9d851485ac9b0a [0,1,1,0,0,0|1,0,1]=4 637 B13R1.2679 O=CC(=O)Nc1cnc(cc1I)Cl 407a3e8121d168045855626b1138563c [0,1,1,0,0,0|1,0,1]=4 638 B13R1.2679 O=CC(=O)Nc1cnc(cc1O)Cl a1d377510b611e03d8fb4c583765aeee [0,1,1,0,0,0|1,0,1]=4 639 B13R1.4928 C=CC(=O)Nc1c(ccnc1Br)Br 0accba9ee3ad59d15484e8cc7ca90f4f [0,1,1,0,0,0|2,0,0]=4 640 B13R1.4928 C=CC(=O)Nc1c(ccnc1Br)C 0b269ac811323942983d65d328783b0d [0,1,1,0,0,0|1,0,1]=4 641 B13R1.4928 C=CC(=O)Nc1c(ccnc1C)Br 8fb7fe2bc234ee9328e6ebbf486973a3 [0,1,1,0,0,0|2,0,0]=4 642 B13R1.4928 C=CC(=O)Nc1c(ccnc1C)C 4459f7d8272113a6c6a367f94a3678cc [0,1,1,0,0,0|1,0,1]=4 643 B13R1.4928 C=CC(=O)Nc1c(ccnc1C)Cl 5144015d22a144dd4a4efb7da5ee9131 [0,1,1,0,0,0|2,0,0]=4 644 B13R1.4928 C=CC(=O)Nc1c(ccnc1C)O 86d86f7bc4ec668e37333b0a5c13f3d6 [0,1,1,0,0,0|2,0,0]=4 645 B13R1.4928 C=CC(=O)Nc1c(ccnc1Cl)Br 1f2b4a02afd5bd81f42b859238595f4d [0,1,1,0,0,0|2,0,0]=4 646 B13R1.4928 C=CC(=O)Nc1c(ccnc1Cl)C a1a35b66296b57b0ed9af48e709673c3 [0,1,1,0,0,0|1,0,1]=4 647 B13R1.4928 C=CC(=O)Nc1c(ccnc1Cl)Cl 402aa2d99bc830b26f2957cb9073a655 [0,1,1,0,0,0|2,0,0]=4 648 B13R1.4928 C=CC(=O)Nc1c(ccnc1Cl)I 742a6055b0613a4276f29fb27ac3899e [0,1,1,0,0,0|2,0,0]=4 649 B13R1.4928 C=CC(=O)Nc1c(ccnc1Cl)O 8d2864e1a393e4b66f152c0e045f0080 [0,1,1,0,0,0|2,0,0]=4 650 B13R1.4928 C=CC(=O)Nc1c(ccnc1F)C 464f54ec93934760155c0ee530d8642e [0,1,1,0,0,0|1,0,1]=4 651 B13R1.4928 C=CC(=O)Nc1c(ccnc1F)Cl ce3e5b293c34189c2b29fee01b527f72 [0,1,1,0,0,0|2,0,0]=4 652 B13R1.4928 C=CC(=O)Nc1c(ccnc1O)C 93c4672db00ff2cff9b05a7b2f2a79b3 [0,1,1,0,0,0|1,0,1]=4 653 B13R1.4928 C=CC(=O)Nc1c(ccnc1O)Cl 6e82049c42620a84c31388b0fd0538a6 [0,1,1,0,0,0|2,0,0]=4 654 B13R1.4928 C=CC(=O)Nc1c(ccnc1O)O a20978e09ca5286552fb25db4544eca9 [0,1,1,0,0,0|2,0,0]=4 655 B13R1.4928 Cc1ccnc(c1NC(=O)C=O)Br c6a7f4ab8600151479b2607c75c937fc [0,1,1,0,0,0|0,0,2]=4 656 B13R1.4928 Cc1ccnc(c1NC(=O)C=O)C 141c06a931023a31e486ee5686592a7f [0,1,1,0,0,0|0,0,2]=4 657 B13R1.4928 Cc1ccnc(c1NC(=O)C=O)Cl 6e9b083bcdcb379a7397a0ca05e19cc4 [0,1,1,0,0,0|0,0,2]=4 658 B13R1.4928 Cc1ccnc(c1NC(=O)C=O)F ebdf46871ea77606341f9274d4f8b129 [0,1,1,0,0,0|0,0,2]=4 659 B13R1.4928 Cc1ccnc(c1NC(=O)C=O)O 0d595f06ac02d985936f276360eb38cf [0,1,1,0,0,0|0,0,2]=4 660 B13R1.4928 Cc1ccnc(c1NC(=O)CO)C 612cf23741bbfb11a4e5cfc156c1e2ca [0,1,1,0,0,0|0,0,2]=4 661 B13R1.4928 Cc1ccnc(c1NC(=O)CO)Cl 0966743a3a8e0b3d3f7d73ca99bf7a1c [0,1,1,0,0,0|0,0,2]=4 662 B13R1.4928 Cc1ccnc(c1NC(=O)CO)F aa755acf55de653685ac5dc681f45c42 [0,1,1,0,0,0|0,0,2]=4 663 B13R1.4928 Cc1ccnc(c1NC(=O)CO)O 4b5125f9b9bef866aac8b8c30d35a11d [0,1,1,0,0,0|0,0,2]=4 664 B13R1.4928 Cc1nccc(c1NC(=O)C=O)Br 181e31b49b3e8a072a94a61704d6351a [0,1,1,0,0,0|1,0,1]=4 665 B13R1.4928 Cc1nccc(c1NC(=O)C=O)Cl d2c3b89770846fa821751b916b863bc8 [0,1,1,0,0,0|1,0,1]=4 666 B13R1.4928 Cc1nccc(c1NC(=O)C=O)O b77fecad7ee5dc985a2a824a594d6739 [0,1,1,0,0,0|1,0,1]=4 667 B13R1.4928 Cc1nccc(c1NC(=O)CO)Br 55c4f5f329afde28d25deacfc1007dbc [0,1,1,0,0,0|1,0,1]=4 668 B13R1.4928 Cc1nccc(c1NC(=O)CO)Cl 56b708eaec806b3eb3f8f132d2257f84 [0,1,1,0,0,0|1,0,1]=4 669 B13R1.4928 Cc1nccc(c1NC(=O)CO)O 26ab0d33898153c244d5571fabd75da0 [0,1,1,0,0,0|1,0,1]=4 670 B13R1.4928 O=C(CO)Nc1c(ccnc1Br)Br 4c0eacfdaa3fdbf3e2959b952a7bea5f [0,1,1,0,0,0|1,0,1]=4 671 B13R1.4928 O=C(CO)Nc1c(ccnc1Cl)Br 9ab3f83b99f6a2570b4aacaeb7a3c7da [0,1,1,0,0,0|1,0,1]=4 672 B13R1.4928 O=C(CO)Nc1c(ccnc1Cl)I 585280f39059c4662478dcbeef518339 [0,1,1,0,0,0|1,0,1]=4 673 B13R1.4928 O=C(CO)Nc1c(ccnc1Cl)O 6e9e3980e875cd10492011408045c0d1 [0,1,1,0,0,0|1,0,1]=4 674 B13R1.4928 O=C(CO)Nc1c(ccnc1O)O 1aa2e82e846131afb78d4c1e989aa7ac [0,1,1,0,0,0|1,0,1]=4 675 B13R1.4928 O=CC(=O)Nc1c(ccnc1Br)Br 883f5bcd021c1b93aa37b338061a972d [0,1,1,0,0,0|1,0,1]=4 676 B13R1.4928 O=CC(=O)Nc1c(ccnc1Cl)Br 71607f991b983645a7f8b99f4320f3ef [0,1,1,0,0,0|1,0,1]=4 677 B13R1.4928 O=CC(=O)Nc1c(ccnc1Cl)Cl 47a399fe2e54d086f11f62e7a0685e6a [0,1,1,0,0,0|1,0,1]=4 678 B13R1.4928 O=CC(=O)Nc1c(ccnc1Cl)I 9913b9f82b3521517f10985b5b7c5f0c [0,1,1,0,0,0|1,0,1]=4 679 B13R1.4928 O=CC(=O)Nc1c(ccnc1Cl)O cc0fe86719fff87a7e10d9bed3568e6b [0,1,1,0,0,0|1,0,1]=4 680 B13R1.4928 O=CC(=O)Nc1c(ccnc1F)Cl 327ec728e2953db8adb28862c9980cdb [0,1,1,0,0,0|1,0,1]=4 681 B13R1.4928 O=CC(=O)Nc1c(ccnc1O)Cl 0c6462171492a49e8ed03f5977af55de [0,1,1,0,0,0|1,0,1]=4 682 B13R1.4928 O=CC(=O)Nc1c(ccnc1O)O 05878be6f7998548b5029c7bbe6b60de [0,1,1,0,0,0|1,0,1]=4 683 B15R2.888 CCNc1cc2ccccc2[nH]c1=O e6db4526c563bb1e2419a99dd1be818a [0,2,0,0,0,0|2,0,0]=4 684 B15R2.888 CCOc1cc2ccccc2[nH]c1=O f14970800600b2f53fead46aab589904 [0,2,0,0,0,0|1,0,0]=3 685 B15R2.888 CCOc1cc2ccccc2oc1=O 66a4520445cf81328be0f83f53fbf376 [0,2,0,0,0,0|2,0,0]=4 686 B15R2.888 O=CNc1cc2ccccc2cc1O 9061e97f416ba179f52288f1546f8900 [0,2,0,0,0,0|2,0,0]=4 687 B15R2.888 O=c1[nH]c2ccccc2cc1NCF 38c5fd561789cf7b5d4cf94c9bd1ca72 [0,2,0,0,0,0|2,0,0]=4 688 B15R2.888 O=c1[nH]c2ccccc2cc1NCO c1a1c8b9579c42cbfc3003473f11dadf [0,2,0,0,0,0|1,0,0]=3 689 B15R2.888 O=c1[nH]c2ccccc2cc1OCF 60b55620bf7cb05f6d352b425379fde0 [0,2,0,0,0,0|1,0,0]=3 690 B15R2.888 O=c1oc2ccccc2cc1NCO 85294def1843979fce5fc9a4c925dfc1 [0,2,0,0,0,0|2,0,0]=4 691 B15R2.888 O=c1oc2ccccc2cc1OCF 92bfc273c837f53341d649f5183f23e5 [0,2,0,0,0,0|2,0,0]=4 692 B15R2.888 OCNc1cc2ccncc2cc1F ac90787a1826a7160b6e649d0ac50a06 [0,2,0,0,0,0|2,0,0]=4 693 B13R2.292 O=CNc1cccc2c1cco2 c68f5cb8bf677e3fa82c8ccd8995468f [0,0,1,1,0,0|1,0,0]=3 694 B13R2.292 O=CNc1cccc2c1ccs2 5e5c42e551ac5de7820a63a514e1969f [0,0,1,1,0,0|1,1,0]=4 695 B13R2.292 O=CNc1cccc2c1cno2 0c8d4b93db10037bb887304d1b6089b7 [0,0,1,1,0,0|2,0,0]=4 696 B13R2.292 O=CNc1cccc2c1nco2 2b3fa2395effdc8cc5afb2b348493aab [0,0,1,1,0,0|2,0,0]=4 697 B13R2.292 O=CNc1nccc2c1cco2 54b5ac575debcd30fc58ae87d68282db [0,0,1,1,0,0|2,0,0]=4 698 B11R1.35 C=C(Br)C(=O)Nc1cccs1 1b9fa33ea7d6b44373c87f86c3092a1e [0,0,1,0,1,0|2,0,0]=4 699 B11R1.35 C=C(Br)C(=O)Nc1ccno1 4a8b0b082862551731afd7cf25aacadb [0,0,1,0,1,0|2,0,0]=4 700 B11R1.35 C=C(Br)C(=O)Nc1ccns1 3943a696e46d2a6cb52555d2fb57eeaf [0,0,1,0,1,0|2,0,0]=4 701 B11R1.35 C=C(Br)C(=O)Nc1cnoc1 f0224b56bc43f911be34952e92a88127 [0,0,1,0,1,0|2,0,0]=4 702 B11R1.35 C=C(Br)C(=O)Nc1cnsc1 ebe7701c2ae978ce22977c60ed08e315 [0,0,1,0,1,0|2,0,0]=4 703 B11R1.35 C=C(Br)C(=O)Nc1cocn1 88f20965ad4d9ad3f2e03a215482523f [0,0,1,0,1,0|2,0,0]=4 704 B11R1.35 C=C(Br)C(=O)Nc1cscn1 0c08f9f42520f9692c4ad3dc63ff8ec5 [0,0,1,0,1,0|2,0,0]=4 705 B11R1.35 C=C(Br)C(=O)Nc1ncco1 da26ad010c456497ffee8cb8f5b5d84f [0,0,1,0,1,0|2,0,0]=4 706 B11R1.35 C=C(Br)C(=O)Nc1nccs1 00f9280cdc8cdb214e244542e7e42eff [0,0,1,0,1,0|2,0,0]=4 707 B11R1.35 C=C(C)C(=O)Nc1cccs1 1760e0a66affe8fd5b39b43d74c60a5e [0,0,1,0,1,0|2,0,0]=4 708 B11R1.35 C=C(C)C(=O)Nc1ccno1 7f4022655a993ebd2236198423a264a0 [0,0,1,0,1,0|2,0,0]=4 709 B11R1.35 C=C(C)C(=O)Nc1ccns1 7beaeec594046c7286b2605b1c941d10 [0,0,1,0,1,0|2,0,0]=4 710 B11R1.35 C=C(C)C(=O)Nc1ccsc1 366abace05079239192443f504356505 [0,0,1,0,1,0|2,0,0]=4 711 B11R1.35 C=C(C)C(=O)Nc1cncs1 bf4252b6ef7145c280bded46597efabf [0,0,1,0,1,0|2,0,0]=4 712 B11R1.35 C=C(C)C(=O)Nc1cnoc1 b508c156337300b7797451b805bc8336 [0,0,1,0,1,0|2,0,0]=4 713 B11R1.35 C=C(C)C(=O)Nc1cnsc1 8b6549a4840ff17fd510a2115fb752be [0,0,1,0,1,0|2,0,0]=4 714 B11R1.35 C=C(C)C(=O)Nc1cocn1 69d9f19cb4e29b9f4696237838dfc4d8 [0,0,1,0,1,0|2,0,0]=4 715 B11R1.35 C=C(C)C(=O)Nc1cscn1 12b1006de1d4e552dc43ecdeeac8ab8e [0,0,1,0,1,0|2,0,0]=4 716 B11R1.35 C=C(C)C(=O)Nc1ncco1 b4352d079128cdc019afd42c4eb31828 [0,0,1,0,1,0|2,0,0]=4 717 B11R1.35 C=C(C)C(=O)Nc1nccs1 2552b154fdbf7cd2eddc0c3f939dd34c [0,0,1,0,1,0|2,0,0]=4 718 B11R1.35 C=C(Cl)C(=O)Nc1ccns1 667c650000085a6e0d91fa015b262543 [0,0,1,0,1,0|2,0,0]=4 719 B11R1.35 C=C(Cl)C(=O)Nc1cnoc1 cbdc2d36c7d1796369d6fd2f43dcbd4f [0,0,1,0,1,0|2,0,0]=4 720 B11R1.35 C=C(Cl)C(=O)Nc1cnsc1 d72b531c7719e0fae8d9eeb8766cb6b6 [0,0,1,0,1,0|2,0,0]=4 721 B11R1.35 C=C(Cl)C(=O)Nc1cocn1 5295f62aaadbce7c5d139dad177232b1 [0,0,1,0,1,0|2,0,0]=4 722 B11R1.35 C=C(Cl)C(=O)Nc1cscn1 053fcf647b542be962ca63c8078dfe77 [0,0,1,0,1,0|2,0,0]=4 723 B11R1.35 C=C(Cl)C(=O)Nc1nccs1 45a3625a8fbbfc1bc20b4985e9539e78 [0,0,1,0,1,0|2,0,0]=4 724 B11R1.35 C=C(F)C(=O)Nc1cccs1 2d2005d88bb5632df0c6ca85c1e786e1 [0,0,1,0,1,0|2,0,0]=4 725 B11R1.35 C=C(F)C(=O)Nc1ccno1 50f6a8d205b2c5018e9220532a8efb0a [0,0,1,0,1,0|2,0,0]=4 726 B11R1.35 C=C(F)C(=O)Nc1ccns1 a5160a01a85e36530e0e063a7b4abbcc [0,0,1,0,1,0|2,0,0]=4 727 B11R1.35 C=C(F)C(=O)Nc1ccsc1 ed13415964f84bdc985e16afedc081cf [0,0,1,0,1,0|2,0,0]=4 728 B11R1.35 C=C(F)C(=O)Nc1cncs1 98ff6fc01c90b3a2155b3912c4bf48bf [0,0,1,0,1,0|2,0,0]=4 729 B11R1.35 C=C(F)C(=O)Nc1cnoc1 ca57ab4383c67de3b904d7e0b1d94d0b [0,0,1,0,1,0|2,0,0]=4 730 B11R1.35 C=C(F)C(=O)Nc1cnsc1 5415cb1128682a054c66e9c12c289b62 [0,0,1,0,1,0|2,0,0]=4 731 B11R1.35 C=C(F)C(=O)Nc1cocn1 83c094c2d22d3b39e03121ed115dbfe3 [0,0,1,0,1,0|2,0,0]=4 732 B11R1.35 C=C(F)C(=O)Nc1cscn1 21693cd8749b1c5f3fd79681d0810298 [0,0,1,0,1,0|2,0,0]=4 733 B11R1.35 C=C(F)C(=O)Nc1ncco1 d91de2ee306cb89a52f6a235a1c4e156 [0,0,1,0,1,0|2,0,0]=4 734 B11R1.35 C=C(F)C(=O)Nc1nccs1 aefefbf3bbdf13d638dd05aafc4bbb82 [0,0,1,0,1,0|2,0,0]=4 735 B13R1.348 C/C(=C/C(=O)Nc1cccnc1)/Cl 4a8e03c788f4164388d34723ef0d6772 [0,0,1,0,0,1|1,0,1]=4 736 B13R1.348 C/C(=C/C(=O)Nc1cccnc1)/I 91cfd9d560f279be184b751c8c0c9420 [0,0,1,0,0,1|1,0,1]=4 737 B13R1.348 C/C(=C\C(=O)Nc1cccnc1)/Cl 5e3ae0175d35dd3c3718688569bf6e8b [0,0,1,0,0,1|1,0,1]=4 738 B13R1.348 C=C(C)CC(=O)Nc1cccnc1 7de7f097984ba97769d9b815260512c5 [0,0,1,0,0,1|1,0,0]=3 739 B13R1.348 C=C(C)CC(=O)Nc1cccnn1 02f673ef6d2a4bf1b30d240b86fc7dac [0,0,1,0,0,1|2,0,0]=4 740 B13R1.348 C=C(C)CC(=O)Nc1cnccn1 6b5d8965839b2f0260058fb7501cf39e [0,0,1,0,0,1|2,0,0]=4 741 B13R1.348 CC(=CC(=O)Nc1cccnc1)C c98c5a5322e62582184121b42743e870 [0,0,1,0,0,1|1,0,1]=4 742 B13R1.348 CC(=CC(=O)Nc1cccnc1)I 5f87e5f202d4bab02b31fad72cf3c085 [0,0,1,0,0,1|1,0,1]=4 743 B13R1.348 CC(=O)CC(=O)Nc1cccnc1 cf7e80314cb04aa2c50b43ed477895f4 [0,0,1,0,0,1|0,0,2]=4 744 B13R1.348 CC(O)CC(=O)Nc1cccnc1 50ee92876efb70dd2200139c3e997a73 [0,0,1,0,0,1|0,0,2]=4 745 B13R1.348 C[C@@H](O)CC(=O)Nc1cccnc1 4e1154c5aea0b166ed1bb60ee7c28f67 [0,0,1,0,0,1|0,0,2]=4 746 B13R1.348 C[C@H](O)CC(=O)Nc1cccnc1 96043d60bb1a360b3a418c39a4922cc6 [0,0,1,0,0,1|0,0,2]=4 747 B13R1.348 NC(=O)CC(=O)Nc1cccnc1 a0eb2502a84c8704f76276ae2bca8bb1 [0,0,1,0,0,1|1,0,1]=4 748 B13R1.348 O=C(C=C(Br)Br)Nc1cccnc1 10b0e85d7fc3d38ecb4c2a97ba458169 [0,0,1,0,0,1|2,0,0]=4 749 B13R1.348 O=C(C=C(Cl)Cl)Nc1cccnc1 630331e63398a3278086ea1b96a5eb9a [0,0,1,0,0,1|2,0,0]=4 750 B13R1.351 C=C(Br)C(=O)NCc1ccccc1 362958306f8cd6df45a1ee1c05f0eb6d [0,0,1,0,0,1|2,0,0]=4 751 B13R1.351 C=C(Br)C(=O)NCc1cccnc1 8d1fadc105bd95f35e11ae3d76090f7a [0,0,1,0,0,1|1,0,0]=3 752 B13R1.351 C=C(Br)C(=O)NCc1cccnn1 078b78220a64124d502e6cda08c2458a [0,0,1,0,0,1|2,0,0]=4 753 B13R1.351 C=C(Br)C(=O)NCc1ccnnc1 ed517c4c8783a760a8a37decabb2effd [0,0,1,0,0,1|2,0,0]=4 754 B13R1.351 C=C(Br)C(=O)NCc1cnccn1 71dd51b720fd14bb77ef846914c0f8ea [0,0,1,0,0,1|2,0,0]=4 755 B13R1.351 C=C(Br)C(=O)NCc1cncnc1 04d553214138a7fc72a674861611b744 [0,0,1,0,0,1|2,0,0]=4 756 B13R1.351 C=C(C)C(=O)NCc1ccccc1 b8731b63880bf5bfc0bcc9801eda0e33 [0,0,1,0,0,1|2,0,0]=4 757 B13R1.351 C=C(C)C(=O)NCc1cccnc1 2327c708065bc31c6f93119e589efedc [0,0,1,0,0,1|1,0,0]=3 758 B13R1.351 C=C(C)C(=O)NCc1cccnn1 3bc1437aaa722aebb58b05616dae3729 [0,0,1,0,0,1|2,0,0]=4 759 B13R1.351 C=C(C)C(=O)NCc1ccnnc1 6b0c5d35aa916890c570368ec7fa8f9e [0,0,1,0,0,1|2,0,0]=4 760 B13R1.351 C=C(C)C(=O)NCc1cnccn1 258bccf405ccfd319f361aff0fd3a5ad [0,0,1,0,0,1|2,0,0]=4 761 B13R1.351 C=C(C)C(=O)NCc1cncnc1 3156c875bc46a8a997f6b0e2032be10f [0,0,1,0,0,1|2,0,0]=4 762 B13R1.351 C=C(CNc1cccnc1)C(=O)O 76d63c60d595f636e9d526b2ab265549 [0,0,1,0,0,1|2,0,0]=4 763 B13R1.351 C=C(Cl)C(=O)NCc1ccccc1 e27b26ae8f47b7b3a12892b36feed08a [0,0,1,0,0,1|2,0,0]=4 764 B13R1.351 C=C(Cl)C(=O)NCc1cccnc1 eff7d3dac76794c29728ba604b01b9a1 [0,0,1,0,0,1|1,0,0]=3 765 B13R1.351 C=C(Cl)C(=O)NCc1cccnn1 eb27e7befc64ed87891a80794f3068fc [0,0,1,0,0,1|2,0,0]=4 766 B13R1.351 C=C(Cl)C(=O)NCc1ccnnc1 86ed472ebdc559eeac4d5f5b0fc105ce [0,0,1,0,0,1|2,0,0]=4 767 B13R1.351 C=C(Cl)C(=O)NCc1cnccn1 d4badc355de8c97a0d3e33959a16e5d4 [0,0,1,0,0,1|2,0,0]=4 768 B13R1.351 C=C(Cl)C(=O)NCc1cncnc1 46436622096fed84dc0fa26b85a5773e [0,0,1,0,0,1|2,0,0]=4 769 B13R1.351 C=C(F)C(=O)NCc1ccccc1 fa9d26934338a9ac877733735088c907 [0,0,1,0,0,1|2,0,0]=4 770 B13R1.351 C=C(F)C(=O)NCc1cccnc1 453aed123b62bbaef6083c927ec52c96 [0,0,1,0,0,1|1,0,0]=3 771 B13R1.351 C=C(F)C(=O)NCc1cccnn1 527acf6448408f8a6f378c9893de7ba6 [0,0,1,0,0,1|2,0,0]=4 772 B13R1.351 C=C(F)C(=O)NCc1ccnnc1 08b2a5dc291c796ddd78029ee4f6ff5f [0,0,1,0,0,1|2,0,0]=4 773 B13R1.351 C=C(F)C(=O)NCc1cnccn1 a2a23082c08ad839048a1a723922a915 [0,0,1,0,0,1|2,0,0]=4 774 B13R1.351 C=C(F)C(=O)NCc1cncnc1 80e5ff333250c5da617f06f73887b78c [0,0,1,0,0,1|2,0,0]=4 775 B13R1.351 CC(=O)C(=O)CNc1cccnc1 4a7c5a69df0e149ed77bbd7e1eb6cf2b [0,0,1,0,0,1|0,0,2]=4 776 B13R1.351 CC(=O)C(=O)NCc1cccnc1 0d79211c3ed031463993a7388b530434 [0,0,1,0,0,1|0,0,2]=4 777 B13R1.351 CC(O)C(=O)NCc1cccnc1 196a561306487eff04711b8143918316 [0,0,1,0,0,1|0,0,2]=4 778 B13R1.351 C[C@@H](O)C(=O)NCc1cccnc1 28351664c772e9804f9cd6f5f57ef8c9 [0,0,1,0,0,1|0,0,2]=4 779 B13R1.351 C[C@H](O)C(=O)NCc1cccnc1 9f0065f37380038f48612b5c96d98230 [0,0,1,0,0,1|0,0,2]=4 780 B13R1.351 NC(=O)C(=O)NCc1cccnc1 31b1edd6b9fa6eec30d233c2a30d42f3 [0,0,1,0,0,1|1,0,1]=4 781 B13R1.351 NC(=O)C(=O)NCc1ccncc1 4b75b5276b108a9b60b2dbbc25bc1db5 [0,0,1,0,0,1|0,0,2]=4 782 B13R1.351 O=C(NCc1cccnc1)C(O)O 5f26f0a960b3596934246819a886ee00 [0,0,1,0,0,1|1,0,1]=4 783 B13R1.351 O=C(O)C(=O)CNc1ccccc1 307d1c795e5d7ce2b611e1a0dc85c4e3 [0,0,1,0,0,1|2,0,0]=4 784 B13R1.351 O=C(O)C(=O)CNc1cccnc1 88e25651d62aeeb5ad6449660315ff83 [0,0,1,0,0,1|1,0,0]=3 785 B13R1.351 O=C(O)C(=O)CNc1cccnn1 da1847cb1046d0677bfb6cabc1fc53d1 [0,0,1,0,0,1|2,0,0]=4 786 B13R1.351 O=C(O)C(=O)CNc1ccnnc1 0b8a29d42b5303dc800ddf86f8350de4 [0,0,1,0,0,1|2,0,0]=4 787 B13R1.351 O=C(O)C(=O)CNc1cnccn1 84328f157de8300124664c3181fda87b [0,0,1,0,0,1|2,0,0]=4 788 B13R1.351 O=C(O)C(=O)CNc1cncnc1 5ac0ba6ab8ded04d2d5ae6261b18c0fe [0,0,1,0,0,1|2,0,0]=4 789 B13R1.351 O=C(O)C(=O)COc1cccnc1 ca434d32f4ceaf175a41bfb99b1c5bcd [0,0,1,0,0,1|2,0,0]=4 790 B13R1.528 C=CC(=O)NCc1cnccc1C c3c22b37291587df0594dff902b06587 [0,0,1,0,0,1|1,0,1]=4 791 B13R1.528 Cc1ccncc1CNC(=O)C=O 1c8ab37d746c59b587ba55ad414478d1 [0,0,1,0,0,1|0,0,2]=4 792 B13R1.528 Cc1ccncc1CNC(=O)CO 16eba2494c1817a786493d50334e5a08 [0,0,1,0,0,1|0,0,2]=4 793 B13R1.528 Cc1ccncc1NCC(=O)CO 3af1b27974074fbcd2bdd88491deb234 [0,0,1,0,0,1|0,0,2]=4 794 B13R1.528 Cc1ccncc1NCC(=O)NO 9a2663b38822a19effe034c594195700 [0,0,1,0,0,1|1,0,1]=4 795 B13R1.528 O=C(CNc1cnccc1F)NO 4faa41e544330defaa0ee5ca4633741c [0,0,1,0,0,1|2,0,0]=4 796 B13R1.528 O=C(CO)CNc1cnccc1Br c8692209798f6f13c7716a79d27ca430 [0,0,1,0,0,1|1,0,1]=4 797 B13R1.528 O=C(CO)CNc1cnccc1Cl d654c4fdeeb7bcbb00456beea51611cd [0,0,1,0,0,1|1,0,1]=4 798 B13R1.528 O=C(CO)CNc1cnccc1F 74d52f3ade4f41b56bfa1af46632be52 [0,0,1,0,0,1|1,0,1]=4 799 B13R1.528 O=C(CO)CNc1cnccc1I 28cbc62912e9666e6ca61e182c081bc3 [0,0,1,0,0,1|1,0,1]=4 800 B13R1.528 O=C(CO)CNc1cnccc1S f21a5ec023649e9dbb2b5669198deaec [0,0,1,0,0,1|1,0,1]=4