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|3,0,0]=4 2 B12R1.43 C=C(Br)C(=O)Nc1ccncc1 b32327489673a9cd42907dfbbaa6efb2 [0,0,1,0,0,0|1,0,0]=2 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|3,0,0]=4 5 B12R1.43 C=C(C)C(=O)Nc1ccncc1 a6503895f463ead4cfde686cd1ac4ab0 [0,0,1,0,0,0|1,0,0]=2 6 B12R1.43 C=C(C)C(=O)Nc1ccncn1 7b4c8cc4e760344285115612ee1cda56 [0,0,1,0,0,0|2,0,0]=3 7 B12R1.43 C=C(F)C(=O)Nc1ccccn1 18214a0ba3e5d2127a3f4d1134aae0ce [0,0,1,0,0,0|3,0,0]=4 8 B12R1.43 C=C(F)C(=O)Nc1cccnc1 654c8aa2035026b72d0c4da71b3cd2c4 [0,0,1,0,0,0|3,0,0]=4 9 B12R1.43 C=C(F)C(=O)Nc1ccncc1 8eceac6429ef0db5763c47674ca9097d [0,0,1,0,0,0|1,0,0]=2 10 B12R1.43 C=C(F)C(=O)Nc1ccncn1 2b673e458572b778c58acf80835f2d71 [0,0,1,0,0,0|2,0,0]=3 11 B12R1.43 C=C(F)C(=O)Nc1ccnnc1 8d6ebfa90d280cbba3beed0a80d80d39 [0,0,1,0,0,0|2,0,0]=3 12 B12R1.43 CC(=O)C(=O)Nc1cccnc1 086af3aba20ae365b3dec827ae002166 [0,0,1,0,0,0|2,0,1]=4 13 B12R1.43 CC(=O)C(=O)Nc1ccncc1 3e894dd89d9bd96b684380f99830dbca [0,0,1,0,0,0|0,0,2]=3 14 B12R1.43 CC(=O)C(=O)Nc1ccncn1 1a4190d5248114309f13c37a45a8ca69 [0,0,1,0,0,0|1,0,2]=4 15 B12R1.43 CC(=O)C(=O)Nc1ccnnc1 ea0ce4872a0280f863f757952ba7597a [0,0,1,0,0,0|1,0,2]=4 16 B12R1.43 CC(Nc1cccnc1)C(=O)N d63e56dbb828c942fcfc8fb45d074de3 [0,0,1,0,0,0|2,0,1]=4 17 B12R1.43 CC(Nc1ccncc1)C(=O)O 3264441d04234b09594e21abb0ee6864 [0,0,1,0,0,0|2,0,1]=4 18 B12R1.43 CC(O)C(=O)Nc1ccncc1 5f38f891f7bf86acd8ff4507d609ca19 [0,0,1,0,0,0|0,0,2]=3 19 B12R1.43 CC(O)C(=O)Nc1ccncn1 fa4d871be4840c74db88dbb2e0ebc781 [0,0,1,0,0,0|1,0,2]=4 20 B12R1.43 CC(O)C(=O)Nc1ccnnc1 16732e308900cbf980136c71509d43c5 [0,0,1,0,0,0|1,0,2]=4 21 B12R1.43 CC(Oc1cccnc1)C(=O)N c93ec9cffe861f7d5419e273b281c733 [0,0,1,0,0,0|2,0,1]=4 22 B12R1.43 CC(S)C(=O)Nc1ccncc1 340d8d7c6f5a85df6b13c5f339034dcb [0,0,1,0,0,0|0,1,2]=4 23 B12R1.43 C[C@@H](Nc1cccnc1)C(=O)N a37c586a2b9dbf1de69a084cd0cef09c [0,0,1,0,0,0|2,0,1]=4 24 B12R1.43 C[C@@H](Nc1ccncc1)C(=O)O 764f440060b5ff5cba00cbd341e47e3c [0,0,1,0,0,0|2,0,1]=4 25 B12R1.43 C[C@@H](O)C(=O)Nc1ccncc1 196aea65f4f06495d0e80a2672b6d60d [0,0,1,0,0,0|0,0,2]=3 26 B12R1.43 C[C@@H](O)C(=O)Nc1ccncn1 7d9f67af772bd752c0545e13edc20578 [0,0,1,0,0,0|1,0,2]=4 27 B12R1.43 C[C@@H](O)C(=O)Nc1ccnnc1 c6d57670365a7f3e6b206e2ee10f2131 [0,0,1,0,0,0|1,0,2]=4 28 B12R1.43 C[C@H](Nc1cccnc1)C(=O)N cffa85eeee0554dd18a262517da3feb0 [0,0,1,0,0,0|2,0,1]=4 29 B12R1.43 C[C@H](Nc1ccncc1)C(=O)O 6e2a1f431f6b654b8228879fdc066074 [0,0,1,0,0,0|2,0,1]=4 30 B12R1.43 C[C@H](O)C(=O)Nc1ccncc1 d03198d60543ea33e6296ae8259bf97a [0,0,1,0,0,0|0,0,2]=3 31 B12R1.43 C[C@H](O)C(=O)Nc1ccncn1 db874a79cab20881c68b86a46e98bad5 [0,0,1,0,0,0|1,0,2]=4 32 B12R1.43 C[C@H](O)C(=O)Nc1ccnnc1 983965256937dfb8a1a6b99941fae0db [0,0,1,0,0,0|1,0,2]=4 33 B12R1.43 NC(=O)C(=O)Nc1cccnc1 511412fcdd7fe0c2e939ebfd9abf8912 [0,0,1,0,0,0|1,0,1]=3 34 B12R1.43 NC(=O)C(=O)Nc1cccnn1 9206a76275bb1c28dd9af43b44126134 [0,0,1,0,0,0|2,0,1]=4 35 B12R1.43 NC(=O)C(=O)Nc1ccncc1 dd57be4da7b5a03a89564a942e16c4be [0,0,1,0,0,0|1,0,1]=3 36 B12R1.43 NC(=O)C(=O)Nc1ccncn1 059b8336ff2d5027d4fae35948d8de21 [0,0,1,0,0,0|2,0,1]=4 37 B12R1.43 NC(=O)C(F)Nc1cccnc1 4ee34b9f1deebdf61d7c6f030a6fa1d2 [0,0,1,0,0,0|2,0,1]=4 38 B12R1.43 NC(=O)C(F)Oc1cccnc1 357fafca4d938eeeb5cdef07ce6e7d3c [0,0,1,0,0,0|2,0,1]=4 39 B12R1.43 O=C(Nc1ccncc1)C(F)F 48290ab64d3521484298cb6f72139a13 [0,0,1,0,0,0|2,0,1]=4 40 B12R1.43 O=C(Nc1ccncc1)C(O)O 7a608e249accbcb0fef3f0b292f9161d [0,0,1,0,0,0|1,0,1]=3 41 B12R1.43 O=C(Nc1ccncn1)C(O)O 4cf8229c260e5b3cb286ab196ee02a12 [0,0,1,0,0,0|2,0,1]=4 42 B12R1.43 O=C(Nc1ccnnc1)C(O)O 90b09787fbddc9fd15a4d41e834f671f [0,0,1,0,0,0|2,0,1]=4 43 B12R1.43 O=C(O)C(F)Nc1ccncc1 cc45994f4e20e8fce4641239ea111ab9 [0,0,1,0,0,0|2,0,1]=4 44 B12R1.43 O=C(O)[C@H](F)Nc1ccncc1 a414a383322565f23e896d7ae5438835 [0,0,1,0,0,0|2,0,1]=4 45 B12R1.169 CCOc1cnccc1NC=O 5733d835f5a71743405640a25f13785e [0,0,1,0,0,0|2,0,1]=4 46 B12R1.169 O=CNc1ccccc1CCO c92dc30b57c13638df27621efe7922c6 [0,0,1,0,0,0|1,0,2]=4 47 B12R1.169 O=CNc1ccncc1CCF 3e5f08729dedd41e32021b12d368b800 [0,0,1,0,0,0|1,0,2]=4 48 B12R1.169 O=CNc1ccncc1CCO d6d9d8e005258ed19e0d406306414d03 [0,0,1,0,0,0|0,0,2]=3 49 B12R1.371 C#CC(=O)Nc1ccncc1Br 76af082c8f8dc5489c5b3d6099f3b712 [0,0,1,0,0,0|2,0,1]=4 50 B12R1.371 C#CC(=O)Nc1ccncc1C 5c447024e6b7af59281f5b80f540374f [0,0,1,0,0,0|1,0,2]=4 51 B12R1.371 C#CC(=O)Nc1ccncc1F 6738813aebaffe567ad0b4473f6b9fd5 [0,0,1,0,0,0|2,0,1]=4 52 B12R1.371 C#CC(=O)Nc1ccncc1I 61727fb9f473c36238595b55adf321cc [0,0,1,0,0,0|2,0,1]=4 53 B12R1.371 C=CC(=O)Nc1ccccc1Br e5d1f40bbb3972cd234b3d1559f149fb [0,0,1,0,0,0|3,0,0]=4 54 B12R1.371 C=CC(=O)Nc1ccccc1C acb3e10026991d61c64ba4069b9746f5 [0,0,1,0,0,0|2,0,1]=4 55 B12R1.371 C=CC(=O)Nc1ccccc1Cl 4977f0e6a6edb54dfe74c87f87185b5c [0,0,1,0,0,0|3,0,0]=4 56 B12R1.371 C=CC(=O)Nc1ccccc1F dbb2194c0b6b7ae61906b5bef156a80b [0,0,1,0,0,0|3,0,0]=4 57 B12R1.371 C=CC(=O)Nc1ccccc1I 1d2658ab33296a9656a08882644409fe [0,0,1,0,0,0|3,0,0]=4 58 B12R1.371 C=CC(=O)Nc1ccccc1O 9447ec7b0f9e158ab19bcffe70be1362 [0,0,1,0,0,0|3,0,0]=4 59 B12R1.371 C=CC(=O)Nc1ccccc1S 2b5292e4efc934dbb57e5219724c1b78 [0,0,1,0,0,0|3,0,0]=4 60 B12R1.371 C=CC(=O)Nc1ccncc1C 55555c9954e007e77c510dd7b31ca2d8 [0,0,1,0,0,0|1,0,1]=3 61 B12R1.371 C=CC(=O)Nc1ccncc1Cl 576ef7f436909add09f5b08fa1a11c27 [0,0,1,0,0,0|2,0,0]=3 62 B12R1.371 C=CC(=O)Nc1ccncc1F 972ef84cf57b1ba9820dd4ed57bbc23b [0,0,1,0,0,0|2,0,0]=3 63 B12R1.371 C=CC(=O)Nc1ccncc1I 1e1a36d76a1ae99a35ea54a250f6f4b0 [0,0,1,0,0,0|2,0,0]=3 64 B12R1.371 C=CC(=O)Nc1ccnnc1C 127e5e40c7ba8b034a51f838267e90f2 [0,0,1,0,0,0|2,0,1]=4 65 B12R1.371 C=CC(=O)Nc1cnncc1Cl 90ebad02b622cf97d573e469cc734b54 [0,0,1,0,0,0|3,0,0]=4 66 B12R1.371 C=CC(=O)Nc1ncncc1C 1423ae82d14e8cc839958b9e012669be [0,0,1,0,0,0|2,0,1]=4 67 B12R1.371 C=CC(=O)Nc1ncncc1Cl a57869af836c7ce20513d8fc10d7676c [0,0,1,0,0,0|3,0,0]=4 68 B12R1.371 C=CC(=O)Nc1ncncc1F ae776adf343a3cc76406b403bb1520b5 [0,0,1,0,0,0|3,0,0]=4 69 B12R1.371 C=CC(=O)Nc1ncncc1I 1e07a5c15f670e751593b17e4ff7e129 [0,0,1,0,0,0|3,0,0]=4 70 B12R1.371 C=CC(=O)Nc1ncncc1O 0b56cea8efda345c74933b46dd228e8f [0,0,1,0,0,0|3,0,0]=4 71 B12R1.371 CCC(=O)Nc1ccncc1Br a7a337fa2944d74a723407969db3425d [0,0,1,0,0,0|2,0,1]=4 72 B12R1.371 CCC(=O)Nc1ccncc1C cdc3b80a45179f2057f4eb28d828733a [0,0,1,0,0,0|1,0,2]=4 73 B12R1.371 CCC(=O)Nc1ccncc1F 0bcc06655d92cc85b4b8034f080d9722 [0,0,1,0,0,0|2,0,1]=4 74 B12R1.371 CCC(=O)Nc1ccncc1I 6bd5e4b36593d6512d0a0c13541830a4 [0,0,1,0,0,0|2,0,1]=4 75 B12R1.371 Cc1ccccc1NC(=O)C=O c48e8fd2ba5e58f34d83735c8fa1debf [0,0,1,0,0,0|1,0,2]=4 76 B12R1.371 Cc1ccccc1NC(=O)CO 8d990dc3b3796a0c64c8b86b8490eb78 [0,0,1,0,0,0|1,0,2]=4 77 B12R1.371 Cc1ccncc1NC(=O)C=O ebf7d0ff6ebe2c20d9b379ab1f797db2 [0,0,1,0,0,0|2,0,1]=4 78 B12R1.371 Cc1cnccc1NC(=O)C=O d371e040c7962bbba87a9c7b8bc33715 [0,0,1,0,0,0|0,0,2]=3 79 B12R1.371 Cc1cncnc1NC(=O)C=O 3f1f6cfbfeb3f90d0c8215cced1205f2 [0,0,1,0,0,0|1,0,2]=4 80 B12R1.371 Cc1nnccc1NC(=O)C=O 9f1b36898bed9463a7e742f76ff3ad26 [0,0,1,0,0,0|1,0,2]=4 81 B12R1.371 O=C(CF)Nc1ccncc1I c72e8b9b967764d59e8cce7225a5dff0 [0,0,1,0,0,0|2,0,1]=4 82 B12R1.371 O=C(CO)Nc1ccccc1F d20a35cb403e68671e72a0dd460c0485 [0,0,1,0,0,0|2,0,1]=4 83 B12R1.371 O=C(CO)Nc1ccccc1I 209ecbfb2e84cc7bc62f1762ecc4331e [0,0,1,0,0,0|2,0,1]=4 84 B12R1.371 O=C(CO)Nc1ccccc1O e8a188e3771eae8a4a1eca1b4e42b466 [0,0,1,0,0,0|2,0,1]=4 85 B12R1.371 O=C(CO)Nc1ccccc1S e3384ae87fb80eb0958c847fa331a653 [0,0,1,0,0,0|2,0,1]=4 86 B12R1.371 O=CC(=O)Nc1ccccc1Br 7058336679ba69d39674b3c86c28e3f9 [0,0,1,0,0,0|2,0,1]=4 87 B12R1.371 O=CC(=O)Nc1ccccc1Cl 9a72d75ca46083d23b6f52a31e240aa0 [0,0,1,0,0,0|2,0,1]=4 88 B12R1.371 O=CC(=O)Nc1ccccc1F 1f81a01759afe8571b5912fad33207bb [0,0,1,0,0,0|2,0,1]=4 89 B12R1.371 O=CC(=O)Nc1ccccc1I 673328a9d4095e886bbc6b7e908b5522 [0,0,1,0,0,0|2,0,1]=4 90 B12R1.371 O=CC(=O)Nc1ccccc1O e415f0146d0743efb0d7d2314f6f490f [0,0,1,0,0,0|2,0,1]=4 91 B12R1.371 O=CC(=O)Nc1ccccc1S 26651d9294816246534bfb73b52fa2e9 [0,0,1,0,0,0|2,0,1]=4 92 B12R1.371 O=CC(=O)Nc1ccncc1Cl 3d92952ab7f8dc54bd6d1270b5303f29 [0,0,1,0,0,0|1,0,1]=3 93 B12R1.371 O=CC(=O)Nc1ccncc1F fc07c5d03e7c77d21e4368571ef59323 [0,0,1,0,0,0|1,0,1]=3 94 B12R1.371 O=CC(=O)Nc1ccncc1I e719b160974ef13cceec000b9064d7ae [0,0,1,0,0,0|1,0,1]=3 95 B12R1.371 O=CC(=O)Nc1cnccc1Br 544e5a1beaef8f49f001e082ed085100 [0,0,1,0,0,0|2,0,1]=4 96 B12R1.371 O=CC(=O)Nc1cnccc1F 89efa6cd3f12faaf6d12ff5b32069922 [0,0,1,0,0,0|2,0,1]=4 97 B12R1.371 O=CC(=O)Nc1cnccc1I 86868fe7e2091d1c6164f6ebb91140bc [0,0,1,0,0,0|2,0,1]=4 98 B12R1.371 O=CC(=O)Nc1cnccc1O 328d9074164ddecb14f57ebdd55ed8b8 [0,0,1,0,0,0|2,0,1]=4 99 B12R1.371 O=CC(=O)Nc1cnccc1S e11604f1f4594f2a4868347d4af3e208 [0,0,1,0,0,0|2,0,1]=4 100 B12R1.371 O=CC(=O)Nc1cnncc1Cl f10456e4a2ebef8e336788587fe17b60 [0,0,1,0,0,0|2,0,1]=4 101 B12R1.371 O=CC(=O)Nc1ncncc1F 02957dc5d5485495b1b895f762928a3b [0,0,1,0,0,0|2,0,1]=4 102 B12R1.371 O=CC(=O)Nc1ncncc1I c43124726955b3819fc6df788c3daf7e [0,0,1,0,0,0|2,0,1]=4 103 B11R1.40 C#CC(=O)Nc1ccncc1 7e9563fca94f65240a5e54094d485c14 [1,0,1,0,0,0|0,0,2]=4 104 B11R1.40 C=CC(=O)Nc1ccccc1 5f69a60f76bf8d4845a783c3048b2563 [1,0,1,0,0,0|1,0,0]=3 105 B11R1.40 C=CC(=O)Nc1ccccn1 34fef90711dfcaefc277492e72bbe936 [1,0,1,0,0,0|2,0,0]=4 106 B11R1.40 C=CC(=O)Nc1cccnc1 de5c772a8cda94a68da43551d49c0fce [1,0,1,0,0,0|2,0,0]=4 107 B11R1.40 C=CC(=O)Nc1ccncc1 415f0c78f33533c78fc6ab46a82fb4b2 [1,0,1,0,0,0|0,0,0]=2 108 B11R1.40 C=CC(=O)Nc1ccncn1 643d07d6d289887519d558aa71cd5c50 [1,0,1,0,0,0|1,0,0]=3 109 B11R1.40 C=CC(=O)Nc1ccnnc1 bb65c517049238b0258f3b8f2eeaa12d [1,0,1,0,0,0|1,0,0]=3 110 B11R1.40 C=CC(=O)Nc1cnncn1 477a08f5c3fff0e6fa8330a98c5556cd [1,0,1,0,0,0|2,0,0]=4 111 B11R1.40 C=CC(C)Nc1ccncc1 c4fde850a7b9aca67a9b7913a57f482d [1,0,1,0,0,0|1,0,1]=4 112 B11R1.40 O=C(CO)Nc1ccncn1 1ec35e9ab589eb6ea004d772ff8dd3ef [1,0,1,0,0,0|1,0,1]=4 113 B11R1.40 O=CC(=O)Nc1ccccc1 d69489ae088f523aa236921a313e92a5 [1,0,1,0,0,0|1,0,1]=4 114 B11R1.40 O=CC(=O)Nc1cccnc1 4483235651c46310384ecdfb83cf0459 [1,0,1,0,0,0|1,0,1]=4 115 B11R1.40 O=CC(=O)Nc1ccncc1 4b5bab6fe314b5f2251f228c60250dcd [1,0,1,0,0,0|0,0,1]=3 116 B11R1.40 O=CC(=O)Nc1ccncn1 e4430f0dc04d916dd5b0397693cc5623 [1,0,1,0,0,0|1,0,1]=4 117 B11R1.40 O=CC(=O)Nc1ccnnc1 478bc45f9e8b5f84f0b4c7f1d8dd1618 [1,0,1,0,0,0|1,0,1]=4 118 B11R1.91 C=C(Br)CNc1ccncc1 c630c08ca7eab911f8871c49a773a556 [1,0,1,0,0,0|1,0,1]=4 119 B11R1.91 C=C(C)CNc1ccncc1 7fd564b3611fb48098820a623411bd04 [1,0,1,0,0,0|1,0,1]=4 120 B11R1.91 C=C(Cl)CNc1ccncc1 92317ebd98de932c9e84fc2ca3dffb66 [1,0,1,0,0,0|1,0,1]=4 121 B11R1.91 C=C(F)CNc1ccncc1 8313ea3d933a1f8b3763daa108cda0e9 [1,0,1,0,0,0|1,0,1]=4 122 B11R1.91 NC(=O)CNc1cccnc1 dbb72e205ac173bc25639603ebb9275b [1,0,1,0,0,0|1,0,1]=4 123 B11R1.91 NC(=O)COc1cccnc1 561263082ed3dec2740bd877b6a3be01 [1,0,1,0,0,0|1,0,1]=4 124 B11R1.91 O=C(O)CNc1ccncc1 d2ec8efae842007114d587a1ec71d62f [1,0,1,0,0,0|1,0,1]=4 125 B11R1.41 C#Cc1cnccc1NC=O 6b3179307dc744ab3578d96a8d55b532 [1,0,1,0,0,0|0,0,2]=4 126 B11R1.41 C=Cc1ccccc1NC=O 318fa617b79be5fa4723a8d8c79b7c87 [1,0,1,0,0,0|1,0,0]=3 127 B11R1.41 C=Cc1ncccc1NC=O f06ac0d926f03852ca9c2a478204d4b9 [1,0,1,0,0,0|2,0,0]=4 128 B11R1.41 COc1cnccc1NC=O 617a9cb7630271e33ed34a3af74e4f7e [1,0,1,0,0,0|1,0,1]=4 129 B11R1.41 CSc1cnccc1NC=O a24d9460de290c2ba3cbe7dca095c9e2 [1,0,1,0,0,0|1,0,1]=4 130 B11R1.41 N#Cc1cnccc1NC=O ca1bedeb575fe2f6259b4421d874b370 [1,0,1,0,0,0|1,0,1]=4 131 B11R1.41 O=CNc1ccccc1C=O 497f54404d9bc48b9253f4f69faf4a1b [1,0,1,0,0,0|1,0,1]=4 132 B11R1.41 O=CNc1ccccc1CO bc6eb11e23bc211022f1c9b04c7ae372 [1,0,1,0,0,0|1,0,1]=4 133 B11R1.41 O=CNc1ccncc1CO 2c0283e41b636611efc6d0c3ec102b9b [1,0,1,0,0,0|0,0,1]=3 134 B11R1.41 O=CNc1cnccc1C=O c67256f0f71abd6e591f2dd7746963ad [1,0,1,0,0,0|1,0,1]=4 135 B11R1.41 O=CNc1ncncc1CO 046a9f2854e3cca6c9f14d3a5e870742 [1,0,1,0,0,0|1,0,1]=4 136 B11R1.41 O=Cc1ccncc1NCO 92c362cf275f32f3edf1bfec0892594d [1,0,1,0,0,0|1,0,1]=4 137 B11R1.86 CC(=O)Nc1ccncc1C c5c42e159450bf609b124aefb3b1a0c2 [1,0,1,0,0,0|0,0,2]=4 138 B11R1.86 CC(=O)Nc1ccncc1F c0f8b81507f6f0da50422e6a37679a28 [1,0,1,0,0,0|1,0,1]=4 139 B11R1.86 CC(=O)Nc1ccncc1I dc888df548d325d9701c437394dfdc81 [1,0,1,0,0,0|1,0,1]=4 140 B11R1.1 C=CCNc1ccc(=O)[nH]c1 a325db61d671abb4e00fdb99e8f49525 [1,0,1,0,0,0|2,0,0]=4 141 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)F f1d1168377b5461695f92ea341af0bc1 [0,1,1,0,0,0|2,0,0]=4 142 B13R1.133 C=C(Br)C(=O)Nc1ccc(cc1)S 454a9b859808ed6ff1cc8d4805a2edf2 [0,1,1,0,0,0|2,0,0]=4 143 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 9e24fdfeceb66a471f038074e6650c09 [0,1,1,0,0,0|2,0,0]=4 144 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F ed1119f2322c1e38fda08671bd6f51bb [0,1,1,0,0,0|2,0,0]=4 145 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I a06a440e48068ac7768066ed0ec08008 [0,1,1,0,0,0|2,0,0]=4 146 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)O 101ad976a47de10bd52fab7f8096fa28 [0,1,1,0,0,0|2,0,0]=4 147 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)S b304a991041eec50c5816fe46dc86828 [0,1,1,0,0,0|2,0,0]=4 148 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)C e2a4986263ef1aaa248d1cf86af35fda [0,1,1,0,0,0|2,0,0]=4 149 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)F 8823c251c857848e0e37057b85f22ab7 [0,1,1,0,0,0|2,0,0]=4 150 B13R1.133 C=C(Cl)C(=O)Nc1ccc(cc1)S f825e46e1b0f1bb5f55d3d03f336c8bd [0,1,1,0,0,0|2,0,0]=4 151 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)C 08c19ef1b1ddf94f6ce183e837de52a1 [0,1,1,0,0,0|2,0,0]=4 152 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)F 321e92cf38980950d0e93ec0036a1fb1 [0,1,1,0,0,0|2,0,0]=4 153 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)I 3c65422f67f150ca360db53a70d4a48e [0,1,1,0,0,0|2,0,0]=4 154 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)O cb22ff43dffe8c6606709eac7c284b21 [0,1,1,0,0,0|2,0,0]=4 155 B13R1.133 C=C(F)C(=O)Nc1ccc(cc1)S 7e471df7355da36c6505d4b7852f0efe [0,1,1,0,0,0|2,0,0]=4 156 B13R1.133 NC(=O)C(=O)Nc1ccc(nc1)F ef7b544a2dc21a15ad3a9eb36477dbc2 [0,1,1,0,0,0|1,0,1]=4 157 B13R1.135 C#CC(O)C(=O)Nc1ccncc1 278ca5925099baa87a1ef47444cfbfc2 [0,1,1,0,0,0|0,0,2]=4 158 B13R1.135 C/C=C(/C)\C(=O)Nc1ccccc1 36d3be3979b4bfcf091d02ede04c695b [0,1,1,0,0,0|2,0,0]=4 159 B13R1.135 C/C=C(/C)\C(=O)Nc1ccncc1 fd7231d55dff452f2b1278b4fd11e41e [0,1,1,0,0,0|1,0,0]=3 160 B13R1.135 C/C=C(/C)\C(=O)Nc1ccncn1 85e7bfa0efecc71d8b3d3ba02b7601b7 [0,1,1,0,0,0|2,0,0]=4 161 B13R1.135 C/C=C(/C)\C(=O)Nc1ccnnc1 20550702b0d5679e31a1c5a98c93c005 [0,1,1,0,0,0|2,0,0]=4 162 B13R1.135 C/C=C(\Br)/C(=O)Nc1ccccc1 4bd6d72546a8dc929e0a44f63e4546b6 [0,1,1,0,0,0|2,0,0]=4 163 B13R1.135 C/C=C(\Br)/C(=O)Nc1ccncc1 1ba8bbd916d99383406e27628f1d421e [0,1,1,0,0,0|1,0,0]=3 164 B13R1.135 C/C=C(\Br)/C(=O)Nc1ccncn1 41f4e46a2d9295c2c2cb2817890f5a86 [0,1,1,0,0,0|2,0,0]=4 165 B13R1.135 C/C=C(\Br)/C(=O)Nc1ccnnc1 a914fac5e33ef404ac46b9f0e67a9292 [0,1,1,0,0,0|2,0,0]=4 166 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 6f6f562818865fa03f3d70f022ad24cf [0,1,1,0,0,0|2,0,0]=4 167 B13R1.135 C/C=C(\C)/C(=O)Nc1ccncc1 09aaf9107df452bb91624dd30163de1d [0,1,1,0,0,0|1,0,0]=3 168 B13R1.135 C/C=C(\C)/C(=O)Nc1ccncn1 309fcc348ed0e1fb0074f1e8d24384f6 [0,1,1,0,0,0|2,0,0]=4 169 B13R1.135 C/C=C(\C)/C(=O)Nc1ccnnc1 07a608a5d369e2b6e8c00a19e250906b [0,1,1,0,0,0|2,0,0]=4 170 B13R1.135 C/C=C(\Cl)/C(=O)Nc1ccncc1 319ee10f0fda6c380e0b47afe8c2a62d [0,1,1,0,0,0|1,0,0]=3 171 B13R1.135 C/C=C(\Cl)/C(=O)Nc1ccncn1 63d1f399c1979162e50519c9a5ec7fc8 [0,1,1,0,0,0|2,0,0]=4 172 B13R1.135 C/C=C(\Cl)/C(=O)Nc1ccnnc1 88f78a0ff724f4f6bb6e8996cf0bd579 [0,1,1,0,0,0|2,0,0]=4 173 B13R1.135 C/C=C(\O)/C(=O)Nc1ccccc1 eee0e1ff497f724ce424d80b97609a0c [0,1,1,0,0,0|1,0,0]=3 174 B13R1.135 C/C=C(\O)/C(=O)Nc1ccccn1 853aa20a0b52ecc933726a0911569e75 [0,1,1,0,0,0|2,0,0]=4 175 B13R1.135 C/C=C(\O)/C(=O)Nc1cccnc1 bd1b7b8d46cffa579aaa5834856667a5 [0,1,1,0,0,0|2,0,0]=4 176 B13R1.135 C/C=C(\O)/C(=O)Nc1ccncc1 40f0f1669f35edfd9bb536394fb83d76 [0,1,1,0,0,0|0,0,0]=2 177 B13R1.135 C/C=C(\O)/C(=O)Nc1ccncn1 8ac5d774d27677b87564f71b0d283f0e [0,1,1,0,0,0|1,0,0]=3 178 B13R1.135 C/C=C(\O)/C(=O)Nc1ccnnc1 6a2ba9957934c5b1d42c5eb0d0d99be1 [0,1,1,0,0,0|1,0,0]=3 179 B13R1.135 C=C(CC)C(=O)Nc1ccncc1 7825063140dfd7d697ac87c55f47dc16 [0,1,1,0,0,0|1,0,0]=3 180 B13R1.135 C=C(CC)C(=O)Nc1ccncn1 6cbc352a219964b60658d0bfdcf8a6de [0,1,1,0,0,0|2,0,0]=4 181 B13R1.135 C=C(CC)C(=O)Nc1ccnnc1 7f73bef803174b46219052948d64ba3a [0,1,1,0,0,0|2,0,0]=4 182 B13R1.135 C=C(CO)C(=O)Nc1ccccn1 65dc75ca6f904ebaa5df74afe459184e [0,1,1,0,0,0|2,0,0]=4 183 B13R1.135 C=C(CO)C(=O)Nc1cccnc1 2694463cd123b76b3774011a528ccdc1 [0,1,1,0,0,0|2,0,0]=4 184 B13R1.135 C=C(CO)C(=O)Nc1ccncc1 b693347d522e30aaccf0eed3a939b915 [0,1,1,0,0,0|0,0,0]=2 185 B13R1.135 C=C(CO)C(=O)Nc1ccncn1 f78a621f4a6131412c295aeb0df9162e [0,1,1,0,0,0|1,0,0]=3 186 B13R1.135 C=C(CO)C(=O)Nc1ccnnc1 1802b3d22eb267640b4e59669a8f2450 [0,1,1,0,0,0|1,0,0]=3 187 B13R1.135 C=CC(=O)C(=O)Nc1ccccc1 cea5efc407a0553f9473edaa659ae4e0 [0,1,1,0,0,0|1,0,1]=4 188 B13R1.135 C=CC(=O)C(=O)Nc1ccncc1 7060e333ad9b1d777706d81ac767aa27 [0,1,1,0,0,0|0,0,1]=3 189 B13R1.135 C=CC(=O)C(=O)Nc1ccncn1 f3a82315ef9d53cd221296eb4b9aadb1 [0,1,1,0,0,0|1,0,1]=4 190 B13R1.135 C=CC(=O)C(=O)Nc1ccnnc1 106e90d1fa94a298673620f5ed57d0c0 [0,1,1,0,0,0|1,0,1]=4 191 B13R1.135 CC=C(C)C(=O)Nc1ccccc1 fbe8483b5219b345554dc8c93d5e7765 [0,1,1,0,0,0|2,0,0]=4 192 B13R1.135 CC=C(C)C(=O)Nc1ccncc1 90bbbdad3873bff42c622256992f80f3 [0,1,1,0,0,0|1,0,0]=3 193 B13R1.135 CC=C(C)C(=O)Nc1ccncn1 7de3a1268b7be51bba8c8fe127db3724 [0,1,1,0,0,0|2,0,0]=4 194 B13R1.135 CC=C(C)C(=O)Nc1ccnnc1 d0da9444fab85e8fee2f37cd9d078095 [0,1,1,0,0,0|2,0,0]=4 195 B13R1.135 CCC(=O)C(=O)Nc1ccncc1 63f9f50bf076ee66da1da2abad89d359 [0,1,1,0,0,0|0,0,2]=4 196 B13R1.135 CCC(O)C(=O)Nc1ccncc1 2282a51641179544fc479a05355fc238 [0,1,1,0,0,0|0,0,2]=4 197 B13R1.135 CC[C@@H](O)C(=O)Nc1ccncc1 3ab51c9b4eccaea20364b8602eb2ab6c [0,1,1,0,0,0|0,0,2]=4 198 B13R1.135 CC[C@H](O)C(=O)Nc1ccncc1 53f93ff2505866f33a1a187fe316c86d [0,1,1,0,0,0|0,0,2]=4 199 B13R1.135 CNC(=O)C(=O)Nc1cccnc1 7bbbbfc6570ebc4c9e5848d493b9ee9a [0,1,1,0,0,0|1,0,1]=4 200 B13R1.135 CNC(=O)C(=O)Nc1ccncc1 c8889c99052321d3f59cfabd029e8d98 [0,1,1,0,0,0|0,0,2]=4 201 B13R1.135 COC(=O)C(=O)Nc1ccncc1 7ff0c8a2e107b507b7cad823917722e1 [0,1,1,0,0,0|1,0,0]=3 202 B13R1.135 COC(=O)C(=O)Nc1ccncn1 cab02cbda01236c9ee03125fcee07f4c [0,1,1,0,0,0|2,0,0]=4 203 B13R1.135 COC(=O)C(=O)Nc1ccnnc1 1bca4d5cc30173b316cf05e334c47f39 [0,1,1,0,0,0|2,0,0]=4 204 B13R1.135 COC(C)C(=O)Nc1ccncc1 80b35e2c577cb85f5f0bf50ed04e932f [0,1,1,0,0,0|0,0,2]=4 205 B13R1.135 CO[C@@H](C)C(=O)Nc1ccncc1 42776ca021b8e111c75364a98f102d8a [0,1,1,0,0,0|0,0,2]=4 206 B13R1.135 CO[C@H](C)C(=O)Nc1ccncc1 15ae522891996a2929f678c09bb733e6 [0,1,1,0,0,0|0,0,2]=4 207 B13R1.135 O=C(Nc1ccncc1)C(O)CO 50a7a602d1a0572ab15a563e31840c81 [0,1,1,0,0,0|0,0,2]=4 208 B13R1.135 O=C(Nc1ccncc1)[C@@H](O)CO 265f9c6664c53a94a60e340759d59c96 [0,1,1,0,0,0|0,0,2]=4 209 B13R1.135 O=C(Nc1ccncc1)[C@H](O)CF a8f523762966e4ac02295aabddfc00d8 [0,1,1,0,0,0|0,0,2]=4 210 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)Cl 9712925cf50d290c5ca581255e4e0850 [0,1,1,0,0,0|2,0,0]=4 211 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)F 7c5572dd8b40ece3ffd44256a3d23cac [0,1,1,0,0,0|2,0,0]=4 212 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)I 1fd8f2e0a0175535b5e3ca97ac504802 [0,1,1,0,0,0|2,0,0]=4 213 B13R1.148 C=C(Br)C(=O)Nc1cccc(c1)O 3fa0a2b47d1a8340058249733b775855 [0,1,1,0,0,0|2,0,0]=4 214 B13R1.148 C=C(Br)C(=O)Nc1ccnc(c1)Br 76a8020f21f4596e9cb86869e81ae78d [0,1,1,0,0,0|1,0,0]=3 215 B13R1.148 C=C(Br)C(=O)Nc1ccnc(c1)F d724b55ab5b8fa462a7d2da2b0fc1514 [0,1,1,0,0,0|1,0,0]=3 216 B13R1.148 C=C(Br)C(=O)Nc1ccnc(n1)S 37670e6894967ba7219dc24d0b790038 [0,1,1,0,0,0|2,0,0]=4 217 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C d7f0adab9362f6757e3932b5ed64a44f [0,1,1,0,0,0|2,0,0]=4 218 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl f7d6c5fdab9be2fbed6349d3d89935f2 [0,1,1,0,0,0|2,0,0]=4 219 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 055b0209d7e74cbc13bc26c296e20c44 [0,1,1,0,0,0|2,0,0]=4 220 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I a730820077bdd3488e4e1534e08ac4df [0,1,1,0,0,0|2,0,0]=4 221 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O f6f332a64537754086a9578583de733f [0,1,1,0,0,0|2,0,0]=4 222 B13R1.148 C=C(C)C(=O)Nc1ccnc(c1)F bec644b20dfaed7c810e00809952feab [0,1,1,0,0,0|1,0,0]=3 223 B13R1.148 C=C(C)C(=O)Nc1ccnc(c1)O 6b3caee8541991253ae9db20c962eca3 [0,1,1,0,0,0|1,0,0]=3 224 B13R1.148 C=C(C)C(=O)Nc1ccnc(n1)C 0e6cc7719f761c1593d5e9e9c302b2c0 [0,1,1,0,0,0|2,0,0]=4 225 B13R1.148 C=C(C)C(=O)Nc1ccnc(n1)F 78b8ca21cf661595e6ff9657ad076ed8 [0,1,1,0,0,0|2,0,0]=4 226 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)C 9a8c0fdb0047244854f39689c116b6d1 [0,1,1,0,0,0|2,0,0]=4 227 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)F 462bd4d72ad8e4a4f9cdb07265f2cfd7 [0,1,1,0,0,0|2,0,0]=4 228 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)I 7081b87d451027cef22f039a44d11fcc [0,1,1,0,0,0|2,0,0]=4 229 B13R1.148 C=C(Cl)C(=O)Nc1cccc(c1)O a365fd9b8d1ca6e67102923b86b991bd [0,1,1,0,0,0|2,0,0]=4 230 B13R1.148 C=C(Cl)C(=O)Nc1ccnc(c1)F 2a1c87304d95fa6a3b07ea0063ff9f3c [0,1,1,0,0,0|1,0,0]=3 231 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)C 9498899bf230f2146ac73cfd9f88398a [0,1,1,0,0,0|2,0,0]=4 232 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)Cl 8c5ea72c1bfc7d066dd58ac1e412fca1 [0,1,1,0,0,0|2,0,0]=4 233 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)F f9ea813bdc8f60db354e6c55b082d3db [0,1,1,0,0,0|2,0,0]=4 234 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)I 18785552453513751edbbe6d33269fd9 [0,1,1,0,0,0|2,0,0]=4 235 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)O ca6c3cab665038a39d2547d06073ac9b [0,1,1,0,0,0|2,0,0]=4 236 B13R1.148 C=C(F)C(=O)Nc1cccc(c1)S f9382276575a379b00ad4d8ba8f35750 [0,1,1,0,0,0|2,0,0]=4 237 B13R1.148 C=C(F)C(=O)Nc1ccnc(c1)C 2ccdc1ebfe0c257d0bb6ee60e16b2376 [0,1,1,0,0,0|1,0,0]=3 238 B13R1.148 C=C(F)C(=O)Nc1ccnc(c1)F 439e333630f9e8a0fa075687794e022a [0,1,1,0,0,0|1,0,0]=3 239 B13R1.148 C=C(F)C(=O)Nc1ccnc(c1)O dd8c2a0420f29c5dff5398e30bc62b5a [0,1,1,0,0,0|1,0,0]=3 240 B13R1.148 C=C(F)C(=O)Nc1ccnc(n1)C bb8702e1398578c01291de1e7fc60a0f [0,1,1,0,0,0|2,0,0]=4 241 B13R1.148 C=C(F)C(=O)Nc1ccnc(n1)F 6605da91302660aeeaa7ea8b787e01b5 [0,1,1,0,0,0|2,0,0]=4 242 B13R1.148 C=C(F)C(=O)Nc1ccnc(n1)S f7cf108f43ffcf4456f4c62c82bde07b [0,1,1,0,0,0|2,0,0]=4 243 B13R1.148 CC(=O)C(=O)Nc1ccnc(c1)Br 8db9c20aa31419374c77a2a0707c3320 [0,1,1,0,0,0|0,0,2]=4 244 B13R1.148 CC(=O)C(=O)Nc1ccnc(c1)C 7bd8285292c594f594aa435d943d536d [0,1,1,0,0,0|0,0,2]=4 245 B13R1.148 CC(=O)C(=O)Nc1ccnc(c1)Cl 481d72653262fbcec5702de9bf24e2b5 [0,1,1,0,0,0|0,0,2]=4 246 B13R1.148 CC(=O)C(=O)Nc1ccnc(c1)F 503e42eebbf6495b3dc030feb91664d2 [0,1,1,0,0,0|0,0,2]=4 247 B13R1.148 CC(=O)C(=O)Nc1ccnc(c1)I b5958af5cd78e431ee2179f050ae4247 [0,1,1,0,0,0|0,0,2]=4 248 B13R1.148 CC(=O)C(=O)Nc1ccnc(c1)O 0a9d7ae72322c92b04e099ad694a02da [0,1,1,0,0,0|0,0,2]=4 249 B13R1.148 CC(O)C(=O)Nc1ccnc(c1)Cl 0cf03be4e669e65be2e9cd5fc925fb0c [0,1,1,0,0,0|0,0,2]=4 250 B13R1.148 CC(O)C(=O)Nc1ccnc(c1)F b4e4a645250fe27b54932ce94a46e151 [0,1,1,0,0,0|0,0,2]=4 251 B13R1.148 CC(O)C(=O)Nc1ccnc(c1)O 19f206f8a2dc7f9f1df006c43a1ac99b [0,1,1,0,0,0|0,0,2]=4 252 B13R1.148 C[C@@H](O)C(=O)Nc1ccnc(c1)Cl 7a00c86850ebe2c999d565eb7a88e845 [0,1,1,0,0,0|0,0,2]=4 253 B13R1.148 C[C@@H](O)C(=O)Nc1ccnc(c1)F 14e85dc7e19b0a390935eea09272adc5 [0,1,1,0,0,0|0,0,2]=4 254 B13R1.148 C[C@@H](O)C(=O)Nc1ccnc(c1)O 87d8d872eceb1b7dc5b2f440ba7c4ca1 [0,1,1,0,0,0|0,0,2]=4 255 B13R1.148 C[C@H](O)C(=O)Nc1ccnc(c1)Cl d24690a2a34aad764f8a8eaee407005d [0,1,1,0,0,0|0,0,2]=4 256 B13R1.148 C[C@H](O)C(=O)Nc1ccnc(c1)F c79655d5be8dbfa68598613a2c5685b5 [0,1,1,0,0,0|0,0,2]=4 257 B13R1.148 C[C@H](O)C(=O)Nc1ccnc(c1)O 40da89e0e4db5990d9315c1b42af9f73 [0,1,1,0,0,0|0,0,2]=4 258 B13R1.148 Cc1cc(ccn1)NC(=O)C(C)O 221bf84c3a41375e9b6254ded24293a9 [0,1,1,0,0,0|0,0,2]=4 259 B13R1.148 Cc1cc(ccn1)NC(=O)C(O)O 09fa797c81795f322945b2bb7dc02666 [0,1,1,0,0,0|1,0,1]=4 260 B13R1.148 Cc1cc(ccn1)NC(=O)[C@@H](C)O d94cb78cf63981c2b85c592232795e4a [0,1,1,0,0,0|0,0,2]=4 261 B13R1.148 Cc1cc(ccn1)NC(=O)[C@H](C)O 89cd7b903e7a8b956b0169b292b47300 [0,1,1,0,0,0|0,0,2]=4 262 B13R1.148 Cc1cncc(c1)NC(=O)C(=O)N ee287b40c4977ec42e0a2c8d555f3901 [0,1,1,0,0,0|1,0,1]=4 263 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)Br 48f69f146366bd037609503ce6edbc56 [0,1,1,0,0,0|1,0,1]=4 264 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)Cl 8b2b3f2e7ee96b17388f44798612113b [0,1,1,0,0,0|1,0,1]=4 265 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)F 8edba9cdb2a2a9c7e3d8e61c4a8ac780 [0,1,1,0,0,0|1,0,1]=4 266 B13R1.148 NC(=O)C(=O)Nc1ccnc(c1)O eacf14a4fd21705c1f276a081b371f80 [0,1,1,0,0,0|1,0,1]=4 267 B13R1.148 NC(=O)C(=O)Nc1cncc(c1)F f209fb4add714d2fdbce4df4d7347ca8 [0,1,1,0,0,0|1,0,1]=4 268 B13R1.148 NC(=O)C(=O)Nc1cncc(c1)I 683448d0e798fa024748685596df01ab [0,1,1,0,0,0|1,0,1]=4 269 B13R1.148 NC(=O)C(=O)Nc1cncc(c1)O 7f63aa5aeb965d43cbba2325a2da5638 [0,1,1,0,0,0|1,0,1]=4 270 B13R1.148 O=C(Nc1ccnc(c1)Cl)C(O)O bd6ab66941bf4b2f31853619ff73d9be [0,1,1,0,0,0|1,0,1]=4 271 B13R1.148 O=C(Nc1ccnc(c1)F)C(O)O c2cc8a422c9c02f1dfc6acab1207d101 [0,1,1,0,0,0|1,0,1]=4 272 B13R1.148 O=C(Nc1ccnc(c1)O)C(O)O 4a7eaa7c7d4a3666fbb42f9211d07596 [0,1,1,0,0,0|1,0,1]=4 273 B13R1.152 C=C(Br)C(=O)N(C)c1ccncc1 2fddfcbf8340255ef347d51594baec0a [0,1,1,0,0,0|1,0,0]=3 274 B13R1.152 C=C(Br)C(=O)N(C)c1ccncn1 ee73c3610ecdc7edb710558a8f94419d [0,1,1,0,0,0|2,0,0]=4 275 B13R1.152 C=C(Br)C(=O)N(C)c1ccnnc1 40b844365c9adeaa3046132d0a1aa91d [0,1,1,0,0,0|2,0,0]=4 276 B13R1.152 C=C(C)C(=O)N(C)c1ccncc1 56a16f1ac452f3a8adb9e0ca2fc8e8cb [0,1,1,0,0,0|1,0,0]=3 277 B13R1.152 C=C(C)C(=O)N(C)c1ccncn1 69908bc45f192edd967aa717cb621509 [0,1,1,0,0,0|2,0,0]=4 278 B13R1.152 C=C(C)C(=O)N(C)c1ccnnc1 df5073d2f68f47b59773a5b234022045 [0,1,1,0,0,0|2,0,0]=4 279 B13R1.152 C=C(Cl)C(=O)N(C)c1ccncc1 f0fb1aa9687c2d6fab3cc4b88b934d45 [0,1,1,0,0,0|1,0,0]=3 280 B13R1.152 C=C(Cl)C(=O)N(C)c1ccncn1 5e868a591bc7bfbbf9c3b814b89c7242 [0,1,1,0,0,0|2,0,0]=4 281 B13R1.152 C=C(Cl)C(=O)N(C)c1ccnnc1 a2e973e136ceb0f7bb9f7a1474e167ce [0,1,1,0,0,0|2,0,0]=4 282 B13R1.152 C=C(F)C(=O)N(C)c1ccncc1 9637299a70414a2620e3151a09f6a0a2 [0,1,1,0,0,0|1,0,0]=3 283 B13R1.152 C=C(F)C(=O)N(C)c1ccncn1 0f2d4a76b74df9d6b4962b308dd0ec2a [0,1,1,0,0,0|2,0,0]=4 284 B13R1.152 C=C(F)C(=O)N(C)c1ccnnc1 253012367cb76d8ba1945b0ca3a44802 [0,1,1,0,0,0|2,0,0]=4 285 B13R1.152 CC(=O)C(=O)N(C)c1ccncc1 5e0d2e3e8d9470fab6a522ffd8ecdc1f [0,1,1,0,0,0|0,0,2]=4 286 B13R1.152 CC(O)C(=O)N(C)c1ccncc1 c4792fe5f8283f9acdb67368082b0c45 [0,1,1,0,0,0|0,0,2]=4 287 B13R1.152 CN(C(=O)C(=O)N)c1cccnc1 1e8596a2bf3637cd0cf3b9c801553053 [0,1,1,0,0,0|1,0,1]=4 288 B13R1.152 CN(C(=O)C(=O)N)c1ccncc1 5d38c09e96523db743a9f3745ec32517 [0,1,1,0,0,0|1,0,1]=4 289 B13R1.152 CN(C(=O)C(O)O)c1ccncc1 be69c2a8dc3565d07b969c7235e92ceb [0,1,1,0,0,0|1,0,1]=4 290 B13R1.152 C[C@@H](O)C(=O)N(C)c1ccncc1 e94f6e138b8850044f13bc1fbee1faa3 [0,1,1,0,0,0|0,0,2]=4 291 B13R1.152 C[C@H](O)C(=O)N(C)c1ccncc1 e85a18b4e10e2e940a0a6a7f8cf08c1e [0,1,1,0,0,0|0,0,2]=4 292 B13R1.202 C=C(Br)C(=O)Nc1ccccc1F 13604416a3c4da70844667aefe20ef90 [0,1,1,0,0,0|2,0,0]=4 293 B13R1.202 C=C(Br)C(=O)Nc1ccccc1I 1726313c329b9d628e3ad935a53840e6 [0,1,1,0,0,0|2,0,0]=4 294 B13R1.202 C=C(Br)C(=O)Nc1ccccc1O 743b42194db7ef352787bc2efb428586 [0,1,1,0,0,0|2,0,0]=4 295 B13R1.202 C=C(Br)C(=O)Nc1ccccc1S 0dd4a6d8a3c58e5e13f3c81c9bb17be3 [0,1,1,0,0,0|2,0,0]=4 296 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 0576d9c026bd55a99b880e0285d0af3a [0,1,1,0,0,0|2,0,0]=4 297 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 9a5a7d5e77293719e5a41cbf540141f2 [0,1,1,0,0,0|2,0,0]=4 298 B13R1.202 C=C(C)C(=O)Nc1ccccc1I cd91cd8d201b261e3018d57456c9eb63 [0,1,1,0,0,0|2,0,0]=4 299 B13R1.202 C=C(C)C(=O)Nc1ccccc1O a32baba90d61f6c17232f9c526339ac7 [0,1,1,0,0,0|2,0,0]=4 300 B13R1.202 C=C(C)C(=O)Nc1ccccc1S d7455653a2beaffe9b65441f63d45072 [0,1,1,0,0,0|2,0,0]=4 301 B13R1.202 C=C(C)C(=O)Nc1ccncc1I 09119c1a79c408766bbee226b259b814 [0,1,1,0,0,0|1,0,0]=3 302 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1F 0058ea394a422f7bb45be91cf4d8a57a [0,1,1,0,0,0|2,0,0]=4 303 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1I a0ad1bc9ff3f2e2a480b76fa2fd1c647 [0,1,1,0,0,0|2,0,0]=4 304 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1O 976ca127a4110954beef8e675fca6537 [0,1,1,0,0,0|2,0,0]=4 305 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1S 8b38f4b23dcd92c8c6b4834e3361ca8e [0,1,1,0,0,0|2,0,0]=4 306 B13R1.202 C=C(Cl)C(=O)Nc1ccncc1Br 5464e6a72e7b52ddbebaab14d3095f72 [0,1,1,0,0,0|1,0,0]=3 307 B13R1.202 C=C(Cl)C(=O)Nc1ccncc1I eb92b28709bfceb229b9cf68405a43ce [0,1,1,0,0,0|1,0,0]=3 308 B13R1.202 C=C(F)C(=O)Nc1ccccc1C d2f8686140d32c62732dd523ad2018cf [0,1,1,0,0,0|2,0,0]=4 309 B13R1.202 C=C(F)C(=O)Nc1ccccc1F 0beb145d350ef96e3ed7bb89676ddb15 [0,1,1,0,0,0|2,0,0]=4 310 B13R1.202 C=C(F)C(=O)Nc1ccccc1I dd38d16bfaff542a418b65cb8d8b1100 [0,1,1,0,0,0|2,0,0]=4 311 B13R1.202 C=C(F)C(=O)Nc1ccccc1O 0b3a0696a4057480e92c278aff0cafc3 [0,1,1,0,0,0|2,0,0]=4 312 B13R1.202 C=C(F)C(=O)Nc1ccccc1S bb5e77292b8d5d15539377fa3cf500f9 [0,1,1,0,0,0|2,0,0]=4 313 B13R1.202 C=C(F)C(=O)Nc1ccncc1I e7edec7ab588e1a33518cade785cb9d5 [0,1,1,0,0,0|1,0,0]=3 314 B13R1.202 C=C(F)C(=O)Nc1ncncc1F b87cbcea80bd5b08c69c524d0b19e13f [0,1,1,0,0,0|2,0,0]=4 315 B13R1.202 C=C(F)C(=O)Nc1ncncc1I 9a41f1657b803a3f36cf0d6fbefe56a3 [0,1,1,0,0,0|2,0,0]=4 316 B13R1.202 CC(=O)C(=O)Nc1ccncc1C dfde7861b972ec4e27c7c0b64913fb30 [0,1,1,0,0,0|0,0,2]=4 317 B13R1.202 CC(=O)C(=O)Nc1ccncc1I c2e302be262506f20c51d049868eabe2 [0,1,1,0,0,0|0,0,2]=4 318 B13R1.202 CC(O)C(=O)Nc1ccncc1I ebd154e832811ade495ce73cc9d5604d [0,1,1,0,0,0|0,0,2]=4 319 B13R1.202 C[C@@H](O)C(=O)Nc1ccncc1I 021e274d3cf74d2751e4c26731ab57b2 [0,1,1,0,0,0|0,0,2]=4 320 B13R1.202 C[C@H](O)C(=O)Nc1ccncc1I 2e8327cb1789015ec7040c9d8b2b7357 [0,1,1,0,0,0|0,0,2]=4 321 B13R1.202 Cc1ncccc1NC(=O)C(=O)N f89abea17adb2d63c07cec9641c51703 [0,1,1,0,0,0|1,0,1]=4 322 B13R1.202 NC(=O)C(=O)Nc1cccnc1F 463d8e11e8427197bc514be7c58bd478 [0,1,1,0,0,0|1,0,1]=4 323 B13R1.202 NC(=O)C(=O)Nc1cccnc1I 1813a6d59c27b112eac2ddcbea0ea42e [0,1,1,0,0,0|1,0,1]=4 324 B13R1.202 NC(=O)C(=O)Nc1cccnc1O df4516c1121714c4e74f3e967fd27c6b [0,1,1,0,0,0|1,0,1]=4 325 B13R1.202 NC(=O)C(=O)Nc1ccncc1I d71c00f2cba7d73c25b64ad59b9c5fc4 [0,1,1,0,0,0|1,0,1]=4 326 B13R1.202 NC(=O)C(=O)Nc1cnccc1F a7564c4f287ea4e3f23997a3db954652 [0,1,1,0,0,0|1,0,1]=4 327 B13R1.202 NC(=O)C(=O)Nc1cnccc1I 317108323b49dae6f97001ec515f317e [0,1,1,0,0,0|1,0,1]=4 328 B13R1.202 O=C(Nc1ccncc1I)C(O)O 40243808bd35aac649c7e18ba4c0e129 [0,1,1,0,0,0|1,0,1]=4 329 B13R1.418 NC(=O)C(CO)Nc1cccnc1 b549af0fdec75c8c038b0c14fccb4f9f [0,1,1,0,0,0|1,0,1]=4 330 B13R1.418 NC(=O)[C@H](CO)Nc1cccnc1 e8e11e8b0a0432ad86c67f3c01eb3115 [0,1,1,0,0,0|1,0,1]=4 331 B13R1.380 CC(=O)Nc1ccncc1CCO a66927f6c7504712d05e3a3f1c9adbd3 [0,1,1,0,0,0|0,0,2]=4 332 B13R1.380 O=CNc1ccccc1C=C(Br)Br 08df6cadb64b93d24dbf911ef81f1ecf [0,1,1,0,0,0|2,0,0]=4 333 B13R1.380 O=CNc1ccccc1C=C(F)F 3556a8dc3a74ccd07ce636f81ac7cb8d [0,1,1,0,0,0|2,0,0]=4 334 B13R1.382 CNC(=O)c1cnccc1NC=O bdfd3b8056fae3c5ae7f23a328277bb4 [0,1,1,0,0,0|2,0,0]=4 335 B13R1.382 COC(=O)c1cnccc1NC=O f8f47253c5ed7985cc081e96cc1f6a8e [0,1,1,0,0,0|2,0,0]=4 336 B13R1.382 O=CNc1ccccc1C(=O)NO 99ae6c68024bc8640d811ad122d1cfb4 [0,1,1,0,0,0|2,0,0]=4 337 B13R1.485 COCCc1cnccc1NC=O a324f7faa193b83bc262d1d7808fb5e1 [0,1,1,0,0,0|0,0,2]=4 338 B13R1.485 O=CCNc1ccncc1CCO 56396042206b906c61082efeef311a8f [0,1,1,0,0,0|0,0,2]=4 339 B13R1.40 C=CC(=O)Nc1ccnc(c1Br)C d695948e018b0a8bb9b91430a81ee9b1 [0,1,1,0,0,0|2,0,0]=4 340 B13R1.40 C=CC(=O)Nc1ccnc(c1Br)F 253c414be6f5359656d23f28826ff9c8 [0,1,1,0,0,0|2,0,0]=4 341 B13R1.40 C=CC(=O)Nc1ccnc(c1C)Br 9535815c49501ea908a83cdd951f1c5d [0,1,1,0,0,0|1,0,1]=4 342 B13R1.40 C=CC(=O)Nc1ccnc(c1C)C 2e89f1222df431552cf8af49e6812b83 [0,1,1,0,0,0|1,0,1]=4 343 B13R1.40 C=CC(=O)Nc1ccnc(c1C)Cl 4dd6190fc6eed8a0c589d519008a7c8c [0,1,1,0,0,0|1,0,1]=4 344 B13R1.40 C=CC(=O)Nc1ccnc(c1C)F bb18d76507dcf42918f8c341a139c800 [0,1,1,0,0,0|1,0,1]=4 345 B13R1.40 C=CC(=O)Nc1ccnc(c1Cl)Br ac5815dc4ee2022baccb24abeca7a3d1 [0,1,1,0,0,0|2,0,0]=4 346 B13R1.40 C=CC(=O)Nc1ccnc(c1Cl)C ddc437c17dd34f401971b46669eb961b [0,1,1,0,0,0|2,0,0]=4 347 B13R1.40 C=CC(=O)Nc1ccnc(c1Cl)Cl 91950b19249483bbeab81952991dbe6a [0,1,1,0,0,0|2,0,0]=4 348 B13R1.40 C=CC(=O)Nc1ccnc(c1Cl)O 6cfcccf2593ad846fbe51a6c6562e233 [0,1,1,0,0,0|2,0,0]=4 349 B13R1.40 C=CC(=O)Nc1ccnc(c1F)Br 2601b677b3141d10fddb17549c29cbac [0,1,1,0,0,0|2,0,0]=4 350 B13R1.40 C=CC(=O)Nc1ccnc(c1F)C 8b091de7bb19a43b500cc869c089869a [0,1,1,0,0,0|2,0,0]=4 351 B13R1.40 C=CC(=O)Nc1ccnc(c1F)Cl a0f4bd03c371b9e0b77dc99cdc25e679 [0,1,1,0,0,0|2,0,0]=4 352 B13R1.40 C=CC(=O)Nc1ccnc(c1F)F 9844e2600666a07956e491275c5e56ca [0,1,1,0,0,0|2,0,0]=4 353 B13R1.40 C=CC(=O)Nc1ccnc(c1I)Br 641d5ef5c0117aa3dbf5355ede97c3bc [0,1,1,0,0,0|2,0,0]=4 354 B13R1.40 C=CC(=O)Nc1ccnc(c1I)C f5de0b15797bedf1853611372ae1c2d0 [0,1,1,0,0,0|2,0,0]=4 355 B13R1.40 C=CC(=O)Nc1ccnc(c1I)Cl 4f5af933be0826bdfca6bbd8733cfaf0 [0,1,1,0,0,0|2,0,0]=4 356 B13R1.40 C=CC(=O)Nc1ccnc(c1I)F 370506dc4bd0bf4cb03ea68b2f88cc91 [0,1,1,0,0,0|2,0,0]=4 357 B13R1.40 C=CC(=O)Nc1ccnc(c1O)Br 419cc9ef8964c0ea218c1c655474965b [0,1,1,0,0,0|2,0,0]=4 358 B13R1.40 C=CC(=O)Nc1ccnc(c1O)Cl 0f3c297e05b0ade9c875d09ecd60bfff [0,1,1,0,0,0|2,0,0]=4 359 B13R1.40 Cc1c(ccnc1Br)NC(=O)C=O 572dab9bb0cbf09cdea16b1a43bc1cb6 [0,1,1,0,0,0|0,0,2]=4 360 B13R1.40 Cc1c(ccnc1Cl)NC(=O)C=O 8401820e9317623451131a591b7916cc [0,1,1,0,0,0|0,0,2]=4 361 B13R1.40 Cc1c(ccnc1F)NC(=O)C=O 4de6dbd012138409e8d479a3bbebe771 [0,1,1,0,0,0|0,0,2]=4 362 B13R1.40 Cc1nccc(c1Br)NC(=O)C=O bd38231c3ea8a827598996dbecf58f36 [0,1,1,0,0,0|1,0,1]=4 363 B13R1.40 Cc1nccc(c1C)NC(=O)C=O 6435c7610aa94b209c99a13ea1585984 [0,1,1,0,0,0|0,0,2]=4 364 B13R1.40 Cc1nccc(c1Cl)NC(=O)C=O ecbae9db08a66e93580437a2740001f7 [0,1,1,0,0,0|1,0,1]=4 365 B13R1.40 Cc1nccc(c1F)NC(=O)C=O f338336ad23d14cfa2584a7f18c0f1d1 [0,1,1,0,0,0|1,0,1]=4 366 B13R1.40 Cc1nccc(c1F)NC(=O)CO 9d9ec988c4761c2f2ef4e7d1d224069e [0,1,1,0,0,0|1,0,1]=4 367 B13R1.40 Cc1nccc(c1I)NC(=O)C=O e7edf448a60940986c4639bbc1adc57a [0,1,1,0,0,0|1,0,1]=4 368 B13R1.40 O=C(CO)Nc1ccnc(c1F)Cl 7ff492983e8501c170aaeaf0e4eb092a [0,1,1,0,0,0|1,0,1]=4 369 B13R1.40 O=C(CO)Nc1ccnc(c1F)F cb83841a62ca405f2d49546b0902025b [0,1,1,0,0,0|1,0,1]=4 370 B13R1.40 O=CC(=O)Nc1ccnc(c1Br)F b8f878811643f221e22dd783b90715b0 [0,1,1,0,0,0|1,0,1]=4 371 B13R1.40 O=CC(=O)Nc1ccnc(c1Br)O 78d3c0036f6bf80ccbe108bd9b36ca46 [0,1,1,0,0,0|1,0,1]=4 372 B13R1.40 O=CC(=O)Nc1ccnc(c1Cl)Br 2b5aed7dba7762d53edaacac59d3b852 [0,1,1,0,0,0|1,0,1]=4 373 B13R1.40 O=CC(=O)Nc1ccnc(c1Cl)Cl 931dcc3305747c4500480d208b99a677 [0,1,1,0,0,0|1,0,1]=4 374 B13R1.40 O=CC(=O)Nc1ccnc(c1Cl)O 23abfd9b869186338dd0f827a58957ba [0,1,1,0,0,0|1,0,1]=4 375 B13R1.40 O=CC(=O)Nc1ccnc(c1F)Br 8fe2e1d91cdb3dddb67e64213766a9b5 [0,1,1,0,0,0|1,0,1]=4 376 B13R1.40 O=CC(=O)Nc1ccnc(c1F)Cl adb7c64156eb30816d6832fd10a41992 [0,1,1,0,0,0|1,0,1]=4 377 B13R1.40 O=CC(=O)Nc1ccnc(c1F)F a9eecfcd3927ad5550ae0a0919077527 [0,1,1,0,0,0|1,0,1]=4 378 B13R1.40 O=CC(=O)Nc1ccnc(c1I)Br 6ece802c4aba2006e06e4604ec26b4d6 [0,1,1,0,0,0|1,0,1]=4 379 B13R1.40 O=CC(=O)Nc1ccnc(c1I)Cl f2169e1562ac81c8a6f6c9ad7cd1e431 [0,1,1,0,0,0|1,0,1]=4 380 B13R1.40 O=CC(=O)Nc1ccnc(c1I)F 1993b8dddf10827446a5f570f586b095 [0,1,1,0,0,0|1,0,1]=4 381 B13R1.40 O=CC(=O)Nc1ccnc(c1O)Br d4dc37a24627e446806b45ba2c5980c8 [0,1,1,0,0,0|1,0,1]=4 382 B13R1.40 O=CC(=O)Nc1ccnc(c1O)Cl 72c1c0edfa43190dc93565b98f4a55f0 [0,1,1,0,0,0|1,0,1]=4 383 B13R1.91 C#CC(=O)Nc1ccncc1C=O b9889df34732901b866e0ce19b8253f8 [0,1,1,0,0,0|1,0,1]=4 384 B13R1.91 C#Cc1cnccc1NC(=O)C=C 14bb33f85408c8b6b0e1a772eed7f9ae [0,1,1,0,0,0|1,0,1]=4 385 B13R1.91 C#Cc1cnccc1NC(=O)C=O 5bacebee7920d1d0837666dd25a416ab [0,1,1,0,0,0|0,0,2]=4 386 B13R1.91 C=CC(=O)Nc1ccccc1C=C 1ac12ee3c174ef750808d5edc13a2beb [0,1,1,0,0,0|2,0,0]=4 387 B13R1.91 C=CC(=O)Nc1ccccc1C=O 65d86af96122000defc423a660e8803f [0,1,1,0,0,0|2,0,0]=4 388 B13R1.91 C=CC(=O)Nc1ccncc1C#N 56712f09e758ac9760cd0e74b736b381 [0,1,1,0,0,0|1,0,1]=4 389 B13R1.91 C=CC(=O)Nc1ccncc1C=O 0aa535c01086d69a66b60ee4aa13aaf2 [0,1,1,0,0,0|1,0,0]=3 390 B13R1.91 C=CC(=O)Nc1ccncc1CO 0ad4c978c8c84636523acd097a8bb886 [0,1,1,0,0,0|1,0,1]=4 391 B13R1.91 C=CC(=O)Nc1ccncc1OC 88b82bf205538b62e35bda9a370ed4b6 [0,1,1,0,0,0|1,0,1]=4 392 B13R1.91 C=CC(=O)Nc1ccncc1SC ea67db63862341eb378c93a26229df6c [0,1,1,0,0,0|1,0,1]=4 393 B13R1.91 C=CC(=O)Nc1ncncc1C=O 8e858b58cdb35271164b8e7b8222b016 [0,1,1,0,0,0|2,0,0]=4 394 B13R1.91 C=Cc1ccccc1NC(=O)C=O b3ac91db34e65fc91e84e9e88eac0332 [0,1,1,0,0,0|1,0,1]=4 395 B13R1.91 C=Cc1ccccc1NC(=O)CO 2020884169c76c360969f1dcc2d335df [0,1,1,0,0,0|1,0,1]=4 396 B13R1.91 CCC(=O)Nc1ccncc1C=O c83018f6dd4e157c5c3c75d136fb23b2 [0,1,1,0,0,0|1,0,1]=4 397 B13R1.91 COc1cnccc1NC(=O)C=O 3edb6f8447089474078fef100b69d88e [0,1,1,0,0,0|0,0,2]=4 398 B13R1.91 CSc1cnccc1NC(=O)C=O 9215c6e215079c1fa9f482da0eaff47f [0,1,1,0,0,0|0,0,2]=4 399 B13R1.91 N#Cc1cnccc1NC(=O)C=O 413bc294ab571025e3e303e2659e1771 [0,1,1,0,0,0|0,0,2]=4 400 B13R1.91 O=CC(=O)Nc1ccccc1C=O 0f4e468224165ad763b0a079aa0b05e7 [0,1,1,0,0,0|1,0,1]=4 401 B13R1.91 O=CC(=O)Nc1ccncc1C=O ab734c4d6405e4dacb526e005cbf2a95 [0,1,1,0,0,0|0,0,1]=3 402 B13R1.91 O=CC(=O)Nc1ccncc1CO 133a370b56d69a0ae80e2ff2f8cf94fd [0,1,1,0,0,0|0,0,2]=4 403 B13R1.91 O=CC(=O)Nc1ncncc1C=O 66eb965c8d221d305138374ac1f70a29 [0,1,1,0,0,0|1,0,1]=4 404 B13R1.91 O=Cc1ccccc1NC(=O)CO 13697760a4b753718875d6dbb7f000ad [0,1,1,0,0,0|1,0,1]=4 405 B13R1.91 O=Cc1cnccc1NC(=O)CF 1597ef425474c860b0a20b5fafa661d5 [0,1,1,0,0,0|1,0,1]=4 406 B13R1.91 O=Cc1cncnc1NC(=O)CO 7dc0ef9f2398b4ff60ffa2a2060553a3 [0,1,1,0,0,0|1,0,1]=4 407 B13R1.470 C/C=C/C(=O)Nc1ccncc1Br f79473d064afd9740027f0ed5f5a5ad6 [0,1,1,0,0,0|2,0,0]=4 408 B13R1.470 C/C=C/C(=O)Nc1ccncc1C 66f0177d7e1fde2b078f076deb4662b7 [0,1,1,0,0,0|1,0,1]=4 409 B13R1.470 C/C=C/C(=O)Nc1ccncc1Cl 25810beb219f3378db8615cac9351b02 [0,1,1,0,0,0|2,0,0]=4 410 B13R1.470 C/C=C/C(=O)Nc1ccncc1F 700d0891458c2a1d63bfb09a5cd2f742 [0,1,1,0,0,0|2,0,0]=4 411 B13R1.470 C/C=C/C(=O)Nc1ccncc1I 15a6df3b81fefd0a163728d31b5722d2 [0,1,1,0,0,0|2,0,0]=4 412 B13R1.470 C=CCC(=O)Nc1ccncc1Br 174ac315397f672971c309035fb9edc9 [0,1,1,0,0,0|2,0,0]=4 413 B13R1.470 C=CCC(=O)Nc1ccncc1C 6a6c0d9d68bcd6982600a774510ab25a [0,1,1,0,0,0|1,0,1]=4 414 B13R1.470 C=CCC(=O)Nc1ccncc1Cl 0af4af1a5d687b8a117e120227cf7da5 [0,1,1,0,0,0|2,0,0]=4 415 B13R1.470 C=CCC(=O)Nc1ccncc1F f88945581429a23bdccbe086e8834d7e [0,1,1,0,0,0|2,0,0]=4 416 B13R1.470 C=CCC(=O)Nc1ccncc1I b67aa50fce7f9de8290d7e465c4b2a38 [0,1,1,0,0,0|2,0,0]=4 417 B13R1.470 COCC(=O)Nc1ccncc1Br ed95ae53f2fdfee0f58c568cd9fc099e [0,1,1,0,0,0|1,0,1]=4 418 B13R1.470 COCC(=O)Nc1ccncc1C f00335175fb7b26b8f7778c77b28da4a [0,1,1,0,0,0|0,0,2]=4 419 B13R1.470 COCC(=O)Nc1ccncc1F 3c0a274f69edcd2d6e2f583a6daf3989 [0,1,1,0,0,0|1,0,1]=4 420 B13R1.470 COCC(=O)Nc1ccncc1I e7cbda18e51b52081f708a1961a318bc [0,1,1,0,0,0|1,0,1]=4 421 B13R1.470 Cc1cnccc1NC(=O)/C=C/Br 045d45e77ada2e94a76977617036f7f4 [0,1,1,0,0,0|1,0,1]=4 422 B13R1.470 Cc1cnccc1NC(=O)/C=C/Cl 8c75a9461e7c463dce41fcf503d0655a [0,1,1,0,0,0|1,0,1]=4 423 B13R1.470 Cc1cnccc1NC(=O)/C=C/I 0450b6e7346a872c7038b28ef2292351 [0,1,1,0,0,0|1,0,1]=4 424 B13R1.470 Cc1cnccc1NC(=O)/C=C\Br f4d7785ceaa85b6c96a6a03a874d24f5 [0,1,1,0,0,0|1,0,1]=4 425 B13R1.470 Cc1cnccc1NC(=O)/C=C\Cl ca6f8b3d13d9509bd6176241c22a5a1e [0,1,1,0,0,0|1,0,1]=4 426 B13R1.470 Cc1cnccc1NC(=O)/C=C\I 0d45b90802201c40978bff09be950c19 [0,1,1,0,0,0|1,0,1]=4 427 B13R1.470 Cc1cnccc1NC(=O)C=CBr 297b40b4f28681691d2558e48890b602 [0,1,1,0,0,0|1,0,1]=4 428 B13R1.470 Cc1cnccc1NC(=O)C=CI c33aadd47f6c0724b5b61ab40588599c [0,1,1,0,0,0|1,0,1]=4 429 B13R1.470 Cc1cnccc1NC(=O)CC=O 4364397933cfda3595e99dde074cb22b [0,1,1,0,0,0|0,0,2]=4 430 B13R1.470 Cc1cnccc1NC(=O)CON 5dab179b7945d3c1b7ed4338dd4c2f8b [0,1,1,0,0,0|0,0,2]=4 431 B13R1.470 NOCC(=O)Nc1ccncc1Br 9ceba476329eed2e1c50e006630189cd [0,1,1,0,0,0|1,0,1]=4 432 B13R1.470 NOCC(=O)Nc1ccncc1Cl 50c820051a78348fea78106698f1ab7d [0,1,1,0,0,0|1,0,1]=4 433 B13R1.470 NOCC(=O)Nc1ccncc1F 558ebc80e4fe7cb76d445171ae337b74 [0,1,1,0,0,0|1,0,1]=4 434 B13R1.470 NOCC(=O)Nc1ccncc1I 5742cd9cda86bb3a22a4a01ff23655ea [0,1,1,0,0,0|1,0,1]=4 435 B13R1.470 NOCC(=O)Nc1ccncc1O 2c8e10f020b76b1e0c1e413f512282ab [0,1,1,0,0,0|1,0,1]=4 436 B13R1.470 O=C(/C=C/Br)Nc1ccncc1Cl b3e1cddf2e56e4e3b867c468455a2a63 [0,1,1,0,0,0|2,0,0]=4 437 B13R1.470 O=C(/C=C/Br)Nc1ccncc1F 08be2ff55987bce81283d047c7ef8110 [0,1,1,0,0,0|2,0,0]=4 438 B13R1.470 O=C(/C=C/Br)Nc1ccncc1I db05dff13231a0ccac8b16e4e58a32be [0,1,1,0,0,0|2,0,0]=4 439 B13R1.470 O=C(/C=C/Cl)Nc1ccncc1Cl 6468d1160dc94a3bf51d9f1aabdfcd1e [0,1,1,0,0,0|2,0,0]=4 440 B13R1.470 O=C(/C=C/Cl)Nc1ccncc1F 162a962928325a89787690d8f95b55b4 [0,1,1,0,0,0|2,0,0]=4 441 B13R1.470 O=C(/C=C/Cl)Nc1ccncc1I 193c1af6af19dd039e102fdf39fd1137 [0,1,1,0,0,0|2,0,0]=4 442 B13R1.470 O=C(/C=C/I)Nc1ccncc1Br 9618a720f90733c0ea79018447e2e49d [0,1,1,0,0,0|2,0,0]=4 443 B13R1.470 O=C(/C=C/I)Nc1ccncc1Cl 81fed6e13fe70f7e391345a352c30cbe [0,1,1,0,0,0|2,0,0]=4 444 B13R1.470 O=C(/C=C/I)Nc1ccncc1F d5069a210e7e14301576fbd5d1d30b1d [0,1,1,0,0,0|2,0,0]=4 445 B13R1.470 O=C(/C=C/I)Nc1ccncc1I 936dc27d2a76360f3a894923e9955c35 [0,1,1,0,0,0|2,0,0]=4 446 B13R1.470 O=C(/C=C\Br)Nc1ccncc1Cl 273a96eafbfb92a1a03517d64a02f184 [0,1,1,0,0,0|2,0,0]=4 447 B13R1.470 O=C(/C=C\Br)Nc1ccncc1F ca268e74e799316e2a981a078d2f9e3f [0,1,1,0,0,0|2,0,0]=4 448 B13R1.470 O=C(/C=C\Br)Nc1ccncc1I b4a746a9f9bcaaf64f9c7e2d96917afa [0,1,1,0,0,0|2,0,0]=4 449 B13R1.470 O=C(/C=C\Cl)Nc1ccncc1Cl 29f539a77d64781adff300c3737191a4 [0,1,1,0,0,0|2,0,0]=4 450 B13R1.470 O=C(/C=C\Cl)Nc1ccncc1F 432ce2145edd4ca9b2f6f860dc1849a6 [0,1,1,0,0,0|2,0,0]=4 451 B13R1.470 O=C(/C=C\Cl)Nc1ccncc1I 764f79d979b20a40eaa363d59fb579d1 [0,1,1,0,0,0|2,0,0]=4 452 B13R1.470 O=C(/C=C\I)Nc1ccncc1Br 1264b4f858d047071c2aa04fa60d52a3 [0,1,1,0,0,0|2,0,0]=4 453 B13R1.470 O=C(/C=C\I)Nc1ccncc1Cl 7934dd0cb6134551d10974f4a6478dc1 [0,1,1,0,0,0|2,0,0]=4 454 B13R1.470 O=C(/C=C\I)Nc1ccncc1F aa218fd7b1ae06bcfc7db4de2dbcfb5a [0,1,1,0,0,0|2,0,0]=4 455 B13R1.470 O=C(/C=C\I)Nc1ccncc1I e1396a739029c1e8797b30aa1c36854a [0,1,1,0,0,0|2,0,0]=4 456 B13R1.470 O=C(C=CBr)Nc1ccncc1Cl 622b8ca547ca28fefd6dc57f9eb7b8ae [0,1,1,0,0,0|2,0,0]=4 457 B13R1.470 O=C(C=CBr)Nc1ccncc1F 45f84bc4ade4dad7681859ee250c73bd [0,1,1,0,0,0|2,0,0]=4 458 B13R1.470 O=C(C=CBr)Nc1ccncc1I 00d739a11a109261dc0eac94a3450120 [0,1,1,0,0,0|2,0,0]=4 459 B13R1.470 O=C(C=CI)Nc1ccncc1Br 951357f1fc21d12fbfd48b4f7eaaee0a [0,1,1,0,0,0|2,0,0]=4 460 B13R1.470 O=C(C=CI)Nc1ccncc1Cl 5ac880db77060e6864b8df3828993c6f [0,1,1,0,0,0|2,0,0]=4 461 B13R1.470 O=C(C=CI)Nc1ccncc1F 87d347b9ac25eb4e5c864e827255c900 [0,1,1,0,0,0|2,0,0]=4 462 B13R1.470 O=C(C=CI)Nc1ccncc1I b0530401c79d36ee9afd2b8170df3892 [0,1,1,0,0,0|2,0,0]=4 463 B13R1.470 O=C(CCO)Nc1ccncc1I 5a1e1117746375515ed2fa51d7a6b79e [0,1,1,0,0,0|1,0,1]=4 464 B13R1.470 O=CCC(=O)Nc1ccncc1Br 860faeffb06d47bbd0b59989a0eb2133 [0,1,1,0,0,0|1,0,1]=4 465 B13R1.470 O=CCC(=O)Nc1ccncc1Cl d33d9befb0b1ed680ff2ff3a90670263 [0,1,1,0,0,0|1,0,1]=4 466 B13R1.470 O=CCC(=O)Nc1ccncc1F e044293e405b4dcdb780771fdccc067f [0,1,1,0,0,0|1,0,1]=4 467 B13R1.470 O=CCC(=O)Nc1ccncc1I 5528ce759f211d50110536ebb3f6cbe5 [0,1,1,0,0,0|1,0,1]=4 468 B13R1.696 C=CC(=O)N(C)c1ccncc1Br e78fd40fd887942f611b379ca880c513 [0,1,1,0,0,0|2,0,0]=4 469 B13R1.696 C=CC(=O)N(C)c1ccncc1Cl 03c6119ec330195e512686f210fffc29 [0,1,1,0,0,0|2,0,0]=4 470 B13R1.696 C=CC(=O)N(C)c1ccncc1I 9d04a6f7cad86c238893abf31c79da8d [0,1,1,0,0,0|2,0,0]=4 471 B13R1.696 CN(C(=O)C=O)c1ccncc1Br a391ed0154c6c05e087c69317627310a [0,1,1,0,0,0|1,0,1]=4 472 B13R1.696 CN(C(=O)C=O)c1ccncc1Cl 7ebed114bdc42a0005c54fd4bdac2230 [0,1,1,0,0,0|1,0,1]=4 473 B13R1.696 CN(C(=O)C=O)c1ccncc1I ca79f5d5ace0a91f064010fa2fe75b5a [0,1,1,0,0,0|1,0,1]=4 474 B13R1.696 CN(C(=O)CO)c1ccncc1Br e00a6ae30a90c241dd7a3dab7a89204d [0,1,1,0,0,0|1,0,1]=4 475 B13R1.696 CN(C(=O)CO)c1ccncc1Cl 648d0e468cbb957f7a69a0805cd49c70 [0,1,1,0,0,0|1,0,1]=4 476 B13R1.696 CN(C(=O)CO)c1ccncc1I 9e56eee5602595a99ffa62a6180c8a32 [0,1,1,0,0,0|1,0,1]=4 477 B13R1.2872 C=CC(=O)Nc1cc(ncc1C)C c6eeda0b5281e63b03b971413cd33044 [0,1,1,0,0,0|1,0,1]=4 478 B13R1.2872 C=CC(=O)Nc1cc(ncc1C)Cl 50293a5304a14896b0d0f0e53f7cad74 [0,1,1,0,0,0|1,0,1]=4 479 B13R1.2872 C=CC(=O)Nc1cc(ncc1C)F d68fbf0cb631e251223de2a32c0a2906 [0,1,1,0,0,0|1,0,1]=4 480 B13R1.2872 C=CC(=O)Nc1cc(ncc1C)O 48a5b3cb50ced44fa02e185ae913bfd0 [0,1,1,0,0,0|1,0,1]=4 481 B13R1.2872 C=CC(=O)Nc1cc(ncc1Cl)F bd2efb2a79f00fa0de67d7db1924104d [0,1,1,0,0,0|2,0,0]=4 482 B13R1.2872 C=CC(=O)Nc1cc(ncc1F)C 7f58330fd066ca279e34cc88388af4f6 [0,1,1,0,0,0|2,0,0]=4 483 B13R1.2872 C=CC(=O)Nc1cc(ncc1F)Cl 5bce9b7d4baa3778e91a7c3f0caf0543 [0,1,1,0,0,0|2,0,0]=4 484 B13R1.2872 C=CC(=O)Nc1cc(ncc1F)F adf29199efea7c1394257fa55b4966db [0,1,1,0,0,0|2,0,0]=4 485 B13R1.2872 C=CC(=O)Nc1cc(ncc1I)Br 67bc935e6181b813928471f8a9286a4a [0,1,1,0,0,0|2,0,0]=4 486 B13R1.2872 C=CC(=O)Nc1cc(ncc1I)Cl 59dff8aa54b4ab12d0384fce318f814f [0,1,1,0,0,0|2,0,0]=4 487 B13R1.2872 C=CC(=O)Nc1cc(ncc1I)F 7fd1d760b36357771de384f332361319 [0,1,1,0,0,0|2,0,0]=4 488 B13R1.2872 Cc1cc(c(cn1)C)NC(=O)C=O 0884435e7d1dba74617a56db4805018c [0,1,1,0,0,0|0,0,2]=4 489 B13R1.2872 Cc1cc(c(cn1)F)NC(=O)C=O 5bec5bb34e7d1c069574911c0f8f1222 [0,1,1,0,0,0|1,0,1]=4 490 B13R1.2872 Cc1cnc(cc1NC(=O)C=O)Br 44c185bb10fe6c23d597090159479812 [0,1,1,0,0,0|0,0,2]=4 491 B13R1.2872 Cc1cnc(cc1NC(=O)C=O)Cl 3fab93f6fa38d8fab7fa70ee69f0fef3 [0,1,1,0,0,0|0,0,2]=4 492 B13R1.2872 Cc1cnc(cc1NC(=O)C=O)F 51936db3e1e684bd1334f043fbae3c72 [0,1,1,0,0,0|0,0,2]=4 493 B13R1.2872 Cc1cnc(cc1NC(=O)C=O)O ebf5239ff089da5a1a50bf5a5cff1f16 [0,1,1,0,0,0|0,0,2]=4 494 B13R1.2872 O=CC(=O)Nc1cc(ncc1Cl)F cdb5a90a0ac0ca57bbc30933025780de [0,1,1,0,0,0|1,0,1]=4 495 B13R1.2872 O=CC(=O)Nc1cc(ncc1F)Cl 223b0ccefefefd91f8d1a9263baa3348 [0,1,1,0,0,0|1,0,1]=4 496 B13R1.2872 O=CC(=O)Nc1cc(ncc1F)F af91b14491d3f1490454786e83a06582 [0,1,1,0,0,0|1,0,1]=4 497 B13R1.2872 O=CC(=O)Nc1cc(ncc1I)Br afb2df90b5c8098cf95410a5ac4e6858 [0,1,1,0,0,0|1,0,1]=4 498 B13R1.2872 O=CC(=O)Nc1cc(ncc1I)F 421c1d048cd520d69003aac103522e9c [0,1,1,0,0,0|1,0,1]=4 499 B13R1.4928 C=CC(=O)Nc1c(cncc1Br)Br d56337d01cf056bd67203d91a34277a3 [0,1,1,0,0,0|2,0,0]=4 500 B13R1.4928 C=CC(=O)Nc1c(cncc1Br)C 4bd958c0783da84b397c69c774d9596a [0,1,1,0,0,0|1,0,1]=4 501 B13R1.4928 C=CC(=O)Nc1c(cncc1Br)Cl 9d7723a14c7d2be98494ce0549c0964e [0,1,1,0,0,0|2,0,0]=4 502 B13R1.4928 C=CC(=O)Nc1c(cncc1Br)F 7893aac889ce4b91939b4232d6685c29 [0,1,1,0,0,0|2,0,0]=4 503 B13R1.4928 C=CC(=O)Nc1c(cncc1C)C eb4a917054fc5e47f9b5396c893c1248 [0,1,1,0,0,0|1,0,1]=4 504 B13R1.4928 C=CC(=O)Nc1c(cncc1Cl)C 6c2eab3e2b28a498573804e9b3e4082e [0,1,1,0,0,0|1,0,1]=4 505 B13R1.4928 C=CC(=O)Nc1c(cncc1Cl)Cl 29d109c809aa0525e83b519928d2c41c [0,1,1,0,0,0|2,0,0]=4 506 B13R1.4928 C=CC(=O)Nc1c(cncc1F)C aacae076e99367ed196611ee605eb96b [0,1,1,0,0,0|1,0,1]=4 507 B13R1.4928 C=CC(=O)Nc1c(cncc1F)F 2e92084769bdd11c8cf53294f1d9e6f5 [0,1,1,0,0,0|2,0,0]=4 508 B13R1.4928 C=CC(=O)Nc1c(cncc1F)O 3c2d209368297c4d8b466977e9590e37 [0,1,1,0,0,0|2,0,0]=4 509 B13R1.4928 C=CC(=O)Nc1c(cncc1I)Br 5a1f3a87c3dfe71ad4f69a8c233ad621 [0,1,1,0,0,0|2,0,0]=4 510 B13R1.4928 C=CC(=O)Nc1c(cncc1I)C 8b75099396430d6f397164a2c645da84 [0,1,1,0,0,0|1,0,1]=4 511 B13R1.4928 C=CC(=O)Nc1c(cncc1I)Cl 0f736007a35bc5ed26c3561485654168 [0,1,1,0,0,0|2,0,0]=4 512 B13R1.4928 C=CC(=O)Nc1c(cncc1I)F 1eb8800b5bc620051b68169939630762 [0,1,1,0,0,0|2,0,0]=4 513 B13R1.4928 C=CC(=O)Nc1c(cncc1I)I 1ef9867ecf72be329592e9be1ec48455 [0,1,1,0,0,0|2,0,0]=4 514 B13R1.4928 Cc1cncc(c1NC(=O)C=O)Br 1593111e904a4c7207e75b89a8c0eafe [0,1,1,0,0,0|0,0,2]=4 515 B13R1.4928 Cc1cncc(c1NC(=O)C=O)C ebd63c12c38e055608f072a1cb6ecef1 [0,1,1,0,0,0|0,0,2]=4 516 B13R1.4928 Cc1cncc(c1NC(=O)C=O)Cl 1b48ae913f6ac86f3e783a600c87caca [0,1,1,0,0,0|0,0,2]=4 517 B13R1.4928 Cc1cncc(c1NC(=O)C=O)F e0d6f3da48a73825b00a62a09502a6cb [0,1,1,0,0,0|0,0,2]=4 518 B13R1.4928 Cc1cncc(c1NC(=O)C=O)I 6247d359aa7ca0689c609de2f3bd952b [0,1,1,0,0,0|0,0,2]=4 519 B13R1.4928 Cc1cncc(c1NC(=O)CO)Br b2d32adbb51fad9706f1d251285387f9 [0,1,1,0,0,0|0,0,2]=4 520 B13R1.4928 Cc1cncc(c1NC(=O)CO)F 079c683122d1d47209062f9950edc647 [0,1,1,0,0,0|0,0,2]=4 521 B13R1.4928 Cc1cncc(c1NC(=O)CO)I e43b15e127551bda624216d6ce534ef0 [0,1,1,0,0,0|0,0,2]=4 522 B13R1.4928 O=C(CO)Nc1c(cncc1Br)Br ab746cb952f90ef83624cfe41b938bcb [0,1,1,0,0,0|1,0,1]=4 523 B13R1.4928 O=C(CO)Nc1c(cncc1Br)F 071671d82a5db7fe4ac2e9af1a89db34 [0,1,1,0,0,0|1,0,1]=4 524 B13R1.4928 O=C(CO)Nc1c(cncc1F)F b35bc7e9ba915281b8ab38154b071be0 [0,1,1,0,0,0|1,0,1]=4 525 B13R1.4928 O=C(CO)Nc1c(cncc1I)Br bb80046422103437d090581435d16400 [0,1,1,0,0,0|1,0,1]=4 526 B13R1.4928 O=C(CO)Nc1c(cncc1I)F 0033d7298e11a29b87c74a8c55179e61 [0,1,1,0,0,0|1,0,1]=4 527 B13R1.4928 O=C(CO)Nc1c(cncc1I)I 1668d792493b6fddafce075a8d838571 [0,1,1,0,0,0|1,0,1]=4 528 B13R1.4928 O=CC(=O)Nc1c(cncc1Br)Br 7391f16718f181100af6e45ad11fcf64 [0,1,1,0,0,0|1,0,1]=4 529 B13R1.4928 O=CC(=O)Nc1c(cncc1Br)F 4f3feb0bf1eaca630d54db9e5b1a174c [0,1,1,0,0,0|1,0,1]=4 530 B13R1.4928 O=CC(=O)Nc1c(cncc1Cl)Cl dc77fb84c14dbd3460dbc5e550c59b46 [0,1,1,0,0,0|1,0,1]=4 531 B13R1.4928 O=CC(=O)Nc1c(cncc1F)F 4fd58f4d36d26428cf9f726279f4eb1c [0,1,1,0,0,0|1,0,1]=4 532 B13R1.4928 O=CC(=O)Nc1c(cncc1I)Br 044640a846cee70f78dbee4e56a101dc [0,1,1,0,0,0|1,0,1]=4 533 B13R1.4928 O=CC(=O)Nc1c(cncc1I)Cl d3fadbef452cfa51e1fa52c75fcd99ec [0,1,1,0,0,0|1,0,1]=4 534 B13R1.4928 O=CC(=O)Nc1c(cncc1I)F e79418d8035076f469c8e952843635d7 [0,1,1,0,0,0|1,0,1]=4 535 B13R1.4928 O=CC(=O)Nc1c(cncc1I)I 67a6e4e05c5180b2718a35067927fd26 [0,1,1,0,0,0|1,0,1]=4 536 B15R2.888 CCNc1cc2ccccc2[nH]c1=O e6db4526c563bb1e2419a99dd1be818a [0,2,0,0,0,0|2,0,0]=4 537 B15R2.888 CCOc1cc2ccccc2[nH]c1=O f14970800600b2f53fead46aab589904 [0,2,0,0,0,0|1,0,0]=3 538 B15R2.888 CCOc1cc2ccccc2oc1=O 66a4520445cf81328be0f83f53fbf376 [0,2,0,0,0,0|2,0,0]=4 539 B15R2.888 CCOc1cc2cnccc2cc1Br 5a68056f1c889046048c078b3ccebe00 [0,2,0,0,0,0|2,0,0]=4 540 B15R2.888 FCOc1cc2cnccc2cc1Br 96a8ec80294b24314690d65cf076b597 [0,2,0,0,0,0|2,0,0]=4 541 B15R2.888 O=CNc1cc2ccccc2cc1O 9061e97f416ba179f52288f1546f8900 [0,2,0,0,0,0|2,0,0]=4 542 B15R2.888 O=CNc1cc2ccncc2cc1F 3edbf839b0024d879be91b986f1c8e44 [0,2,0,0,0,0|2,0,0]=4 543 B15R2.888 O=c1[nH]c2ccccc2cc1NCF 38c5fd561789cf7b5d4cf94c9bd1ca72 [0,2,0,0,0,0|2,0,0]=4 544 B15R2.888 O=c1[nH]c2ccccc2cc1NCO c1a1c8b9579c42cbfc3003473f11dadf [0,2,0,0,0,0|1,0,0]=3 545 B15R2.888 O=c1[nH]c2ccccc2cc1OCF 60b55620bf7cb05f6d352b425379fde0 [0,2,0,0,0,0|1,0,0]=3 546 B15R2.888 O=c1oc2ccccc2cc1NCO 85294def1843979fce5fc9a4c925dfc1 [0,2,0,0,0,0|2,0,0]=4 547 B15R2.888 O=c1oc2ccccc2cc1OCF 92bfc273c837f53341d649f5183f23e5 [0,2,0,0,0,0|2,0,0]=4 548 B13R2.292 O=CNc1cccc2c1cco2 c68f5cb8bf677e3fa82c8ccd8995468f [0,0,1,1,0,0|1,0,0]=3 549 B13R2.292 O=CNc1cccc2c1ccs2 5e5c42e551ac5de7820a63a514e1969f [0,0,1,1,0,0|1,1,0]=4 550 B13R2.292 O=CNc1cccc2c1cno2 0c8d4b93db10037bb887304d1b6089b7 [0,0,1,1,0,0|2,0,0]=4 551 B13R2.292 O=CNc1cccc2c1nco2 2b3fa2395effdc8cc5afb2b348493aab [0,0,1,1,0,0|2,0,0]=4 552 B13R2.292 O=CNc1ccnc2c1CCO2 c2f90541c273502de6ceddeb54b54c30 [0,0,1,1,0,0|0,0,2]=4 553 B13R2.292 O=CNc1ccnc2c1occ2 12a38561f38ba4b01a4526ddf345d9b0 [0,0,1,1,0,0|2,0,0]=4 554 B13R2.292 O=CNc1ccnc2c1scc2 53123709cde534fc8303689bf47fa53a [0,0,1,1,0,0|2,0,0]=4 555 B13R2.292 O=CNc1ccnc2n1ccn2 b0b378b543a84d2dde5f635d3cac4b16 [0,0,1,1,0,0|2,0,0]=4 556 B13R2.292 O=CNc1ccnn2c1ccc2 2122233c4875efff80512e7558d2d834 [0,0,1,1,0,0|2,0,0]=4 557 B13R2.292 O=CNc1nccc2c1cco2 54b5ac575debcd30fc58ae87d68282db [0,0,1,1,0,0|2,0,0]=4 558 B13R2.292 O=CNc1ncnc2c1ccs2 d1da3b91281d7e1aa10cd62cc1b3ba04 [0,0,1,1,0,0|1,1,0]=4 559 B11R1.35 C=C(Br)C(=O)Nc1cccs1 1b9fa33ea7d6b44373c87f86c3092a1e [0,0,1,0,1,0|2,0,0]=4 560 B11R1.35 C=C(Br)C(=O)Nc1ccno1 4a8b0b082862551731afd7cf25aacadb [0,0,1,0,1,0|2,0,0]=4 561 B11R1.35 C=C(Br)C(=O)Nc1ccns1 3943a696e46d2a6cb52555d2fb57eeaf [0,0,1,0,1,0|2,0,0]=4 562 B11R1.35 C=C(Br)C(=O)Nc1cnoc1 f0224b56bc43f911be34952e92a88127 [0,0,1,0,1,0|2,0,0]=4 563 B11R1.35 C=C(Br)C(=O)Nc1cnsc1 ebe7701c2ae978ce22977c60ed08e315 [0,0,1,0,1,0|2,0,0]=4 564 B11R1.35 C=C(C)C(=O)Nc1cccs1 1760e0a66affe8fd5b39b43d74c60a5e [0,0,1,0,1,0|2,0,0]=4 565 B11R1.35 C=C(C)C(=O)Nc1ccno1 7f4022655a993ebd2236198423a264a0 [0,0,1,0,1,0|2,0,0]=4 566 B11R1.35 C=C(C)C(=O)Nc1ccns1 7beaeec594046c7286b2605b1c941d10 [0,0,1,0,1,0|2,0,0]=4 567 B11R1.35 C=C(C)C(=O)Nc1ccsc1 366abace05079239192443f504356505 [0,0,1,0,1,0|2,0,0]=4 568 B11R1.35 C=C(C)C(=O)Nc1cncs1 bf4252b6ef7145c280bded46597efabf [0,0,1,0,1,0|2,0,0]=4 569 B11R1.35 C=C(C)C(=O)Nc1cnoc1 b508c156337300b7797451b805bc8336 [0,0,1,0,1,0|2,0,0]=4 570 B11R1.35 C=C(C)C(=O)Nc1cnsc1 8b6549a4840ff17fd510a2115fb752be [0,0,1,0,1,0|2,0,0]=4 571 B11R1.35 C=C(Cl)C(=O)Nc1ccns1 667c650000085a6e0d91fa015b262543 [0,0,1,0,1,0|2,0,0]=4 572 B11R1.35 C=C(Cl)C(=O)Nc1cnoc1 cbdc2d36c7d1796369d6fd2f43dcbd4f [0,0,1,0,1,0|2,0,0]=4 573 B11R1.35 C=C(Cl)C(=O)Nc1cnsc1 d72b531c7719e0fae8d9eeb8766cb6b6 [0,0,1,0,1,0|2,0,0]=4 574 B11R1.35 C=C(F)C(=O)Nc1cccs1 2d2005d88bb5632df0c6ca85c1e786e1 [0,0,1,0,1,0|2,0,0]=4 575 B11R1.35 C=C(F)C(=O)Nc1ccno1 50f6a8d205b2c5018e9220532a8efb0a [0,0,1,0,1,0|2,0,0]=4 576 B11R1.35 C=C(F)C(=O)Nc1ccns1 a5160a01a85e36530e0e063a7b4abbcc [0,0,1,0,1,0|2,0,0]=4 577 B11R1.35 C=C(F)C(=O)Nc1ccsc1 ed13415964f84bdc985e16afedc081cf [0,0,1,0,1,0|2,0,0]=4 578 B11R1.35 C=C(F)C(=O)Nc1cncs1 98ff6fc01c90b3a2155b3912c4bf48bf [0,0,1,0,1,0|2,0,0]=4 579 B11R1.35 C=C(F)C(=O)Nc1cnoc1 ca57ab4383c67de3b904d7e0b1d94d0b [0,0,1,0,1,0|2,0,0]=4 580 B11R1.35 C=C(F)C(=O)Nc1cnsc1 5415cb1128682a054c66e9c12c289b62 [0,0,1,0,1,0|2,0,0]=4 581 B13R1.348 C/C(=C/C(=O)Nc1ccncc1)/Cl 6b6756a46f192d663aafe90d035e9b02 [0,0,1,0,0,1|1,0,1]=4 582 B13R1.348 C/C(=C/C(=O)Nc1ccncc1)/I a17862cbd1ed4aa5a675cf2c8a1911fe [0,0,1,0,0,1|1,0,1]=4 583 B13R1.348 C/C(=C\C(=O)Nc1ccncc1)/Cl d9c87fb3a7bc9ba2ce653a213c8670db [0,0,1,0,0,1|1,0,1]=4 584 B13R1.348 C=C(C)CC(=O)Nc1ccncc1 583d70b1367045c0f79f31171613f561 [0,0,1,0,0,1|1,0,0]=3 585 B13R1.348 C=C(C)CC(=O)Nc1ccncn1 2967abc85c4e1caafa8cd31b7188d94a [0,0,1,0,0,1|2,0,0]=4 586 B13R1.348 CC(=CC(=O)Nc1ccncc1)C 96978c0802e5f4b278ceea9dde97b562 [0,0,1,0,0,1|1,0,1]=4 587 B13R1.348 CC(=CC(=O)Nc1ccncc1)I 182ec60ecad09e3c208bad3b05f81f11 [0,0,1,0,0,1|1,0,1]=4 588 B13R1.348 NC(=O)CC(=O)Nc1cccnc1 a0eb2502a84c8704f76276ae2bca8bb1 [0,0,1,0,0,1|1,0,1]=4 589 B13R1.348 O=C(C=C(Br)Br)Nc1ccncc1 89660cf3654472acb5330eff071c8a20 [0,0,1,0,0,1|2,0,0]=4 590 B13R1.348 O=C(C=C(Cl)Cl)Nc1ccncc1 3a4a69720dfd826bd5dc201937b5f721 [0,0,1,0,0,1|2,0,0]=4 591 B13R1.351 C=C(Br)C(=O)NCc1ccccc1 362958306f8cd6df45a1ee1c05f0eb6d [0,0,1,0,0,1|2,0,0]=4 592 B13R1.351 C=C(Br)C(=O)NCc1ccncc1 ab876f68958de86a5dc58118c8c46c02 [0,0,1,0,0,1|1,0,0]=3 593 B13R1.351 C=C(Br)C(=O)NCc1ccncn1 afd801bc00bf45e37afc19c3128a0ea6 [0,0,1,0,0,1|2,0,0]=4 594 B13R1.351 C=C(Br)C(=O)NCc1ccnnc1 ed517c4c8783a760a8a37decabb2effd [0,0,1,0,0,1|2,0,0]=4 595 B13R1.351 C=C(C)C(=O)NCc1ccccc1 b8731b63880bf5bfc0bcc9801eda0e33 [0,0,1,0,0,1|2,0,0]=4 596 B13R1.351 C=C(C)C(=O)NCc1ccncc1 7e421b255b3a476301cb352da65fb4e8 [0,0,1,0,0,1|1,0,0]=3 597 B13R1.351 C=C(C)C(=O)NCc1ccncn1 6972ffcd33024721e1d7437ef593f132 [0,0,1,0,0,1|2,0,0]=4 598 B13R1.351 C=C(C)C(=O)NCc1ccnnc1 6b0c5d35aa916890c570368ec7fa8f9e [0,0,1,0,0,1|2,0,0]=4 599 B13R1.351 C=C(CNc1ccncc1)C(=O)O 568ceccaf32d035a7ceac5f7bd29b9fc [0,0,1,0,0,1|2,0,0]=4 600 B13R1.351 C=C(Cl)C(=O)NCc1ccccc1 e27b26ae8f47b7b3a12892b36feed08a [0,0,1,0,0,1|2,0,0]=4 601 B13R1.351 C=C(Cl)C(=O)NCc1ccncc1 2e969facf875f2fdd8cb9d6e8b6e304d [0,0,1,0,0,1|1,0,0]=3 602 B13R1.351 C=C(Cl)C(=O)NCc1ccncn1 2ffe76b7fd41774d4f426b83ead1cbfb [0,0,1,0,0,1|2,0,0]=4 603 B13R1.351 C=C(Cl)C(=O)NCc1ccnnc1 86ed472ebdc559eeac4d5f5b0fc105ce [0,0,1,0,0,1|2,0,0]=4 604 B13R1.351 C=C(F)C(=O)NCc1ccccc1 fa9d26934338a9ac877733735088c907 [0,0,1,0,0,1|2,0,0]=4 605 B13R1.351 C=C(F)C(=O)NCc1ccncc1 ad77e15af97f17a45ef735d9e08e4d73 [0,0,1,0,0,1|1,0,0]=3 606 B13R1.351 C=C(F)C(=O)NCc1ccncn1 5fcc47b442a79a73803aa18d205c86ba [0,0,1,0,0,1|2,0,0]=4 607 B13R1.351 C=C(F)C(=O)NCc1ccnnc1 08b2a5dc291c796ddd78029ee4f6ff5f [0,0,1,0,0,1|2,0,0]=4 608 B13R1.351 CC(=O)C(=O)CNc1ccncc1 7518f3bbccfde80670f1b069cec88dcb [0,0,1,0,0,1|0,0,2]=4 609 B13R1.351 CC(=O)C(=O)NCc1ccncc1 65cfd575801d865ed0879db5ab872d3f [0,0,1,0,0,1|0,0,2]=4 610 B13R1.351 CC(O)C(=O)NCc1ccncc1 8afc2ae412004ec865559879a117699c [0,0,1,0,0,1|0,0,2]=4 611 B13R1.351 C[C@@H](O)C(=O)NCc1ccncc1 1e2a4110afd885762829502fdbe89109 [0,0,1,0,0,1|0,0,2]=4 612 B13R1.351 C[C@H](O)C(=O)NCc1ccncc1 219617f570e0a2eaabb342bdfae28e64 [0,0,1,0,0,1|0,0,2]=4 613 B13R1.351 NC(=O)C(=O)NCc1cccnc1 31b1edd6b9fa6eec30d233c2a30d42f3 [0,0,1,0,0,1|0,0,2]=4 614 B13R1.351 NC(=O)C(=O)NCc1ccncc1 4b75b5276b108a9b60b2dbbc25bc1db5 [0,0,1,0,0,1|1,0,1]=4 615 B13R1.351 O=C(NCc1ccncc1)C(O)O af4ae90f6c398f5a59ab2f22f59b70e2 [0,0,1,0,0,1|1,0,1]=4 616 B13R1.351 O=C(O)C(=O)CNc1ccccc1 307d1c795e5d7ce2b611e1a0dc85c4e3 [0,0,1,0,0,1|2,0,0]=4 617 B13R1.351 O=C(O)C(=O)CNc1ccncc1 317adb8476eb5c87dcb29beb0602a588 [0,0,1,0,0,1|1,0,0]=3 618 B13R1.351 O=C(O)C(=O)CNc1ccncn1 041fa6a0eacaabbe1f49587804fd5156 [0,0,1,0,0,1|2,0,0]=4 619 B13R1.351 O=C(O)C(=O)CNc1ccnnc1 0b8a29d42b5303dc800ddf86f8350de4 [0,0,1,0,0,1|2,0,0]=4 620 B13R1.351 O=C(O)C(=O)COc1ccncc1 bf258993d15018866e425fad65d6f14c [0,0,1,0,0,1|2,0,0]=4 621 B13R1.528 C=CC(=O)NCc1ccncc1Br 8c08193c71cc08b6a2d5caa79bc06144 [0,0,1,0,0,1|2,0,0]=4 622 B13R1.528 C=CC(=O)NCc1ccncc1C d169817b3108d5fda197c2c9bd92215d [0,0,1,0,0,1|1,0,1]=4 623 B13R1.528 C=CC(=O)NCc1ccncc1Cl be95d7e7480218b0c17dbe762761cf97 [0,0,1,0,0,1|2,0,0]=4 624 B13R1.528 C=CC(=O)NCc1ccncc1F 50e1ae83c4ae49369fef298b6bce7225 [0,0,1,0,0,1|2,0,0]=4 625 B13R1.528 C=CC(=O)NCc1ccncc1O 473fa136df2362546501615348ff0285 [0,0,1,0,0,1|2,0,0]=4 626 B13R1.528 Cc1cnccc1CNC(=O)C=O 14e01b5eea4309d1296189e27680ac0a [0,0,1,0,0,1|0,0,2]=4 627 B13R1.528 Cc1cnccc1CNC(=O)CO 95c590fbddf04d1fd115d3257e9b7386 [0,0,1,0,0,1|0,0,2]=4 628 B13R1.528 Cc1cnccc1NCC(=O)CO 6c2bc310fd775ab6027838708b8a2d98 [0,0,1,0,0,1|0,0,2]=4 629 B13R1.528 O=C(CNc1ccncc1F)NO f68dcbed5f386a4edcd4f822569cc1c7 [0,0,1,0,0,1|2,0,0]=4 630 B13R1.528 O=C(CO)CNc1ccncc1Br ca98395d90949e74a2000c5e31793b4c [0,0,1,0,0,1|1,0,1]=4 631 B13R1.528 O=C(CO)CNc1ccncc1Cl 050db4384a933fb5a8757e568632daaa [0,0,1,0,0,1|1,0,1]=4 632 B13R1.528 O=C(CO)CNc1ccncc1F f38d2eb0805282fdf60e891ae7c80ad8 [0,0,1,0,0,1|1,0,1]=4 633 B13R1.528 O=C(CO)CNc1ccncc1I 65a2b74bdc80f1c8044ed572abfba527 [0,0,1,0,0,1|1,0,1]=4 634 B13R1.528 O=C(CO)NCc1ccncc1Br 4ff39359647533793f8d32d3cbe4f55e [0,0,1,0,0,1|1,0,1]=4 635 B13R1.528 O=C(CO)NCc1ccncc1Cl 7ac1be4f1c5cd2889aa61459d30347e5 [0,0,1,0,0,1|1,0,1]=4 636 B13R1.528 O=C(CO)NCc1ccncc1F e4d2c6d5591ebd91dd6031892485d5a5 [0,0,1,0,0,1|1,0,1]=4 637 B13R1.528 O=C(CO)NCc1ccncc1O 78ca414a28cb359f54ea0a1cbdddf10e [0,0,1,0,0,1|1,0,1]=4 638 B13R1.528 O=CC(=O)NCc1ccncc1Br f1adef988bcb17bbe50d2ca488f96b59 [0,0,1,0,0,1|1,0,1]=4 639 B13R1.528 O=CC(=O)NCc1ccncc1Cl 577bde66b86d41d02d522aa1184f4fc1 [0,0,1,0,0,1|1,0,1]=4 640 B13R1.528 O=CC(=O)NCc1ccncc1F a7e23971adf0760916c3cd9a7acc593a [0,0,1,0,0,1|1,0,1]=4 641 B13R1.528 O=CC(=O)NCc1ccncc1O a5ae65b78f2d779fbc8c2611069872f8 [0,0,1,0,0,1|1,0,1]=4