0 B14R1.60 C#CCC(=O)N(C)Cc1ccccc1 ef09a1d96b4a97435e5d2ae1018cb214 [0,0,0,0,0,0|3,0,0]=3 1 B14R1.60 C#CCC(=O)N(C)Cc1ccccn1 f6e96888ba3d4916b9acf3e2bf914fd9 [0,0,0,0,0,0|4,0,0]=4 2 B14R1.60 C#CCC(=O)N(C)Cc1cccnc1 55dbe3ec1a87d0ce3882e082bf81c3a2 [0,0,0,0,0,0|4,0,0]=4 3 B14R1.60 C#CCC(=O)N(C)Cc1ccncc1 9ae95e7f52c9cbcdf4abef930c3b8eec [0,0,0,0,0,0|4,0,0]=4 4 B14R1.60 C#CCN(C)C(=O)Cc1ccccn1 0c0a3faa2c2d310187d3554166ef7b2b [0,0,0,0,0,0|2,0,1]=3 5 B14R1.60 C#CCN(C)C(=O)Cc1cccnc1 a07ee15c7ba24a1d090c4e97b3a599c3 [0,0,0,0,0,0|2,0,1]=3 6 B14R1.60 C#CCN(C)C(=O)Cc1ccncc1 d4819a7cf4941820f48fec0f069434ec [0,0,0,0,0,0|2,0,1]=3 7 B14R1.60 C#CCN(C)C(=O)Cc1ccncn1 587cad34c2d511ff5a3c86c94909b4b3 [0,0,0,0,0,0|3,0,1]=4 8 B14R1.60 C#CCN(C)C(=O)Cc1cnccn1 f27cc9ac93fc98649b5b1d45d396a983 [0,0,0,0,0,0|3,0,1]=4 9 B14R1.60 C#CCN(C)C(=O)Cc1cncnc1 7669abddb2603024b634bc1e2199bb04 [0,0,0,0,0,0|3,0,1]=4 10 B14R1.60 C#CCN(C)C(=O)Cc1ncccn1 4b222cfd7acb25bce1cdcd5871749e97 [0,0,0,0,0,0|3,0,1]=4 11 B14R1.60 C#CCN(C)C(=O)Nc1ccccc1 131b5116d0f13e870c96253ff6699a75 [0,0,0,0,0,0|2,0,1]=3 12 B14R1.60 C#CCN(C)C(=O)Nc1ccccn1 10629772f06100c7d996e61137b0cfbd [0,0,0,0,0,0|3,0,1]=4 13 B14R1.60 C#CCN(C)C(=O)Nc1cccnc1 d73e3d5c2b70519b980bea4af9b5e459 [0,0,0,0,0,0|3,0,1]=4 14 B14R1.60 C#CCN(C)C(=O)Nc1ccncc1 273b10c5e28c0545446bd0321edcbb50 [0,0,0,0,0,0|3,0,1]=4 15 B14R1.60 C#CCN(C)C(=S)Nc1ccccc1 57716b7d80c6fba6146544ed51a5363e [0,0,0,0,0,0|2,0,1]=3 16 B14R1.60 C#CCN(C)C(=S)Nc1ccccn1 f6cc71132b6a278e84c06af796f9a8e3 [0,0,0,0,0,0|3,0,1]=4 17 B14R1.60 C#CCN(C)C(=S)Nc1cccnc1 25ea6adf5b421198fc4fb88a2f4f134e [0,0,0,0,0,0|3,0,1]=4 18 B14R1.60 C#CCN(C)C(=S)Nc1ccncc1 d34fea4bda808d7427c3d022293ecd4a [0,0,0,0,0,0|3,0,1]=4 19 B14R1.60 C#CCN(C)C(C)Cc1ccccn1 d4c8d57ad0eb3e24574cdb472dc22cb5 [0,0,0,0,0,0|1,0,0]=1 20 B14R1.60 C#CCN(C)C(C)Cc1cccnc1 f2c33a48071a03e90bd41517608919ad [0,0,0,0,0,0|1,0,0]=1 21 B14R1.60 C#CCN(C)C(C)Cc1cnccn1 fd9ab06b7578275a07dced0ff12ac20b [0,0,0,0,0,0|2,0,0]=2 22 B14R1.60 C=CCN(C)C(C)Cc1ccccc1 6d5f364a4c0592010ddc36c0a4847d7e [0,0,0,0,0,0|0,0,2]=2 23 B14R1.60 C=CCN(C)C(C)Cc1ccccn1 b026c1b9e1a8d1ecb320ac8ae8dcab88 [0,0,0,0,0,0|1,0,2]=3 24 B14R1.60 C=CCN(C)C(C)Cc1cccnc1 fe8e1fea36e689ef1cf5bb942604bff3 [0,0,0,0,0,0|1,0,2]=3 25 B14R1.60 C=CCN(C)C(C)Cc1cnccn1 73bdeb9ba9b70b185f54c228bfbe1b5e [0,0,0,0,0,0|2,0,2]=4 26 B14R1.60 CC(CC#N)N(C)Cc1ccccc1 b56192f8fb935ea0987988846b0b9ac3 [0,0,0,0,0,0|3,0,0]=3 27 B14R1.60 CC(CC#N)N(C)Cc1ccccn1 0c24c63ab6e186bd681f3112d4161bb5 [0,0,0,0,0,0|4,0,0]=4 28 B14R1.60 CC(CC#N)N(C)Cc1cccnc1 5182f4dcf03a895139bd4b75b5aff21c [0,0,0,0,0,0|4,0,0]=4 29 B14R1.60 CC(CC#N)N(C)Cc1ccncc1 489065490e22dc64c1e8f58540bf4451 [0,0,0,0,0,0|4,0,0]=4 30 B14R1.60 CC(CCO)N(C)Cc1ccccc1 c8e84933cb4d51429e188c87a1ee58ce [0,0,0,0,0,0|3,0,1]=4 31 B14R1.60 CC(Cc1ccccn1)N(C)CC#N 88ef2f459e9552c42fa26122de611988 [0,0,0,0,0,0|2,0,0]=2 32 B14R1.60 CC(Cc1ccccn1)N(C)CC=O 56f561a3aee17dbc9dffe89d5c777bb9 [0,0,0,0,0,0|2,0,1]=3 33 B14R1.60 CC(Cc1ccccn1)N(C)CCF 27f95c5f812f81ca7f1ecdcd0387bcf5 [0,0,0,0,0,0|2,0,1]=3 34 B14R1.60 CC(Cc1ccccn1)N(C)CCO 2896b768a3d5615320630832a2650e3f [0,0,0,0,0,0|2,0,1]=3 35 B14R1.60 CC(Cc1ccccn1)N(C)CCS 75ac01d95ef6eb98a072776ca5017435 [0,0,0,0,0,0|2,0,1]=3 36 B14R1.60 CC(Cc1cccnc1)N(C)CC#N 27980195f65e8f5bf1f322cfcf0c4b41 [0,0,0,0,0,0|2,0,0]=2 37 B14R1.60 CC(Cc1cccnc1)N(C)CC=O 6a22f7a113df87f4cdbc99585c3b7176 [0,0,0,0,0,0|2,0,1]=3 38 B14R1.60 CC(Cc1cccnc1)N(C)CCF 532b431a86bbaf55e11bd9f571df08fe [0,0,0,0,0,0|2,0,1]=3 39 B14R1.60 CC(Cc1cccnc1)N(C)CCO f6771b48bdd04667ca7bc8500c4e7e84 [0,0,0,0,0,0|2,0,1]=3 40 B14R1.60 CC(Cc1cccnc1)N(C)CCS c5a3f591766443b2a1eead13b36e14c5 [0,0,0,0,0,0|2,0,1]=3 41 B14R1.60 CC(Cc1cnccn1)N(C)CC#N da2fec768c129b47e7491be64b298ada [0,0,0,0,0,0|3,0,0]=3 42 B14R1.60 CC(Cc1cnccn1)N(C)CC=O d6de5fc7eb8581f04e58c5d8d70975ee [0,0,0,0,0,0|3,0,1]=4 43 B14R1.60 CC(Cc1cnccn1)N(C)CCF 708675c492ebc666c6a70917021c3db6 [0,0,0,0,0,0|3,0,1]=4 44 B14R1.60 CC(Cc1cnccn1)N(C)CCO 7713a4a3789400d66411e4f7f1290f6d [0,0,0,0,0,0|3,0,1]=4 45 B14R1.60 CC(Cc1cnccn1)N(C)CCS 1431d9a1d02e13f2ba4f8ee1237f9f72 [0,0,0,0,0,0|3,0,1]=4 46 B14R1.60 CCCC(C)N(C)Cc1ccccc1 64b55cac22241bcc0b4498e89ffd34f1 [0,0,0,0,0,0|2,0,2]=4 47 B14R1.60 CCCN(C)C(C)Cc1ccccn1 2580e36a089b970508636493fe17b809 [0,0,0,0,0,0|1,0,2]=3 48 B14R1.60 CCCN(C)C(C)Cc1cccnc1 c8985805f45328af67f7a482d4c89619 [0,0,0,0,0,0|1,0,2]=3 49 B14R1.60 CCCN(C)C(C)Cc1cnccn1 ef701e2b24661b6fc8a25d7fdd0b0619 [0,0,0,0,0,0|2,0,2]=4 50 B14R1.60 CN(CC#N)C(=O)Cc1ccccn1 7684c004fde2dec15dd2aadb7d61cc68 [0,0,0,0,0,0|3,0,1]=4 51 B14R1.60 CN(CC#N)C(=O)Cc1cccnc1 45ac9cd7d886c6270ce588b98f01f0d2 [0,0,0,0,0,0|3,0,1]=4 52 B14R1.60 CN(CC#N)C(=O)Cc1ccncc1 877937794b3d7cdf046a716d14ca395c [0,0,0,0,0,0|3,0,1]=4 53 B14R1.60 CN(CC#N)C(=O)Nc1ccccc1 2e395d679bf3ef265b06fd81d5919b98 [0,0,0,0,0,0|3,0,1]=4 54 B14R1.60 CN(CC#N)C(=S)Nc1ccccc1 9e982d82ed6c92279f21950f97e77e66 [0,0,0,0,0,0|3,0,1]=4 55 B14R1.60 CN(Cc1ccccc1)C(=O)CC#N b645064408c52919c6f929c74a3cd07e [0,0,0,0,0,0|4,0,0]=4 56 B14R1.60 COCC(C)N(C)Cc1ccccc1 13d1be6539c1b53acf21210cc75358a7 [0,0,0,0,0,0|3,0,1]=4 57 B14R1.60 COCN(C)C(C)Cc1ccccn1 806af0f561d895b3e8b2c86cb82923fd [0,0,0,0,0,0|2,0,1]=3 58 B14R1.60 COCN(C)C(C)Cc1cccnc1 c6cfc6fa9a77921f321b255adbc0d44b [0,0,0,0,0,0|2,0,1]=3 59 B14R1.60 COCN(C)C(C)Cc1cnccn1 1b450dd9c2aebf258352b8e6f550a96c [0,0,0,0,0,0|3,0,1]=4 60 B14R1.60 CSCN(C)C(C)Cc1ccccn1 45e124d48426d09e6f6abedd2bf36910 [0,0,0,0,0,0|2,0,1]=3 61 B14R1.60 CSCN(C)C(C)Cc1cccnc1 8c7b4672b9121012957a2a52a940e27c [0,0,0,0,0,0|2,0,1]=3 62 B14R1.60 CSCN(C)C(C)Cc1cnccn1 35aa5bb50d83b007ae86564dea52ca98 [0,0,0,0,0,0|3,0,1]=4 63 B14R1.60 C[C@@H](CCO)N(C)Cc1ccccc1 d1e1e45e35e1cd2754788c8badbb9d9d [0,0,0,0,0,0|3,0,1]=4 64 B13R1.42 C#CCC(=O)NCc1ccccc1 d236f4ac27abfdae2e206aa52fd216ae [1,0,0,0,0,0|3,0,0]=4 65 B13R1.42 C#CCC(C)OCc1ccccc1 87e1f5be78cc6b5f9357a2c4c8e68c1c [1,0,0,0,0,0|2,0,0]=3 66 B13R1.42 C#CCC(C)OCc1ccccn1 a406730106335daff1d0a24c4caa5ebb [1,0,0,0,0,0|3,0,0]=4 67 B13R1.42 C#CCC(C)OCc1cccnc1 020e72210008f881641d31349ec9184f [1,0,0,0,0,0|3,0,0]=4 68 B13R1.42 C#CCN(C)CCc1ccccc1 eee59183f04633b9feade53e582fa207 [1,0,0,0,0,0|0,0,0]=1 69 B13R1.42 C#CCN(C)CCc1ccccn1 f58d16434669f0725a662f7579200ca4 [1,0,0,0,0,0|1,0,0]=2 70 B13R1.42 C#CCN(C)CCc1cccnc1 08eb9abcdebc59678e3f78e438860dee [1,0,0,0,0,0|1,0,0]=2 71 B13R1.42 C#CCN(C)CCc1ccncc1 1b88df7a7cf395d9ea098714ecaece79 [1,0,0,0,0,0|1,0,0]=2 72 B13R1.42 C=CCN(C)CCc1ccccc1 e3a976f7e1831649e9d77b225b1ffc7b [1,0,0,0,0,0|0,0,2]=3 73 B13R1.42 C=CCN(C)CCc1ccccn1 acac44dfb824206a4fdc6fa5cefc49ef [1,0,0,0,0,0|1,0,2]=4 74 B13R1.42 C=CCN(C)CCc1cccnc1 cdf829cd26068d822ce4e8d3f492374f [1,0,0,0,0,0|1,0,2]=4 75 B13R1.42 C=CCN(C)CCc1ccncc1 400edd4b1bb865cbbfa62f2f8ddfab6e [1,0,0,0,0,0|1,0,2]=4 76 B13R1.42 C=CCN(C)CSc1ccccc1 610cccc011824b045829b3860dd96ef4 [1,0,0,0,0,0|1,0,2]=4 77 B13R1.42 CC(CC#N)NCc1ccccc1 8fc7a6046c4b75e3b9dcff3dc71b417a [1,0,0,0,0,0|3,0,0]=4 78 B13R1.42 CC(CC#N)OCc1ccccc1 f7e39773b16a04fd938abd3ccc58366f [1,0,0,0,0,0|3,0,0]=4 79 B13R1.42 CC(CCc1ccccc1)NC#N 4fd42473f135ef90c8c043d8407dd69d [1,0,0,0,0,0|3,0,0]=4 80 B13R1.42 CCCN(C)CCc1ccccc1 a41beb51cc343624f1c890785f4bdd38 [1,0,0,0,0,0|0,0,2]=3 81 B13R1.42 CCCN(C)CCc1ccccn1 9d41cae91559775116f2c67bba968325 [1,0,0,0,0,0|1,0,2]=4 82 B13R1.42 CCCN(C)CCc1cccnc1 96a3682f00487bb288ecb76c14cca66f [1,0,0,0,0,0|1,0,2]=4 83 B13R1.42 CCCN(C)CCc1ccncc1 88ff6e856f3cadb879b79cc36f17ad55 [1,0,0,0,0,0|1,0,2]=4 84 B13R1.42 CN(CC#N)CCc1ccccc1 fd5f8532536f4fe062678e26044496c1 [1,0,0,0,0,0|1,0,0]=2 85 B13R1.42 CN(CC#N)CCc1ccccn1 19073cb97aec933df98b4ae7cce792b3 [1,0,0,0,0,0|2,0,0]=3 86 B13R1.42 CN(CC#N)CCc1cccnc1 d8be3b7a00154efbe4aa285efca9dfc9 [1,0,0,0,0,0|2,0,0]=3 87 B13R1.42 CN(CC#N)CCc1ccncc1 5365cdc4624360947c44288f65e4621f [1,0,0,0,0,0|2,0,0]=3 88 B13R1.42 CN(CC=O)CCc1ccccc1 41bbf4a6bcb8e065d52edf61eb677740 [1,0,0,0,0,0|1,0,1]=3 89 B13R1.42 CN(CC=O)CCc1ccccn1 b40eb0039034d399f721afb2ead598b2 [1,0,0,0,0,0|2,0,1]=4 90 B13R1.42 CN(CC=O)CCc1cccnc1 a759df71d9b4cc18dca7b2363094742c [1,0,0,0,0,0|2,0,1]=4 91 B13R1.42 CN(CC=O)CCc1ccncc1 943e2e04129af93894853dac799ec9fd [1,0,0,0,0,0|2,0,1]=4 92 B13R1.42 CN(CCF)CCc1ccccc1 1781394fa8b0991b0b61fe822c9dd8d3 [1,0,0,0,0,0|1,0,1]=3 93 B13R1.42 CN(CCF)CCc1ccccn1 ce0c1551ccb1a752e9301d7dfe2f0eb7 [1,0,0,0,0,0|2,0,1]=4 94 B13R1.42 CN(CCF)CCc1cccnc1 e551c941ef62e4bb57a32f2bb5bb5814 [1,0,0,0,0,0|2,0,1]=4 95 B13R1.42 CN(CCF)CCc1ccncc1 69658119577c09aee0ef5bcc414f5a87 [1,0,0,0,0,0|2,0,1]=4 96 B13R1.42 CN(CCO)CCc1ccccc1 4c669cc510b57787c8bc9fcbecf75376 [1,0,0,0,0,0|1,0,1]=3 97 B13R1.42 CN(CCO)CCc1ccccn1 151354c1cac05e71f825dfc42a6dd998 [1,0,0,0,0,0|2,0,1]=4 98 B13R1.42 CN(CCO)CCc1cccnc1 0d0d5bbae9e923fcd28bc0946c8a9260 [1,0,0,0,0,0|2,0,1]=4 99 B13R1.42 CN(CCO)CCc1ccncc1 20f566599d36546e7b25000efa420215 [1,0,0,0,0,0|2,0,1]=4 100 B13R1.42 CN(CCS)CCc1ccccc1 d45b47e6351da8dae4096dc30623fdf0 [1,0,0,0,0,0|1,0,1]=3 101 B13R1.42 CN(CCS)CCc1ccccn1 5044cea88d6b8c3a06913f25295d2093 [1,0,0,0,0,0|2,0,1]=4 102 B13R1.42 CN(CCS)CCc1cccnc1 41837343e9939003790382e0af23088c [1,0,0,0,0,0|2,0,1]=4 103 B13R1.42 CN(CCS)CCc1ccncc1 3bc75dff825e0878aea51111ddf7b592 [1,0,0,0,0,0|2,0,1]=4 104 B13R1.42 COCN(C)CCc1ccccc1 e7d3165b0b61bc462d79ae1576fa1ba9 [1,0,0,0,0,0|1,0,1]=3 105 B13R1.42 COCN(C)CCc1ccccn1 33b281c25bc5b136c758322ee97fa4aa [1,0,0,0,0,0|2,0,1]=4 106 B13R1.42 COCN(C)CCc1cccnc1 705f32602fc6ff6e7ed48bb8c14a71f7 [1,0,0,0,0,0|2,0,1]=4 107 B13R1.42 COCN(C)CCc1ccncc1 a1d8cd2571d681345b46a3901e0fc33b [1,0,0,0,0,0|2,0,1]=4 108 B13R1.42 CSCN(C)CCc1ccccc1 9944bfe9badd870ea5b4a03d98255fd2 [1,0,0,0,0,0|1,0,1]=3 109 B13R1.42 CSCN(C)CCc1ccccn1 8344131679c9e98e493f585533fa826d [1,0,0,0,0,0|2,0,1]=4 110 B13R1.42 CSCN(C)CCc1cccnc1 b0f9a262f27a1cc2cff0cead67cf0589 [1,0,0,0,0,0|2,0,1]=4 111 B13R1.42 CSCN(C)CCc1ccncc1 998aa740ee950b78446d7e1da29fb945 [1,0,0,0,0,0|2,0,1]=4 112 B13R1.42 C[C@@H](CC#N)OCc1ccccc1 be24e4f36e686ae691993f20b2046013 [1,0,0,0,0,0|3,0,0]=4 113 B13R1.42 C[C@H](CC#N)OCc1ccccc1 862b4d2a5dd7e9fd25f039263754f779 [1,0,0,0,0,0|3,0,0]=4 114 B13R1.44 C#CCCN(C)Cc1ccccc1 d94e07beabeb3addf4e1f9564bcfae7b [1,0,0,0,0,0|2,0,0]=3 115 B13R1.44 C#CCCN(C)Cc1ccccn1 bb849a8b56eca3f42cb6cfed9c8a4f6e [1,0,0,0,0,0|3,0,0]=4 116 B13R1.44 C#CCCN(C)Cc1cccnc1 4e875ef1cbc42ea00c7e30ef6933f75b [1,0,0,0,0,0|3,0,0]=4 117 B13R1.44 C#CCCN(C)Cc1ccncc1 df1830f5e035587ed535e938939de8b5 [1,0,0,0,0,0|3,0,0]=4 118 B13R1.44 C#CCNC(=O)Cc1ccccn1 c08c7070a31efb544f28e2cf2e1d83b2 [1,0,0,0,0,0|2,0,1]=4 119 B13R1.44 C#CCNC(=O)Cc1cccnc1 52821d1a059b1586c67f26486d5a49f8 [1,0,0,0,0,0|2,0,1]=4 120 B13R1.44 C#CCNC(=O)Cc1ccncc1 3415e6d3396725fcfdfd8d62ce1f8dab [1,0,0,0,0,0|2,0,1]=4 121 B13R1.44 C#CCNC(=S)Nc1ccccc1 26339542648d19e35f125495b7dc2106 [1,0,0,0,0,0|2,0,1]=4 122 B13R1.44 C#CCNC(C)Cc1ccccn1 9a3f7b9011e35483503e7398f429c39d [1,0,0,0,0,0|1,0,0]=2 123 B13R1.44 C#CCNC(C)Cc1cccnc1 ea0bb3710f90a836e88ad94e93346627 [1,0,0,0,0,0|1,0,0]=2 124 B13R1.44 C#CCNC(C)Cc1ccncc1 33269ccc3b2a970d629d561bbdde1044 [1,0,0,0,0,0|1,0,0]=2 125 B13R1.44 C#CCNC(C)Cc1cnccn1 7136a34e9a5d6e51fded31c129dce278 [1,0,0,0,0,0|2,0,0]=3 126 B13R1.44 C#CCOC(C)Cc1ccccc1 bb04191db13c6a3b0b5d248fa7ca05f7 [1,0,0,0,0,0|1,0,0]=2 127 B13R1.44 C#CCOC(C)Cc1ccccn1 6e73427ad7449d1eefda67cb2ae6b079 [1,0,0,0,0,0|2,0,0]=3 128 B13R1.44 C#CCOC(C)Cc1cnccn1 4a645378aab2a1b8a68ce4dbe3f816d8 [1,0,0,0,0,0|3,0,0]=4 129 B13R1.44 C#CCO[C@@H](C)Cc1ccccc1 30f021bd79edd5dc5aa3f42523a3a320 [1,0,0,0,0,0|1,0,0]=2 130 B13R1.44 C#CCO[C@H](C)Cc1ccccc1 79425d7d0bc1b7627c8ec7c320d37fa0 [1,0,0,0,0,0|1,0,0]=2 131 B13R1.44 C=CCNC(C)Cc1ccccn1 29157b676bab3bfbd1de0c67396e0241 [1,0,0,0,0,0|1,0,2]=4 132 B13R1.44 C=CCNC(C)Cc1cccnc1 8a38fb446554076aa67a82f5707f8f09 [1,0,0,0,0,0|1,0,2]=4 133 B13R1.44 C=CCNC(C)Cc1ccncc1 8b302c9e28326cabf5e401bc2019bdaa [1,0,0,0,0,0|1,0,2]=4 134 B13R1.44 C=CCOC(C)Cc1ccccc1 a9098dea91ada715f8cf428fa7a580a9 [1,0,0,0,0,0|1,0,2]=4 135 B13R1.44 C=CCO[C@@H](C)Cc1ccccc1 fb190cfd5c02df111bb2b90c847035c4 [1,0,0,0,0,0|1,0,2]=4 136 B13R1.44 C=CCO[C@H](C)Cc1ccccc1 d069b1420c77e4523afa1be804514d1f [1,0,0,0,0,0|1,0,2]=4 137 B13R1.44 CC(CCC#N)Nc1ccccc1 2f273fcfb174a08ee6e5c4c6b7e7afaa [1,0,0,0,0,0|3,0,0]=4 138 B13R1.44 CC(Cc1ccccc1)OCC#N 5b3b60c337da9ec34ff3f7dcadb0289b [1,0,0,0,0,0|2,0,0]=3 139 B13R1.44 CC(Cc1ccccc1)OCC=O a7eaac1b2aa21388bd39cab2a97d7f12 [1,0,0,0,0,0|2,0,1]=4 140 B13R1.44 CC(Cc1ccccc1)OCCF 40c0d1fb211b589ef3fa26aebde3a13f [1,0,0,0,0,0|2,0,1]=4 141 B13R1.44 CC(Cc1ccccc1)OCCS eee651bccc078c60c2c124960fd1edd5 [1,0,0,0,0,0|2,0,1]=4 142 B13R1.44 CC(Cc1ccccn1)NCC#N df3ffb58f9433ab0efcaebfb8cf1ba2d [1,0,0,0,0,0|2,0,0]=3 143 B13R1.44 CC(Cc1ccccn1)NCC=O c2daeb5d3ac0d2bc58fd015b06f23477 [1,0,0,0,0,0|2,0,1]=4 144 B13R1.44 CC(Cc1ccccn1)NCCF 527ade0f5304db944420a1847e79e654 [1,0,0,0,0,0|2,0,1]=4 145 B13R1.44 CC(Cc1ccccn1)NCCO ba264b17215bdb75982180f401b19fbd [1,0,0,0,0,0|2,0,1]=4 146 B13R1.44 CC(Cc1ccccn1)NCCS 5c574e494cfea2c911455fefb02e7cc9 [1,0,0,0,0,0|2,0,1]=4 147 B13R1.44 CC(Cc1ccccn1)OCC#N 0463b9a60d718234986f6b6be5b66915 [1,0,0,0,0,0|3,0,0]=4 148 B13R1.44 CC(Cc1cccnc1)NCC#N e796d5d9d04b3d1312472deec6ce29e4 [1,0,0,0,0,0|2,0,0]=3 149 B13R1.44 CC(Cc1cccnc1)NCC=O 70ad7497d7ad435db39be0e6f1dfbc2a [1,0,0,0,0,0|2,0,1]=4 150 B13R1.44 CC(Cc1cccnc1)NCCF 6e0d57fb8d7d365f7554051bf98041e9 [1,0,0,0,0,0|2,0,1]=4 151 B13R1.44 CC(Cc1cccnc1)NCCO 735196b1b0c2bd53362947f808d932cf [1,0,0,0,0,0|2,0,1]=4 152 B13R1.44 CC(Cc1cccnc1)NCCS de95198e15ada8265e8f6fb17b9ff99f [1,0,0,0,0,0|2,0,1]=4 153 B13R1.44 CC(Cc1ccncc1)NCC#N aa81e76db230577f1c94bb60afd04dea [1,0,0,0,0,0|2,0,0]=3 154 B13R1.44 CC(Cc1ccncc1)NCC=O fa65195a8943bfa73ea8f6cc1f480299 [1,0,0,0,0,0|2,0,1]=4 155 B13R1.44 CC(Cc1ccncc1)NCCF 1dbfb9ab3307b30e610a5158b4499828 [1,0,0,0,0,0|2,0,1]=4 156 B13R1.44 CC(Cc1ccncc1)NCCO ed3834d4786dae22bd4e8189fa17c295 [1,0,0,0,0,0|2,0,1]=4 157 B13R1.44 CC(Cc1ccncc1)NCCS d0bc3797e2f1692c57c9b91362839704 [1,0,0,0,0,0|2,0,1]=4 158 B13R1.44 CC(Cc1cnccn1)NCC#N 63f85f33cc801e7d445b8158d2865da8 [1,0,0,0,0,0|3,0,0]=4 159 B13R1.44 CCCNC(C)Cc1ccccn1 08a9ae499a0ab2b3686ed9f796aeb713 [1,0,0,0,0,0|1,0,2]=4 160 B13R1.44 CCCNC(C)Cc1cccnc1 d3783f138eefc7174b8325666f11aae7 [1,0,0,0,0,0|1,0,2]=4 161 B13R1.44 CCCNC(C)Cc1ccncc1 ed6140f88e422fed342ce366cb4c481d [1,0,0,0,0,0|1,0,2]=4 162 B13R1.44 CCCOC(C)Cc1ccccc1 0d6e3fc488ed6570a7168edeaecd186c [1,0,0,0,0,0|1,0,2]=4 163 B13R1.44 CCCO[C@@H](C)Cc1ccccc1 3b4dd1b88c8a6095ff95285b4bf0c213 [1,0,0,0,0,0|1,0,2]=4 164 B13R1.44 CCCO[C@H](C)Cc1ccccc1 86496af3292741ec4d8a65d7a8599233 [1,0,0,0,0,0|1,0,2]=4 165 B13R1.44 CN(CCC#N)Cc1ccccc1 cec7715a54239ab8b228508276bff0c6 [1,0,0,0,0,0|3,0,0]=4 166 B13R1.44 COCNC(C)Cc1ccccn1 bdef7d44fcae90d367ec08c1653624aa [1,0,0,0,0,0|2,0,1]=4 167 B13R1.44 COCNC(C)Cc1cccnc1 cceae8db0edb8cc2c8df4aba54b3f57d [1,0,0,0,0,0|2,0,1]=4 168 B13R1.44 COCNC(C)Cc1ccncc1 e7e77f73a77112135fbcc2c2fb76d0b1 [1,0,0,0,0,0|2,0,1]=4 169 B13R1.44 CSCNC(C)Cc1ccccn1 0163679dcc20e6ad194d00c367953e93 [1,0,0,0,0,0|2,0,1]=4 170 B13R1.44 CSCNC(C)Cc1cccnc1 d8c1306effb4b39add9880cb1d79a606 [1,0,0,0,0,0|2,0,1]=4 171 B13R1.44 CSCNC(C)Cc1ccncc1 b689cae66553db07fb56e61e4daec079 [1,0,0,0,0,0|2,0,1]=4 172 B13R1.44 CSCOC(C)Cc1ccccc1 d47eb7c2add4cd77a238aaa487c41e75 [1,0,0,0,0,0|2,0,1]=4 173 B13R1.44 CSCO[C@@H](C)Cc1ccccc1 a4c62954b462c72460667b177c2c1967 [1,0,0,0,0,0|2,0,1]=4 174 B13R1.44 CSCO[C@H](C)Cc1ccccc1 7a09f89b34308b5d0baa28a6445feb4b [1,0,0,0,0,0|2,0,1]=4 175 B13R1.44 C[C@@H](Cc1ccccc1)OCC#N c9db6ebaf80ce0f8f961992a1e40ae30 [1,0,0,0,0,0|2,0,0]=3 176 B13R1.44 C[C@@H](Cc1ccccc1)OCC=O 3e9b0a0db080f9810e8770e46fc90e59 [1,0,0,0,0,0|2,0,1]=4 177 B13R1.44 C[C@@H](Cc1ccccc1)OCCF adba34a14ed1f92e1af6eb0b6e97a5ec [1,0,0,0,0,0|2,0,1]=4 178 B13R1.44 C[C@@H](Cc1ccccc1)OCCS 5758e84ff221c2386d02535eac8a32e6 [1,0,0,0,0,0|2,0,1]=4 179 B13R1.44 C[C@H](Cc1ccccc1)OCC#N d046cd52bb8d82356b7560c2e9e43a07 [1,0,0,0,0,0|2,0,0]=3 180 B13R1.44 C[C@H](Cc1ccccc1)OCC=O 7f98e05865117522aeb093a5dc0cee4a [1,0,0,0,0,0|2,0,1]=4 181 B13R1.44 C[C@H](Cc1ccccc1)OCCF 18fbc53f40b2dd24993aec64b50307bf [1,0,0,0,0,0|2,0,1]=4 182 B13R1.44 C[C@H](Cc1ccccc1)OCCS 1c77b2735448efeb08b15e0d9fc3458a [1,0,0,0,0,0|2,0,1]=4 183 B13R1.135 C#CC(=O)N(C)Cc1ccccc1 7af7ad1a108dcc530898f51b515618ff [1,0,0,0,0,0|3,0,0]=4 184 B13R1.135 C#CC(C)N(C)Cc1cccnc1 fff97ff03ef40a6dfdb18d4a030a4d71 [1,0,0,0,0,0|3,0,0]=4 185 B13R1.135 C#CC(C)N(C)Cc1ccncc1 eeb2d79463e980b5173781e22ca2b9bb [1,0,0,0,0,0|3,0,0]=4 186 B13R1.135 CC(CO)N(C)Cc1ccccc1 b2040d31f4919def57cebe2f3b9bcf51 [1,0,0,0,0,0|3,0,0]=4 187 B13R1.135 CC(Cc1ccccn1)N(C)C=O 89e7ba29094c63689609d17c9eea263b [1,0,0,0,0,0|2,0,1]=4 188 B13R1.135 CC(Cc1ccccn1)N(C)CF 5942b073e8bb2598e2e6c29504e0fb67 [1,0,0,0,0,0|2,0,0]=3 189 B13R1.135 CC(Cc1ccccn1)N(C)CO 1bac6048c7537564e8f18bba48e0962a [1,0,0,0,0,0|2,0,0]=3 190 B13R1.135 CC(Cc1cccnc1)N(C)C=O 960d343187a44a96564c3d732f202c21 [1,0,0,0,0,0|2,0,1]=4 191 B13R1.135 CC(Cc1cccnc1)N(C)CF b4401fca8af3cfba89f43ecfcf8f6f2e [1,0,0,0,0,0|2,0,0]=3 192 B13R1.135 CC(Cc1cccnc1)N(C)CO 24581cba4f64d54115131f082e0abc43 [1,0,0,0,0,0|2,0,0]=3 193 B13R1.135 CC(Cc1cnccn1)N(C)CF 711d84a0c6b62b42a35219ce5e745ab1 [1,0,0,0,0,0|3,0,0]=4 194 B13R1.135 CC(Cc1cnccn1)N(C)CO a2d7f84c3432ad37bf05df1152a5d39a [1,0,0,0,0,0|3,0,0]=4 195 B13R1.135 CCC(C)C(C)Nc1ccccc1 73b2cd226841b6348e2e0f4edcd68945 [1,0,0,0,0,0|2,0,1]=4 196 B13R1.135 CCC(C)N(C)Cc1ccccc1 e234f9a3b43c51cdfa21362e0b953970 [1,0,0,0,0,0|2,0,1]=4 197 B13R1.135 CCN(C)C(C)Cc1ccccn1 29e1e980ad7deada42b016bfaf8b7698 [1,0,0,0,0,0|1,0,1]=3 198 B13R1.135 CCN(C)C(C)Cc1cccnc1 b5f8bfaa700ebbc3f6091d0908f8f856 [1,0,0,0,0,0|1,0,1]=3 199 B13R1.135 CCN(C)C(C)Cc1cnccn1 ff8b861f062ae2227f14eaa30f5af1a0 [1,0,0,0,0,0|2,0,1]=4 200 B13R1.135 C[C@@H](CO)N(C)Cc1ccccc1 7445e9b044c2ec7fd2309346654ec286 [1,0,0,0,0,0|3,0,0]=4 201 B13R1.135 C[C@H](CO)N(C)Cc1ccccc1 1735f5f3edda1be34df094fd556d944d [1,0,0,0,0,0|3,0,0]=4 202 B15R1.48 C#CCC(=O)N(C)Cc1ccc(cc1)Br b421545fd989f0fea1acb52f23fe7bd9 [0,1,0,0,0,0|3,0,0]=4 203 B15R1.48 C#CCC(=O)N(C)Cc1ccc(cc1)C 8f5814f2a3ddda564e2071dd93ea5b9f [0,1,0,0,0,0|3,0,0]=4 204 B15R1.48 C#CCC(=O)N(C)Cc1ccc(cc1)Cl 45a817a265a2ed7480a3be989009500f [0,1,0,0,0,0|3,0,0]=4 205 B15R1.48 C#CCC(=O)N(C)Cc1ccc(cc1)F 1b5db7f2a322c8051ca14f8b82c040b5 [0,1,0,0,0,0|3,0,0]=4 206 B15R1.48 C#CCC(=O)N(C)Cc1ccc(cc1)I 4ea2b44ed47bdd0e2b56690a0dae4cbc [0,1,0,0,0,0|3,0,0]=4 207 B15R1.48 C#CCC(=O)N(C)Cc1ccc(cc1)O f6b69b9dfcb544330c09351ff524e548 [0,1,0,0,0,0|3,0,0]=4 208 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)Br 1a7888bad3a6a4a9a8e7cbe9eb96dab4 [0,1,0,0,0,0|1,0,1]=3 209 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)C f7750cce1ebec0f1c2e4d8eb9e555535 [0,1,0,0,0,0|1,0,1]=3 210 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)Cl 9ecc3d1b0961fd2b98b97a670424435c [0,1,0,0,0,0|1,0,1]=3 211 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)F a1974efaf99b6143b4164e230d26d2a9 [0,1,0,0,0,0|1,0,1]=3 212 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)I f243b81ac1b772ff3b873745d1f60362 [0,1,0,0,0,0|1,0,1]=3 213 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)O 78e5889581254b5025f57afbc643a57a [0,1,0,0,0,0|1,0,1]=3 214 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cc1)S 3bf6de84be6b17d42bef027994ea2ca1 [0,1,0,0,0,0|1,0,1]=3 215 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cn1)Br 756d90a4255ec2ff30f3b63f11bcec55 [0,1,0,0,0,0|2,0,1]=4 216 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cn1)C 5a996782928d3a312964019bdf66d9c4 [0,1,0,0,0,0|2,0,1]=4 217 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cn1)Cl ae29f6e7073e9129ee48bb365d036533 [0,1,0,0,0,0|2,0,1]=4 218 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cn1)F 80b2fdbaafe41e20332454fe623f085d [0,1,0,0,0,0|2,0,1]=4 219 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cn1)I d8b30b25ed4cf8c34a9cddebc17c5945 [0,1,0,0,0,0|2,0,1]=4 220 B15R1.48 C#CCN(C)C(=O)Cc1ccc(cn1)O 8e1cea7e98f589ad4dea3d75949e6637 [0,1,0,0,0,0|2,0,1]=4 221 B15R1.48 C#CCN(C)C(=O)Cc1ccc(nc1)Br bd6b2c717390e9a1ff342154a9f462d0 [0,1,0,0,0,0|2,0,1]=4 222 B15R1.48 C#CCN(C)C(=O)Cc1ccc(nc1)C 4c5eefbf6800b6b631496e571d67cc0b [0,1,0,0,0,0|2,0,1]=4 223 B15R1.48 C#CCN(C)C(=O)Cc1ccc(nc1)Cl 3b19e1355ceb143fcce624266d604be1 [0,1,0,0,0,0|2,0,1]=4 224 B15R1.48 C#CCN(C)C(=O)Cc1ccc(nc1)F be51e83f2c1a2398e63eafa440ad79fe [0,1,0,0,0,0|2,0,1]=4 225 B15R1.48 C#CCN(C)C(=O)Cc1ccc(nc1)O 9672d2d3e6bb996201f9bd9a1af17807 [0,1,0,0,0,0|2,0,1]=4 226 B15R1.48 C#CCN(C)C(=O)Cn1ccc(=O)cc1 c5323b524f399d13bc21980ebe7469b6 [0,1,0,0,0,0|2,0,1]=4 227 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)Br 800f785912c1b20c11778008ddec7f69 [0,1,0,0,0,0|2,0,1]=4 228 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)C efc395c9cce511943a89936153016977 [0,1,0,0,0,0|2,0,1]=4 229 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)Cl 6afa317fdcf060b0770c679049196e4d [0,1,0,0,0,0|2,0,1]=4 230 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)F c39379a9e949c5e3690cd0af0920238e [0,1,0,0,0,0|2,0,1]=4 231 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)I d45ed9c1350e45707864c9c6ddc9027b [0,1,0,0,0,0|2,0,1]=4 232 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)N 80fd349f2e783834e53d4b2b4e626994 [0,1,0,0,0,0|2,0,1]=4 233 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)O 9a4b9cb9890d10d6667d9336203e0e18 [0,1,0,0,0,0|2,0,1]=4 234 B15R1.48 C#CCN(C)C(=O)Nc1ccc(cc1)S 5299f00c3769ecfc59dc69234f9206e3 [0,1,0,0,0,0|2,0,1]=4 235 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)Br 4e826e31926ba208738b7feec7dfd4c7 [0,1,0,0,0,0|2,0,1]=4 236 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)C 84cb56dfa33692322767f862259130c0 [0,1,0,0,0,0|2,0,1]=4 237 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)Cl f9106ad274e66aa4656e819b67d3727d [0,1,0,0,0,0|2,0,1]=4 238 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)F 25b94ba61d6069516ff3c5a8171789da [0,1,0,0,0,0|2,0,1]=4 239 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)I cd3cead0253419eb66288201f589b1d5 [0,1,0,0,0,0|2,0,1]=4 240 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)N c0b5210b17b0741db3a0dab2bebaa457 [0,1,0,0,0,0|2,0,1]=4 241 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)O f437b97d6989d187f9f50b80f7b9a7aa [0,1,0,0,0,0|2,0,1]=4 242 B15R1.48 C#CCN(C)C(=S)Nc1ccc(cc1)S c0cf176066ac04045433b8a1b85c3223 [0,1,0,0,0,0|2,0,1]=4 243 B15R1.48 C=CCN(C)C(C)Cc1ccc(cc1)F 15b29df37e2fcaa58812b1457939864b [0,1,0,0,0,0|0,0,2]=3 244 B15R1.48 CC(CC#N)N(C)Cc1ccc(cc1)Br 23a9c53bf9140a4ecedfa4782c3c9cea [0,1,0,0,0,0|3,0,0]=4 245 B15R1.48 CC(CC#N)N(C)Cc1ccc(cc1)Cl a2f35990057926c7cc579af277f6bb76 [0,1,0,0,0,0|3,0,0]=4 246 B15R1.48 CC(CC#N)N(C)Cc1ccc(cc1)F d5ac090cb48f2c9d634316b9071514c4 [0,1,0,0,0,0|3,0,0]=4 247 B15R1.48 CC(CC#N)N(C)Cc1ccc(cc1)I ab259a92daff29f6e50404494cb9fef3 [0,1,0,0,0,0|3,0,0]=4 248 B15R1.48 CN(CC#N)C(=O)Cc1ccc(cc1)Br bb41d731490b8608deee509e6507aa23 [0,1,0,0,0,0|2,0,1]=4 249 B15R1.48 CN(CC#N)C(=O)Cc1ccc(cc1)Cl f0775354a29633d7a2cc9ea2713a554e [0,1,0,0,0,0|2,0,1]=4 250 B15R1.48 CN(CC#N)C(=O)Cc1ccc(cc1)F 1d245e46eb8c7dfbf5a1444ccd41572f [0,1,0,0,0,0|2,0,1]=4 251 B15R1.48 CN(CC#N)C(=O)Cc1ccc(cc1)I 72d022e566418de3a545a82dfe469408 [0,1,0,0,0,0|2,0,1]=4 252 B15R1.48 CN(CC#N)C(=O)Cc1ccc(cc1)O 6d6c85d91bf6862bec093df8078cfaf2 [0,1,0,0,0,0|2,0,1]=4 253 B15R1.48 CN(CC#N)C(=O)Cc1ccc(cc1)S d4f867d1a6139256865c139d9bf052db [0,1,0,0,0,0|2,0,1]=4 254 B15R1.48 Cc1ccc(cc1)CC(=O)N(C)CC#N 1fa71622b9ae899e7d4ef06edcb30dba [0,1,0,0,0,0|2,0,1]=4 255 B15R1.48 Cc1ccc(cc1)CN(C)C(C)CC#N 62737d8a445f5895346ef97097baf27c [0,1,0,0,0,0|3,0,0]=4 256 B15R1.49 C#CCC(=O)N(C)Cc1cccc(c1)Br 104251febec44366717803232ac423bd [0,1,0,0,0,0|3,0,0]=4 257 B15R1.49 C#CCC(=O)N(C)Cc1cccc(c1)C 76c3250ece48a9af9cff27afeb851d8d [0,1,0,0,0,0|3,0,0]=4 258 B15R1.49 C#CCC(=O)N(C)Cc1cccc(c1)Cl 5905fc4613180992d4a4209a4e71b5e2 [0,1,0,0,0,0|3,0,0]=4 259 B15R1.49 C#CCC(=O)N(C)Cc1cccc(c1)F 9b07b97c21f7d9fba5599e49d15bfc5c [0,1,0,0,0,0|3,0,0]=4 260 B15R1.49 C#CCC(=O)N(C)Cc1cccc(c1)I 6b13afefbb2c3c50969361001ac4d989 [0,1,0,0,0,0|3,0,0]=4 261 B15R1.49 C#CCC(=O)N(C)Cc1cccc(c1)O 145991489011f13aa1d62d242dd8f5d5 [0,1,0,0,0,0|3,0,0]=4 262 B15R1.49 C#CCN(C)C(=O)Cc1cc(ccn1)Br 9c0d6bdfc118044562dca28ae8e13584 [0,1,0,0,0,0|2,0,1]=4 263 B15R1.49 C#CCN(C)C(=O)Cc1cc(ccn1)C 7886f4c1e58b56902fde0fc0c9bc8658 [0,1,0,0,0,0|2,0,1]=4 264 B15R1.49 C#CCN(C)C(=O)Cc1cccc(c1)Br 0f9496652a3ba2782f8549915ac3ae22 [0,1,0,0,0,0|1,0,1]=3 265 B15R1.49 C#CCN(C)C(=O)Cc1cccc(c1)C 036e217a71b5c6c31e3e2c0a8d59d971 [0,1,0,0,0,0|1,0,1]=3 266 B15R1.49 C#CCN(C)C(=O)Cc1cccc(c1)Cl 9c6f95a48dac90f757f5ee5864763417 [0,1,0,0,0,0|1,0,1]=3 267 B15R1.49 C#CCN(C)C(=O)Cc1cccc(c1)F 2cc853a5df16503f5468d2067d01e326 [0,1,0,0,0,0|1,0,1]=3 268 B15R1.49 C#CCN(C)C(=O)Cc1cccc(c1)I c8ae61e557c327670839972f6f50d777 [0,1,0,0,0,0|1,0,1]=3 269 B15R1.49 C#CCN(C)C(=O)Cc1cccc(c1)O 7d917a25359c5d6b7a5880706b6c681e [0,1,0,0,0,0|1,0,1]=3 270 B15R1.49 C#CCN(C)C(=O)Cc1cccc(c1)S 8e5ebf500f0f6e716d53376d4af9fe0f [0,1,0,0,0,0|1,0,1]=3 271 B15R1.49 C#CCN(C)C(=O)Cc1cccc(n1)Br 95168c053195ab24782fc2464569c778 [0,1,0,0,0,0|2,0,1]=4 272 B15R1.49 C#CCN(C)C(=O)Cc1cccc(n1)C af9f5ffedf2c956721047e5d87bc7656 [0,1,0,0,0,0|2,0,1]=4 273 B15R1.49 C#CCN(C)C(=O)Cc1cccc(n1)Cl 1beb363fd0f9707fb365c1b7afdde286 [0,1,0,0,0,0|2,0,1]=4 274 B15R1.49 C#CCN(C)C(=O)Cc1cccc(n1)F 199f54caf76c37d8b814f61bb61742ba [0,1,0,0,0,0|2,0,1]=4 275 B15R1.49 C#CCN(C)C(=O)Cc1ccnc(c1)Br 362e591892d40cc40a1a6c0d65adbf52 [0,1,0,0,0,0|2,0,1]=4 276 B15R1.49 C#CCN(C)C(=O)Cc1ccnc(c1)C 62317913b55c5f1318b4338ab86da725 [0,1,0,0,0,0|2,0,1]=4 277 B15R1.49 C#CCN(C)C(=O)Cc1ccnc(c1)Cl 10c45df1649d026598bb23588ec5f729 [0,1,0,0,0,0|2,0,1]=4 278 B15R1.49 C#CCN(C)C(=O)Cc1ccnc(c1)F bfc1c1745784dff3c3bf4212e2b1668e [0,1,0,0,0,0|2,0,1]=4 279 B15R1.49 C#CCN(C)C(=O)Cc1cncc(c1)Br 32f980aa1138fba5e407deab64054c1a [0,1,0,0,0,0|2,0,1]=4 280 B15R1.49 C#CCN(C)C(=O)Cc1cncc(c1)C d26849260c7a90346d3801df6740435d [0,1,0,0,0,0|2,0,1]=4 281 B15R1.49 C#CCN(C)C(=O)Cc1cncc(c1)Cl 4e56e820e9d87895b7c87ecf4176584d [0,1,0,0,0,0|2,0,1]=4 282 B15R1.49 C#CCN(C)C(=O)Cc1cncc(c1)F d7a6dd09b8476cc1265efbb393708141 [0,1,0,0,0,0|2,0,1]=4 283 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)Br a6bbddea4fd9a39c898282f73d9cf669 [0,1,0,0,0,0|2,0,1]=4 284 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)C f96cacef7cc62ffddccf3e44eb98ed13 [0,1,0,0,0,0|2,0,1]=4 285 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)Cl cba862e1871abcc66008c4a4615c9c08 [0,1,0,0,0,0|2,0,1]=4 286 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)F ddff1c3d07615509779e5d7964ea6c6e [0,1,0,0,0,0|2,0,1]=4 287 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)I 2b21075e7d81c7ee3e7d1f4b05b882ff [0,1,0,0,0,0|2,0,1]=4 288 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)N 187edbbda930e023cb3bbec6f58777f4 [0,1,0,0,0,0|2,0,1]=4 289 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)O 637b22c17eec2aadaf62350e5011940c [0,1,0,0,0,0|2,0,1]=4 290 B15R1.49 C#CCN(C)C(=O)Nc1cccc(c1)S 75d67a832310f74a13893acb3a6f854a [0,1,0,0,0,0|2,0,1]=4 291 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)Br 38c0a193633ddda2c6bce6efff5c99e3 [0,1,0,0,0,0|2,0,1]=4 292 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)C 901a80b7cedb7d38edb6598ce5cecbc7 [0,1,0,0,0,0|2,0,1]=4 293 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)Cl dc6919a5665acea682391932bea65e89 [0,1,0,0,0,0|2,0,1]=4 294 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)F 02d3065ca84354a62b986f7652c11c77 [0,1,0,0,0,0|2,0,1]=4 295 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)I 57f35e827c39db9e5e495e72b4d15e02 [0,1,0,0,0,0|2,0,1]=4 296 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)N 220a59233bb41d068565bc2585fcc9db [0,1,0,0,0,0|2,0,1]=4 297 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)O a42114f0a2f96f1518d287b61d2b193f [0,1,0,0,0,0|2,0,1]=4 298 B15R1.49 C#CCN(C)C(=S)Nc1cccc(c1)S ee3e0d657928ffa17abfb6fda5568850 [0,1,0,0,0,0|2,0,1]=4 299 B15R1.49 C#CCN(C)C(C)Cc1cccc(c1)F a98dfcd05c6d8551f00b148218317f9e [0,1,0,0,0,0|0,0,0]=1 300 B15R1.49 C=CCN(C)C(C)Cc1cccc(c1)F b5d36d8a5e9827ecf3ff823a3be7e46e [0,1,0,0,0,0|0,0,2]=3 301 B15R1.49 CC(CC#N)N(C)Cc1cccc(c1)Br a663cf2f662fa511478f15f4af705ca5 [0,1,0,0,0,0|3,0,0]=4 302 B15R1.49 CC(CC#N)N(C)Cc1cccc(c1)Cl 6984f19c712a4876bb315e99e6b2fec9 [0,1,0,0,0,0|3,0,0]=4 303 B15R1.49 CC(CC#N)N(C)Cc1cccc(c1)F 520253dab29ac10fce3586c97ebf0a41 [0,1,0,0,0,0|3,0,0]=4 304 B15R1.49 CC(CC#N)N(C)Cc1cccc(c1)I a94bac4c8169d2f35ad7cdeb890972fd [0,1,0,0,0,0|3,0,0]=4 305 B15R1.49 CN(CC#N)C(=O)Cc1cccc(c1)Br 47a2d9e72e0e952f09ffe23299c41e86 [0,1,0,0,0,0|2,0,1]=4 306 B15R1.49 CN(CC#N)C(=O)Cc1cccc(c1)Cl ca8a753395f8df45f505fb58a7f0ce37 [0,1,0,0,0,0|2,0,1]=4 307 B15R1.49 CN(CC#N)C(=O)Cc1cccc(c1)F 0627ab120242f99f6503925a903539fa [0,1,0,0,0,0|2,0,1]=4 308 B15R1.49 CN(CC#N)C(=O)Cc1cccc(c1)I 0befcce76ab638615e2f8a2237b63355 [0,1,0,0,0,0|2,0,1]=4 309 B15R1.49 CN(CC#N)C(=O)Cc1cccc(c1)O df3de8701017600a0d980ca5bd8c5f04 [0,1,0,0,0,0|2,0,1]=4 310 B15R1.49 CN(CC#N)C(=O)Cc1cccc(c1)S 19dc0ffa94d284bc6e71d3f63a10e43e [0,1,0,0,0,0|2,0,1]=4 311 B15R1.49 Cc1cccc(c1)CC(=O)N(C)CC#N 8cbcef45bc94ad0c66411ea284454a6e [0,1,0,0,0,0|2,0,1]=4 312 B15R1.49 Cc1cccc(c1)CN(C)C(C)CC#N c7a8a96bf2e4e810fa6ed0fca0191370 [0,1,0,0,0,0|3,0,0]=4 313 B15R1.496 C=C(C)CN(C)C(C)Cc1ccccn1 dde23c88682195e5898cfbd70d16ee13 [0,1,0,0,0,0|1,0,2]=4 314 B15R1.496 C=C(C)CN(C)C(C)Cc1cccnc1 2d74406fe80f80915c954537d57abea5 [0,1,0,0,0,0|1,0,2]=4 315 B15R1.496 C=C(Cl)CN(C)C(C)Cc1cccnc1 e44ce3501b3bb25a20408a9255dd3d13 [0,1,0,0,0,0|1,0,2]=4 316 B15R1.496 C=C(F)CN(C)C(C)Cc1cccnc1 e730b50de2de3b3b11ecedf46ed73ef8 [0,1,0,0,0,0|1,0,2]=4 317 B15R1.496 CC(C)CN(C)C(C)Cc1ccccc1 406b2e87b344c4539d1182b6ef56d508 [0,1,0,0,0,0|0,0,2]=3 318 B15R1.496 CC(C)CN(C)C(C)Cc1ccccn1 11f4f1db31bc8fe5d77bcc46721a65d5 [0,1,0,0,0,0|1,0,2]=4 319 B15R1.496 CC(C)CN(C)C(C)Cc1cccnc1 d627609580060865430fa08d412cf2a8 [0,1,0,0,0,0|1,0,2]=4 320 B15R1.496 CC(Cc1ccccn1)N(C)CC(=O)N aa685777d016a02a1c4af82e8f313d42 [0,1,0,0,0,0|2,0,1]=4 321 B15R1.496 CC(Cc1ccccn1)N(C)CC(=O)O bba081918fdb5468c21a795d48cca44e [0,1,0,0,0,0|2,0,1]=4 322 B15R1.496 CC(Cc1ccccn1)N(C)CC(F)F 12c01d15d9ea36597ec987c1c55a83ba [0,1,0,0,0,0|2,0,1]=4 323 B15R1.496 CC(Cc1ccccn1)N(C)CN(C)C ba2a13a9f25d6cd45ce92d4134363eb3 [0,1,0,0,0,0|2,0,1]=4 324 B15R1.496 CC(Cc1ccccn1)N(C)C[C@H](C)O 1a2418cdb1ac9f035c6769c88a00d1cc [0,1,0,0,0,0|1,0,2]=4 325 B15R1.496 CC(Cc1ccccn1)N(C)C[N+](=O)[O-] 0370b9cb4bc6ae8bac17edb079f87690 [0,1,0,0,0,0|3,0,0]=4 326 B15R1.496 CC(Cc1cccnc1)N(C)CC(=O)N cf020e38007877ae17d0cc388e02a33f [0,1,0,0,0,0|2,0,1]=4 327 B15R1.496 CC(Cc1cccnc1)N(C)CC(=O)O c55058ffe1eb1200aa9c9ade5498f002 [0,1,0,0,0,0|2,0,1]=4 328 B15R1.496 CC(Cc1cccnc1)N(C)CC(F)F ad1269e47b50eb7dce8b2ecf1cb0a251 [0,1,0,0,0,0|2,0,1]=4 329 B15R1.496 CC(Cc1cccnc1)N(C)CN(C)C d598732136c000c1d54f64acdd96a62d [0,1,0,0,0,0|2,0,1]=4 330 B15R1.496 CC(Cc1cccnc1)N(C)C[C@H](C)O b165745ee9576fad8fa6fe43b7eb5a87 [0,1,0,0,0,0|1,0,2]=4 331 B15R1.496 CC(Cc1cccnc1)N(C)C[N+](=O)[O-] 885b5cde299a5aa7b79cc3e6076de3d2 [0,1,0,0,0,0|3,0,0]=4 332 B15R1.496 CC(O)CN(C)C(C)Cc1ccccn1 3a44b1c925006d1860f7276dfc9d7008 [0,1,0,0,0,0|1,0,2]=4 333 B15R1.496 CC(O)CN(C)C(C)Cc1cccnc1 753c9f43a125af7e5d35b46107e195c8 [0,1,0,0,0,0|1,0,2]=4 334 B15R1.551 C#CCCC(=O)N(C)Cc1ccccc1 b29dd1d8e62e8c8f5b9abe1e09001b69 [0,1,0,0,0,0|3,0,0]=4 335 B15R1.551 C#CCCN(C)C(=O)Cc1ccccn1 5004bf5fa6d15ffc8ec61bb1a925ef32 [0,1,0,0,0,0|2,0,1]=4 336 B15R1.551 C#CCCN(C)C(=O)Cc1cccnc1 5d6482d9d9cdddf5d1557fd32d27568b [0,1,0,0,0,0|2,0,1]=4 337 B15R1.551 C#CCCN(C)C(=O)Cc1ccncc1 d7a0df48df3c184293fb0d291e901bf6 [0,1,0,0,0,0|2,0,1]=4 338 B15R1.551 C#CCCN(C)C(=O)Nc1ccccc1 8436c47cf3faca98d2650a90d49cca2d [0,1,0,0,0,0|2,0,1]=4 339 B15R1.551 C#CCCN(C)C(=S)Nc1ccccc1 125c158f97d8d9f9b620498153fce871 [0,1,0,0,0,0|2,0,1]=4 340 B15R1.551 C#CCCN(C)C(C)Cc1ccccn1 67670090e0480efbaf5cfea62cd9d917 [0,1,0,0,0,0|1,0,0]=2 341 B15R1.551 C#CCCN(C)C(C)Cc1cccnc1 0141845bbc56e3edc67c92aa5338cb97 [0,1,0,0,0,0|1,0,0]=2 342 B15R1.551 C#CCCN(C)C(C)Cc1cnccn1 7273697230d59f401f925ab07e9550c0 [0,1,0,0,0,0|2,0,0]=3 343 B15R1.551 C#CCNC(=O)C(C)Nc1ccccc1 bd95b12273b4e9341308f5a1d52bd788 [0,1,0,0,0,0|3,0,0]=4 344 B15R1.551 C#CCNC(=O)C(O)Cc1ccccc1 a16af40118cc645968fe995d41177ff4 [0,1,0,0,0,0|3,0,0]=4 345 B15R1.551 C#CCNC(=O)C(S)Cc1ccccc1 edb8a5dae1ebbec0031b219cff70354c [0,1,0,0,0,0|3,0,0]=4 346 B15R1.551 C#CCNC(=O)N(C)Cc1ccccc1 a0c980ecfa4f8292eecb07a5f02c7336 [0,1,0,0,0,0|3,0,0]=4 347 B15R1.551 C#CCNC(=O)[C@@H](O)Cc1ccccc1 9468d19b400475df944366c905889448 [0,1,0,0,0,0|3,0,0]=4 348 B15R1.551 C#CCNC(=O)[C@H](O)Cc1ccccc1 8fb358988c2489b0ef68158ddb272dfa [0,1,0,0,0,0|3,0,0]=4 349 B15R1.551 C#CCNC(=S)N(C)Cc1ccccc1 3022f089cb366d01b44df0b3b41970f8 [0,1,0,0,0,0|3,0,0]=4 350 B15R1.551 C/C=C/CN(C)C(C)Cc1ccccn1 58ceee580b1b44d1e8e2eb745e2b8f65 [0,1,0,0,0,0|1,0,2]=4 351 B15R1.551 C/C=C/CN(C)C(C)Cc1cccnc1 5df49a6873dec64c386eb7f561b8e59d [0,1,0,0,0,0|1,0,2]=4 352 B15R1.551 C/C=C\CN(C)C(C)Cc1ccccn1 22465c0855d2463f82c4b1bcc294924c [0,1,0,0,0,0|1,0,2]=4 353 B15R1.551 C/C=C\CN(C)C(C)Cc1cccnc1 4198ac0c52920463d3c4f08e1055f81c [0,1,0,0,0,0|1,0,2]=4 354 B15R1.551 C=CCCN(C)C(C)Cc1ccccc1 bba159a8706eee072302b49114e7fcc6 [0,1,0,0,0,0|0,0,2]=3 355 B15R1.551 C=CCCN(C)C(C)Cc1ccccn1 27d004c9b75ed9fabb60b1ff696bc92e [0,1,0,0,0,0|1,0,2]=4 356 B15R1.551 C=CCCN(C)C(C)Cc1cccnc1 dc2ac915dd4bec70afdbc2cb3afcf21a [0,1,0,0,0,0|1,0,2]=4 357 B15R1.551 CC#CCC(=O)N(C)Cc1ccccc1 dbbed1e85333013fe7be981960916a6d [0,1,0,0,0,0|3,0,0]=4 358 B15R1.551 CC(CCC#N)N(C)Cc1ccccc1 28c46a24217109e7bb26e7ea82312960 [0,1,0,0,0,0|2,0,1]=4 359 B15R1.551 CC(Cc1ccccn1)N(C)C/C=C/Cl eb71e7d960642b22c7b15fc5bb1e3ad0 [0,1,0,0,0,0|1,0,2]=4 360 B15R1.551 CC(Cc1ccccn1)N(C)C/C=C\Cl c9aa1d47599739ed340f006227987a4d [0,1,0,0,0,0|1,0,2]=4 361 B15R1.551 CC(Cc1ccccn1)N(C)C/C=C\O 1c43504f8d0f802fd8a4b76c1396a5af [0,1,0,0,0,0|1,0,2]=4 362 B15R1.551 CC(Cc1ccccn1)N(C)CCC#N 8c99315991e1002bae402d764e623c9a [0,1,0,0,0,0|1,0,1]=3 363 B15R1.551 CC(Cc1ccccn1)N(C)CCC=O ee5b7b14f1e3a0b9f56ad740c9ed7b33 [0,1,0,0,0,0|1,0,2]=4 364 B15R1.551 CC(Cc1ccccn1)N(C)CCCF 24e4e03458ccbdbf31debc9c86110bfe [0,1,0,0,0,0|1,0,2]=4 365 B15R1.551 CC(Cc1ccccn1)N(C)CCCO 10cc2d06b2dfa2d780450a7d6021d09e [0,1,0,0,0,0|1,0,2]=4 366 B15R1.551 CC(Cc1ccccn1)N(C)CCCS 27e722c0bdc1ca2859ef474ea2bd4dde [0,1,0,0,0,0|1,0,2]=4 367 B15R1.551 CC(Cc1cccnc1)N(C)C/C=C/Cl 097760278e295582c8f77f9df5b375db [0,1,0,0,0,0|1,0,2]=4 368 B15R1.551 CC(Cc1cccnc1)N(C)C/C=C\Cl ae2f61005c36ff784e26c8781bed19d9 [0,1,0,0,0,0|1,0,2]=4 369 B15R1.551 CC(Cc1cccnc1)N(C)C/C=C\O 7a1eb8944adb7d11b78241ca99e2cfd8 [0,1,0,0,0,0|1,0,2]=4 370 B15R1.551 CC(Cc1cccnc1)N(C)CCC#N 47673b3bc7b87cba319296ffa7500d9a [0,1,0,0,0,0|1,0,1]=3 371 B15R1.551 CC(Cc1cccnc1)N(C)CCC=O aafb3af2c7874b928074f63e3052015f [0,1,0,0,0,0|1,0,2]=4 372 B15R1.551 CC(Cc1cccnc1)N(C)CCCF 3711a29ab24aab504e6d6fc8d5f4de9c [0,1,0,0,0,0|1,0,2]=4 373 B15R1.551 CC(Cc1cccnc1)N(C)CCCO 147033171e3820eb94ef0a42eb499577 [0,1,0,0,0,0|1,0,2]=4 374 B15R1.551 CC(Cc1cccnc1)N(C)CCCS 2a3b1845592f10e10b02f6e45b59ee5a [0,1,0,0,0,0|1,0,2]=4 375 B15R1.551 CC(Cc1cnccn1)N(C)CCC#N 78038955d7ad6ad3fe2d44ce9a28c3f6 [0,1,0,0,0,0|2,0,1]=4 376 B15R1.551 CCCCN(C)C(C)Cc1ccccn1 59a36c9e33ca221597d5d2129bd496b2 [0,1,0,0,0,0|1,0,2]=4 377 B15R1.551 CCCCN(C)C(C)Cc1cccnc1 54779a84a99630c0e5dfbc19741987a0 [0,1,0,0,0,0|1,0,2]=4 378 B15R1.551 CCOCN(C)C(C)Cc1ccccn1 66661b9f84f93e4586a3ea5c43345707 [0,1,0,0,0,0|1,0,2]=4 379 B15R1.551 CCOCN(C)C(C)Cc1cccnc1 df30733af3ef24d4147914b28ca07fca [0,1,0,0,0,0|1,0,2]=4 380 B15R1.551 COCCN(C)C(C)Cc1ccccn1 8601f673cee7c82fc1a1f8619628b4a8 [0,1,0,0,0,0|1,0,2]=4 381 B15R1.551 COCCN(C)C(C)Cc1cccnc1 c106c30ccf0a6aba87d1d781f1ff7208 [0,1,0,0,0,0|1,0,2]=4 382 B15R1.551 CSCCN(C)C(C)Cc1ccccn1 993204adca089f4c47b1fd7777322ece [0,1,0,0,0,0|1,0,2]=4 383 B15R1.551 CSCCN(C)C(C)Cc1cccnc1 64c3f4b1bdd19e9afebbbc8680bd1f4b [0,1,0,0,0,0|1,0,2]=4 384 B15R1.578 C#CCN(C)C(=O)C(=C)c1ccccc1 88a622a4633c8d8047f28faec47cb603 [0,1,0,0,0,0|1,0,2]=4 385 B15R1.578 C#CCN(C)C(=O)C(=O)c1ccccc1 279756deada3f481404def66c85964ca [0,1,0,0,0,0|1,0,2]=4 386 B15R1.578 C#CCN(C)C(=O)C(C)c1cccnc1 f22c6a6b7dce6ce0ae4f3ced8c74bd3f [0,1,0,0,0,0|2,0,1]=4 387 B15R1.578 C#CCN(C)C(=O)C(F)c1ccccc1 52a165c0bf17b53c97ba5466204f8f51 [0,1,0,0,0,0|1,0,1]=3 388 B15R1.578 C#CCN(C)C(=O)C(O)c1ccccc1 988d1d86c5edd13ac7937763f3770809 [0,1,0,0,0,0|1,0,1]=3 389 B15R1.578 C#CCN(C)C(=O)C(O)c1cccnc1 0dc43c3f60ca2d667f85289e052b5e5b [0,1,0,0,0,0|2,0,1]=4 390 B15R1.578 C#CCN(C)C(=O)C(O)c1ccncc1 f79e26dad2e735a29ce18539f36b354b [0,1,0,0,0,0|2,0,1]=4 391 B15R1.578 C#CCN(C)C(=O)[C@@H](O)c1ccccc1 62b3d4e2381610ce2e9b75589e649376 [0,1,0,0,0,0|1,0,1]=3 392 B15R1.578 C#CCN(C)C(=O)[C@H](F)c1ccccc1 f42caa061dac51e78549685759482a31 [0,1,0,0,0,0|1,0,1]=3 393 B15R1.578 C#CCN(C)C(=O)[C@H](O)c1ccccc1 0d67f78382292311a932afeac277e1b7 [0,1,0,0,0,0|1,0,1]=3 394 B15R1.578 C=CCN(C)C(C)C(=O)c1ccccc1 d7ac9fcead21e435c9afb334ee408152 [0,1,0,0,0,0|0,0,3]=4 395 B15R1.578 CC(C(=O)N(C)CC#N)c1ccccc1 384daea2148dfa24fb69098e06310505 [0,1,0,0,0,0|2,0,1]=4 396 B15R1.578 CN(CC#N)C(=O)C(F)c1ccccc1 cabb7cfc63918e109f272d2e4c9df10f [0,1,0,0,0,0|2,0,1]=4 397 B15R1.578 CN(CC#N)C(=O)C(O)c1ccccc1 0de09583bb5257c2408ca434e56d5ba8 [0,1,0,0,0,0|2,0,1]=4 398 B15R1.578 CN(CC#N)C(=O)[C@@H](O)c1ccccc1 12e34076b884accc93c3842bf00283c9 [0,1,0,0,0,0|2,0,1]=4 399 B15R1.578 CN(CC#N)C(=O)[C@H](F)c1ccccc1 024ee34feb0b4f7680352b83e6dcd478 [0,1,0,0,0,0|2,0,1]=4 400 B15R1.578 CN(CC#N)C(=O)[C@H](O)c1ccccc1 886d2e05ca6970e7a33b58ff463646a1 [0,1,0,0,0,0|2,0,1]=4 401 B15R1.578 C[C@@H](C(=O)N(C)CC#N)c1ccccc1 7c6c9d39cecb391e3e971be3a71e87bb [0,1,0,0,0,0|2,0,1]=4 402 B15R1.578 C[C@H](C(=O)N(C)CC#N)c1ccccc1 c4d00fb0423ec0e211646cee6b87e188 [0,1,0,0,0,0|2,0,1]=4 403 B15R1.640 C#CCC(=O)N(CC)Cc1ccccc1 b867b07a071b779aef6c46671ba3b8d0 [0,1,0,0,0,0|3,0,0]=4 404 B15R1.640 C#CCN(C)C(C=O)Cc1ccccc1 fbd0e8bc01bd75f2a9d5860bc6a3c76f [0,1,0,0,0,0|0,0,1]=2 405 B15R1.640 C#CCN(C)C(CO)Cc1ccccc1 b5b65c70c2d08e0d75bd40ab197910a0 [0,1,0,0,0,0|0,0,0]=1 406 B15R1.640 C#CCN(C)[C@H](CO)Cc1ccccc1 24201ee77479a5c830abc0024b9076bc [0,1,0,0,0,0|0,0,0]=1 407 B15R1.640 C=CCN(C)C(C#N)Cc1ccccc1 d79d6ea5b3b7752cd19f2250722fc20b [0,1,0,0,0,0|0,0,3]=4 408 B15R1.640 C=CCN(C)C(C=O)Cc1ccccc1 f6ec1a4a2d61a93d643f3cd969e588d1 [0,1,0,0,0,0|0,0,3]=4 409 B15R1.640 C=CCN(C)C(CO)Cc1ccccc1 66c4171fa501f1a587acfe4cc45efac6 [0,1,0,0,0,0|0,0,2]=3 410 B15R1.640 C=CCN(C)[C@H](CO)Cc1ccccc1 f3be722f26c4722e32e120f400153385 [0,1,0,0,0,0|0,0,2]=3 411 B15R1.640 CCCN(C)C(C=O)Cc1ccccc1 a3579a17e1994bd964babeef8d4a7c7d [0,1,0,0,0,0|0,0,3]=4 412 B15R1.640 CCCN(C)C(CO)Cc1ccccc1 ae170b40e345a680d63c6005a2b319c1 [0,1,0,0,0,0|0,0,2]=3 413 B15R1.640 CCCN(C)[C@H](CO)Cc1ccccc1 355e64945765915de15066b25ff76c72 [0,1,0,0,0,0|0,0,2]=3 414 B15R1.640 CN(CC#N)C(C=O)Cc1ccccc1 6830178646916dd74d9c321828994fb1 [0,1,0,0,0,0|1,0,1]=3 415 B15R1.640 CN(CC#N)C(CO)Cc1ccccc1 92f7abdf91608efdd828a4a9275ffb62 [0,1,0,0,0,0|1,0,0]=2 416 B15R1.640 CN(CC#N)[C@H](CO)Cc1ccccc1 c137ac22ad7ce253eb4dfacda003137a [0,1,0,0,0,0|1,0,0]=2 417 B15R1.640 CN(CC=O)C(CO)Cc1ccccc1 bf18d9ce74b2194ec7130efd5f1e44b5 [0,1,0,0,0,0|1,0,1]=3 418 B15R1.640 CN(CC=O)[C@H](CO)Cc1ccccc1 9959e76680b146cd9a032917dc76b4df [0,1,0,0,0,0|1,0,1]=3 419 B15R1.640 CN(CCF)C(C=O)Cc1ccccc1 daf83ac1f264afd91c5ef22472018df3 [0,1,0,0,0,0|1,0,2]=4 420 B15R1.640 CSCN(C)C(CO)Cc1ccccc1 7f6f32be17dc633017a411f68eae128f [0,1,0,0,0,0|1,0,1]=3 421 B15R1.640 CSCN(C)[C@H](CO)Cc1ccccc1 9e704c6b8002342b2fe15f2f28a73e87 [0,1,0,0,0,0|1,0,1]=3 422 B15R1.973 C#CC(=O)N(C)C(C)Cc1ccccn1 24d14da0830ca4b296fd7de3478a2ba1 [0,1,0,0,0,0|1,0,1]=3 423 B15R1.973 C#CC(=O)N(C)C(C)Cc1cccnc1 27b5e561ab3e581e72d2c435c08a6d4b [0,1,0,0,0,0|1,0,1]=3 424 B15R1.973 C#CC(=O)N(C)C(C)Cc1cnccn1 fafeabb961de2b65bffdec3fb1f09f36 [0,1,0,0,0,0|2,0,1]=4 425 B15R1.973 C#CC(O)C(=O)N(C)Cc1ccccc1 528fb006d117e57acc78cb531d820fe0 [0,1,0,0,0,0|3,0,0]=4 426 B15R1.973 C=CC(C)N(C)C(C)Cc1ccccn1 15c3d976ecab9ccbfe27de219ec1c2d3 [0,1,0,0,0,0|1,0,2]=4 427 B15R1.973 C=CC(C)N(C)C(C)Cc1cccnc1 1228d76fe581c91419e9335279d90fa1 [0,1,0,0,0,0|1,0,2]=4 428 B15R1.973 CC(C=O)N(C)C(C)Cc1ccccn1 5be134b2a17d80d1af28f8a0ec5767c5 [0,1,0,0,0,0|2,0,1]=4 429 B15R1.973 CC(C=O)N(C)C(C)Cc1cccnc1 cca7ad48bc9ce4ee4c403f9528d44041 [0,1,0,0,0,0|2,0,1]=4 430 B15R1.973 CC(CO)N(C)C(C)Cc1ccccn1 9179c9603cd294175e8d769d51c1e9ff [0,1,0,0,0,0|2,0,1]=4 431 B15R1.973 CC(CO)N(C)C(C)Cc1cccnc1 b67dea0667ea24212486df956f595245 [0,1,0,0,0,0|2,0,1]=4 432 B15R1.973 CC(Cc1ccccn1)N(C)[C@H](C)C=O 50c0da9d49406b5c2a0e819626c61e22 [0,1,0,0,0,0|2,0,1]=4 433 B15R1.973 CC(Cc1cccnc1)N(C)[C@@H](C)CO da8f9035a2668719744fe2e696292cc5 [0,1,0,0,0,0|2,0,1]=4 434 B15R1.973 CC(Cc1cccnc1)N(C)[C@H](C)C=O 9e18556cc4d6d1eeccd5b95868dcc2ed [0,1,0,0,0,0|2,0,1]=4 435 B15R1.973 CC(Cc1cccnc1)N(C)[C@H](C)CO e77c257a561abcec4358e4014c4d6eb4 [0,1,0,0,0,0|2,0,1]=4 436 B15R1.973 CCC(C)N(C)C(C)Cc1ccccn1 ab0b8331dfd5b4529c07455dd87b0cb9 [0,1,0,0,0,0|1,0,2]=4 437 B15R1.973 CCC(C)N(C)C(C)Cc1cccnc1 682636e63e9b85d388cedc06ee3f4d48 [0,1,0,0,0,0|1,0,2]=4 438 B15R1.1289 C#CCN(C=O)C(C)Cc1ccccc1 db234931d0e1e6f174eb9048e8ee584d [0,1,0,0,0,0|0,0,1]=2 439 B15R1.1289 C#CCN(CC)C(C)Cc1ccccc1 8f17c3872110ca71a4aec56833c95e4c [0,1,0,0,0,0|0,0,0]=1 440 B15R1.1289 C#CCN(CF)C(C)Cc1ccccc1 8fd915185dbdd05b347f8df6309250b3 [0,1,0,0,0,0|0,0,0]=1 441 B15R1.1289 C#CCN(CO)C(C)Cc1ccccc1 05fc1c81abf5bff7fe69a32cabe9615f [0,1,0,0,0,0|0,0,0]=1 442 B15R1.1289 C=CCN(C#N)C(C)Cc1ccccc1 f764d5ecafd80a0bc87321f593d203ac [0,1,0,0,0,0|0,0,3]=4 443 B15R1.1289 C=CCN(CC)C(C)Cc1cccnc1 0e09b5e5a829370a5d43bb7bf6485adb [0,1,0,0,0,0|1,0,2]=4 444 B15R1.1289 CCCN(CC)C(C)Cc1cccnc1 01c5e52684e66d1cd2671fefed728e07 [0,1,0,0,0,0|1,0,2]=4 445 B15R1.1289 CCN(CC#N)C(C)Cc1cccnc1 242d66f246b25ccc19646b06c31868e8 [0,1,0,0,0,0|2,0,0]=3 446 B15R1.1289 CCN(CC=O)C(C)Cc1cccnc1 bc65fcdc2038cebd7a20a75fb0e1642d [0,1,0,0,0,0|2,0,1]=4 447 B15R1.1289 CCN(CCS)C(C)Cc1cccnc1 78ae0ca4467c8bfa4ccc9930b6203928 [0,1,0,0,0,0|2,0,1]=4 448 B15R1.1289 CCN(COC)C(C)Cc1cccnc1 58dc18dc2bcbe3f2f41f00a533ce25ce [0,1,0,0,0,0|2,0,1]=4 449 B15R1.3960 C#CCC(=O)N(C)Cc1ccccc1C 621b88c94b80c8c2773c700089e1fe65 [0,1,0,0,0,0|3,0,0]=4 450 B15R1.3960 C#CCC(=O)N(C)Cc1ccccc1Cl 44a244c36fd71560b24f15339a7fdb45 [0,1,0,0,0,0|3,0,0]=4 451 B15R1.3960 C#CCC(=O)N(C)Cc1ccccc1F 474955cf3027a8815098e562db836fdc [0,1,0,0,0,0|3,0,0]=4 452 B15R1.3960 C#CCC(=O)N(C)Cc1ccccc1I fa2c3cbd05fd5f0f583a1026aaac3394 [0,1,0,0,0,0|3,0,0]=4 453 B15R1.3960 C#CCC(=O)N(C)Cc1ccccc1O 1b64ba15081b66ebde1cf7f60687c413 [0,1,0,0,0,0|3,0,0]=4 454 B15R1.3960 C#CCN(C)C(=O)Cc1ccccc1Br e3d811c6fec4c0651dfad8e2d8bd4a76 [0,1,0,0,0,0|1,0,1]=3 455 B15R1.3960 C#CCN(C)C(=O)Cc1ccccc1Cl 69ed31c8048fc26aae2c426288a89fe3 [0,1,0,0,0,0|1,0,1]=3 456 B15R1.3960 C#CCN(C)C(=O)Cc1ccccc1F d790708086d5f8e62c4deb022503e887 [0,1,0,0,0,0|1,0,1]=3 457 B15R1.3960 C#CCN(C)C(=O)Cc1ccccc1I 967945fc1dccf4ce4fb2ad84322ab1f8 [0,1,0,0,0,0|1,0,1]=3 458 B15R1.3960 C#CCN(C)C(=O)Cc1ccccc1O 422ee67853e38823cee5771c04ebceed [0,1,0,0,0,0|1,0,1]=3 459 B15R1.3960 C#CCN(C)C(=O)Cc1cccnc1Br 7a6d6823441e76a06de4356b5d21d87d [0,1,0,0,0,0|2,0,1]=4 460 B15R1.3960 C#CCN(C)C(=O)Cc1cccnc1Cl c00440bb51ec55b6db0c2db8bf8d5930 [0,1,0,0,0,0|2,0,1]=4 461 B15R1.3960 C#CCN(C)C(=O)Cc1ccncc1Cl f2a071c6f08867fd7781655ae7367cb3 [0,1,0,0,0,0|2,0,1]=4 462 B15R1.3960 C#CCN(C)C(=O)Cc1ncccc1Br fee38869054d5d30fd3c8be3839a12a0 [0,1,0,0,0,0|2,0,1]=4 463 B15R1.3960 C#CCN(C)C(=O)Cc1ncccc1Cl 5b8068b3a027d32ea9135a5e2b01fe1c [0,1,0,0,0,0|2,0,1]=4 464 B15R1.3960 C#CCN(C)C(=O)Cc1ncccc1F 84cad6f8594d68784281d3cbfb7b7a4f [0,1,0,0,0,0|2,0,1]=4 465 B15R1.3960 C#CCN(C)C(=O)Cc1ncccc1O 182123e463c4f8df7725188e612ce4cc [0,1,0,0,0,0|2,0,1]=4 466 B15R1.3960 C#CCN(C)C(=O)Cn1ccccc1=O eee0e7f2989d310a42b8d0d661fdc20f [0,1,0,0,0,0|2,0,1]=4 467 B15R1.3960 C#CCN(C)C(=O)Nc1ccccc1Br 5a79aa1128fc3f2862344bcc77430e8f [0,1,0,0,0,0|2,0,1]=4 468 B15R1.3960 C#CCN(C)C(=O)Nc1ccccc1C 2f79fa4dc8332dc22d547a200f6aab6d [0,1,0,0,0,0|2,0,1]=4 469 B15R1.3960 C#CCN(C)C(=O)Nc1ccccc1Cl 28f118a6706c2166efae6aee9f7b5ba1 [0,1,0,0,0,0|2,0,1]=4 470 B15R1.3960 C#CCN(C)C(=O)Nc1ccccc1F d359bba78bbd165fe6b5449f50d494db [0,1,0,0,0,0|2,0,1]=4 471 B15R1.3960 C#CCN(C)C(=O)Nc1ccccc1I 7f9eacf257296c5bdc772f3236f6b464 [0,1,0,0,0,0|2,0,1]=4 472 B15R1.3960 C#CCN(C)C(=O)Nc1ccccc1N 7666ca7457b0c65cb283fbb470b1ac94 [0,1,0,0,0,0|2,0,1]=4 473 B15R1.3960 C#CCN(C)C(=O)Nc1ccccc1O d86e8827d8f26a0be533280e3b3a88cf [0,1,0,0,0,0|2,0,1]=4 474 B15R1.3960 C#CCN(C)C(=S)Nc1ccccc1C b281a572b2de9216f2d8f1d6ab9c7121 [0,1,0,0,0,0|2,0,1]=4 475 B15R1.3960 C#CCN(C)C(=S)Nc1ccccc1Cl 019bb692b73bda633de1fae6f6113e71 [0,1,0,0,0,0|2,0,1]=4 476 B15R1.3960 C#CCN(C)C(=S)Nc1ccccc1F 487d56793726aafd00110c667246bac6 [0,1,0,0,0,0|2,0,1]=4 477 B15R1.3960 C#CCN(C)C(=S)Nc1ccccc1I 2c95c428da53e6c4e7b5203570b862df [0,1,0,0,0,0|2,0,1]=4 478 B15R1.3960 C#CCN(C)C(=S)Nc1ccccc1N 0be1b6b7db7049c7b9c4726f9d0596c9 [0,1,0,0,0,0|2,0,1]=4 479 B15R1.3960 C#CCN(C)C(=S)Nc1ccccc1O 3acf76868350b3f0f4b1bb1062e26143 [0,1,0,0,0,0|2,0,1]=4 480 B15R1.3960 C#CCN(C)C(=S)Nc1ccccc1S c8fe4e76d13db660154d50fef8047457 [0,1,0,0,0,0|2,0,1]=4 481 B15R1.3960 CC(CC#N)N(C)Cc1ccccc1Cl f8db6d8881c186e3018fece43056fbe2 [0,1,0,0,0,0|3,0,0]=4 482 B15R1.3960 CC(CC#N)N(C)Cc1ccccc1F c9405da4719d825515736281b3d87734 [0,1,0,0,0,0|3,0,0]=4 483 B15R1.3960 CC(CC#N)N(C)Cc1ccccc1I 93ce2b99250946d8bfff85744b55ca71 [0,1,0,0,0,0|3,0,0]=4 484 B15R1.3960 CN(CC#N)C(=O)Cc1ccccc1Br a6687afed7a2d75b38650691b998a28c [0,1,0,0,0,0|2,0,1]=4 485 B15R1.3960 CN(CC#N)C(=O)Cc1ccccc1Cl 5e04f779cbcc0cf175bd7fed569ed807 [0,1,0,0,0,0|2,0,1]=4 486 B15R1.3960 CN(CC#N)C(=O)Cc1ccccc1F fab86e7d9d34bc574208df5482a23144 [0,1,0,0,0,0|2,0,1]=4 487 B15R1.3960 CN(CC#N)C(=O)Cc1ccccc1I b0959e8de54dd15cc24743adb643930b [0,1,0,0,0,0|2,0,1]=4 488 B15R1.3960 CN(CC#N)C(=O)Cc1ccccc1O 2a5a23e6314b7968a21b91e3af98c991 [0,1,0,0,0,0|2,0,1]=4 489 B15R1.3960 Cc1ccccc1CC(=O)N(C)CC#N 63a592e98664f62af4e0179208479202 [0,1,0,0,0,0|2,0,1]=4 490 B15R2.64 CC(Cc1ccccc1)N2CCSC2 7ca3acca0930eb1dd51cc08457f4cdfa [0,0,0,1,0,0|1,0,1]=3 491 B15R2.888 C#CCN1Cc2ccccc2CC1C ef41c0978a1214110754361f6ec89cb6 [0,0,0,1,0,0|0,0,0]=1 492 B15R2.888 C#CCN1Cc2ccccc2C[C@@H]1C 5f22770e3621327ed577cb3fd0389d13 [0,0,0,1,0,0|0,0,0]=1 493 B15R2.888 C#CCN1Cc2ccccc2C[C@H]1C 7769150d4673d0812cbda996a9f23279 [0,0,0,1,0,0|0,0,0]=1 494 B15R2.888 C=CCN1Cc2ccccc2CC1C 20db9e225051a5cc4cba31b52ebbdcb7 [0,0,0,1,0,0|0,0,2]=3 495 B15R2.888 C=CCN1Cc2ccccc2C[C@@H]1C dc8fcd9ba8a6937823d68656e45bb52f [0,0,0,1,0,0|0,0,2]=3 496 B15R2.888 C=CCN1Cc2ccccc2C[C@H]1C a8b1eff94600d94169e9712aa4ba8cf8 [0,0,0,1,0,0|0,0,2]=3 497 B15R2.888 CC1Cc2ccccc2CN1CC#N ebd3bdc50c6ef683ce265fc81d32a9fa [0,0,0,1,0,0|1,0,0]=2 498 B15R2.888 CC1Cc2ccccc2CN1CC=O 429b3b6b5c89aa333a6c107fbb9ed3b3 [0,0,0,1,0,0|1,0,1]=3 499 B15R2.888 CC1Cc2ccccc2CN1CCF b26cec1b680e6165ec0b52aa8489e776 [0,0,0,1,0,0|1,0,1]=3 500 B15R2.888 CC1Cc2ccccc2CN1CCO 9c1685f0c8a074170a388b62dcb3b1c5 [0,0,0,1,0,0|1,0,1]=3 501 B15R2.888 CC1Cc2ccccc2CN1CCS 0b634a2927613fdb65caa93b93ce1194 [0,0,0,1,0,0|1,0,1]=3 502 B15R2.888 CCCN1Cc2ccccc2CC1C d4ce3c5f5006da117af6ab8be9400c6c [0,0,0,1,0,0|0,0,2]=3 503 B15R2.888 CCCN1Cc2ccccc2C[C@@H]1C 0ab3bef80b3547425b6fa7d573838b21 [0,0,0,1,0,0|0,0,2]=3 504 B15R2.888 CCCN1Cc2ccccc2C[C@H]1C 7271893d9bf61ffdfdbecba8dc0e5d50 [0,0,0,1,0,0|0,0,2]=3 505 B15R2.888 COCN1Cc2ccccc2CC1C d311123c7d90e7232b6c6f4bf331eaed [0,0,0,1,0,0|1,0,1]=3 506 B15R2.888 COCN1Cc2ccccc2C[C@@H]1C 138dafcac795f763eb5ec50d7ffd903f [0,0,0,1,0,0|1,0,1]=3 507 B15R2.888 COCN1Cc2ccccc2C[C@H]1C 71769540221e53f8c69919c0a4c05a0b [0,0,0,1,0,0|1,0,1]=3 508 B15R2.888 CSCN1Cc2ccccc2CC1C 25f16d0bebc4b4cf8df0a4cd272ede47 [0,0,0,1,0,0|1,0,1]=3 509 B15R2.888 CSCN1Cc2ccccc2C[C@@H]1C deec22e603978dfb088ffbc627c04e2b [0,0,0,1,0,0|1,0,1]=3 510 B15R2.888 CSCN1Cc2ccccc2C[C@H]1C 3b58f8e30572bf1a786b6e3ec48d12c5 [0,0,0,1,0,0|1,0,1]=3 511 B15R2.888 C[C@@H]1Cc2ccccc2CN1CC#N 44dad3a26b80dcac360e0eb45ceb9263 [0,0,0,1,0,0|1,0,0]=2 512 B15R2.888 C[C@@H]1Cc2ccccc2CN1CC=O 518af3a937ead6a6076cfd2c7e075145 [0,0,0,1,0,0|1,0,1]=3 513 B15R2.888 C[C@@H]1Cc2ccccc2CN1CCF 214720f80d85b9e68a0f77f68fd74f0b [0,0,0,1,0,0|1,0,1]=3 514 B15R2.888 C[C@@H]1Cc2ccccc2CN1CCO de9a72ea9fcd09c23b4ae1c9ebe0226d [0,0,0,1,0,0|1,0,1]=3 515 B15R2.888 C[C@@H]1Cc2ccccc2CN1CCS 17d8ee1c617ec02d73a6386b74f312bd [0,0,0,1,0,0|1,0,1]=3 516 B15R2.888 C[C@H]1Cc2ccccc2CN1CC#N af7b08d3e9b48ef8f0b56cfaa83364d5 [0,0,0,1,0,0|1,0,0]=2 517 B15R2.888 C[C@H]1Cc2ccccc2CN1CC=O 80b10167807b46548409061eb62a4ffa [0,0,0,1,0,0|1,0,1]=3 518 B15R2.888 C[C@H]1Cc2ccccc2CN1CCF 36d27ef0ab2b0868243f10d4346ffed3 [0,0,0,1,0,0|1,0,1]=3 519 B15R2.888 C[C@H]1Cc2ccccc2CN1CCO 9e8c0dc0281c9991c513dbba8e34a16b [0,0,0,1,0,0|1,0,1]=3 520 B15R2.888 C[C@H]1Cc2ccccc2CN1CCS 24c67e6725bf1bc24e87db9e48174e54 [0,0,0,1,0,0|1,0,1]=3 521 B15R2.1342 C#CCN(C)[C@@H]1C[C@H]1c2ccccc2 707c3b29af0414adaf68ae5704d9a71f [0,0,0,1,0,0|0,0,0]=1 522 B15R2.1342 C#CCN(C)[C@H]1C[C@@H]1c2ccccc2 b07012a70603a8b0e8199556ac1353e9 [0,0,0,1,0,0|0,0,0]=1 523 B15R2.1342 C=CCN(C)[C@@H]1C[C@H]1c2ccccc2 bbb43165108cf449e69152ef4957a888 [0,0,0,1,0,0|0,0,2]=3 524 B15R2.1342 C=CCN(C)[C@H]1C[C@@H]1c2ccccc2 78bd430d30e802c741c9e0b5d5edb6ff [0,0,0,1,0,0|0,0,2]=3 525 B15R2.1342 CC(CC#N)N1CC1c2ccccc2 f64f318d7f0834efbe2dfe1655218256 [0,0,0,1,0,0|3,0,0]=4 526 B15R2.1342 CC(CC#N)N1C[C@@H]1c2ccccc2 88c795bc6c1d3280bf602aeba1de4945 [0,0,0,1,0,0|3,0,0]=4 527 B15R2.1342 CCCN(C)[C@@H]1C[C@H]1c2ccccc2 c9eddceb5fa827e4461109f501366ff0 [0,0,0,1,0,0|0,0,2]=3 528 B15R2.1342 CCCN(C)[C@H]1C[C@@H]1c2ccccc2 e929ed8574b2575beda066aaa63d476f [0,0,0,1,0,0|0,0,2]=3 529 B15R2.1342 CN(CC#N)[C@@H]1C[C@H]1c2ccccc2 ecd60af81fb6be164d5094737f849c2c [0,0,0,1,0,0|1,0,0]=2 530 B15R2.1342 CN(CC#N)[C@H]1C[C@@H]1c2ccccc2 81a5811d1e73dc18077764cea9cbcd69 [0,0,0,1,0,0|1,0,0]=2 531 B15R2.1342 CN(CC=O)[C@@H]1C[C@H]1c2ccccc2 b24a90084f515937ee3677b0298b66f4 [0,0,0,1,0,0|1,0,1]=3 532 B15R2.1342 CN(CC=O)[C@H]1C[C@@H]1c2ccccc2 1c1996d37ecd4bfffd4741ed83444c63 [0,0,0,1,0,0|1,0,1]=3 533 B15R2.1342 CN(CCS)[C@@H]1C[C@H]1c2ccccc2 275b28a604a2f8407c62132ddff7e58b [0,0,0,1,0,0|1,0,1]=3 534 B15R2.1342 CN(CCS)[C@H]1C[C@@H]1c2ccccc2 a825108c44590747be58a47d238718dd [0,0,0,1,0,0|1,0,1]=3 535 B15R2.1342 COCN(C)[C@@H]1C[C@H]1c2ccccc2 3d38603e2f4102ebba10057ec62f2f7f [0,0,0,1,0,0|1,0,1]=3 536 B15R2.1342 COCN(C)[C@H]1C[C@@H]1c2ccccc2 b4209801f84d7464cc6dfa846d40a7d1 [0,0,0,1,0,0|1,0,1]=3 537 B15R2.1342 CSCN(C)[C@@H]1C[C@H]1c2ccccc2 69e999ba51bc81ca853ec9980bbeba14 [0,0,0,1,0,0|1,0,1]=3 538 B15R2.1342 CSCN(C)[C@H]1C[C@@H]1c2ccccc2 c759e8a1e09db0b603c49ca1a1693381 [0,0,0,1,0,0|1,0,1]=3 539 B15R2.1356 C#CCC(=O)N1Cc2ccccc2C1 8347589fe364f39327fde5950c21a71f [0,0,0,1,0,0|3,0,0]=4 540 B15R2.1356 C#CCN(C)c1nc2ccccc2[nH]1 6cc6bd3d882706d81f5c204036f2bb8e [0,0,0,1,0,0|2,0,1]=4 541 B15R2.1356 C#CCN(C)c1nc2ccccc2o1 86357ecf9115a4d839e5caee3eb1166f [0,0,0,1,0,0|2,0,1]=4 542 B15R2.1356 C#CCN(C)c1nc2ccccc2s1 e14a217d3f20c4332ef9ad03e5bba5f4 [0,0,0,1,0,0|2,0,1]=4 543 B15R2.1356 C=CCN(C)C1Cc2ccccc2C1 5a4ab157b8cc69f7a3a90e0a3016626b [0,0,0,1,0,0|0,0,2]=3 544 B15R2.1356 CC(CC#N)N1Cc2ccccc2C1 ffdee3f07ffd5963600b2376067a0ab6 [0,0,0,1,0,0|3,0,0]=4 545 B13R1.47 C#CCN(C)C(=O)c1ccccc1 31dac31ccb0c0638118c11b349c85bbc [0,0,0,0,1,0|1,0,1]=3 546 B13R1.47 C#CCN(C)C(=O)c1ccccn1 d9b6ed7c11a5bc6b0ece09260060b952 [0,0,0,0,1,0|2,0,1]=4 547 B13R1.47 C#CCN(C)C(=O)c1cccnc1 0848d6c23e0c68af0c47a273dbf613a6 [0,0,0,0,1,0|2,0,1]=4 548 B13R1.47 C#CCN(C)C(=O)c1ccncc1 2922013344893d97d29ba040afc7d142 [0,0,0,0,1,0|2,0,1]=4 549 B13R1.47 C#CCN(C)C(C)c1ccccn1 b1fda3dd372dd58e3934ea09930e2af2 [0,0,0,0,1,0|1,0,0]=2 550 B13R1.47 C#CCN(C)C(C)c1ccncc1 305b3f21af1d9665ea27630f481014b7 [0,0,0,0,1,0|1,0,0]=2 551 B13R1.47 C#CCN(C)C(C)c1ccncn1 ee7008d48a8e86ab7611939df88d5e44 [0,0,0,0,1,0|2,0,0]=3 552 B13R1.47 C#CCN(C)[C@@H](C)c1ccncc1 c0131ca469325e29703e79995889d302 [0,0,0,0,1,0|1,0,0]=2 553 B13R1.47 C=CCN(C)C(C)c1ccccc1 2e7571f5b5ca85d6c4876254f45feb03 [0,0,0,0,1,0|0,0,2]=3 554 B13R1.47 C=CCN(C)C(C)c1ccccn1 ad5f78bbbeb6fd3987254147d1f8c5c8 [0,0,0,0,1,0|1,0,2]=4 555 B13R1.47 C=CCN(C)C(C)c1cccnc1 6c42f60ac4d8af670f3df8b80bc6cf38 [0,0,0,0,1,0|1,0,2]=4 556 B13R1.47 C=CCN(C)C(C)c1ccncc1 bbe762460b9d64fc6a138dafc95693f4 [0,0,0,0,1,0|1,0,2]=4 557 B13R1.47 C=CCN(C)[C@@H](C)c1ccccc1 abfaed4bd3a8382009351ac91a7f7b49 [0,0,0,0,1,0|0,0,2]=3 558 B13R1.47 C=CCN(C)[C@@H](C)c1ccncc1 b99e5919c3136d62a6dfbbd5fb327a6c [0,0,0,0,1,0|1,0,2]=4 559 B13R1.47 C=CCN(C)[C@H](C)c1ccccc1 1c522a676124aba5b5c92e8f80f81359 [0,0,0,0,1,0|0,0,2]=3 560 B13R1.47 CC(CC#N)N(C)c1ccccc1 b1c90d954b2486948703965bdfd3306e [0,0,0,0,1,0|3,0,0]=4 561 B13R1.47 CC(c1ccccc1)N(C)CC=O 1ce181373083ea400cf0571b778bb4da [0,0,0,0,1,0|1,0,1]=3 562 B13R1.47 CC(c1ccccn1)N(C)CC#N d98f59308eadf55f34ac52fd3005a48e [0,0,0,0,1,0|2,0,0]=3 563 B13R1.47 CC(c1ccccn1)N(C)CC=O 7312bfc3590ab9aa28e2a425c5b649f0 [0,0,0,0,1,0|2,0,1]=4 564 B13R1.47 CC(c1ccccn1)N(C)CCF 76878aa536f41e38bf3e339aa59589df [0,0,0,0,1,0|2,0,1]=4 565 B13R1.47 CC(c1ccccn1)N(C)CCS 449fdef5648e05c1eee082a43a184df8 [0,0,0,0,1,0|2,0,1]=4 566 B13R1.47 CC(c1cccnc1)N(C)CC#N 53c98ca41a05232b18c582babb41e5c5 [0,0,0,0,1,0|2,0,0]=3 567 B13R1.47 CC(c1cccnc1)N(C)CC=O 5eed25f6bfb8ff46a024c08bac6beaad [0,0,0,0,1,0|2,0,1]=4 568 B13R1.47 CC(c1ccncc1)N(C)CC#N 4b9c013839d36bf083932b25c4f9f11f [0,0,0,0,1,0|2,0,0]=3 569 B13R1.47 CC(c1ccncc1)N(C)CC=O 39da3c3ca6aaf1df0ee7c79fca3fcab9 [0,0,0,0,1,0|2,0,1]=4 570 B13R1.47 CC(c1ccncc1)N(C)CCF 708615f6bdd609b7d535b908618db692 [0,0,0,0,1,0|2,0,1]=4 571 B13R1.47 CC(c1ccncc1)N(C)CCS e47810dd92e063b898e2ed61dc78bccd [0,0,0,0,1,0|2,0,1]=4 572 B13R1.47 CC(c1ccncn1)N(C)CC#N 0a02da9171d9fbed2e0282ab6e62af30 [0,0,0,0,1,0|3,0,0]=4 573 B13R1.47 CCCN(C)C(C)c1ccccn1 36d594dacd9fc57df30b5e41f8fab5cd [0,0,0,0,1,0|1,0,2]=4 574 B13R1.47 CCCN(C)C(C)c1ccncc1 5b427653d0f9fa885ddf04779eb19f1e [0,0,0,0,1,0|1,0,2]=4 575 B13R1.47 CCCN(C)[C@@H](C)c1ccncc1 c012bd3332c5b53eb01136a2f6253d02 [0,0,0,0,1,0|1,0,2]=4 576 B13R1.47 CN(CC#N)C(=O)c1ccccc1 25d19f3c9dcfe88ddc67f4ada6b60c90 [0,0,0,0,1,0|2,0,1]=4 577 B13R1.47 COCN(C)C(C)c1ccccn1 f7578e27504d5e126ddf4f03d9443c5d [0,0,0,0,1,0|2,0,1]=4 578 B13R1.47 COCN(C)C(C)c1cccnc1 62cff4d0e7e3dd6675d927e16d276899 [0,0,0,0,1,0|2,0,1]=4 579 B13R1.47 COCN(C)C(C)c1ccncc1 b7eb9d97783aa8139c9f4c034d593a2c [0,0,0,0,1,0|2,0,1]=4 580 B13R1.47 COCN(C)[C@@H](C)c1ccncc1 3a8bd46de4c82de8b962e1148974c0af [0,0,0,0,1,0|2,0,1]=4 581 B13R1.47 CSCN(C)C(C)c1ccccn1 21dda18c793c97a87de63311256233f3 [0,0,0,0,1,0|2,0,1]=4 582 B13R1.47 CSCN(C)C(C)c1ccncc1 0e1279d951beea1961bfe3ba5bc5dc62 [0,0,0,0,1,0|2,0,1]=4 583 B13R1.47 CSCN(C)[C@@H](C)c1ccncc1 c4de85b13f7394a2db04fc27d3552890 [0,0,0,0,1,0|2,0,1]=4 584 B13R1.47 C[C@@H](c1ccccc1)N(C)CC=O 37e311d6bbe80a63a70a65a2c9b9cf7a [0,0,0,0,1,0|1,0,1]=3 585 B13R1.47 C[C@@H](c1ccncc1)N(C)CC#N 7fef5cd380c8d21bb0cc4ce4bae30cb4 [0,0,0,0,1,0|2,0,0]=3 586 B13R1.47 C[C@@H](c1ccncc1)N(C)CC=O 9899ba2f47280c76044bb496660fa1e7 [0,0,0,0,1,0|2,0,1]=4 587 B13R1.47 C[C@@H](c1ccncc1)N(C)CCF 22d7adb43a6c86383b27a3cb94f94be8 [0,0,0,0,1,0|2,0,1]=4 588 B13R1.47 C[C@@H](c1ccncc1)N(C)CCS 0734ecc8378942425a55157e258908fc [0,0,0,0,1,0|2,0,1]=4 589 B13R1.47 C[C@H](c1ccccc1)N(C)CC=O 217324e581ec9c77f96593abc7246ee0 [0,0,0,0,1,0|1,0,1]=3 590 B13R1.66 C#CCN(C)C(=O)Cc1ccco1 581ccb3ccec8937e2ad7c3d08371d01c [0,0,0,0,1,0|2,0,1]=4 591 B13R1.66 C#CCN(C)C(=O)Cc1cccs1 8fad34af5e23889348becc1528705a18 [0,0,0,0,1,0|2,0,1]=4 592 B13R1.66 C#CCN(C)C(=O)Cc1ccoc1 1bc62d8030b2340d9b9d792884149c56 [0,0,0,0,1,0|2,0,1]=4 593 B13R1.66 C#CCN(C)C(=O)Cc1ccsc1 e1bb132e92bb284cc2048eede76a249e [0,0,0,0,1,0|2,0,1]=4 594 B13R1.66 C#CCN(C)C(=O)Cn1cccc1 8481d8c70f150b166fb083986c0a61b9 [0,0,0,0,1,0|2,0,1]=4 595 B15R1.809 C#CCC(=O)NC(C)Cc1ccccn1 c42b6073e188ec4cd77ccc02c8d97bf8 [0,0,0,0,0,1|3,0,0]=4 596 B15R1.809 C#CCC(=O)NC(C)Cc1cccnc1 9b697babe3a3a32c5b063101b46d9c21 [0,0,0,0,0,1|3,0,0]=4 597 B15R1.809 C#CCC(=O)NC(C)Cc1ccncc1 55a3c23a204971d8aae98f2424a1857c [0,0,0,0,0,1|3,0,0]=4 598 B15R1.809 C#CCN(C)CC(=O)Cc1ccccc1 73a6c9eea0e2db3181774209b4f3b5aa [0,0,0,0,0,1|1,0,1]=3 599 B15R1.809 C#CCN(C)CC(=O)Nc1ccccc1 bca3fe6bf440b41b20208451ce39e404 [0,0,0,0,0,1|2,0,1]=4 600 B15R1.809 C#CCN(C)CC(=O)Oc1ccccc1 612d018d32361610328d9d8e8c1830bc [0,0,0,0,0,1|2,0,1]=4 601 B15R1.809 C=CCC(C)OC(C)Cc1ccccc1 be4ffe80fa6f3151a3a2277e2388fce5 [0,0,0,0,0,1|1,0,2]=4 602 B15R1.809 C=CCN(C)CC(O)Cc1ccccc1 351d456c79f65fdc6f8a6e7b9a65e8ad [0,0,0,0,0,1|1,0,2]=4 603 B15R1.809 C=CCN(C)C[C@@H](O)Cc1ccccc1 fdb526de015b4a259c6bfa98ae5bd071 [0,0,0,0,0,1|1,0,2]=4 604 B15R1.809 C=CC[C@@H](C)OC(C)Cc1ccccc1 2107d4aa3a9178e235574b936d5ee820 [0,0,0,0,0,1|1,0,2]=4 605 B15R1.809 C=CC[C@H](C)OC(C)Cc1ccccc1 aee2f52bf6fc6e6fe0216b58b3e0e4f1 [0,0,0,0,0,1|1,0,2]=4 606 B15R1.809 CC#CC(C)OC(C)Cc1ccccc1 d0c6e571cf42ba52a4f301f3056a8a35 [0,0,0,0,0,1|1,0,2]=4 607 B15R1.809 CC(CC#N)NC(C)Cc1ccccn1 0ab153ce7537f21caf9706551cbc44b1 [0,0,0,0,0,1|3,0,0]=4 608 B15R1.809 CC(CC#N)NC(C)Cc1cccnc1 3fd26f639b3ec4d19a3986b39f80fbc8 [0,0,0,0,0,1|3,0,0]=4 609 B15R1.809 CC(CC#N)NC(C)Cc1ccncc1 555cc38e5161b20222be2f473234d597 [0,0,0,0,0,1|3,0,0]=4 610 B15R1.809 CC(CC#N)OC(C)Cc1ccccc1 ad74f3f988bca1ee5b519a90348ad04b [0,0,0,0,0,1|2,0,0]=3 611 B15R1.809 CC(CC#N)OC(C)Cc1ccccn1 400fb86831451d11b9defaf9648793af [0,0,0,0,0,1|3,0,0]=4 612 B15R1.809 CC(CC#N)O[C@@H](C)Cc1ccccc1 cc2b39be19f760fe1727af8faaa2c4a3 [0,0,0,0,0,1|2,0,0]=3 613 B15R1.809 CC(CC#N)O[C@H](C)Cc1ccccc1 aa9d109ef27eb9585d60958dacbadf64 [0,0,0,0,0,1|2,0,0]=3 614 B15R1.809 CN(CC#N)CC(=O)Cc1ccccc1 a9c3952c12ed7d49fb9a808741a8c362 [0,0,0,0,0,1|2,0,1]=4 615 B15R1.809 COCC(C)OC(C)Cc1ccccc1 17b3b8e6a28cd1c2f4e0f0c1ff85dd7f [0,0,0,0,0,1|2,0,1]=4 616 B15R1.809 COCC(C)O[C@@H](C)Cc1ccccc1 cad5a713f6499a5bc5512dadec22ea7c [0,0,0,0,0,1|2,0,1]=4 617 B15R1.809 COCC(C)O[C@H](C)Cc1ccccc1 32c808197543ae59309408c81b391e81 [0,0,0,0,0,1|2,0,1]=4 618 B15R1.826 C#CCC(=O)N(C)CCc1ccccc1 cd39c2101706c2fd203a32b4e8c3648d [0,0,0,0,0,1|3,0,0]=4 619 B15R1.826 C#CCN(C)C(=O)/C=C/c1ccccc1 3610958fe68e09eaf651eb76851ff6e7 [0,0,0,0,0,1|1,0,2]=4 620 B15R1.826 C#CCN(C)C(=O)C#Cc1ccccc1 af7f1840561335fb946efcdbf890c702 [0,0,0,0,0,1|1,0,2]=4 621 B15R1.826 C#CCN(C)C(=O)C=Cc1ccccc1 56660a02f9731690a10281b723636c63 [0,0,0,0,0,1|1,0,2]=4 622 B15R1.826 C#CCN(C)C(=O)CCc1ccccc1 ad967460b1927477815b6cd8915fba57 [0,0,0,0,0,1|1,0,1]=3 623 B15R1.826 C#CCN(C)C(=O)CCc1ccccn1 399cde870dc37da46ff88b29328a6ae0 [0,0,0,0,0,1|2,0,1]=4 624 B15R1.826 C#CCN(C)C(=O)CCc1cccnc1 5fda8f4cadbc4ab483f657c4c7a1b732 [0,0,0,0,0,1|2,0,1]=4 625 B15R1.826 C#CCN(C)C(=O)CCc1ccncc1 6c6ead5a3f8bc4817c35dceac29b697b [0,0,0,0,0,1|2,0,1]=4 626 B15R1.826 C#CCN(C)C(=O)COc1ccccc1 1d0a19acfd3ac39e7c7de80ea6203724 [0,0,0,0,0,1|1,0,1]=3 627 B15R1.826 C#CCN(C)C(=O)COc1ccccn1 11118002df81f05c8af9fb617534cffa [0,0,0,0,0,1|2,0,1]=4 628 B15R1.826 C#CCN(C)C(=O)COc1cccnc1 fdb515c212c64acbe611a416bbe024b5 [0,0,0,0,0,1|2,0,1]=4 629 B15R1.826 C#CCN(C)C(=O)COc1ccncc1 1f81aeed085911f0b633ead91d07922f [0,0,0,0,0,1|2,0,1]=4 630 B15R1.826 C#CCN(C)C(=O)CSc1ccccc1 ce00e3b2153e2955ac218dee890b6f2f [0,0,0,0,0,1|1,0,1]=3 631 B15R1.826 C#CCN(C)C(=O)CSc1ccccn1 f9c913df5e7baf2cb265a0799dda1043 [0,0,0,0,0,1|2,0,1]=4 632 B15R1.826 C#CCN(C)C(=O)CSc1ccncc1 046171b9df59b47932f0ba7c65322898 [0,0,0,0,0,1|2,0,1]=4 633 B15R1.826 C#CCN(C)C(=O)NCc1ccccc1 b444c7c9a319dd6829d701241f4664d6 [0,0,0,0,0,1|1,0,1]=3 634 B15R1.826 C#CCN(C)C(=O)NCc1ccccn1 4ecc6bd98d34aa78886f080c9394b37e [0,0,0,0,0,1|2,0,1]=4 635 B15R1.826 C#CCN(C)C(=O)NCc1cccnc1 da19f9852ac2c20044968bd7b9f53926 [0,0,0,0,0,1|2,0,1]=4 636 B15R1.826 C#CCN(C)C(=O)NCc1ccncc1 0edab7a4966656f5a7778a04571e8be0 [0,0,0,0,0,1|2,0,1]=4 637 B15R1.826 C#CCN(C)C(=S)NCc1ccccc1 87d7f79d07e8b35471755388a11c8325 [0,0,0,0,0,1|1,0,1]=3 638 B15R1.826 C#CCN(C)C(=S)NCc1ccccn1 52cc4508c1788e86bb52d710482367ac [0,0,0,0,0,1|2,0,1]=4 639 B15R1.826 C#CCN(C)C(=S)NCc1cccnc1 aec15494129e669a5cc0f1a770a1c49a [0,0,0,0,0,1|2,0,1]=4 640 B15R1.826 C#CCN(C)C(=S)NCc1ccncc1 974c098fb1a0c06f8c5cfe7d4e94b2a9 [0,0,0,0,0,1|2,0,1]=4 641 B15R1.826 C#CCN(C)C(C)CCc1ccccc1 d742f5065dcbaa9ea6ba39ccea04b53c [0,0,0,0,0,1|0,0,0]=1 642 B15R1.826 C#CCN(C)C(C)COc1ccccc1 599f64ba659350a21d8013acfdb0719f [0,0,0,0,0,1|0,0,0]=1 643 B15R1.826 C=CCN(C)C(C)CCc1ccccc1 c0072e5850467b23a5e721718dfbd79d [0,0,0,0,0,1|0,0,2]=3 644 B15R1.826 C=CCN(C)C(C)COc1ccccc1 0b78a85e57696a6ab8f7c829bbbf265f [0,0,0,0,0,1|0,0,2]=3 645 B15R1.826 CC(CC#N)N(C)CCc1ccccc1 e518afca8e6442da4f98569776d89106 [0,0,0,0,0,1|3,0,0]=4 646 B15R1.826 CC(CCc1ccccc1)N(C)CCF db751bd37982c27ec8d648ad7387dd9e [0,0,0,0,0,1|1,0,1]=3 647 B15R1.826 CC(COc1ccccc1)N(C)CCF e4dfc5f0f8f97da3f740e6213398ac5b [0,0,0,0,0,1|1,0,1]=3 648 B15R1.826 CCCN(C)C(C)COc1ccccc1 914714ab976dea0c002d70b484245393 [0,0,0,0,0,1|0,0,2]=3 649 B15R1.826 CN(CC#N)C(=O)CCc1ccccc1 eb88039a8aa01d5e542009758847f602 [0,0,0,0,0,1|2,0,1]=4 650 B15R1.826 CN(CC#N)C(=O)COc1ccccc1 26a603381cfb9fe1da2038d30538667e [0,0,0,0,0,1|2,0,1]=4 651 B15R1.826 CN(CC#N)C(=O)CSc1ccccc1 448808ebc3713d3c64973bfda4729cf2 [0,0,0,0,0,1|2,0,1]=4 652 B15R1.826 CN(CC#N)C(=O)NCc1ccccc1 25edd59d7068846013128401b800ec8b [0,0,0,0,0,1|2,0,1]=4 653 B15R1.826 CN(CC#N)C(=S)NCc1ccccc1 176e4d4bb1cb87dca3725a15c1f8037f [0,0,0,0,0,1|2,0,1]=4 654 B12R1.8 BrCCNCCc1ccccc1 44438bbdc203ba2a96e00daceba19cdb [2,0,0,0,0,0|1,0,1]=4 655 B12R1.8 C#CCCCNc1ccccc1 74fc175421dbc3b424699e770c0c2fc6 [2,0,0,0,0,0|2,0,0]=4 656 B12R1.8 C#CCCNCc1ccccc1 9efcf95ab875a3743cf2704fb10ab2d7 [2,0,0,0,0,0|2,0,0]=4 657 B12R1.8 C#CCCOCc1ccccc1 97bbe114df19205ca39f984806a809da [2,0,0,0,0,0|2,0,0]=4 658 B12R1.8 C#CCNCCc1ccccc1 92e5ef2f7dd8ca50296fc5c10a5e2140 [2,0,0,0,0,0|0,0,0]=2 659 B12R1.8 C#CCNCCc1ccccn1 e1cf6dd033aadde6da07434202745395 [2,0,0,0,0,0|1,0,0]=3 660 B12R1.8 C#CCNCCc1cccnc1 e60b4d1abf32bb9fd8746da8f436489d [2,0,0,0,0,0|1,0,0]=3 661 B12R1.8 C#CCNCCc1ccncc1 c64471921438c4519b11dff9e39caf1f [2,0,0,0,0,0|1,0,0]=3 662 B12R1.8 C#CCNCCc1ccncn1 f2e94ad7ac8da7a87b357b1bd3423161 [2,0,0,0,0,0|2,0,0]=4 663 B12R1.8 C#CCNCCc1cnccn1 63aaba78d37ccba31c11b968d1aeade4 [2,0,0,0,0,0|2,0,0]=4 664 B12R1.8 C#CCNCCc1ncccn1 7d6aa83eaba903818f0de22466067e77 [2,0,0,0,0,0|2,0,0]=4 665 B12R1.8 C#CCOCCc1ccccc1 1e82b640f7f45e3a6d3d3fcd5bd127f6 [2,0,0,0,0,0|1,0,0]=3 666 B12R1.8 C#CCOCCc1ccccn1 9893f75bd965843947744e3b27cc7da1 [2,0,0,0,0,0|2,0,0]=4 667 B12R1.8 C#CCOCCc1cccnc1 d7ccc976f9d62df6e2aab2082fe6ddfb [2,0,0,0,0,0|2,0,0]=4 668 B12R1.8 C#CCOCCc1ccncc1 5e03604e158db99f11ef01f90386ed59 [2,0,0,0,0,0|2,0,0]=4 669 B12R1.8 C=CCNCCc1ccccc1 e4db187976e48a8658dbc174b43f52d7 [2,0,0,0,0,0|0,0,2]=4 670 B12R1.8 CCCNCCc1ccccc1 de4634a5b10be0583379bf36a55fd975 [2,0,0,0,0,0|0,0,2]=4 671 B12R1.8 COCNCCc1ccccc1 a912e7467b1cfbc21e322d32a6dcd9f6 [2,0,0,0,0,0|1,0,1]=4 672 B12R1.8 CSCNCCc1ccccc1 8cb9946ee650f17d4a684e0a1795e862 [2,0,0,0,0,0|1,0,1]=4 673 B12R1.8 FCCNCCc1ccccc1 361355d651ba3401fa85cac238cfdb0b [2,0,0,0,0,0|1,0,1]=4 674 B12R1.8 ICCNCCc1ccccc1 3d43af0eb4bc8ed1c19be50fd2591b44 [2,0,0,0,0,0|1,0,1]=4 675 B12R1.8 N#CCNCCc1ccccc1 196965f1ea9924e72f23b610f5ed5162 [2,0,0,0,0,0|1,0,0]=3 676 B12R1.8 N#CCNCCc1ccccn1 163b09df21cb199dae55caf11c578544 [2,0,0,0,0,0|2,0,0]=4 677 B12R1.8 N#CCNCCc1cccnc1 16954d72667e4e911286fe1fd74ebb45 [2,0,0,0,0,0|2,0,0]=4 678 B12R1.8 N#CCNCCc1ccncc1 f33c4f1b8764efe9a51017b3091f844f [2,0,0,0,0,0|2,0,0]=4 679 B12R1.8 N#CCOCCc1ccccc1 f710fd753c514569a7e1cf024d236cec [2,0,0,0,0,0|2,0,0]=4 680 B12R1.8 O=CCNCCc1ccccc1 7b8a13082bcfdef296ce3280285f19f6 [2,0,0,0,0,0|1,0,1]=4 681 B12R1.8 OCCNCCc1ccccc1 6832b0d8880be8700c4d8c29ed63036c [2,0,0,0,0,0|1,0,1]=4 682 B12R1.8 SCCNCCc1ccccc1 77f9cf13a4d370b17f1b8a888b3044b3 [2,0,0,0,0,0|1,0,1]=4 683 B12R1.27 C#CC(C)NCc1ccccc1 0c823c8410acc72523ada4697880703b [2,0,0,0,0,0|2,0,0]=4 684 B12R1.27 C#CC(C)OCc1ccccc1 f6359202a87cde289007d81369eaa165 [2,0,0,0,0,0|2,0,0]=4 685 B12R1.27 C#C[C@@H](C)NCc1ccccc1 51fd06b5dc99f337c53516eb04becf75 [2,0,0,0,0,0|2,0,0]=4 686 B12R1.27 C#C[C@@H](C)OCc1ccccc1 5a1f683c3ddc74682e7065902596ab4b [2,0,0,0,0,0|2,0,0]=4 687 B12R1.27 C#C[C@H](C)NCc1ccccc1 5c0b47a0f6d5613da204666041aaf216 [2,0,0,0,0,0|2,0,0]=4 688 B12R1.27 C#C[C@H](C)OCc1ccccc1 760d62af860bc17bf4194987b15f5245 [2,0,0,0,0,0|2,0,0]=4 689 B12R1.27 CCN(C)CCc1ccccc1 7c4ca4f684c66e96c63c7f2e129ac623 [2,0,0,0,0,0|0,0,1]=3 690 B12R1.27 CCN(C)CCc1ccccn1 2fc992e6b94f2894c06f88d1be2c6eae [2,0,0,0,0,0|1,0,1]=4 691 B12R1.27 CCN(C)CCc1cccnc1 8f102e3d75ada77333a942e239825207 [2,0,0,0,0,0|1,0,1]=4 692 B12R1.27 CCN(C)CCc1ccncc1 b74613155a01263f6023f3efd6abab19 [2,0,0,0,0,0|1,0,1]=4 693 B12R1.27 CN(C=O)CCc1ccccc1 9fb02e1cb373d4704048d9ef6c04ee21 [2,0,0,0,0,0|1,0,1]=4 694 B12R1.27 CN(CF)CCc1ccccc1 af958a660e6bf737d02c2dfab1bc467d [2,0,0,0,0,0|1,0,0]=3 695 B12R1.27 CN(CF)CCc1ccccn1 e47249cec0a9e47647623cac83a45a8e [2,0,0,0,0,0|2,0,0]=4 696 B12R1.27 CN(CF)CCc1cccnc1 e55726a3c32e233d630a4f29602b811f [2,0,0,0,0,0|2,0,0]=4 697 B12R1.27 CN(CF)CCc1ccncc1 6e2d36b26079cda0d2af1bea77a09d35 [2,0,0,0,0,0|2,0,0]=4 698 B12R1.27 CN(CO)CCc1ccccc1 c9a67cdf713e4c874ec2d63ed5e8590a [2,0,0,0,0,0|1,0,0]=3 699 B12R1.27 CN(CO)CCc1ccccn1 aa0d4ac6d05fc927494412ee9fe9c7cc [2,0,0,0,0,0|2,0,0]=4 700 B12R1.27 CN(CO)CCc1cccnc1 b13669a1ddf1ac46ef1460e055843b9e [2,0,0,0,0,0|2,0,0]=4 701 B12R1.27 CN(CO)CCc1ccncc1 d571b134ccefa2efaeb2d36d2248e45c [2,0,0,0,0,0|2,0,0]=4 702 B12R1.32 C#CCN(C)Cc1ccccc1 e56580931f8cdab6398e6e077f7d4a03 [2,0,0,0,0,0|1,0,0]=3 703 B12R1.32 C#CCN(C)Cc1ccccn1 f145763fba53098f3e320f234a5cab86 [2,0,0,0,0,0|2,0,0]=4 704 B12R1.32 C#CCN(C)Cc1cccnc1 6a0e8980e1db38379d45f813996daa18 [2,0,0,0,0,0|2,0,0]=4 705 B12R1.32 C#CCN(C)Cc1ccncc1 ab6e9ad74b9d390aee55cc92598ed193 [2,0,0,0,0,0|2,0,0]=4 706 B12R1.32 CC(CC#N)Nc1ccccc1 9d497ef86eee6b3cf19732b73151dfc5 [2,0,0,0,0,0|2,0,0]=4 707 B12R1.32 CC(Cc1ccccn1)NCF d5fdd6b98c347b6317b5d0d8cf3c28b6 [2,0,0,0,0,0|2,0,0]=4 708 B12R1.32 CC(Cc1ccccn1)NCO eb641c414d0b15108bf9321647b7890c [2,0,0,0,0,0|2,0,0]=4 709 B12R1.32 CC(Cc1cccnc1)NCF 0a8331e6b65f8d98e5c22c4682170fe6 [2,0,0,0,0,0|2,0,0]=4 710 B12R1.32 CC(Cc1cccnc1)NCO 2d1e9d214ab4e58b5282fe30111314e4 [2,0,0,0,0,0|2,0,0]=4 711 B12R1.32 CC(Cc1ccncc1)NCF 552d22a85f958469339986039ae7dce3 [2,0,0,0,0,0|2,0,0]=4 712 B12R1.32 CC(Cc1ccncc1)NCO def23991f96c3f6436149b61afb90490 [2,0,0,0,0,0|2,0,0]=4 713 B12R1.32 CCNC(C)Cc1ccccn1 3f739570fdaf944ffb41444c69149a83 [2,0,0,0,0,0|1,0,1]=4 714 B12R1.32 CCNC(C)Cc1cccnc1 1c73ce06501092b14624237b8eaa830e [2,0,0,0,0,0|1,0,1]=4 715 B12R1.32 CCNC(C)Cc1ccncc1 1ac39eab33f6c8633237d01993a17382 [2,0,0,0,0,0|1,0,1]=4 716 B12R1.32 CCOC(C)Cc1ccccc1 37a2c2b5ef50b1a7cf2088b7456e4451 [2,0,0,0,0,0|1,0,1]=4 717 B12R1.32 CCO[C@@H](C)Cc1ccccc1 19276107fa4d022850aeee4089dafd0c [2,0,0,0,0,0|1,0,1]=4 718 B12R1.32 CCO[C@H](C)Cc1ccccc1 2f8e91d1dc9d2f9667dcff63e87e082c [2,0,0,0,0,0|1,0,1]=4 719 B12R1.32 CN(CC#N)Cc1ccccc1 5c32846a8b8f40e8ba55bc3d3a77884c [2,0,0,0,0,0|2,0,0]=4 720 B12R1.43 CC(C)C(C)Nc1ccccc1 48093fab6ce2f9bea5eaf7557d6a555a [2,0,0,0,0,0|2,0,0]=4 721 B12R1.43 CC(C)N(C)Cc1ccccc1 d5edd43e495581ab07d4c878cf7efc6a [2,0,0,0,0,0|2,0,0]=4 722 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 638de983f09ad8573a19e829866f679b [2,0,0,0,0,0|2,0,0]=4 723 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 37a4cc2968d8598e2dd44bb0f3ee65d4 [2,0,0,0,0,0|2,0,0]=4 724 B14R1.29 C#CCN(C)CC(=C)c1ccccc1 e91e4f09ed3b3ab946694d2d0b1ce0ed [1,1,0,0,0,0|0,0,1]=3 725 B14R1.29 C#CCN(C)CC(=O)c1ccccc1 a0e33e215556c8b2984637ac5c9da79a [1,1,0,0,0,0|0,0,1]=3 726 B14R1.29 C#CCN(C)CC(=O)c1ccccn1 dce96ad19d4d45a1aae983e16729acaa [1,1,0,0,0,0|1,0,1]=4 727 B14R1.29 C#CCN(C)CC(=O)c1cccnc1 a42cf169a4d72f6132de491eb88eeeb8 [1,1,0,0,0,0|1,0,1]=4 728 B14R1.29 C#CCN(C)CC(C)c1ccccc1 9dbf52e6d8925530573dfb75be96e40e [1,1,0,0,0,0|0,0,0]=2 729 B14R1.29 C#CCN(C)CC(F)c1ccccc1 fbe3a7ff7afa575e2a89bde5e0b4e0a1 [1,1,0,0,0,0|0,0,0]=2 730 B14R1.29 C#CCN(C)CC(O)c1ccccc1 f86fcdad35b72c238c688a601e76a703 [1,1,0,0,0,0|0,0,0]=2 731 B14R1.29 C#CCN(C)CC(O)c1ccncc1 1d99fe07c2f0e1115e870ddd441c9790 [1,1,0,0,0,0|1,0,0]=3 732 B14R1.29 C#CCN(C)CC(O)c1cnccn1 6b6354f5ce1f65bb56fb182b9a2245f4 [1,1,0,0,0,0|2,0,0]=4 733 B14R1.29 C#CCN(C)C[C@@H](C)c1ccccc1 42d752da39f7394539683072a6ee25bb [1,1,0,0,0,0|0,0,0]=2 734 B14R1.29 C#CCN(C)C[C@@H](O)c1ccccc1 a663538734d2b367652bd13677d67406 [1,1,0,0,0,0|0,0,0]=2 735 B14R1.29 C#CCN(C)C[C@H](O)c1ccccc1 75b4eaa33c8650edd10ecbb079d4eaa4 [1,1,0,0,0,0|0,0,0]=2 736 B14R1.29 C=C(CN(C)CC#N)c1ccccc1 009a9bde57351d731edfb6299d404354 [1,1,0,0,0,0|1,0,1]=4 737 B14R1.29 C=CCN(C)CC(C)c1ccccc1 c7e8f81163c79bd252d3a29d8cd8cbde [1,1,0,0,0,0|0,0,2]=4 738 B14R1.29 C=CCN(C)CC(F)c1ccccc1 9a56b82de1db62ae90ec871e63b95df1 [1,1,0,0,0,0|0,0,2]=4 739 B14R1.29 C=CCN(C)CC(O)c1ccccc1 8496ab5e49d6063bba059e5d805c87ec [1,1,0,0,0,0|0,0,2]=4 740 B14R1.29 C=CCN(C)C[C@@H](C)c1ccccc1 c766011c7fa2d64c62840b3d2447c6b6 [1,1,0,0,0,0|0,0,2]=4 741 B14R1.29 C=CCN(C)C[C@@H](O)c1ccccc1 c647395c9030d5e8303868865801b0f1 [1,1,0,0,0,0|0,0,2]=4 742 B14R1.29 C=CCN(C)C[C@H](O)c1ccccc1 144ea471ed663867a90ffbc776d3019e [1,1,0,0,0,0|0,0,2]=4 743 B14R1.29 CC(CN(C)CC#N)c1ccccc1 2cb46c4ef49ab72705abd18b35b84730 [1,1,0,0,0,0|1,0,0]=3 744 B14R1.29 CC(CN(C)CCF)c1ccccc1 140970528aaea690fe5f783431a111f7 [1,1,0,0,0,0|1,0,1]=4 745 B14R1.29 CC(CN(C)CCO)c1ccccc1 edb6a4ffe94ea59a63300029644c100a [1,1,0,0,0,0|1,0,1]=4 746 B14R1.29 CCCN(C)CC(O)c1ccccc1 b90a1dc84cbcfac4dcf7ff788c68d2dc [1,1,0,0,0,0|0,0,2]=4 747 B14R1.29 CCCN(C)C[C@H](O)c1ccccc1 5e312c0a98e57adca5f81aea162253cf [1,1,0,0,0,0|0,0,2]=4 748 B14R1.29 CN(CC#N)CC(=O)c1ccccc1 d11549a871fd19977b8bdfa04c046249 [1,1,0,0,0,0|1,0,1]=4 749 B14R1.29 CN(CC#N)CC(F)c1ccccc1 3bc981bf6a182582d439b8e840ca7fa5 [1,1,0,0,0,0|1,0,0]=3 750 B14R1.29 CN(CC#N)CC(O)c1ccccc1 19a6b3b1837e6c672ec5df43d8fecd39 [1,1,0,0,0,0|1,0,0]=3 751 B14R1.29 CN(CC#N)CC(O)c1ccncc1 8669f1d758476403ba1131d0b8142f62 [1,1,0,0,0,0|2,0,0]=4 752 B14R1.29 CN(CC#N)C[C@@H](O)c1ccccc1 7b0b3395d325f83091c0a7ffb34bfe75 [1,1,0,0,0,0|1,0,0]=3 753 B14R1.29 CN(CC#N)C[C@H](O)c1ccccc1 2f6a0568140ffbd1761198921efa77d3 [1,1,0,0,0,0|1,0,0]=3 754 B14R1.29 CN(CC=O)CC(O)c1ccccc1 d6068d50d6b05ecb012939a189d508d8 [1,1,0,0,0,0|1,0,1]=4 755 B14R1.29 CN(CC=O)C[C@H](O)c1ccccc1 433f1342591288635d4c30a983ff8e34 [1,1,0,0,0,0|1,0,1]=4 756 B14R1.29 CN(CCF)CC(O)c1ccccc1 edd12d1d9a080bc7a8ef5b60585f26c1 [1,1,0,0,0,0|1,0,1]=4 757 B14R1.29 CN(CCF)C[C@H](O)c1ccccc1 00abfe292d122e3f570ab8427ef8caa8 [1,1,0,0,0,0|1,0,1]=4 758 B14R1.29 CN(CCO)CC(O)c1ccccc1 cc94471c57a33dd17330aae3a8bb5ab3 [1,1,0,0,0,0|1,0,1]=4 759 B14R1.29 CN(CCO)C[C@H](O)c1ccccc1 9145f290e70408a94f719176421f344d [1,1,0,0,0,0|1,0,1]=4 760 B14R1.29 CN(CCS)CC(O)c1ccccc1 e2fe0ddabe77e6c0b0e38231f0cff7d1 [1,1,0,0,0,0|1,0,1]=4 761 B14R1.29 CN(CCS)C[C@H](O)c1ccccc1 444592d55a70f458ddd1dd7244684192 [1,1,0,0,0,0|1,0,1]=4 762 B14R1.29 COCN(C)CC(O)c1ccccc1 87f54cc7de0d27966905b69525db21a8 [1,1,0,0,0,0|1,0,1]=4 763 B14R1.29 COCN(C)C[C@H](O)c1ccccc1 6b8474b0f389e41fb96310a3176cad3f [1,1,0,0,0,0|1,0,1]=4 764 B14R1.29 CSCN(C)CC(O)c1ccccc1 2472e6fa11640fc109662fb6c179d5ab [1,1,0,0,0,0|1,0,1]=4 765 B14R1.29 CSCN(C)C[C@H](O)c1ccccc1 157e52ad634b0a0eb14f252e900a7aa4 [1,1,0,0,0,0|1,0,1]=4 766 B14R1.29 C[C@H](CN(C)CC#N)c1ccccc1 d4140ffa8dab4eb7685b12d34053575b [1,1,0,0,0,0|1,0,0]=3 767 B14R1.29 C[C@H](CN(C)CCF)c1ccccc1 07eb5dc52261cc002ef09cb7ffcd3e09 [1,1,0,0,0,0|1,0,1]=4 768 B14R1.29 C[C@H](CN(C)CCO)c1ccccc1 b26665350ef7e3a9664e9b95d0aca23f [1,1,0,0,0,0|1,0,1]=4 769 B14R1.32 C#CCC(C)OCc1cccc(c1)Br a9636a7a296f59778a99e1b92c4b6366 [1,1,0,0,0,0|2,0,0]=4 770 B14R1.32 C#CCC(C)OCc1cccc(c1)C 6efec74e7207103234c3328bb85feafd [1,1,0,0,0,0|2,0,0]=4 771 B14R1.32 C#CCC(C)OCc1cccc(c1)Cl 01022e42f7dd58ad5654800ed1b67567 [1,1,0,0,0,0|2,0,0]=4 772 B14R1.32 C#CCC(C)OCc1cccc(c1)F abca3a633859d99173dfce654cd4af82 [1,1,0,0,0,0|2,0,0]=4 773 B14R1.32 C#CCC(C)OCc1cccc(c1)I c10f291f9df146b90950800a00db9a6a [1,1,0,0,0,0|2,0,0]=4 774 B14R1.32 C#CCN(C)CCc1cccc(c1)Br d9bbba991fe23f4d3f19f1a217b6ca28 [1,1,0,0,0,0|0,0,0]=2 775 B14R1.32 C#CCN(C)CCc1cccc(c1)C a310979e5b0cad811c8540b079f2b383 [1,1,0,0,0,0|0,0,0]=2 776 B14R1.32 C#CCN(C)CCc1cccc(c1)Cl 3ef59f311eefc9e8ea698f093b496a8e [1,1,0,0,0,0|0,0,0]=2 777 B14R1.32 C#CCN(C)CCc1cccc(c1)F 96ab1c4eab2159f12c254a0bc156b390 [1,1,0,0,0,0|0,0,0]=2 778 B14R1.32 C#CCN(C)CCc1cncc(n1)Cl 9da06e4ea6fae575455fe046362d3467 [1,1,0,0,0,0|2,0,0]=4 779 B14R1.32 C=CCN(C)CCc1cccc(c1)Br 0a0e880aeb0f51c6caa9a47db77adcd5 [1,1,0,0,0,0|0,0,2]=4 780 B14R1.32 C=CCN(C)CCc1cccc(c1)C 7f1cd246af44166ff974896e3d84ed96 [1,1,0,0,0,0|0,0,2]=4 781 B14R1.32 C=CCN(C)CCc1cccc(c1)Cl 4d39f5b339222dd0b6c8c336a69d84ba [1,1,0,0,0,0|0,0,2]=4 782 B14R1.32 C=CCN(C)CCc1cccc(c1)F d0801f889b41af64e661724b65d46fb0 [1,1,0,0,0,0|0,0,2]=4 783 B14R1.32 CCCN(C)CCc1cccc(c1)Br 8c9268847b55108e42751fcd2b979b43 [1,1,0,0,0,0|0,0,2]=4 784 B14R1.32 CCCN(C)CCc1cccc(c1)C 928aa60d00e07d892b0975a1b37c821f [1,1,0,0,0,0|0,0,2]=4 785 B14R1.32 CCCN(C)CCc1cccc(c1)Cl df95458c95b3da98665ebc5792635c0e [1,1,0,0,0,0|0,0,2]=4 786 B14R1.32 CCCN(C)CCc1cccc(c1)F a52b1ba72741e3f12ae797cd5f23e46d [1,1,0,0,0,0|0,0,2]=4 787 B14R1.32 CN(CC#N)CCc1cccc(c1)Br a39495fb2b6905361c8cd2c523d002c5 [1,1,0,0,0,0|1,0,0]=3 788 B14R1.32 CN(CC#N)CCc1cccc(c1)Cl ba310e5afa242644244a161a0ec9074b [1,1,0,0,0,0|1,0,0]=3 789 B14R1.32 CN(CC#N)CCc1cccc(c1)F 14249674906bb7c2521126fd02273798 [1,1,0,0,0,0|1,0,0]=3 790 B14R1.32 CN(CC=O)CCc1cccc(c1)Br b15a8c940847c9437c0bb43fba0de6c0 [1,1,0,0,0,0|1,0,1]=4 791 B14R1.32 CN(CC=O)CCc1cccc(c1)Cl 6dcfcfe63c1343621066e52a60dbc194 [1,1,0,0,0,0|1,0,1]=4 792 B14R1.32 CN(CC=O)CCc1cccc(c1)F aa67c955609cd72575bd87c5c12c7634 [1,1,0,0,0,0|1,0,1]=4 793 B14R1.32 CN(CCF)CCc1cccc(c1)Br b44e3f57d9fdd8215cbe2ae5bbec0238 [1,1,0,0,0,0|1,0,1]=4 794 B14R1.32 CN(CCF)CCc1cccc(c1)Cl 38ff84af173149b4addfde8f164e03e1 [1,1,0,0,0,0|1,0,1]=4 795 B14R1.32 CN(CCF)CCc1cccc(c1)F 16bcda92ed4be66e6207929002bf3844 [1,1,0,0,0,0|1,0,1]=4 796 B14R1.32 CN(CCO)CCc1cccc(c1)Br 59fb88a4025748fe5fefec1305a9968f [1,1,0,0,0,0|1,0,1]=4 797 B14R1.32 CN(CCO)CCc1cccc(c1)Cl 5ad14b540395166004c7cdeb6733c00b [1,1,0,0,0,0|1,0,1]=4 798 B14R1.32 CN(CCO)CCc1cccc(c1)F 6e464aa0e1b32e5e5e302a28097b5088 [1,1,0,0,0,0|1,0,1]=4 799 B14R1.32 CN(CCS)CCc1cccc(c1)Br 2d29f7749d53651c4080b3d92bf47091 [1,1,0,0,0,0|1,0,1]=4 800 B14R1.32 CN(CCS)CCc1cccc(c1)Cl 209de13d72ac33b36edbe9a858dad855 [1,1,0,0,0,0|1,0,1]=4 801 B14R1.32 CN(CCS)CCc1cccc(c1)F fa3c875f096c1966b1d6bb3c8ac5e11c [1,1,0,0,0,0|1,0,1]=4 802 B14R1.32 COCN(C)CCc1cccc(c1)Br f3d1f11d9964463afe11f0780378d208 [1,1,0,0,0,0|1,0,1]=4 803 B14R1.32 COCN(C)CCc1cccc(c1)C 293ba532ff906c76180a7a97977bd963 [1,1,0,0,0,0|1,0,1]=4 804 B14R1.32 COCN(C)CCc1cccc(c1)Cl 6ba20520b6e3546245a397aa1fbabfcb [1,1,0,0,0,0|1,0,1]=4 805 B14R1.32 COCN(C)CCc1cccc(c1)F 7690ca63770f56a83c0db6dab503c39a [1,1,0,0,0,0|1,0,1]=4 806 B14R1.32 CSCN(C)CCc1cccc(c1)Br eee88ae295fc93c9b8fbee25fc9002b8 [1,1,0,0,0,0|1,0,1]=4 807 B14R1.32 CSCN(C)CCc1cccc(c1)C ce129557f0329edde1949ebe566d67f5 [1,1,0,0,0,0|1,0,1]=4 808 B14R1.32 CSCN(C)CCc1cccc(c1)Cl feecb189c64f10abce2e1d06c7e261c5 [1,1,0,0,0,0|1,0,1]=4 809 B14R1.32 CSCN(C)CCc1cccc(c1)F 55873de30a70ec5945758993eb76027c [1,1,0,0,0,0|1,0,1]=4 810 B14R1.32 Cc1cccc(c1)CCN(C)CC#N 8ba380f02c24d2aca63be352b14984e0 [1,1,0,0,0,0|1,0,0]=3 811 B14R1.32 Cc1cccc(c1)CCN(C)CC=O 69f18612ef94eef934c03d051efa2fbf [1,1,0,0,0,0|1,0,1]=4 812 B14R1.32 Cc1cccc(c1)CCN(C)CCF 65227aa0a5c9ad4b2bef8daf66e4f705 [1,1,0,0,0,0|1,0,1]=4 813 B14R1.32 Cc1cccc(c1)CCN(C)CCO 558a00e158831b32374925acf53f02f0 [1,1,0,0,0,0|1,0,1]=4 814 B14R1.32 Cc1cccc(c1)CCN(C)CCS 5f333f112209fa5e47ffcd799b507c32 [1,1,0,0,0,0|1,0,1]=4 815 B14R1.156 C#CCCN(C)CCc1ccccc1 844250652f28374e4c1a011ccb39e482 [1,1,0,0,0,0|0,0,0]=2 816 B14R1.156 C#CCCN(C)CCc1ccccn1 a75face495dedb8b8098ce20df696d3e [1,1,0,0,0,0|1,0,0]=3 817 B14R1.156 C#CCCN(C)CCc1cccnc1 222c0f2ed692b208699443b8a2316289 [1,1,0,0,0,0|1,0,0]=3 818 B14R1.156 C#CCCN(C)CCc1ccncc1 e6c0665e41bee58cf9392d5d9052fe40 [1,1,0,0,0,0|1,0,0]=3 819 B14R1.156 C#CCNC(=O)CCc1ccccc1 d76fb62e424f58abeb1e0d103fc750fd [1,1,0,0,0,0|2,0,0]=4 820 B14R1.156 C#CCNC(C)CCc1ccccc1 88981b17b6fc7ed0576771d911a3e5c8 [1,1,0,0,0,0|1,0,0]=3 821 B14R1.156 C#CCNC(C)COc1ccccc1 e2bda4f861351389087b0aff43975d6a [1,1,0,0,0,0|2,0,0]=4 822 B14R1.156 C#CCN[C@@H](C)CCc1ccccc1 0a01d9df6e8d5493e528ee63992ffebc [1,1,0,0,0,0|1,0,0]=3 823 B14R1.156 C#CCN[C@H](C)CCc1ccccc1 14cfe3d83575417ad8f22fc997b9b65a [1,1,0,0,0,0|1,0,0]=3 824 B14R1.156 C#CCOC(C)CCc1ccccc1 82642bb8d54ad6b93c56fa035a28fda9 [1,1,0,0,0,0|1,0,0]=3 825 B14R1.156 C#CCOC(C)CCc1ccncc1 a07b34c88e4f18d40b4df977a141ad49 [1,1,0,0,0,0|2,0,0]=4 826 B14R1.156 C#CCOC(C)COc1ccccc1 b49d899ae466db79dc37af75e91674e6 [1,1,0,0,0,0|2,0,0]=4 827 B14R1.156 C/C=C/CN(C)CCc1ccccc1 5ad23eb54ed290e86646c7bbbf4d1c2d [1,1,0,0,0,0|0,0,2]=4 828 B14R1.156 C/C=C\CN(C)CCc1ccccc1 5ab7b9d629460aae3ffcd49cb82f3a9a [1,1,0,0,0,0|0,0,2]=4 829 B14R1.156 C=CCCN(C)CCc1ccccc1 d7d729df7b7059ae1536666e7e2bc4af [1,1,0,0,0,0|0,0,2]=4 830 B14R1.156 CC(CCc1ccccc1)NCC#N efaa076a0107e3fb9887d775cbde195e [1,1,0,0,0,0|2,0,0]=4 831 B14R1.156 CC(CCc1ccccc1)OCC#N 045818c9a9d97392d893eb11ee845b2a [1,1,0,0,0,0|2,0,0]=4 832 B14R1.156 CCCCN(C)CCc1ccccc1 1696f3a3dc4e8917b86ebd77597b988f [1,1,0,0,0,0|0,0,2]=4 833 B14R1.156 CN(C/C=C/Cl)CCc1ccccc1 ed10c64bacc235d3adbc512124a8a7c7 [1,1,0,0,0,0|0,0,2]=4 834 B14R1.156 CN(C/C=C\Cl)CCc1ccccc1 a99d63c09ac02e30f3794716a09a2ac0 [1,1,0,0,0,0|0,0,2]=4 835 B14R1.156 CN(C/C=C\O)CCc1ccccc1 cd231a2a289e51a1700c7bae1f6fe0e6 [1,1,0,0,0,0|0,0,2]=4 836 B14R1.156 CN(CCC#N)CCc1ccccc1 3f6c346a41c5edc73a663a7109f69a43 [1,1,0,0,0,0|0,0,1]=3 837 B14R1.156 CN(CCC#N)CCc1ccccn1 0649a1f10a53bcb6707e835c4c406223 [1,1,0,0,0,0|1,0,1]=4 838 B14R1.156 CN(CCC#N)CCc1cccnc1 6730b534906abc84bd843fddaad697e0 [1,1,0,0,0,0|1,0,1]=4 839 B14R1.156 CN(CCC#N)CCc1ccncc1 cb97c7203fe7921eb1b670548e0e4f56 [1,1,0,0,0,0|1,0,1]=4 840 B14R1.156 CN(CCC=O)CCc1ccccc1 355f522019877440080f2d605ea1a23f [1,1,0,0,0,0|0,0,2]=4 841 B14R1.156 CN(CCCF)CCc1ccccc1 f3a4558fe72e94788442330d90ab958a [1,1,0,0,0,0|0,0,2]=4 842 B14R1.156 CN(CCCO)CCc1ccccc1 f58911388adabe8822f5cb65e730fb66 [1,1,0,0,0,0|0,0,2]=4 843 B14R1.156 CN(CCCS)CCc1ccccc1 923fcd16cf4107c7aa75f52f48fd37c6 [1,1,0,0,0,0|0,0,2]=4 844 B14R1.156 CN(CCON)CCc1ccccc1 3f14b6695b0367896e9865c3064f9928 [1,1,0,0,0,0|1,0,1]=4 845 B14R1.156 COCCN(C)CCc1ccccc1 64a6d15e3ae66dc3fda64b801bcc3381 [1,1,0,0,0,0|0,0,2]=4 846 B14R1.156 CSCCN(C)CCc1ccccc1 6042e803bf81a118182fd82d39803565 [1,1,0,0,0,0|0,0,2]=4 847 B14R1.156 C[C@@H](CCc1ccccc1)NCC#N 7c93b2650addabeb88a7446c118c5784 [1,1,0,0,0,0|2,0,0]=4 848 B14R1.156 C[C@@H](CCc1ccccc1)OCC#N 127e86ee81c1b5a4ac925edb5b598410 [1,1,0,0,0,0|2,0,0]=4 849 B14R1.156 C[C@H](CCc1ccccc1)NCC#N f5d870507ac8200a4892604280f1883e [1,1,0,0,0,0|2,0,0]=4 850 B14R1.156 C[C@H](CCc1ccccc1)OCC#N ab8f8b00f648e359dcd18fad5c245067 [1,1,0,0,0,0|2,0,0]=4 851 B14R1.502 C#CCC(C)OCc1ccc(cc1)Br 868372085ffd79ed60eadb587bf47281 [1,1,0,0,0,0|2,0,0]=4 852 B14R1.502 C#CCC(C)OCc1ccc(cc1)C 4a82bfbe1cbbc4317ae0be9030d40b87 [1,1,0,0,0,0|2,0,0]=4 853 B14R1.502 C#CCC(C)OCc1ccc(cc1)Cl ee5152284a7678e592b082f1b8e051a4 [1,1,0,0,0,0|2,0,0]=4 854 B14R1.502 C#CCC(C)OCc1ccc(cc1)F 710e0f800a40b9f917b801a32f868414 [1,1,0,0,0,0|2,0,0]=4 855 B14R1.502 C#CCC(C)OCc1ccc(cc1)I 33d0a3768e13273180e9f3d0fbc15d19 [1,1,0,0,0,0|2,0,0]=4 856 B14R1.502 C#CCN(C)CCc1ccc(cc1)Br 526de8f9250913b932e5a79fd4e5915d [1,1,0,0,0,0|0,0,0]=2 857 B14R1.502 C#CCN(C)CCc1ccc(cc1)C 33df9d58aa61f73ba4d99b2c6439910e [1,1,0,0,0,0|0,0,0]=2 858 B14R1.502 C#CCN(C)CCc1ccc(cc1)Cl eabf7d73d829be4b1ee97c7ef8802e73 [1,1,0,0,0,0|0,0,0]=2 859 B14R1.502 C#CCN(C)CCc1ccc(cc1)F 8a35ad4bedc4eff2c935a2a8ad7deb14 [1,1,0,0,0,0|0,0,0]=2 860 B14R1.502 C#CCN(C)CCc1ccc(cc1)I 5224bcf4bc7d7a4cfbc7433cbfc87b0c [1,1,0,0,0,0|0,0,0]=2 861 B14R1.502 C=CCN(C)CCc1ccc(cc1)Br 2df5133d82f608443ce43f99d99d3c9a [1,1,0,0,0,0|0,0,2]=4 862 B14R1.502 C=CCN(C)CCc1ccc(cc1)C 9aefe9c02d4569977d1d0e1b290bcf44 [1,1,0,0,0,0|0,0,2]=4 863 B14R1.502 C=CCN(C)CCc1ccc(cc1)Cl df4cbc403a20316e0362febb9a44d4fb [1,1,0,0,0,0|0,0,2]=4 864 B14R1.502 C=CCN(C)CCc1ccc(cc1)F fd76efc2abbbe42dc1c3238c5b47bd15 [1,1,0,0,0,0|0,0,2]=4 865 B14R1.502 C=CCN(C)CCc1ccc(cc1)I 5f39a141b1040cbab48568574739699d [1,1,0,0,0,0|0,0,2]=4 866 B14R1.502 CCCN(C)CCc1ccc(cc1)Br 1299f61dd408d6e611bb192ce96c8390 [1,1,0,0,0,0|0,0,2]=4 867 B14R1.502 CCCN(C)CCc1ccc(cc1)C fd922e339c67adf19b20b87dedde6c0b [1,1,0,0,0,0|0,0,2]=4 868 B14R1.502 CCCN(C)CCc1ccc(cc1)Cl 2e2a77401792f7af7dcba1d0b14aa5ae [1,1,0,0,0,0|0,0,2]=4 869 B14R1.502 CCCN(C)CCc1ccc(cc1)F 28c3bbfb80cb104e3f20c03e005ae533 [1,1,0,0,0,0|0,0,2]=4 870 B14R1.502 CCCN(C)CCc1ccc(cc1)I e6cbedbd937da218ef1f76d27079499c [1,1,0,0,0,0|0,0,2]=4 871 B14R1.502 CN(CC#N)CCc1ccc(cc1)Br b0b18db3a0fa22b86e9e21295dc38bd2 [1,1,0,0,0,0|1,0,0]=3 872 B14R1.502 CN(CC#N)CCc1ccc(cc1)Cl 60e21b0f921b56dbf3036c4334f332ed [1,1,0,0,0,0|1,0,0]=3 873 B14R1.502 CN(CC#N)CCc1ccc(cc1)F dd0a89e6cea4b332f5ed870afe2828cf [1,1,0,0,0,0|1,0,0]=3 874 B14R1.502 CN(CC#N)CCc1ccc(cc1)I 93e58a21e8bd5db848152164f30c7468 [1,1,0,0,0,0|1,0,0]=3 875 B14R1.502 CN(CC#N)CCc1ccc(nc1)Cl 50f4d9a5af993025a02719c23866c45e [1,1,0,0,0,0|2,0,0]=4 876 B14R1.502 CN(CC#N)CSc1ccc(cc1)Cl 025bfe20103db668c2adc42d4994d929 [1,1,0,0,0,0|2,0,0]=4 877 B14R1.502 CN(CC=O)CCc1ccc(cc1)Br 0c12b9132f250630de33ed888e05ec42 [1,1,0,0,0,0|1,0,1]=4 878 B14R1.502 CN(CC=O)CCc1ccc(cc1)Cl ab1902d69216f203f3b713ebc5c1a63c [1,1,0,0,0,0|1,0,1]=4 879 B14R1.502 CN(CC=O)CCc1ccc(cc1)F 6aa56dcc10e86d2ee1e53d060b7d070d [1,1,0,0,0,0|1,0,1]=4 880 B14R1.502 CN(CCF)CCc1ccc(cc1)Br bd3bf8ac9978df384d43b82af60a6e3a [1,1,0,0,0,0|1,0,1]=4 881 B14R1.502 CN(CCF)CCc1ccc(cc1)Cl bc9ac9f1e9800b002c764a41fceddb47 [1,1,0,0,0,0|1,0,1]=4 882 B14R1.502 CN(CCF)CCc1ccc(cc1)F a1a23530d344e604c68c900ef01e5549 [1,1,0,0,0,0|1,0,1]=4 883 B14R1.502 CN(CCF)CCc1ccc(cc1)I b7b8234f6d5d8111c57080de5ea52726 [1,1,0,0,0,0|1,0,1]=4 884 B14R1.502 CN(CCO)CCc1ccc(cc1)Br 5a27cea3456260047a34b70c0adda41b [1,1,0,0,0,0|1,0,1]=4 885 B14R1.502 CN(CCO)CCc1ccc(cc1)Cl 49dd1dbf9eb2785860d39efa544a64ec [1,1,0,0,0,0|1,0,1]=4 886 B14R1.502 CN(CCO)CCc1ccc(cc1)F 41e233ef6adeb7686b68c2fadaaa1ef0 [1,1,0,0,0,0|1,0,1]=4 887 B14R1.502 CN(CCO)CCc1ccc(cc1)I 45471da8e62dc499b94ef721c3fae49d [1,1,0,0,0,0|1,0,1]=4 888 B14R1.502 CN(CCS)CCc1ccc(cc1)Br 7e55a59c03a861a54fb97dc0c9d4c0cc [1,1,0,0,0,0|1,0,1]=4 889 B14R1.502 CN(CCS)CCc1ccc(cc1)Cl 0479dd951bdee41ea4d38c753858c0e5 [1,1,0,0,0,0|1,0,1]=4 890 B14R1.502 CN(CCS)CCc1ccc(cc1)F 2c2334c07bebeecc6d7e8b66ddc82add [1,1,0,0,0,0|1,0,1]=4 891 B14R1.502 COCN(C)CCc1ccc(cc1)Br 758276c59b6ddbb18d3f82c0ac67dab9 [1,1,0,0,0,0|1,0,1]=4 892 B14R1.502 COCN(C)CCc1ccc(cc1)C 5553caa8c5cf0dfdca024c59f3d60a05 [1,1,0,0,0,0|1,0,1]=4 893 B14R1.502 COCN(C)CCc1ccc(cc1)Cl 822ff4299456d88cb678c77a169688b7 [1,1,0,0,0,0|1,0,1]=4 894 B14R1.502 COCN(C)CCc1ccc(cc1)F cc0cd7118722161d78f1fcf530066e73 [1,1,0,0,0,0|1,0,1]=4 895 B14R1.502 CSCN(C)CCc1ccc(cc1)Br a424fd5f3472dcfffa860ddf176b5841 [1,1,0,0,0,0|1,0,1]=4 896 B14R1.502 CSCN(C)CCc1ccc(cc1)C b02a1409de8859abb62584eca351bd5e [1,1,0,0,0,0|1,0,1]=4 897 B14R1.502 CSCN(C)CCc1ccc(cc1)Cl a71804f4162bf854afc24ebe1bd982b3 [1,1,0,0,0,0|1,0,1]=4 898 B14R1.502 CSCN(C)CCc1ccc(cc1)F e627e0070468f44a31b011c8c02618f7 [1,1,0,0,0,0|1,0,1]=4 899 B14R1.502 Cc1ccc(cc1)CCN(C)CC#N bc01af211e516beee2d1fc507161202d [1,1,0,0,0,0|1,0,0]=3 900 B14R1.502 Cc1ccc(cc1)CCN(C)CC=O 7eb58c59c9babe185f14ff942d51308d [1,1,0,0,0,0|1,0,1]=4 901 B14R1.502 Cc1ccc(cc1)CCN(C)CCF 5e5d4cbbe95a6afe736adf7111dbcdd9 [1,1,0,0,0,0|1,0,1]=4 902 B14R1.502 Cc1ccc(cc1)CCN(C)CCO 919e024d154a5a0a82b19e33467925b7 [1,1,0,0,0,0|1,0,1]=4 903 B14R1.502 Cc1ccc(cc1)CCN(C)CCS 68fd7fe3f4d9d69e49e0cef665547740 [1,1,0,0,0,0|1,0,1]=4 904 B14R1.502 Cc1ccc(cc1)SCN(C)CC#N 4ea973642c0b5e0503c94dc8faaad0da [1,1,0,0,0,0|2,0,0]=4 905 B14R1.598 C#CCC(C)OCc1ccccc1Br 023580f0a5e7f30d6dba40d0e5003c45 [1,1,0,0,0,0|2,0,0]=4 906 B14R1.598 C#CCC(C)OCc1ccccc1Cl 80ffaf9df84da5e5b3f43f85c290524a [1,1,0,0,0,0|2,0,0]=4 907 B14R1.598 C#CCC(C)OCc1ccccc1I c70930daf6829021f56dd7981f70f04f [1,1,0,0,0,0|2,0,0]=4 908 B14R1.598 C#CCN(C)CCc1ccccc1Br 966ce7e3e371db8ed88822bc79cfaa67 [1,1,0,0,0,0|0,0,0]=2 909 B14R1.598 C#CCN(C)CCc1ccccc1C 164eef40f277f36de4a04ae27d6dca55 [1,1,0,0,0,0|0,0,0]=2 910 B14R1.598 C#CCN(C)CCc1ccccc1Cl 5a5da88f1e34da60072afcf50e90057d [1,1,0,0,0,0|0,0,0]=2 911 B14R1.598 C#CCN(C)CCc1ccccc1F acce1d0d85e164e18eccea70a42a7918 [1,1,0,0,0,0|0,0,0]=2 912 B14R1.598 C#CCN(C)CCc1ccccc1I c197aaa8caae5e9d854b96e5bc2806c7 [1,1,0,0,0,0|0,0,0]=2 913 B14R1.598 C=CCN(C)CCc1ccccc1Br 1c40e1c20eb5e8d4c5eb26aa352ed0f8 [1,1,0,0,0,0|0,0,2]=4 914 B14R1.598 C=CCN(C)CCc1ccccc1C 30822bfed353a6b294c764b70d0b5e64 [1,1,0,0,0,0|0,0,2]=4 915 B14R1.598 C=CCN(C)CCc1ccccc1Cl 7c29ccefc631d4db56d96371a8862209 [1,1,0,0,0,0|0,0,2]=4 916 B14R1.598 C=CCN(C)CCc1ccccc1F 0c7b1f694cb95ef54050f5c68afeb1f6 [1,1,0,0,0,0|0,0,2]=4 917 B14R1.598 C=CCN(C)CCc1ccccc1I fe3c0859debf5ee557fa5997bd2ba270 [1,1,0,0,0,0|0,0,2]=4 918 B14R1.598 CCCN(C)CCc1ccccc1C aa1d0c2c8358b39a3c7369e6213f60f0 [1,1,0,0,0,0|0,0,2]=4 919 B14R1.598 CCCN(C)CCc1ccccc1Cl 4a57ae08c2f70e754bbd1bb1186ea57e [1,1,0,0,0,0|0,0,2]=4 920 B14R1.598 CCCN(C)CCc1ccccc1F a19bbdc71208d10ef37605e70e695209 [1,1,0,0,0,0|0,0,2]=4 921 B14R1.598 CCCN(C)CCc1ccccc1I 97a69904860fea9d8ad755f754605ab1 [1,1,0,0,0,0|0,0,2]=4 922 B14R1.598 CN(CC#N)CCc1ccccc1Br c284f5b2f548c0bfc0013e3f840d8f07 [1,1,0,0,0,0|1,0,0]=3 923 B14R1.598 CN(CC#N)CCc1ccccc1Cl 786fb0fdb76e740da793749fcb31ad8d [1,1,0,0,0,0|1,0,0]=3 924 B14R1.598 CN(CC#N)CCc1ccccc1F a765a94d0069776ca86349fb38dcb475 [1,1,0,0,0,0|1,0,0]=3 925 B14R1.598 CN(CC#N)CCc1ccccc1I e6fe30b77caabaffd1d4fe1ac0108255 [1,1,0,0,0,0|1,0,0]=3 926 B14R1.598 CN(CC=O)CCc1ccccc1Br cfe19b1c0f24cf68c2f05b29aa2b6c0f [1,1,0,0,0,0|1,0,1]=4 927 B14R1.598 CN(CC=O)CCc1ccccc1Cl 3415f16a6607970e3f214682ea7bb4d6 [1,1,0,0,0,0|1,0,1]=4 928 B14R1.598 CN(CC=O)CCc1ccccc1F 5dce2fc289d46d8da5237d7cd77483c8 [1,1,0,0,0,0|1,0,1]=4 929 B14R1.598 CN(CCF)CCc1ccccc1Cl 01ef4cfbad907ddd64c97c7f3c4c5e40 [1,1,0,0,0,0|1,0,1]=4 930 B14R1.598 CN(CCF)CCc1ccccc1F fd5ed6918538fc7719ba89b4f4603edf [1,1,0,0,0,0|1,0,1]=4 931 B14R1.598 CN(CCF)CCc1ccccc1I 8ca6da5cd6e5927c491045a744f8ab5f [1,1,0,0,0,0|1,0,1]=4 932 B14R1.598 CN(CCO)CCc1ccccc1Cl 736e3f086f80b67d7d74838c60a85d52 [1,1,0,0,0,0|1,0,1]=4 933 B14R1.598 CN(CCO)CCc1ccccc1F d74b8ea816ff5612a8d9d8a571b8bc8a [1,1,0,0,0,0|1,0,1]=4 934 B14R1.598 CN(CCO)CCc1ccccc1I 092ca1919bf8133e9329fa559e9fc8d9 [1,1,0,0,0,0|1,0,1]=4 935 B14R1.598 CN(CCS)CCc1ccccc1Cl 8ae6be99fc5514e95b588ee4f9b33c41 [1,1,0,0,0,0|1,0,1]=4 936 B14R1.598 CN(CCS)CCc1ccccc1F 14b984e6614e12ea46735028cda23e70 [1,1,0,0,0,0|1,0,1]=4 937 B14R1.598 COCN(C)CCc1ccccc1Br 6a6746a409f61afcad7744204ea5bdbb [1,1,0,0,0,0|1,0,1]=4 938 B14R1.598 COCN(C)CCc1ccccc1C 865ba9db9e9bae9781610e155695bdb4 [1,1,0,0,0,0|1,0,1]=4 939 B14R1.598 COCN(C)CCc1ccccc1Cl 2d1ab26d90d9c62389e9d30f723af3e7 [1,1,0,0,0,0|1,0,1]=4 940 B14R1.598 COCN(C)CCc1ccccc1F 0d8c00fc55d138b6d7e88f17567b66e2 [1,1,0,0,0,0|1,0,1]=4 941 B14R1.598 CSCN(C)CCc1ccccc1Cl 0918fe3ad829d8a62b731090863e29ce [1,1,0,0,0,0|1,0,1]=4 942 B14R1.598 CSCN(C)CCc1ccccc1F cbd2f3da8ea691f6ac1568b147c61eec [1,1,0,0,0,0|1,0,1]=4 943 B14R1.598 Cc1ccccc1CCN(C)CC#N 390054dc8c2dece45e047944b2d18d46 [1,1,0,0,0,0|1,0,0]=3 944 B14R1.598 Cc1ccccc1CCN(C)CC=O 83ea42cc806dfc6acfa5bb26eb69b441 [1,1,0,0,0,0|1,0,1]=4 945 B14R1.598 Cc1ccccc1CCN(C)CCF cf97e8dec3b010ebd742b38ff9260cd2 [1,1,0,0,0,0|1,0,1]=4 946 B14R1.598 Cc1ccccc1CCN(C)CCS 37e04284c2cdb051e133c934b65c13a3 [1,1,0,0,0,0|1,0,1]=4 947 B14R1.756 C#CC(=O)N(C)CCc1ccccc1 f4e021139dd5053642c0ba4ac7d283c1 [1,1,0,0,0,0|0,0,1]=3 948 B14R1.756 C#CC(=O)N(C)CCc1ccccn1 74309837cafe3e9637be5e8c3541f792 [1,1,0,0,0,0|1,0,1]=4 949 B14R1.756 C#CC(=O)N(C)CCc1cccnc1 0aa967fd42daa9d079bac91e975920cd [1,1,0,0,0,0|1,0,1]=4 950 B14R1.756 C#CC(=O)N(C)CCc1ccncc1 14251e8e44ddb3a055e7a2df660d36c2 [1,1,0,0,0,0|1,0,1]=4 951 B14R1.756 C=CC(C)N(C)CCc1ccccc1 fc4b5738361861dcd5c23446e6289413 [1,1,0,0,0,0|0,0,2]=4 952 B14R1.756 CC(C=O)N(C)CCc1ccccc1 7762b6b8d25accb17c34bfec5da5b078 [1,1,0,0,0,0|1,0,1]=4 953 B14R1.756 CC(CO)N(C)CCc1ccccc1 c7af129cf55f78144597f556c8edb085 [1,1,0,0,0,0|1,0,1]=4 954 B14R1.756 CCC(C)N(C)CCc1ccccc1 2e3be22a2b4b596061bad5fc425062b7 [1,1,0,0,0,0|0,0,2]=4 955 B14R1.756 C[C@@H](CO)N(C)CCc1ccccc1 c51a31d1a4790851ddc2e698d9db0caa [1,1,0,0,0,0|1,0,1]=4 956 B14R1.756 C[C@H](C=O)N(C)CCc1ccccc1 f3be0e4c262d665e5e4c38c5431a7097 [1,1,0,0,0,0|1,0,1]=4 957 B14R1.756 C[C@H](CO)N(C)CCc1ccccc1 4d81750f56427f48f73bed492cafd664 [1,1,0,0,0,0|1,0,1]=4 958 B14R1.818 C=C(Br)CN(C)CCc1ccccc1 794312b035aa3fc98978a61815bc863a [1,1,0,0,0,0|0,0,2]=4 959 B14R1.818 C=C(C)CN(C)CCc1ccccc1 a250e3e29aa3c63263bae8935b1d0b9e [1,1,0,0,0,0|0,0,2]=4 960 B14R1.818 CC(C)CN(C)CCc1ccccc1 4e04915240ea8b644f6b89e808e055d0 [1,1,0,0,0,0|0,0,2]=4 961 B14R1.818 CC(O)CN(C)CCc1ccccc1 a8113519dd90c75d7f301b766a38f9a2 [1,1,0,0,0,0|0,0,2]=4 962 B14R1.818 CN(C)CN(C)CCc1ccccc1 57e362a4e2969492186d715c8147336f [1,1,0,0,0,0|1,0,1]=4 963 B14R1.818 CN(CCc1ccccc1)CC(=O)N dbbf5488cbb826be810d72ed3d4edea0 [1,1,0,0,0,0|1,0,1]=4 964 B14R1.818 CN(CCc1ccccc1)CC(=O)O 38e75e598ab7781049d06a33df0cca8e [1,1,0,0,0,0|1,0,1]=4 965 B14R1.818 CN(CCc1ccccc1)CC(F)F e69fbaa636ef2a959a347575ceaa1c3a [1,1,0,0,0,0|1,0,1]=4 966 B14R1.818 CN(CCc1ccccc1)C[N+](=O)[O-] fc13b31385e094259757bb19846d09e6 [1,1,0,0,0,0|2,0,0]=4 967 B14R1.818 C[C@@H](O)CN(C)CCc1ccccc1 1b3364fdbe3016c36df8cdf4715204ff [1,1,0,0,0,0|0,0,2]=4 968 B14R1.818 C[C@H](O)CN(C)CCc1ccccc1 7823c0a40b670480f9687b5244c48a86 [1,1,0,0,0,0|0,0,2]=4 969 B14R1.979 C#CCC(CC)OCc1ccccc1 420dbc0efb8bbb2788b5709c3e7039ea [1,1,0,0,0,0|2,0,0]=4 970 B14R1.979 C=CCN(CC)CCc1ccccc1 f8bf01dec12143d2366a3351d5c18266 [1,1,0,0,0,0|0,0,2]=4 971 B14R1.979 CCCN(CF)CCc1ccccc1 a32521fa3bb9d37b48e6c2b1442a828f [1,1,0,0,0,0|0,0,2]=4 972 B14R1.979 CCN(CC#N)CCc1ccccn1 f71b9425a946ec7b49dd9a1e63b57698 [1,1,0,0,0,0|2,0,0]=4 973 B14R1.979 CCN(CC#N)CCc1cccnc1 f07ae9727f90c5da93a6ce82ac418f70 [1,1,0,0,0,0|2,0,0]=4 974 B14R1.979 CCN(CC#N)CCc1ccncc1 02dcba0c64427f068d9f40ab21b9147f [1,1,0,0,0,0|2,0,0]=4 975 B14R1.979 CCN(CC=O)CCc1ccccc1 48f39945367aabdec382fc8277192115 [1,1,0,0,0,0|1,0,1]=4 976 B14R1.979 CCN(CCCl)CCc1ccccc1 ce0e598c5d486400e7589261cd754587 [1,1,0,0,0,0|1,0,1]=4 977 B14R1.979 CCN(CCO)CCc1ccccc1 7f6bf84fbfd1c1cb29cf1cc6c0ec5f1a [1,1,0,0,0,0|1,0,1]=4 978 B14R1.979 OCCN(CO)CCc1ccccc1 7446095c2f909091793473a37d221d17 [1,1,0,0,0,0|1,0,1]=4 979 B14R1.33 C#CCCN(C)Cc1ccc(cc1)Br 36259a7f3f8e0467e7d222c7cadb66ba [1,1,0,0,0,0|2,0,0]=4 980 B14R1.33 C#CCCN(C)Cc1ccc(cc1)C 1a572d5e32f1758355e9e1b82097bda5 [1,1,0,0,0,0|2,0,0]=4 981 B14R1.33 C#CCCN(C)Cc1ccc(cc1)Cl b49c8b478bdf9ed04421dd7b7e267a42 [1,1,0,0,0,0|2,0,0]=4 982 B14R1.33 C#CCCN(C)Cc1ccc(cc1)F 3ef998ea91bac41f6f6714c5ea0d566d [1,1,0,0,0,0|2,0,0]=4 983 B14R1.33 C#CCCN(C)Cc1ccc(cc1)I a4ac2cfa6ae950dd82194aa22f7f0e82 [1,1,0,0,0,0|2,0,0]=4 984 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Br b5916288b46af70fdd0db486ff6d0b9a [1,1,0,0,0,0|1,0,1]=4 985 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)C 7349025a72278667f3ff1a59ad88452e [1,1,0,0,0,0|1,0,1]=4 986 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)Cl 89fbbe91abdb84642307875f0dbc0caa [1,1,0,0,0,0|1,0,1]=4 987 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)F 962706231d20720406074778518190ea [1,1,0,0,0,0|1,0,1]=4 988 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)I 2ce30e2427297c6d0ed979b5e68dd220 [1,1,0,0,0,0|1,0,1]=4 989 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)O 9abeda3815ea78e326b6971fd605ef51 [1,1,0,0,0,0|1,0,1]=4 990 B14R1.33 C#CCNC(=O)Cc1ccc(cc1)S 2efaab20391f2113a0ddfea70399c76d [1,1,0,0,0,0|1,0,1]=4 991 B14R1.33 C#CCNC(C)Cc1ccc(cc1)F c4c7d56b4a9bd38dd3fb6769abfebb38 [1,1,0,0,0,0|0,0,0]=2 992 B14R1.33 C#CCOC(C)Cc1ccc(cc1)Br 1f193db13717ea3b09fe5f9cc427af67 [1,1,0,0,0,0|1,0,0]=3 993 B14R1.33 C#CCOC(C)Cc1ccc(cc1)C c4fb3288e1fca34712c9be917c875ce8 [1,1,0,0,0,0|1,0,0]=3 994 B14R1.33 C#CCOC(C)Cc1ccc(cc1)Cl 1454841ccf55e7cf1c3e34d5ed5af433 [1,1,0,0,0,0|1,0,0]=3 995 B14R1.33 C#CCOC(C)Cc1ccc(cc1)F e2f1d7660b80cd95393b3339be58af6b [1,1,0,0,0,0|1,0,0]=3 996 B14R1.33 CC(Cc1ccc(cc1)Br)OCC#N 6433ce32621161872c9ba8bff04ff29c [1,1,0,0,0,0|2,0,0]=4 997 B14R1.33 CC(Cc1ccc(cc1)Cl)OCC#N 4f352fbf0a4c9525d28c4a908c67e15b [1,1,0,0,0,0|2,0,0]=4 998 B14R1.33 CC(Cc1ccc(cc1)F)NCC#N 59abc1f026b87630085f6dbf6f6f3aa3 [1,1,0,0,0,0|1,0,0]=3 999 B14R1.33 CC(Cc1ccc(cc1)F)NCCBr cc1f3128c436d3e2b7e16650da20594f [1,1,0,0,0,0|1,0,1]=4 1000 B14R1.33 CC(Cc1ccc(cc1)F)NCCF dbb488056af4af31a11213cb69659adc [1,1,0,0,0,0|1,0,1]=4 1001 B14R1.33 CC(Cc1ccc(cc1)F)NCCI 88ede970c1e4481fa7db629b2f94fe17 [1,1,0,0,0,0|1,0,1]=4 1002 B14R1.33 CC(Cc1ccc(cc1)F)NCCO 67d11fcf852c365993635ca6ccdb89b8 [1,1,0,0,0,0|1,0,1]=4 1003 B14R1.33 CC(Cc1ccc(cc1)F)OCC#N 927bfed1fa1fa57b55b9b0c6ca24c883 [1,1,0,0,0,0|2,0,0]=4 1004 B14R1.33 CCCNC(C)Cc1ccc(cc1)F 6f91ce5a8cb3ad22f778a7c06a6b3726 [1,1,0,0,0,0|0,0,2]=4 1005 B14R1.33 Cc1ccc(cc1)CC(C)OCC#N 941b2df063726bc4ed4368f43c1dd2c1 [1,1,0,0,0,0|2,0,0]=4 1006 B14R1.34 C#CCCN(C)Cc1cccc(c1)Br 8f098c1612f958dd29e82513fb2108f6 [1,1,0,0,0,0|2,0,0]=4 1007 B14R1.34 C#CCCN(C)Cc1cccc(c1)C 435376d685b214e42b8ae859355fc13f [1,1,0,0,0,0|2,0,0]=4 1008 B14R1.34 C#CCCN(C)Cc1cccc(c1)Cl 3718c87db5361de849f95a6348786e6f [1,1,0,0,0,0|2,0,0]=4 1009 B14R1.34 C#CCCN(C)Cc1cccc(c1)F e058b97d66378ad469e7ba605be6c08e [1,1,0,0,0,0|2,0,0]=4 1010 B14R1.34 C#CCCN(C)Cc1cccc(c1)I 6cc60fe25dafb662c702eb7d226d279a [1,1,0,0,0,0|2,0,0]=4 1011 B14R1.34 C#CCNC(=O)Cc1cccc(c1)Br 915b70f5b3367a6eb6b329defc0c9432 [1,1,0,0,0,0|1,0,1]=4 1012 B14R1.34 C#CCNC(=O)Cc1cccc(c1)C 4942cb919f80b4f4b821037ad89677da [1,1,0,0,0,0|1,0,1]=4 1013 B14R1.34 C#CCNC(=O)Cc1cccc(c1)Cl 3ad7ff119fffa9da70ae69129d4ec34c [1,1,0,0,0,0|1,0,1]=4 1014 B14R1.34 C#CCNC(=O)Cc1cccc(c1)F 1834aa037495e51de2573b62292eb49a [1,1,0,0,0,0|1,0,1]=4 1015 B14R1.34 C#CCNC(=O)Cc1cccc(c1)I f7c5dda29964b8ebe0d8e6451b1696a1 [1,1,0,0,0,0|1,0,1]=4 1016 B14R1.34 C#CCNC(=O)Cc1cccc(c1)O aaa7be5b5641d4ec22dcd20c1a4cdbe5 [1,1,0,0,0,0|1,0,1]=4 1017 B14R1.34 C#CCNC(=O)Cc1cccc(c1)S ec4681417567d09b5168e4485f4f6325 [1,1,0,0,0,0|1,0,1]=4 1018 B14R1.34 C#CCNC(C)Cc1cccc(c1)F a296800b2cdfa88a7a1ad498aae617dd [1,1,0,0,0,0|0,0,0]=2 1019 B14R1.34 C#CCN[C@@H](C)Cc1cccc(c1)Cl 2c325bcd3be0e97e2180152b6f70a643 [1,1,0,0,0,0|0,0,0]=2 1020 B14R1.34 C#CCOC(C)Cc1cc(ccn1)C 6f52a7b4c1eeab00c1a05c064734d0b7 [1,1,0,0,0,0|2,0,0]=4 1021 B14R1.34 C#CCOC(C)Cc1cccc(c1)C d629c4b24f8d6b8a2bc5be7191bd349c [1,1,0,0,0,0|1,0,0]=3 1022 B14R1.34 C#CCOC(C)Cc1cccc(c1)Cl 550a7bca3b48abab58d21a4c9d0471e5 [1,1,0,0,0,0|1,0,0]=3 1023 B14R1.34 C#CCOC(C)Cc1cccc(c1)F 5693e961c17665260452294d83f8c6a0 [1,1,0,0,0,0|1,0,0]=3 1024 B14R1.34 C#CCOC(C)Cc1cccc(n1)C e25abac09f59ceef6777a6a2d721e05f [1,1,0,0,0,0|2,0,0]=4 1025 B14R1.34 C#CCOC(C)Cc1cccc(n1)F 3e4f4f5122cf0878c5b7530cc3c5ae45 [1,1,0,0,0,0|2,0,0]=4 1026 B14R1.34 C=CCN[C@@H](C)Cc1cccc(c1)Cl 5b47e4228ae031390d4ac5502afe28fb [1,1,0,0,0,0|0,0,2]=4 1027 B14R1.34 CC(Cc1cccc(c1)Cl)OCC#N 3c6f0cbce10c8b91b09986371fa129b9 [1,1,0,0,0,0|2,0,0]=4 1028 B14R1.34 CC(Cc1cccc(c1)F)NCC#N b8aec1eea9d83660c1c6d0909f67ad4e [1,1,0,0,0,0|1,0,0]=3 1029 B14R1.34 CC(Cc1cccc(c1)F)NCCBr d85dda37b62be13f21fdf89c61b61aa3 [1,1,0,0,0,0|1,0,1]=4 1030 B14R1.34 CC(Cc1cccc(c1)F)NCCF 69d2e329bca70da686e574e0bfb2d2f2 [1,1,0,0,0,0|1,0,1]=4 1031 B14R1.34 CC(Cc1cccc(c1)F)NCCI 245fbede447eeaa5c2fd58b548f8b3da [1,1,0,0,0,0|1,0,1]=4 1032 B14R1.34 CC(Cc1cccc(c1)F)NCCO 953db1a3178b905ce573428135941937 [1,1,0,0,0,0|1,0,1]=4 1033 B14R1.34 CC(Cc1cccc(c1)F)OCC#N 7098a1267a1b298a1573af060037914f [1,1,0,0,0,0|2,0,0]=4 1034 B14R1.34 CCCNC(C)Cc1cccc(c1)F cea990cd4d1c3cfff2eb57ea6b2d5864 [1,1,0,0,0,0|0,0,2]=4 1035 B14R1.34 CCCN[C@@H](C)Cc1cccc(c1)Cl b469a02c036100fd2c7928d8e0380230 [1,1,0,0,0,0|0,0,2]=4 1036 B14R1.34 COCN[C@@H](C)Cc1cccc(c1)Cl c0c06a381b304b8adf524b415b26d12d [1,1,0,0,0,0|1,0,1]=4 1037 B14R1.34 CSCN[C@@H](C)Cc1cccc(c1)Cl 234470f9132d742085833478a8556a6c [1,1,0,0,0,0|1,0,1]=4 1038 B14R1.34 C[C@@H](Cc1cccc(c1)Cl)NCC#N 0b8f04919c02114b3765131433bec603 [1,1,0,0,0,0|1,0,0]=3 1039 B14R1.34 C[C@@H](Cc1cccc(c1)Cl)NCC=O 807e914aa85da445d3f898d0caea5080 [1,1,0,0,0,0|1,0,1]=4 1040 B14R1.34 C[C@@H](Cc1cccc(c1)Cl)NCCF cc0679f770fab7586f4f010fe886925b [1,1,0,0,0,0|1,0,1]=4 1041 B14R1.34 C[C@@H](Cc1cccc(c1)Cl)NCCO 92caef3082373d707108f2a27adb6062 [1,1,0,0,0,0|1,0,1]=4 1042 B14R1.34 C[C@@H](Cc1cccc(c1)Cl)NCCS be31188a9e485df55407d5c321a655a6 [1,1,0,0,0,0|1,0,1]=4 1043 B14R1.34 Cc1cccc(c1)CC(C)OCC#N ad3c9103ca7074d6ce041b2fc462143a [1,1,0,0,0,0|2,0,0]=4 1044 B14R1.158 C#CCCCN(C)Cc1ccccc1 7b9bfb4907a25fdd260dea7b99394feb [1,1,0,0,0,0|2,0,0]=4 1045 B14R1.158 C#CCCNC(C)Cc1ccccn1 c95adcbe97bde2e6c12d1c92d5260230 [1,1,0,0,0,0|1,0,0]=3 1046 B14R1.158 C#CCCNC(C)Cc1cccnc1 1b399cbed9b9edca32d4ad5e5bcb6f39 [1,1,0,0,0,0|1,0,0]=3 1047 B14R1.158 C#CCCNC(C)Cc1ccncc1 964b068abb388be9d22de6867dfaf64e [1,1,0,0,0,0|1,0,0]=3 1048 B14R1.158 C#CCCNC(C)Cc1cnccn1 3fddf1ab2e7e8ec6031a5249e3e5d340 [1,1,0,0,0,0|2,0,0]=4 1049 B14R1.158 C#CCCOC(C)Cc1ccccc1 e7908561448c7d79805feeb3266393c5 [1,1,0,0,0,0|1,0,0]=3 1050 B14R1.158 C#CCCOC(C)Cc1ccccn1 278bdc6bdd5047a8c5b74541fd1e1341 [1,1,0,0,0,0|2,0,0]=4 1051 B14R1.158 C#CCCO[C@@H](C)Cc1ccccc1 8643c0f9aa4ea07eaeacda93d4150021 [1,1,0,0,0,0|1,0,0]=3 1052 B14R1.158 C#CCCO[C@H](C)Cc1ccccc1 aa42aeef574195c5a24cfbc9612d19b0 [1,1,0,0,0,0|1,0,0]=3 1053 B14R1.158 C#CCNCC(=O)Cc1ccccc1 932df164bb92a04497109829a4154cfc [1,1,0,0,0,0|1,0,1]=4 1054 B14R1.158 C#CCNCC(C)Oc1ccccc1 fa4247445fd58a8e593a7b699640fb92 [1,1,0,0,0,0|1,0,0]=3 1055 B14R1.158 C#CCNCC(C)Oc1cccnc1 701268a3fcd07d79983d0fb762f92181 [1,1,0,0,0,0|2,0,0]=4 1056 B14R1.158 C#CCNCC(O)Cc1ccccc1 a18e8155671c47115e87ab1ca80bdd14 [1,1,0,0,0,0|1,0,0]=3 1057 B14R1.158 C#CCOCC(C)Oc1ccccc1 2922ab35d1a818fe8a3ddd92b31f2b62 [1,1,0,0,0,0|2,0,0]=4 1058 B14R1.158 C#CCOC[C@H](C)Oc1ccccc1 b3617976d59d26e7c6eca567160a3c5c [1,1,0,0,0,0|2,0,0]=4 1059 B14R1.158 C=CCCNC(C)Cc1ccccc1 d1a6bf4b859ee87b1cc8d66b1173ea5c [1,1,0,0,0,0|0,0,2]=4 1060 B14R1.158 CC(CNCC#N)Oc1ccccc1 956a907a7937d144ef0944679efeaf8a [1,1,0,0,0,0|2,0,0]=4 1061 B14R1.158 CC(COCC#N)Cc1ccccc1 c6e2e3963be8d500345b6c56ea4e5980 [1,1,0,0,0,0|2,0,0]=4 1062 B14R1.158 CC(Cc1ccccc1)NCCCCl b21e6802ea33fc058ed5b68c54bcb71e [1,1,0,0,0,0|0,0,2]=4 1063 B14R1.158 CC(Cc1ccccc1)OCCC#N 3b858c2f987ae49fa7ed342e3f3817ec [1,1,0,0,0,0|1,0,1]=4 1064 B14R1.158 CC(Cc1ccccc1)OCSC#N 081bac47f42532c88b6e8bd99de5b0f6 [1,1,0,0,0,0|2,0,0]=4 1065 B14R1.158 CC(Cc1ccccn1)NCCC#N 29bd764397211d5dc47e207700f867b0 [1,1,0,0,0,0|1,0,1]=4 1066 B14R1.158 CC(Cc1cccnc1)NCCC#N cc3a90fd71f14d13423769a3dfa21e9b [1,1,0,0,0,0|1,0,1]=4 1067 B14R1.158 CC(Cc1ccncc1)NCCC#N 8dfa99e229fc8002253ad1b373df9d9c [1,1,0,0,0,0|1,0,1]=4 1068 B14R1.158 CC=CCNC(C)Cc1ccccc1 68190deac38f5c6b60d561d66d9a5458 [1,1,0,0,0,0|0,0,2]=4 1069 B14R1.158 CCCCNC(C)Cc1ccccc1 3b7762a1c6f5672e948978257da74303 [1,1,0,0,0,0|0,0,2]=4 1070 B14R1.158 C[C@@H](Cc1ccccc1)OCCC#N 400bd27cab656dd17ad53b205b06bfda [1,1,0,0,0,0|1,0,1]=4 1071 B14R1.158 C[C@@H](Cc1ccccc1)OCSC#N 0838a50e5aacbfd7bdedebe7a02b05a0 [1,1,0,0,0,0|2,0,0]=4 1072 B14R1.158 C[C@H](Cc1ccccc1)OCCC#N bdcfe5c3a49e1c0f968a9462ed0b1d89 [1,1,0,0,0,0|1,0,1]=4 1073 B14R1.158 C[C@H](Cc1ccccc1)OCSC#N e3610eb69008b899b0a128fa33deba3b [1,1,0,0,0,0|2,0,0]=4 1074 B14R1.158 N#CCNCC(O)Cc1ccccc1 b68ad95a3ab7de3caaac8fe08637c26e [1,1,0,0,0,0|2,0,0]=4 1075 B14R1.166 C#CCNC(=O)C(O)c1ccccc1 21e9a5e8dc0ae02ed214bf707249efbe [1,1,0,0,0,0|1,0,1]=4 1076 B14R1.166 C#CCNC(=O)[C@@H](O)c1ccccc1 f7ce0a64446a71f89db782ce81d580b5 [1,1,0,0,0,0|1,0,1]=4 1077 B14R1.166 C#CCNC(=O)[C@H](O)c1ccccc1 29bdf14e977cca15afa69af8577775f3 [1,1,0,0,0,0|1,0,1]=4 1078 B14R1.467 C#CCCN(CC)Cc1ccccc1 c6a9816ce2ed3a2bcd0e32de1aea9171 [1,1,0,0,0,0|2,0,0]=4 1079 B14R1.467 C#CCCN(CF)Cc1ccccc1 46fc16a33bdedbccd240bedc236bb7a5 [1,1,0,0,0,0|2,0,0]=4 1080 B14R1.467 C#CCCN(CO)Cc1ccccc1 7bdb9cba79d092f97aa9c3cc901a2b36 [1,1,0,0,0,0|2,0,0]=4 1081 B14R1.467 C#CCNC(C#N)Cc1ccccc1 a0e8aae696a0d9efc076b3857c6c7caa [1,1,0,0,0,0|0,0,1]=3 1082 B14R1.467 C#CCNC(C=O)Cc1ccccc1 adf38994ad2d98e62e783e8f7cba7522 [1,1,0,0,0,0|0,0,1]=3 1083 B14R1.467 C#CCNC(CC)Cc1ccccc1 fa546ee1fbaa34421f8476489a536aaa [1,1,0,0,0,0|0,0,0]=2 1084 B14R1.467 C#CCNC(CO)Cc1ccccc1 89f04cbc9e4e64718621c8d20548182a [1,1,0,0,0,0|0,0,0]=2 1085 B14R1.467 C#CCN[C@@H](CO)Cc1ccccc1 be306a30ce5db1caa9b51ec03735e2dd [1,1,0,0,0,0|0,0,0]=2 1086 B14R1.467 C#CCN[C@H](CO)Cc1ccccc1 bc8f189aa940384980e28d14b3ba3d1f [1,1,0,0,0,0|0,0,0]=2 1087 B14R1.467 C#CCOC(C#C)Cc1ccccc1 c43e272091e0d3cb8b0c6783af26a6cb [1,1,0,0,0,0|1,0,1]=4 1088 B14R1.467 C#CCOC(CC)Cc1ccccn1 379b8676b628e8c2b998ed5b21e0e1d3 [1,1,0,0,0,0|2,0,0]=4 1089 B14R1.467 C=CCNC(CC)Cc1ccccc1 d5afa207dc006663799350d6bbdb50f3 [1,1,0,0,0,0|0,0,2]=4 1090 B14R1.467 C=CCNC(CO)Cc1ccccc1 44afa4b4dc55aca26997abf2e8d4e4cf [1,1,0,0,0,0|0,0,2]=4 1091 B14R1.467 C=CCN[C@@H](CO)Cc1ccccc1 703bb979789848c664dc00f09c43106d [1,1,0,0,0,0|0,0,2]=4 1092 B14R1.467 C=CCN[C@H](CO)Cc1ccccc1 801dc5dda06de8f8d835294bae344fa6 [1,1,0,0,0,0|0,0,2]=4 1093 B14R1.467 CCC(Cc1ccccc1)NCC#N 047599493206cf2bfe305a451e533172 [1,1,0,0,0,0|1,0,0]=3 1094 B14R1.467 CCC(Cc1ccccc1)NCC=O 528791b240f6cb13a502e007ecf3b05d [1,1,0,0,0,0|1,0,1]=4 1095 B14R1.467 CCC(Cc1ccccc1)NCCF 29053fec9d928b35441036247459c689 [1,1,0,0,0,0|1,0,1]=4 1096 B14R1.467 CCC(Cc1ccccc1)NCCO da05fa3293e3e247b743f2cb352f4f83 [1,1,0,0,0,0|1,0,1]=4 1097 B14R1.467 CCC(Cc1ccccc1)NCCS 70761abd9051e7b6a9e96ce8210c520e [1,1,0,0,0,0|1,0,1]=4 1098 B14R1.467 CCC(Cc1ccccc1)NCOC 6a78d62c1b2eedcd8fc16a308d25c459 [1,1,0,0,0,0|1,0,1]=4 1099 B14R1.467 CCC(Cc1ccccc1)NCSC d5c9a08aab461a1630da63771281bbb7 [1,1,0,0,0,0|1,0,1]=4 1100 B14R1.467 CCC(Cc1ccccc1)OCC#N e57125860a7347c0cf2192ee616321b5 [1,1,0,0,0,0|2,0,0]=4 1101 B14R1.467 CCCNC(CC)Cc1ccccc1 ce4ae77e15e7c2f3c893cdcb23d6da89 [1,1,0,0,0,0|0,0,2]=4 1102 B14R1.467 CCCNC(CO)Cc1ccccc1 aca098aea34f4ede56f6f17ce44533f3 [1,1,0,0,0,0|0,0,2]=4 1103 B14R1.467 CCCN[C@@H](CO)Cc1ccccc1 05ee3a90375fe8d7775a9c4cc1b8b2e7 [1,1,0,0,0,0|0,0,2]=4 1104 B14R1.467 CCCN[C@H](CO)Cc1ccccc1 550fab230e1c6fb54e9f2add5a3bd413 [1,1,0,0,0,0|0,0,2]=4 1105 B14R1.467 COCNC(CO)Cc1ccccc1 f421898f1aac5165206a2ecf31276119 [1,1,0,0,0,0|1,0,1]=4 1106 B14R1.467 COCN[C@@H](CO)Cc1ccccc1 026df76c950494e5a3114ada2e6afd0e [1,1,0,0,0,0|1,0,1]=4 1107 B14R1.467 COCN[C@H](CO)Cc1ccccc1 5984322a468b7173a6066e9a311c5f6e [1,1,0,0,0,0|1,0,1]=4 1108 B14R1.467 CSCNC(CO)Cc1ccccc1 106060e1c2bb275166e4d7bfbc7d7a5c [1,1,0,0,0,0|1,0,1]=4 1109 B14R1.467 CSCN[C@@H](CO)Cc1ccccc1 ca4cb62919fb0aab7f2d4bb6dd3e990a [1,1,0,0,0,0|1,0,1]=4 1110 B14R1.467 CSCN[C@H](CO)Cc1ccccc1 39e8b9e363c147925dd1afe52ccdead1 [1,1,0,0,0,0|1,0,1]=4 1111 B14R1.467 N#CCNC(C#N)Cc1ccccc1 36a6558e07189b76387d5b23aeee1a03 [1,1,0,0,0,0|1,0,1]=4 1112 B14R1.467 N#CCNC(C=O)Cc1ccccc1 eeef0de03093ea8a8c8e5941409edfee [1,1,0,0,0,0|1,0,1]=4 1113 B14R1.467 N#CCNC(CO)Cc1ccccc1 4447fd6e8313bcfef70a36ab6aa14474 [1,1,0,0,0,0|1,0,0]=3 1114 B14R1.467 N#CCN[C@@H](CO)Cc1ccccc1 ec6858eff28b8defc491c97cf65a8636 [1,1,0,0,0,0|1,0,0]=3 1115 B14R1.467 N#CCN[C@H](CO)Cc1ccccc1 e7a97c30d9d6f1756d0a4f307cc47b4c [1,1,0,0,0,0|1,0,0]=3 1116 B14R1.467 O=CCNC(CO)Cc1ccccc1 be4c7c5e88d7a2d997996812569efe94 [1,1,0,0,0,0|1,0,1]=4 1117 B14R1.467 O=CCN[C@@H](CO)Cc1ccccc1 6e4faf3858b36741a3c85e8388a1943d [1,1,0,0,0,0|1,0,1]=4 1118 B14R1.467 O=CCN[C@H](CO)Cc1ccccc1 21aed2474a2d0a5ed20e1804d2fb0da9 [1,1,0,0,0,0|1,0,1]=4 1119 B14R1.467 OCC(Cc1ccccc1)NCCF 2e64e9ba09b48277b1bcf6d50988491d [1,1,0,0,0,0|1,0,1]=4 1120 B14R1.467 OCC(Cc1ccccc1)NCCS 2ea4faac9dc05aad7ad0bf715a31b4ec [1,1,0,0,0,0|1,0,1]=4 1121 B14R1.467 OCCNC(CO)Cc1ccccc1 77f3f903f3b64594c1920543eaea671a [1,1,0,0,0,0|1,0,1]=4 1122 B14R1.467 OCCN[C@@H](CO)Cc1ccccc1 77562f2eb5c04c97db0994052904c8b1 [1,1,0,0,0,0|1,0,1]=4 1123 B14R1.467 OCCN[C@H](CO)Cc1ccccc1 fe74e718daf5deb6354bb3efb8a805b1 [1,1,0,0,0,0|1,0,1]=4 1124 B14R1.467 OC[C@@H](Cc1ccccc1)NCCF 1320705de7975c7855cf17c2a130ed34 [1,1,0,0,0,0|1,0,1]=4 1125 B14R1.467 OC[C@@H](Cc1ccccc1)NCCS b58a31b68ed75d3ac43161b232c304b6 [1,1,0,0,0,0|1,0,1]=4 1126 B14R1.467 OC[C@H](Cc1ccccc1)NCCF 0f6f38d75910bacd141e413bdfd9c236 [1,1,0,0,0,0|1,0,1]=4 1127 B14R1.467 OC[C@H](Cc1ccccc1)NCCS aee311a81fad0ea071d7170e10b82d26 [1,1,0,0,0,0|1,0,1]=4 1128 B14R1.743 C#CC(=O)NC(C)Cc1ccccn1 407f9d181ecd773556d49c756e01473a [1,1,0,0,0,0|1,0,1]=4 1129 B14R1.743 C#CC(=O)NC(C)Cc1cccnc1 28e89d5bb7205848a5462c5b7547ad49 [1,1,0,0,0,0|1,0,1]=4 1130 B14R1.743 C#CC(=O)NC(C)Cc1ccncc1 e2b2a9c1cfc2e5d780ad2733d55f1c05 [1,1,0,0,0,0|1,0,1]=4 1131 B14R1.743 C#CC(C)NC(C)Cc1ccccc1 208444991f2c3f0bcaacc93fc1dccd12 [1,1,0,0,0,0|0,0,0]=2 1132 B14R1.743 C#C[C@@H](C)NC(C)Cc1ccccc1 248e8d682df6690b09070ec8df771651 [1,1,0,0,0,0|0,0,0]=2 1133 B14R1.743 C#C[C@H](C)NC(C)Cc1ccccc1 8c85135c547083a184fa73eb8b306ab2 [1,1,0,0,0,0|0,0,0]=2 1134 B14R1.743 C=CC(C)NC(C)Cc1ccccc1 3d02360185673ddb44aac80b3fae467e [1,1,0,0,0,0|0,0,2]=4 1135 B14R1.946 C#CCCN(C)Cc1ccccc1Br 084dfd227fe23d79830199f089dbf077 [1,1,0,0,0,0|2,0,0]=4 1136 B14R1.946 C#CCCN(C)Cc1ccccc1C 950d2c597ee6cee4e287df4566ec5686 [1,1,0,0,0,0|2,0,0]=4 1137 B14R1.946 C#CCCN(C)Cc1ccccc1Cl ca3f4092915ce892bcd52a29eaf18abf [1,1,0,0,0,0|2,0,0]=4 1138 B14R1.946 C#CCCN(C)Cc1ccccc1F 6a162781763bfb3f3f962a70cbbc9dbb [1,1,0,0,0,0|2,0,0]=4 1139 B14R1.946 C#CCCN(C)Cc1ccccc1I 7efcdada61e85c228cc4c9cdedc930b7 [1,1,0,0,0,0|2,0,0]=4 1140 B14R1.946 C#CCNC(=O)Cc1ccccc1Br f245d8d1ad860eb90c6f8329d3a420cd [1,1,0,0,0,0|1,0,1]=4 1141 B14R1.946 C#CCNC(=O)Cc1ccccc1C ce6afde18d94932496ee99571032ca24 [1,1,0,0,0,0|1,0,1]=4 1142 B14R1.946 C#CCNC(=O)Cc1ccccc1Cl 1116202700b2fb9af4cb331f72b40c59 [1,1,0,0,0,0|1,0,1]=4 1143 B14R1.946 C#CCNC(=O)Cc1ccccc1F afde0a70fa49654eb01785390941666b [1,1,0,0,0,0|1,0,1]=4 1144 B14R1.946 C#CCNC(=O)Cc1ccccc1I 2ebe28dc5e030de1802655a866ec00ef [1,1,0,0,0,0|1,0,1]=4 1145 B14R1.946 C#CCNC(=O)Cc1ccccc1O 652a7474ae78e13e58ab8bcc883bf4ac [1,1,0,0,0,0|1,0,1]=4 1146 B14R1.946 C#CCOC(C)Cc1ccccc1Cl 69eca8ffc9589c2398848ddb089c67a4 [1,1,0,0,0,0|1,0,0]=3 1147 B14R1.946 C#CCOC(C)Cc1ncccc1C f42383b5c764290b0cf47e23710a9c92 [1,1,0,0,0,0|2,0,0]=4 1148 B14R1.946 CC(Cc1ccccc1Cl)OCC#N 071b2c9c8c347cbaa8d9f13330689997 [1,1,0,0,0,0|2,0,0]=4 1149 B14R1.134 CCN(C)C(C)Cc1ccc(cc1)F f21a33eaabd4e9f238379eb2b2bc8696 [1,1,0,0,0,0|0,0,1]=3 1150 B14R1.135 CCN(C)C(C)Cc1cccc(c1)F cd8aa845792625616cac4e7e156d2a02 [1,1,0,0,0,0|0,0,1]=3 1151 B14R1.425 CC(C)N(C)C(C)Cc1ccccn1 694f96cd4086664b8a67bc92459c22be [1,1,0,0,0,0|1,0,1]=4 1152 B14R1.425 CC(C)N(C)C(C)Cc1cccnc1 17efec9048cf4b9ae9e813516b4b4922 [1,1,0,0,0,0|1,0,1]=4 1153 B14R1.532 CCN(CC)C(C)Cc1cccnc1 ba842535a4588af6fdd95e7883485244 [1,1,0,0,0,0|1,0,1]=4 1154 B14R1.532 CCN(CO)C(C)Cc1cccnc1 073bb5284f78e06da92e1b7b8d940e68 [1,1,0,0,0,0|1,0,1]=4 1155 B14R1.1031 CCN(C)C(C=O)Cc1ccccc1 ca656620cf7cac13e8a45976ba09b14e [1,1,0,0,0,0|0,0,2]=4 1156 B14R1.1031 CN(C=O)C(CO)Cc1ccccc1 d3d049033861692eabc4fd5b578e3013 [1,1,0,0,0,0|1,0,1]=4 1157 B14R1.1031 CN(C=O)[C@H](CO)Cc1ccccc1 b7192b8a421ce08b351f885d9882803d [1,1,0,0,0,0|1,0,1]=4 1158 B14R1.1031 CN(CO)C(CO)Cc1ccccc1 9a02d4b05b9c1e54dad2ce5afebf031b [1,1,0,0,0,0|1,0,0]=3 1159 B14R1.1031 CN(CO)[C@H](CO)Cc1ccccc1 ae0ffd275d692349811c2577ac054f23 [1,1,0,0,0,0|1,0,0]=3 1160 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Br c3f9091fef81b5980bf828b7fc2c328e [0,1,0,0,1,0|1,0,1]=4 1161 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)C f608fddabb9b03b9d9d91a389e79764c [0,1,0,0,1,0|1,0,1]=4 1162 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)Cl fa18067ad93d0e7088ab628c447d6059 [0,1,0,0,1,0|1,0,1]=4 1163 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)F 7a669a9a07d5e3c75623e517478ef035 [0,1,0,0,1,0|1,0,1]=4 1164 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)I bb8347b3725f27f811a77519f1777bf7 [0,1,0,0,1,0|1,0,1]=4 1165 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)O 5231be89422b434cc1e1463b1bb959f7 [0,1,0,0,1,0|1,0,1]=4 1166 B14R1.35 C#CCN(C)C(=O)c1ccc(cc1)S d65ea0aa59f5b295d7c4196ee2fb788a [0,1,0,0,1,0|1,0,1]=4 1167 B14R1.35 C#CCN(C)C(C)c1ccc(cc1)Br e20c107031998274979c0869ec5ee1fa [0,1,0,0,1,0|0,0,0]=2 1168 B14R1.35 C#CCN(C)C(C)c1ccc(cc1)F 382855167532c1cc120a25605f883606 [0,1,0,0,1,0|0,0,0]=2 1169 B14R1.35 C#CCN(C)[C@@H](C)c1ccc(cc1)F 5feaf08d89ac38e45586aa1ed6697683 [0,1,0,0,1,0|0,0,0]=2 1170 B14R1.35 C#CCN(C)[C@H](C)c1ccc(cc1)F 7a0ae40fca9b685b6364a4777728d898 [0,1,0,0,1,0|0,0,0]=2 1171 B14R1.35 C=CCN(C)C(C)c1ccc(cc1)Br 1a66d245e8534649cd88b20f79e95bb2 [0,1,0,0,1,0|0,0,2]=4 1172 B14R1.35 C=CCN(C)C(C)c1ccc(cc1)C 1f84e7b123babfa1f7e3904d920076e7 [0,1,0,0,1,0|0,0,2]=4 1173 B14R1.35 C=CCN(C)C(C)c1ccc(cc1)Cl 483efb358aff2e219d5d74fffe4adecd [0,1,0,0,1,0|0,0,2]=4 1174 B14R1.35 C=CCN(C)C(C)c1ccc(cc1)F 68a8a38f8eec8552bd670eb552bf006b [0,1,0,0,1,0|0,0,2]=4 1175 B14R1.35 C=CCN(C)[C@@H](C)c1ccc(cc1)Br e9eaa7823bea3b8ab0eb0376a3390991 [0,1,0,0,1,0|0,0,2]=4 1176 B14R1.35 C=CCN(C)[C@@H](C)c1ccc(cc1)Cl d8dc856b9f0a168fd4dcf37b59f3622f [0,1,0,0,1,0|0,0,2]=4 1177 B14R1.35 C=CCN(C)[C@@H](C)c1ccc(cc1)F 10b7f1ebe0bffa7e6c97cb6799e5fbbd [0,1,0,0,1,0|0,0,2]=4 1178 B14R1.35 C=CCN(C)[C@H](C)c1ccc(cc1)Cl 369bc28a020c0b2ec6c62ecfb60597a5 [0,1,0,0,1,0|0,0,2]=4 1179 B14R1.35 C=CCN(C)[C@H](C)c1ccc(cc1)F 5f24dffd64b339c2694834d940f62241 [0,1,0,0,1,0|0,0,2]=4 1180 B14R1.35 CC(c1ccc(cc1)Br)N(C)CC=O dc5a4ab31f75f8aab63bb59222449954 [0,1,0,0,1,0|1,0,1]=4 1181 B14R1.35 CC(c1ccc(cc1)Cl)N(C)CC=O 7932d841bad6dabb5d465aafcaed7e06 [0,1,0,0,1,0|1,0,1]=4 1182 B14R1.35 CC(c1ccc(cc1)F)N(C)CC#N cd324b22fb1b08ac66e162cd692299e9 [0,1,0,0,1,0|1,0,0]=3 1183 B14R1.35 CC(c1ccc(cc1)F)N(C)CC=O 4d72ee46f1ec492cf51dc61f2785d4c7 [0,1,0,0,1,0|1,0,1]=4 1184 B14R1.35 CC(c1ccc(cc1)F)N(C)CCO 352548b4574ce56c6c860119156788cd [0,1,0,0,1,0|1,0,1]=4 1185 B14R1.35 C[C@@H](c1ccc(cc1)Br)N(C)CC=O 925e0c57e2477c70341bfd927a6c6e38 [0,1,0,0,1,0|1,0,1]=4 1186 B14R1.35 C[C@@H](c1ccc(cc1)Cl)N(C)CC=O 01b8cfe9fa3b23b82cf7781dad4bf56c [0,1,0,0,1,0|1,0,1]=4 1187 B14R1.35 C[C@@H](c1ccc(cc1)F)N(C)CC#N 619fe0a9e84825224d686e480fad9427 [0,1,0,0,1,0|1,0,0]=3 1188 B14R1.35 C[C@@H](c1ccc(cc1)F)N(C)CC=O e7aecfdf737e11f508f9b2d237655c13 [0,1,0,0,1,0|1,0,1]=4 1189 B14R1.35 C[C@@H](c1ccc(cc1)F)N(C)CCO 4c8da297f013f7da415aeede8806873d [0,1,0,0,1,0|1,0,1]=4 1190 B14R1.35 C[C@H](c1ccc(cc1)Cl)N(C)CC=O ab273a55469205c71f6d96373fb203ea [0,1,0,0,1,0|1,0,1]=4 1191 B14R1.35 C[C@H](c1ccc(cc1)F)N(C)CC#N 1d698b7591ee2233a79ee4a36beb961c [0,1,0,0,1,0|1,0,0]=3 1192 B14R1.35 C[C@H](c1ccc(cc1)F)N(C)CC=O e0601f267859ca296a5ca2d7fd0bb118 [0,1,0,0,1,0|1,0,1]=4 1193 B14R1.35 C[C@H](c1ccc(cc1)F)N(C)CCO f2849f5f5c0261645d9177960cde3c2f [0,1,0,0,1,0|1,0,1]=4 1194 B14R1.35 Cc1ccc(cc1)C(C)N(C)CC#N 6ff34aa624fe3d433ce8ddeebc24dff9 [0,1,0,0,1,0|1,0,0]=3 1195 B14R1.35 Cc1ccc(cc1)C(C)N(C)CC=O 2c1b651b34937950819a96b0f778eda6 [0,1,0,0,1,0|1,0,1]=4 1196 B14R1.36 C#CCN(C)C(=O)c1cccc(c1)Br 36ad8ce93787eb680f2387b898644fae [0,1,0,0,1,0|1,0,1]=4 1197 B14R1.36 C#CCN(C)C(=O)c1cccc(c1)C d12fd8001f3656613ece1989272e0106 [0,1,0,0,1,0|1,0,1]=4 1198 B14R1.36 C#CCN(C)C(=O)c1cccc(c1)Cl 2fff8db53ff841ff9f534e896fbfb6dd [0,1,0,0,1,0|1,0,1]=4 1199 B14R1.36 C#CCN(C)C(=O)c1cccc(c1)F 400fd02b099607cd67820502e68c043c [0,1,0,0,1,0|1,0,1]=4 1200 B14R1.36 C#CCN(C)C(=O)c1cccc(c1)I e5123de6a80ea20fc92f3794b902f787 [0,1,0,0,1,0|1,0,1]=4 1201 B14R1.36 C#CCN(C)C(=O)c1cccc(c1)O d03a405d2f9e2b1e29c0788084844acc [0,1,0,0,1,0|1,0,1]=4 1202 B14R1.36 C#CCN(C)C(=O)c1cccc(c1)S ace78afebd2f4b0e82b0d51605817077 [0,1,0,0,1,0|1,0,1]=4 1203 B14R1.36 C#CCN(C)C(C)c1cccc(c1)Cl 2438d18e2b0ccb64e9cadf00c20a8dc7 [0,1,0,0,1,0|0,0,0]=2 1204 B14R1.36 C#CCN(C)C(C)c1cccc(c1)F c93a34136f8b68d12dd4606a5fc652a3 [0,1,0,0,1,0|0,0,0]=2 1205 B14R1.36 C#CCN(C)[C@@H](C)c1cccc(c1)F 320136d91340394c0509d8fe72278256 [0,1,0,0,1,0|0,0,0]=2 1206 B14R1.36 C#CCN(C)[C@H](C)c1cccc(c1)F 1ff66c91ff15534979780233b6bbab0d [0,1,0,0,1,0|0,0,0]=2 1207 B14R1.36 C=CCN(C)C(C)c1cccc(c1)Br 1c43c9fb6c8e2de7767ea5792184ac0e [0,1,0,0,1,0|0,0,2]=4 1208 B14R1.36 C=CCN(C)C(C)c1cccc(c1)Cl 6718891397d7a0f23180e59f1b4c7bb1 [0,1,0,0,1,0|0,0,2]=4 1209 B14R1.36 C=CCN(C)C(C)c1cccc(c1)F 1715b6d04fb6014fbb9cb3f1cb2b1503 [0,1,0,0,1,0|0,0,2]=4 1210 B14R1.36 C=CCN(C)[C@@H](C)c1cccc(c1)C 1c85ffba4f8a2d30ef42e0069636f11a [0,1,0,0,1,0|0,0,2]=4 1211 B14R1.36 C=CCN(C)[C@@H](C)c1cccc(c1)F 6ee06ed342ec6de32edd1ae126673660 [0,1,0,0,1,0|0,0,2]=4 1212 B14R1.36 C=CCN(C)[C@H](C)c1cccc(c1)F 6069d206c2e7ffde8a70af211dc02111 [0,1,0,0,1,0|0,0,2]=4 1213 B14R1.36 CC(c1cccc(c1)Cl)N(C)CC=O 9308afa367bf18b70df1309890fb1094 [0,1,0,0,1,0|1,0,1]=4 1214 B14R1.36 CC(c1cccc(c1)F)N(C)CC#N 5628e4a2dc18119215fc5666672e77c8 [0,1,0,0,1,0|1,0,0]=3 1215 B14R1.36 CC(c1cccc(c1)F)N(C)CC=O 1f467f670aa44812a70f42486e38167a [0,1,0,0,1,0|1,0,1]=4 1216 B14R1.36 C[C@@H](c1cccc(c1)F)N(C)CC#N 0b5bf55b9b6b7077f27b47d8be7d61b1 [0,1,0,0,1,0|1,0,0]=3 1217 B14R1.36 C[C@@H](c1cccc(c1)F)N(C)CC=O 3bd8efdd826ce4c05932331999e22b1f [0,1,0,0,1,0|1,0,1]=4 1218 B14R1.36 C[C@H](c1cccc(c1)F)N(C)CC#N adad4ac206ae101d786c29a93201f2b7 [0,1,0,0,1,0|1,0,0]=3 1219 B14R1.36 C[C@H](c1cccc(c1)F)N(C)CC=O 144e8969c31bb84059a8bf5beedb45b2 [0,1,0,0,1,0|1,0,1]=4 1220 B14R1.36 Cc1cccc(c1)[C@H](C)N(C)CC=O 5360a00e214cc363238ec3b694f55a58 [0,1,0,0,1,0|1,0,1]=4 1221 B14R1.417 CC(C)CN(C)C(C)c1ccccc1 823beb220e577fa924f3b8518e50f80f [0,1,0,0,1,0|0,0,2]=4 1222 B14R1.417 CC(C)CN(C)[C@@H](C)c1ccccc1 2809f1891beb4861aebac035129b5f07 [0,1,0,0,1,0|0,0,2]=4 1223 B14R1.417 CC(C)CN(C)[C@H](C)c1ccccc1 e074929bc8fc6f400eef0e5417db46a7 [0,1,0,0,1,0|0,0,2]=4 1224 B14R1.417 CC(c1ccccc1)N(C)CC(=O)N 87de98ed64ffc26fb5c8c5f2bc23e106 [0,1,0,0,1,0|1,0,1]=4 1225 B14R1.417 C[C@@H](c1ccccc1)N(C)CC(=O)N 1b97d3b59a1137b6610bcc48c832263c [0,1,0,0,1,0|1,0,1]=4 1226 B14R1.417 C[C@H](c1ccccc1)N(C)CC(=O)N e08edc4c3161c908015ff8649b3ddd5b [0,1,0,0,1,0|1,0,1]=4 1227 B14R1.478 C#CCN(CC)C(C)c1ccccc1 52203f400eaf14de1d9655f94d4880f1 [0,1,0,0,1,0|0,0,0]=2 1228 B14R1.478 C#CCN(CF)C(C)c1ccccc1 4d7b2064878e85adffb33c11c546fa3f [0,1,0,0,1,0|0,0,0]=2 1229 B14R1.478 C#CCN(CO)C(C)c1ccccc1 882792c591eefd583a89bc4b9a15ddf3 [0,1,0,0,1,0|0,0,0]=2 1230 B14R1.478 C=CCN(CC)C(C)c1ccccc1 bd7a7f169e4b564906b346562abadc6c [0,1,0,0,1,0|0,0,2]=4 1231 B14R1.478 C=CCN(CC)[C@@H](C)c1ccccc1 5b66aaced93c9304937688754b7581df [0,1,0,0,1,0|0,0,2]=4 1232 B14R1.478 C=CCN(CF)C(C)c1ccccc1 3ec762586d497594b9b4e199962a797b [0,1,0,0,1,0|0,0,2]=4 1233 B14R1.478 C=CCN(CF)[C@@H](C)c1ccccc1 ded3fafd0418716056e62c16a5d3c5f3 [0,1,0,0,1,0|0,0,2]=4 1234 B14R1.478 C=CCN(CO)C(C)c1ccccc1 256a10d0a0ec21df9f28283d4e040b2f [0,1,0,0,1,0|0,0,2]=4 1235 B14R1.478 C=CCN(CO)[C@@H](C)c1ccccc1 18b499eef209f758a921570108a66891 [0,1,0,0,1,0|0,0,2]=4 1236 B14R1.478 CC(c1ccccc1)N(CO)CCO 50e05bc58fbb19ad7a3cf3fb397d7cf7 [0,1,0,0,1,0|1,0,1]=4 1237 B14R1.478 CCN(CC=O)C(C)c1ccccc1 9eb911c127bfa3638e0704a7256b9bce [0,1,0,0,1,0|1,0,1]=4 1238 B14R1.478 CCN(CCO)C(C)c1ccccc1 ade9e16bf52c6b47857584b010b6ecb4 [0,1,0,0,1,0|1,0,1]=4 1239 B14R1.478 CCN(CCO)[C@@H](C)c1ccccc1 6cb4fdc94a04b71a8063e231c7584f4e [0,1,0,0,1,0|1,0,1]=4 1240 B14R1.478 CCN(CCO)[C@H](C)c1ccccc1 44ae38a3883e8757eb3e4c7a199d1217 [0,1,0,0,1,0|1,0,1]=4 1241 B14R1.478 C[C@@H](c1ccccc1)N(CO)CCO 22ee2d08a30f1254e8f9984708a582ef [0,1,0,0,1,0|1,0,1]=4 1242 B14R1.478 C[C@H](c1ccccc1)N(CO)CCO f828f8291e98a5ac9871ad588b312bb4 [0,1,0,0,1,0|1,0,1]=4 1243 B14R1.510 C#CCN(C)C(C)(C)c1ccccc1 813f6f69f2c78d453fdc65d035945cce [0,1,0,0,1,0|0,0,0]=2 1244 B14R1.510 C=CCN(C)C(C)(C)c1ccccc1 f3ecdd9b8392ce39dd67a4b9a241aa04 [0,1,0,0,1,0|0,0,2]=4 1245 B14R1.510 CCCN(C)C(C)(C)c1ccccc1 1627af5d863ce71097eb9404d4bdef5a [0,1,0,0,1,0|0,0,2]=4 1246 B14R1.510 CN(CC#N)C(C)(C)c1ccccc1 51f19a5f8dd51c523c41d960201e2fa7 [0,1,0,0,1,0|1,0,0]=3 1247 B14R1.510 CN(CC=O)C(C)(C)c1ccccc1 e49f411d02539edf4b21bf5b22ba7885 [0,1,0,0,1,0|1,0,1]=4 1248 B14R1.510 CN(CCF)C(C)(C)c1ccccc1 3287f28c5852743bf9d247ba36e2d0f8 [0,1,0,0,1,0|1,0,1]=4 1249 B14R1.510 CN(CCS)C(C)(C)c1ccccc1 d62d258bf593216f66b734eb879efee6 [0,1,0,0,1,0|1,0,1]=4 1250 B14R1.510 CSCN(C)C(C)(C)c1ccccc1 1580096c34660c31fb114ed2e5a8b2a7 [0,1,0,0,1,0|1,0,1]=4 1251 B14R1.604 C#CCN(C)C(C#N)c1ccccc1 056f9cdf66b7c53b6d2de6fb7e55be0a [0,1,0,0,1,0|0,0,1]=3 1252 B14R1.604 C#CCN(C)C(C=C)c1ccccc1 caedb0e21f15e9e4c227b0d2a5e552b9 [0,1,0,0,1,0|0,0,1]=3 1253 B14R1.604 C#CCN(C)C(C=O)c1ccccc1 b51bb92b44760b608dd2762680b8c3fd [0,1,0,0,1,0|0,0,1]=3 1254 B14R1.604 C#CCN(C)C(CC)c1ccccc1 bed45a39a20da89a117926b943765271 [0,1,0,0,1,0|0,0,0]=2 1255 B14R1.604 C#CCN(C)C(CC)c1ccccn1 9cfcb836ac56ff845a1cc77725b95085 [0,1,0,0,1,0|1,0,0]=3 1256 B14R1.604 C#CCN(C)C(CC)c1cccnc1 56096c0a670e55ab305665e2e4a98f15 [0,1,0,0,1,0|1,0,0]=3 1257 B14R1.604 C#CCN(C)C(CO)c1ccccc1 a03d129afd39911c862fb573f5643a30 [0,1,0,0,1,0|0,0,0]=2 1258 B14R1.604 C#CCN(C)[C@@H](CO)c1ccccc1 d1d3af394e215f631b02c0625ff5b539 [0,1,0,0,1,0|0,0,0]=2 1259 B14R1.604 C#CCN(C)[C@H](CO)c1ccccc1 5c2ad244183dd8144a516ce6c3ae9040 [0,1,0,0,1,0|0,0,0]=2 1260 B14R1.604 C=CC(c1ccccc1)N(C)CC#N 799a3b5ca6b402326fda0d8ff509848b [0,1,0,0,1,0|1,0,1]=4 1261 B14R1.604 C=CCN(C)C(CC)c1ccccc1 b36aab99c9d6b5e0707b4a78f7e68301 [0,1,0,0,1,0|0,0,2]=4 1262 B14R1.604 C=CCN(C)C(CO)c1ccccc1 0556491c8693323f6ab1a678fef67613 [0,1,0,0,1,0|0,0,2]=4 1263 B14R1.604 C=CCN(C)[C@@H](CO)c1ccccc1 d4d11e790d4e62b932e7f1d297205908 [0,1,0,0,1,0|0,0,2]=4 1264 B14R1.604 C=CCN(C)[C@H](CO)c1ccccc1 d1cf69577213610d79ae9f4feb05f49f [0,1,0,0,1,0|0,0,2]=4 1265 B14R1.604 CCC(c1ccccc1)N(C)CC#N 0a420a583b4101d32d5ac45a6dbedc5e [0,1,0,0,1,0|1,0,0]=3 1266 B14R1.604 CCC(c1ccccc1)N(C)CC=O 5717a37c4b886147f0486fc931de197d [0,1,0,0,1,0|1,0,1]=4 1267 B14R1.604 CCC(c1ccccc1)N(C)CCF a5f76a62334eed94d645c130a55d0fbe [0,1,0,0,1,0|1,0,1]=4 1268 B14R1.604 CCC(c1ccccc1)N(C)CSC e14c3e091c3694dd687d6f9e108366c5 [0,1,0,0,1,0|1,0,1]=4 1269 B14R1.604 CCC(c1ccccn1)N(C)CC#N a0361e74b22b3044bf27051efed64a81 [0,1,0,0,1,0|2,0,0]=4 1270 B14R1.604 CCC(c1cccnc1)N(C)CC#N 3db48ed0b4f3a38aad37d013c8c64c56 [0,1,0,0,1,0|2,0,0]=4 1271 B14R1.604 CCCN(C)C(CC)c1ccccc1 78100d7670fe1cf411106f4500ed92c6 [0,1,0,0,1,0|0,0,2]=4 1272 B14R1.604 CCCN(C)C(CO)c1ccccc1 df53ca81491d0c6975758052b92d1542 [0,1,0,0,1,0|0,0,2]=4 1273 B14R1.604 CCCN(C)[C@@H](CO)c1ccccc1 0b597cc6954ecda264dc98fe7eb0fc2b [0,1,0,0,1,0|0,0,2]=4 1274 B14R1.604 CCCN(C)[C@H](CO)c1ccccc1 bcdcfc083e958c98140fbaa06d218c6b [0,1,0,0,1,0|0,0,2]=4 1275 B14R1.604 CN(CC#N)C(C#N)c1ccccc1 ba0cb7e46076ffbdab3f5e189afa9167 [0,1,0,0,1,0|1,0,1]=4 1276 B14R1.604 CN(CC#N)C(C=O)c1ccccc1 34a7242f3b437ad707f5d170d7d12b39 [0,1,0,0,1,0|1,0,1]=4 1277 B14R1.604 CN(CC#N)C(CO)c1ccccc1 b37cc2e213efb6745a3bf1cd6d294741 [0,1,0,0,1,0|1,0,0]=3 1278 B14R1.604 CN(CC#N)[C@@H](CO)c1ccccc1 efb9047b0da4be608c1c1865d15d27a2 [0,1,0,0,1,0|1,0,0]=3 1279 B14R1.604 CN(CC#N)[C@H](CO)c1ccccc1 d91d457ac4cf78715ec4bef20bd22b34 [0,1,0,0,1,0|1,0,0]=3 1280 B14R1.604 CN(CC=O)C(CO)c1ccccc1 7aeb32b3a02dcd5d5dd21b751d039306 [0,1,0,0,1,0|1,0,1]=4 1281 B14R1.604 CN(CC=O)[C@@H](CO)c1ccccc1 c844c16045d65fe199c86cbc461f37e0 [0,1,0,0,1,0|1,0,1]=4 1282 B14R1.604 CN(CC=O)[C@H](CO)c1ccccc1 81740cf8a2f7a0dbd9e729fbdae7a612 [0,1,0,0,1,0|1,0,1]=4 1283 B14R1.604 CN(CCF)C(CO)c1ccccc1 3af2c4f207dcdf573da3d7b2cd024d7c [0,1,0,0,1,0|1,0,1]=4 1284 B14R1.604 CN(CCF)[C@@H](CO)c1ccccc1 6701e919dfacecde0eb841433efd5dc5 [0,1,0,0,1,0|1,0,1]=4 1285 B14R1.604 CN(CCF)[C@H](CO)c1ccccc1 90093110223117aae5a636bf9bb75930 [0,1,0,0,1,0|1,0,1]=4 1286 B14R1.604 CN(CCO)C(CO)c1ccccc1 1b7ccfe0d92c38fef4c766ab50a68242 [0,1,0,0,1,0|1,0,1]=4 1287 B14R1.604 CN(CCO)[C@@H](CO)c1ccccc1 cf74bee259346e0a75fb5fa989e3f0f1 [0,1,0,0,1,0|1,0,1]=4 1288 B14R1.604 CN(CCO)[C@H](CO)c1ccccc1 cc270f7b30a03de8242210dffb5ef450 [0,1,0,0,1,0|1,0,1]=4 1289 B14R1.604 CN(CCS)C(CO)c1ccccc1 e1fe1570bd47ed703ecd0612b4ffa37d [0,1,0,0,1,0|1,0,1]=4 1290 B14R1.604 CN(CCS)[C@@H](CO)c1ccccc1 a36f672e41abe224562e1b3a2de0b9b8 [0,1,0,0,1,0|1,0,1]=4 1291 B14R1.604 CN(CCS)[C@H](CO)c1ccccc1 e643cbd9b7d3c129c52d91623ca9ca1e [0,1,0,0,1,0|1,0,1]=4 1292 B14R1.604 COCN(C)C(CO)c1ccccc1 3b9f46980a637b6693b9c984ee7f8911 [0,1,0,0,1,0|1,0,1]=4 1293 B14R1.604 COCN(C)[C@@H](CO)c1ccccc1 cdfaefdd30a635ffc977c4f1b4e93dfc [0,1,0,0,1,0|1,0,1]=4 1294 B14R1.604 COCN(C)[C@H](CO)c1ccccc1 256accad16d31c0572686bbb7e336351 [0,1,0,0,1,0|1,0,1]=4 1295 B14R1.604 CSCN(C)C(CO)c1ccccc1 b33fc68f13a88cea8c15f5234c551ac2 [0,1,0,0,1,0|1,0,1]=4 1296 B14R1.604 CSCN(C)[C@@H](CO)c1ccccc1 1455763e408183200c6527692f2dbe0d [0,1,0,0,1,0|1,0,1]=4 1297 B14R1.604 CSCN(C)[C@H](CO)c1ccccc1 b6cbafe9a55ceed02daca5f1fc43bc8b [0,1,0,0,1,0|1,0,1]=4 1298 B14R1.3348 C#CCN(C)C(=O)c1ccccc1C b86a6c023e520d10d313c1a706263ea9 [0,1,0,0,1,0|1,0,1]=4 1299 B14R1.3348 C#CCN(C)C(=O)c1ccccc1F 1e3ee839da15548c1bac11ac59047baf [0,1,0,0,1,0|1,0,1]=4 1300 B14R1.3348 C#CCN(C)C(=O)c1ccccc1I da4bf8b63c4cc20faba63fb66ecf342d [0,1,0,0,1,0|1,0,1]=4 1301 B14R1.3348 C#CCN(C)C(C)c1ccccc1C 39f4df0102b4f57cef7a6b104728367e [0,1,0,0,1,0|0,0,0]=2 1302 B14R1.3348 C#CCN(C)C(C)c1ccccc1Cl 78e2b4845efa2ae42c90ed37ad639527 [0,1,0,0,1,0|0,0,0]=2 1303 B14R1.3348 C#CCN(C)C(C)c1ccccc1F 7986619c6fa6cbb2dc01168a017338f3 [0,1,0,0,1,0|0,0,0]=2 1304 B14R1.3348 C#CCN(C)[C@@H](C)c1ccccc1Cl 933217d1c1a80d1b7969c49c02a821a2 [0,1,0,0,1,0|0,0,0]=2 1305 B14R1.3348 C#CCN(C)[C@@H](C)c1ccccc1F 6c031f56da4581a067ac17fe8566eb9b [0,1,0,0,1,0|0,0,0]=2 1306 B14R1.3348 C#CCN(C)[C@H](C)c1ccccc1Cl 1a61b131dfa60f178631ecb2d1bd62e6 [0,1,0,0,1,0|0,0,0]=2 1307 B14R1.3348 C=CCN(C)C(C)c1ccccc1C d39bcb16cdaf0e4028b3ac18eca496c8 [0,1,0,0,1,0|0,0,2]=4 1308 B14R1.3348 C=CCN(C)C(C)c1ccccc1Cl 752534440d37d4f29dc4ad19b1d5bc05 [0,1,0,0,1,0|0,0,2]=4 1309 B14R1.3348 C=CCN(C)C(C)c1ccccc1F cd2607bcda6a529ca9e76890c4470f04 [0,1,0,0,1,0|0,0,2]=4 1310 B14R1.3348 C=CCN(C)[C@@H](C)c1ccccc1Cl bf86f1e6ddd5598b9daa6a06d050ad1d [0,1,0,0,1,0|0,0,2]=4 1311 B14R1.3348 C=CCN(C)[C@@H](C)c1ccccc1F c70e1fc6fbcedcd87296a82a36b93591 [0,1,0,0,1,0|0,0,2]=4 1312 B14R1.3348 C=CCN(C)[C@H](C)c1ccccc1Cl 51ebcc6fd48ce450b964ebd8e0229806 [0,1,0,0,1,0|0,0,2]=4 1313 B14R1.3348 CC(c1ccccc1Cl)N(C)CC=O 18c3bd08b7aa55ddf259f739c2542d9e [0,1,0,0,1,0|1,0,1]=4 1314 B14R1.3348 CC(c1ccccc1F)N(C)CC=O 5cf81e98c74637418f466da51a118211 [0,1,0,0,1,0|1,0,1]=4 1315 B14R1.3348 CCCN(C)C(C)c1ccccc1C 8e7230fab5f18fc0449e42d4a75c8bc2 [0,1,0,0,1,0|0,0,2]=4 1316 B14R1.3348 COCN(C)C(C)c1ccccc1C e4e7352ecf5b1fd0d61a48909e2ba350 [0,1,0,0,1,0|1,0,1]=4 1317 B14R1.3348 C[C@@H](c1ccccc1Cl)N(C)CC=O 8779aeaac71e461289804d6b2da127fa [0,1,0,0,1,0|1,0,1]=4 1318 B14R1.3348 C[C@@H](c1ccccc1F)N(C)CC=O 28b1ac45f0a3c385a469c3229527d361 [0,1,0,0,1,0|1,0,1]=4 1319 B14R1.3348 C[C@H](c1ccccc1Cl)N(C)CC=O 198233ece9776ffa2c3fa2365cdd6542 [0,1,0,0,1,0|1,0,1]=4 1320 B14R1.3348 Cc1ccccc1C(C)N(C)CC=O 821672a0f7ceb281764268ab235da887 [0,1,0,0,1,0|1,0,1]=4 1321 B14R1.475 C#CCN(C)C(C)C(=O)c1cccs1 f5e52970e946d1f8e1318b30c52e597a [0,1,0,0,1,0|1,0,1]=4 1322 B16R1.936 C#CCC(=O)NC(CC)Cc1ccccc1 9d6571288cb4e6c3610ac9650e00cf14 [0,1,0,0,0,1|2,0,0]=4 1323 B16R1.936 C#CCC(=O)NC(CO)Cc1ccccc1 4d04cfbe4c8f635b0437b205971c9a60 [0,1,0,0,0,1|2,0,0]=4 1324 B16R1.936 C#CCC(=O)N[C@@H](CO)Cc1ccccc1 667b03212dec5babac6ac758d5154213 [0,1,0,0,0,1|2,0,0]=4 1325 B16R1.936 C#CCC(=O)N[C@H](CO)Cc1ccccc1 0114e095497abd070fbd1128c42bb1d7 [0,1,0,0,0,1|2,0,0]=4 1326 B16R1.936 C#CCC(C)OC(C=O)Cc1ccccc1 d8308560396771554d8ddd5abd3bf591 [0,1,0,0,0,1|1,0,1]=4 1327 B16R1.936 C#CCN(C)CC(C#N)Cc1ccccc1 ffdc35de79cb2a8ae8612e95c540cd0d [0,1,0,0,0,1|0,0,1]=3 1328 B16R1.936 CC(CC#N)NC(CO)Cc1ccccc1 64ffd612262240066867e9b7cfc4c641 [0,1,0,0,0,1|2,0,0]=4 1329 B16R1.936 CC(CC#N)N[C@@H](CO)Cc1ccccc1 8c83456b07ee6a66215863a7a0273b53 [0,1,0,0,0,1|2,0,0]=4 1330 B16R1.936 CC(CC#N)N[C@H](CO)Cc1ccccc1 71a0f1e6bf7ee99e8bbbb46d86234b21 [0,1,0,0,0,1|2,0,0]=4 1331 B16R1.936 CCC(Cc1ccccc1)NC(C)CC#N 01424273b4a1f0b3a536d12ea9962c0b [0,1,0,0,0,1|2,0,0]=4 1332 B16R1.936 CN(CC#N)CC(C#N)Cc1ccccc1 be6bb1e07de2ceac6129816ab7d68485 [0,1,0,0,0,1|1,0,1]=4 1333 B16R1.945 C#CCN(C)C(=O)/C(=C/c1ccccc1)/C a460955167142d936e4464ecf4a121df [0,1,0,0,0,1|0,0,2]=4 1334 B16R1.945 C#CCN(C)C(=O)C(=O)Cc1ccccc1 3a22012e1bf45a69a287ba87697b13f2 [0,1,0,0,0,1|1,0,1]=4 1335 B16R1.945 C#CCN(C)C(=O)C(C)Oc1ccccc1 9f448002ad604f76141529585f536e72 [0,1,0,0,0,1|1,0,0]=3 1336 B16R1.945 C#CCN(C)C(=O)C(C)Oc1ccccn1 010e783baba39439b674e2158a2a15f7 [0,1,0,0,0,1|2,0,0]=4 1337 B16R1.945 C#CCN(C)C(=O)C(C)Sc1ccccn1 6306298b26ed8c5351b6b687abfc1f67 [0,1,0,0,0,1|2,0,0]=4 1338 B16R1.945 C#CCN(C)C(=O)C(O)Cc1ccccc1 fb2b0d222250c72def684333d53424e1 [0,1,0,0,0,1|1,0,0]=3 1339 B16R1.945 C#CCN(C)C(=O)C(O)Cc1cccnc1 0daab8cdf9f592597eeac74f9bea641d [0,1,0,0,0,1|2,0,0]=4 1340 B16R1.945 C#CCN(C)C(=O)C(S)Cc1ccccc1 b6d3f7abc2545eaf566802a0bdced774 [0,1,0,0,0,1|1,0,0]=3 1341 B16R1.945 C#CCN(C)C(=O)[C@@H](C)Oc1ccccc1 f9b21fb814d469bb75f90ee848f09c81 [0,1,0,0,0,1|1,0,0]=3 1342 B16R1.945 C#CCN(C)C(=O)[C@@H](O)Cc1ccccc1 6cb7c89896f98a9de2f5813acc4640cb [0,1,0,0,0,1|1,0,0]=3 1343 B16R1.945 C#CCN(C)C(=O)[C@H](C)Oc1ccccc1 46306e9a3ea8cd1547b4559f19bab779 [0,1,0,0,0,1|1,0,0]=3 1344 B16R1.945 C#CCN(C)C(=O)[C@H](O)Cc1ccccc1 7e4ea6756384bbbb1774c96150be436f [0,1,0,0,0,1|1,0,0]=3 1345 B16R1.945 CC(Oc1ccccc1)C(=O)N(C)CC#N 7e6498a5daf88937180858974dda83d4 [0,1,0,0,0,1|2,0,0]=4 1346 B16R1.945 CN(CC#N)C(=O)C(O)Cc1ccccc1 d432f4553a08ff933f27662bca335a18 [0,1,0,0,0,1|2,0,0]=4 1347 B16R1.945 CN(CC#N)C(=O)C(S)Cc1ccccc1 ed0d4d6022493e087ed44815827acc53 [0,1,0,0,0,1|2,0,0]=4 1348 B16R1.945 CN(CC#N)C(=O)[C@@H](O)Cc1ccccc1 b87edaea28bc02e46355f24c9a71abff [0,1,0,0,0,1|2,0,0]=4 1349 B16R1.945 CN(CC#N)C(=O)[C@H](O)Cc1ccccc1 5ed575da085afc7adc58c1bac4d20a48 [0,1,0,0,0,1|2,0,0]=4 1350 B16R1.945 C[C@@H](Oc1ccccc1)C(=O)N(C)CC#N 674765c289218a2e80602233fb44d416 [0,1,0,0,0,1|2,0,0]=4 1351 B16R1.945 C[C@H](Oc1ccccc1)C(=O)N(C)CC#N 5323c50a6e0778e88ce56fbfd76d77b6 [0,1,0,0,0,1|2,0,0]=4 1352 B16R1.955 C#CCC(=O)NC(C)Cc1ccc(cc1)O 9b52faee07955c7046a7082c3ecdc77e [0,1,0,0,0,1|2,0,0]=4 1353 B16R1.955 C#CCN(C)CC(C)Oc1ccc(cc1)F 7335c2e7f8e773fd4aa710a527799e64 [0,1,0,0,0,1|1,0,0]=3 1354 B16R1.955 CC(CC#N)OC(C)Cc1ccc(cc1)Br 1e79d2c7e3a929778772824a50b4a669 [0,1,0,0,0,1|2,0,0]=4 1355 B16R1.955 CC(CC#N)OC(C)Cc1ccc(cc1)Cl 36a3d7b742a25929b09f0cf4070b90c2 [0,1,0,0,0,1|2,0,0]=4 1356 B16R1.955 CC(CC#N)OC(C)Cc1ccc(cc1)F f0a55cbab7981d73d3318c1833cbc93c [0,1,0,0,0,1|2,0,0]=4 1357 B16R1.955 CC(CN(C)CC#N)Oc1ccc(cc1)F 06762168e671db7be10063c1b12d4963 [0,1,0,0,0,1|2,0,0]=4 1358 B16R1.955 Cc1ccc(cc1)CC(C)OC(C)CC#N 0a88aa83021835c0f9121c21d1b91fb3 [0,1,0,0,0,1|2,0,0]=4 1359 B16R1.956 C#CCC(=O)NC(C)Cc1cccc(c1)O 15b93515bc18c11d0d6b2e5f20fb79a3 [0,1,0,0,0,1|2,0,0]=4 1360 B16R1.956 C#CCC(=O)N[C@@H](C)Cc1cccc(c1)Cl 4278dcaddd5e3ef2fc6b5c59b8746a72 [0,1,0,0,0,1|2,0,0]=4 1361 B16R1.956 C#CCC(=O)N[C@@H](C)Cc1cccc(c1)O ec771555a7d022d8327e44ee9793a87a [0,1,0,0,0,1|2,0,0]=4 1362 B16R1.956 C#CCC(C)OC(C)Cc1cccc(c1)F e60b566f603b62e328d872927ad2d89a [0,1,0,0,0,1|1,0,0]=3 1363 B16R1.956 C#CCN(C)CC(=O)Cc1cccc(c1)Br 0a0df114dc99bfeeca91ed1c9e378782 [0,1,0,0,0,1|1,0,1]=4 1364 B16R1.956 CC(CC#N)NC(C)Cc1cccc(c1)F 2a2a71c9bdac56559a58562120abc882 [0,1,0,0,0,1|2,0,0]=4 1365 B16R1.956 CC(CC#N)N[C@@H](C)Cc1cccc(c1)Cl 2fa06d6c4eec233a8b56f67d74e2aec6 [0,1,0,0,0,1|2,0,0]=4 1366 B16R1.956 CC(CC#N)OC(C)Cc1cccc(c1)Cl 792b7f8e1beb205b5dea23fbe873e8cd [0,1,0,0,0,1|2,0,0]=4 1367 B16R1.956 CC(CC#N)OC(C)Cc1cccc(c1)F ec59419b7fded90c066029e87b7a3820 [0,1,0,0,0,1|2,0,0]=4 1368 B16R1.956 CC(Cc1cccc(c1)F)O[C@@H](C)CC#N 0d135f6c0d3e398cecd54c299c500aea [0,1,0,0,0,1|2,0,0]=4 1369 B16R1.956 CC(Cc1cccc(c1)F)O[C@H](C)CC#N 8c602fa2a50be655655922f45477c77b [0,1,0,0,0,1|2,0,0]=4 1370 B16R1.956 Cc1cccc(c1)CC(C)OC(C)CC#N decaadfd6cd005e1027576dc74970911 [0,1,0,0,0,1|2,0,0]=4 1371 B16R1.1497 C#CCCN(C)CC(=O)Cc1ccccc1 e1e7eb3925245348e593602d57243119 [0,1,0,0,0,1|1,0,1]=4 1372 B16R1.1497 C#CCN[C@H](C)CN(C)Cc1ccccc1 4bbf13b5828c44048ec20ed3e4353aca [0,1,0,0,0,1|2,0,0]=4 1373 B16R1.4235 C#CCC(=O)NC(C)Cc1ccccc1O 280c2ce818b17b64a3b22f919e0116e9 [0,1,0,0,0,1|2,0,0]=4 1374 B16R1.4235 C#CCN(C)CC(O)Cc1ccccc1F 3649d2ae4f73b562b2cd806d34fbb586 [0,1,0,0,0,1|1,0,0]=3 1375 B16R1.4235 CN(CC#N)CC(O)Cc1ccccc1F 57ce7b4ca9a9a595e67840e865e6f98e [0,1,0,0,0,1|2,0,0]=4 1376 B16R1.194 CC(COc1ccccc1)N(CO)CCO 5175584bfc6d72f0f35ced4efb8d39ad [0,1,0,0,0,1|1,0,1]=4 1377 B16R1.194 CCN(CCO)C(C)COc1ccccc1 9af8721875867409933ba7baa5341fc5 [0,1,0,0,0,1|1,0,1]=4 1378 B16R1.912 C#CCN(C)C(=O)CC(C)c1ccccc1 79c1869b2eb58dcd51fad0712f44f247 [0,1,0,0,0,1|1,0,1]=4 1379 B16R1.912 C#CCN(C)C(=O)CC(O)c1ccccc1 5866739c35ef3c4fcd3e032f2ae9f5dd [0,1,0,0,0,1|1,0,1]=4 1380 B16R1.912 C#CCN(C)C(=O)CN(C)c1ccccc1 48d3c01e7adbd2cdded870e4714b75d5 [0,1,0,0,0,1|1,0,1]=4 1381 B16R1.912 C#CCN(C)C(=O)C[C@@H](C)c1ccccc1 f4e39b9eb82a4b235395d90fbddb52d0 [0,1,0,0,0,1|1,0,1]=4 1382 B16R1.912 C#CCN(C)C(=O)C[C@@H](O)c1ccccc1 5f358d7aa92a9086c604be716687a195 [0,1,0,0,0,1|1,0,1]=4 1383 B16R1.912 C#CCN(C)C(=O)C[C@H](C)c1ccccc1 8263ee183e3196ffb3e27b2039396ef6 [0,1,0,0,0,1|1,0,1]=4 1384 B16R1.912 C#CCN(C)C(=O)C[C@H](O)c1ccccc1 a28037d0a5d9ba2dee5a40d3928e6df8 [0,1,0,0,0,1|1,0,1]=4 1385 B16R1.912 C#CCN(C)C(=O)NC(C)c1ccccc1 046d8485d08bff7ef55c70ef6d2d2837 [0,1,0,0,0,1|1,0,1]=4 1386 B16R1.912 C#CCN(C)C(=O)N[C@@H](C)c1ccccc1 dc1795dff8eba4e90818d0eb45b9de95 [0,1,0,0,0,1|1,0,1]=4 1387 B16R1.912 C#CCN(C)C(=O)N[C@H](C)c1ccccc1 2d107d44a1fe937360afcb8da0d38d26 [0,1,0,0,0,1|1,0,1]=4 1388 B16R1.912 C#CCN(C)C(=S)NC(C)c1ccccc1 806a5df40e594951adb0644ed9d67deb [0,1,0,0,0,1|1,0,1]=4 1389 B16R1.912 C#CCN(C)C(=S)N[C@@H](C)c1ccccc1 328b77ba99523262b35c36347a1fab09 [0,1,0,0,0,1|1,0,1]=4 1390 B16R1.912 C#CCN(C)C(=S)N[C@H](C)c1ccccc1 caf28eeb21e0c8d508143d33b7c5b783 [0,1,0,0,0,1|1,0,1]=4 1391 B16R1.979 C#CCN(C)C(=O)CCc1ccc(cc1)Br b7b5fe50eb53ecc44554c41679c67f08 [0,1,0,0,0,1|1,0,1]=4 1392 B16R1.979 C#CCN(C)C(=O)CCc1ccc(cc1)C 0740d625afb9c2ba1386a8475215ba6e [0,1,0,0,0,1|1,0,1]=4 1393 B16R1.979 C#CCN(C)C(=O)CCc1ccc(cc1)Cl a9f76d7d9706b3e1cd0c9c6cb02ceee8 [0,1,0,0,0,1|1,0,1]=4 1394 B16R1.979 C#CCN(C)C(=O)CCc1ccc(cc1)F ce59c1ce40f9f2b5d42a025d8c767b5f [0,1,0,0,0,1|1,0,1]=4 1395 B16R1.979 C#CCN(C)C(=O)CCc1ccc(cc1)I aa5f4cae6c861cac62a205a60b6c3cc0 [0,1,0,0,0,1|1,0,1]=4 1396 B16R1.979 C#CCN(C)C(=O)CCc1ccc(cc1)O 8c4ba5d1f977dcf2ec346ccf1daeda42 [0,1,0,0,0,1|1,0,1]=4 1397 B16R1.979 C#CCN(C)C(=O)CCc1ccc(cc1)S 8debea18b92829733994bba2c0f1ead3 [0,1,0,0,0,1|1,0,1]=4 1398 B16R1.979 C#CCN(C)C(=O)COc1ccc(cc1)Br b28c4b95ddfc6a3b74f3fdf9d9eb0566 [0,1,0,0,0,1|1,0,1]=4 1399 B16R1.979 C#CCN(C)C(=O)COc1ccc(cc1)C 257438c931dd039c090dac25caa752a8 [0,1,0,0,0,1|1,0,1]=4 1400 B16R1.979 C#CCN(C)C(=O)COc1ccc(cc1)Cl ddc3bc31b724661582021f7dc55fb14a [0,1,0,0,0,1|1,0,1]=4 1401 B16R1.979 C#CCN(C)C(=O)COc1ccc(cc1)F 7b233587905de6a21cfbd3309865aa4f [0,1,0,0,0,1|1,0,1]=4 1402 B16R1.979 C#CCN(C)C(=O)COc1ccc(cc1)I f57e1fb65d07670299f88c770cc8a059 [0,1,0,0,0,1|1,0,1]=4 1403 B16R1.979 C#CCN(C)C(=O)COc1ccc(cc1)O 10f7c4890ab5373c448d290f2bb70a90 [0,1,0,0,0,1|1,0,1]=4 1404 B16R1.979 C#CCN(C)C(=O)CSc1ccc(cc1)Br 1f076f82777675797a6a28a76a2741df [0,1,0,0,0,1|1,0,1]=4 1405 B16R1.979 C#CCN(C)C(=O)CSc1ccc(cc1)C 8279650e3d72b95e18976580a2f72aa6 [0,1,0,0,0,1|1,0,1]=4 1406 B16R1.979 C#CCN(C)C(=O)CSc1ccc(cc1)Cl c701e0e99322cb025c1f91147d2e7e8e [0,1,0,0,0,1|1,0,1]=4 1407 B16R1.979 C#CCN(C)C(=O)CSc1ccc(cc1)F 83d362d3f00cd0194992bbf5b27c1597 [0,1,0,0,0,1|1,0,1]=4 1408 B16R1.979 C#CCN(C)C(=O)NCc1ccc(cc1)Br ab43369b8c25e40cba39fe0e24943d57 [0,1,0,0,0,1|1,0,1]=4 1409 B16R1.979 C#CCN(C)C(=O)NCc1ccc(cc1)C 90bd8fb7e04a8dd6d65ba6b6bc6f84ef [0,1,0,0,0,1|1,0,1]=4 1410 B16R1.979 C#CCN(C)C(=O)NCc1ccc(cc1)Cl b9e0e4865b4c6c8be2baaa1971e07217 [0,1,0,0,0,1|1,0,1]=4 1411 B16R1.979 C#CCN(C)C(=O)NCc1ccc(cc1)F 1a5837f174bc049464e19b13ab47fc63 [0,1,0,0,0,1|1,0,1]=4 1412 B16R1.979 C#CCN(C)C(=O)NCc1ccc(cc1)I b7add17ebe0ce70b0e8fb11061310fbb [0,1,0,0,0,1|1,0,1]=4 1413 B16R1.979 C#CCN(C)C(=O)NCc1ccc(cc1)O 6dc668ca799ae0c2d47d3b7098d4b2a4 [0,1,0,0,0,1|1,0,1]=4 1414 B16R1.979 C#CCN(C)C(=S)NCc1ccc(cc1)Br a2cddcfa30231e33b6f9b7c62c593beb [0,1,0,0,0,1|1,0,1]=4 1415 B16R1.979 C#CCN(C)C(=S)NCc1ccc(cc1)C da1738324b797a5d0419344db0ecde02 [0,1,0,0,0,1|1,0,1]=4 1416 B16R1.979 C#CCN(C)C(=S)NCc1ccc(cc1)Cl 9bfa5f05b1faf3d1815d6ee6eded3d11 [0,1,0,0,0,1|1,0,1]=4 1417 B16R1.979 C#CCN(C)C(=S)NCc1ccc(cc1)F cae7ccdd00e5bb78483003a192b5406a [0,1,0,0,0,1|1,0,1]=4 1418 B16R1.979 C#CCN(C)C(=S)NCc1ccc(cc1)I de83571b52ba9f992a8481bb68b4457a [0,1,0,0,0,1|1,0,1]=4 1419 B16R1.979 C#CCN(C)C(=S)NCc1ccc(cc1)O 14f0ecb91ade22af287f06849da7fde6 [0,1,0,0,0,1|1,0,1]=4 1420 B16R1.980 C#CCN(C)C(=O)CCc1cccc(c1)Br 89058489041e74869a537255670471e3 [0,1,0,0,0,1|1,0,1]=4 1421 B16R1.980 C#CCN(C)C(=O)CCc1cccc(c1)C 6125c2736b33c01c0b70cd1a9928a0f7 [0,1,0,0,0,1|1,0,1]=4 1422 B16R1.980 C#CCN(C)C(=O)CCc1cccc(c1)Cl 467cbc2febf27fc9d74c76d60eafbf67 [0,1,0,0,0,1|1,0,1]=4 1423 B16R1.980 C#CCN(C)C(=O)CCc1cccc(c1)F 3aa519f8d94fe329cb726cf96ae81e27 [0,1,0,0,0,1|1,0,1]=4 1424 B16R1.980 C#CCN(C)C(=O)CCc1cccc(c1)I 663177c2b79dacb1da2c5cd5857f7087 [0,1,0,0,0,1|1,0,1]=4 1425 B16R1.980 C#CCN(C)C(=O)CCc1cccc(c1)O dcda66cc33dccbeae5696a16e667f602 [0,1,0,0,0,1|1,0,1]=4 1426 B16R1.980 C#CCN(C)C(=O)COc1cccc(c1)Br 02f56c78b9fb18fd33ecc189d23115d3 [0,1,0,0,0,1|1,0,1]=4 1427 B16R1.980 C#CCN(C)C(=O)COc1cccc(c1)C 004125c2311c2c7f980812cf5d46d725 [0,1,0,0,0,1|1,0,1]=4 1428 B16R1.980 C#CCN(C)C(=O)COc1cccc(c1)Cl 42f374e8bdc4782be9f55e4968397e90 [0,1,0,0,0,1|1,0,1]=4 1429 B16R1.980 C#CCN(C)C(=O)COc1cccc(c1)F ec5cdacdb83742c650c15a146e1819e7 [0,1,0,0,0,1|1,0,1]=4 1430 B16R1.980 C#CCN(C)C(=O)COc1cccc(c1)I 653b69342aadc41892478eb821da7b5f [0,1,0,0,0,1|1,0,1]=4 1431 B16R1.980 C#CCN(C)C(=O)COc1cccc(c1)O e4fd138a175e6499d802b00a65e2a87f [0,1,0,0,0,1|1,0,1]=4 1432 B16R1.980 C#CCN(C)C(=O)CSc1cccc(c1)Br a2ddf324f5d2f0c7bcfd316247bd281a [0,1,0,0,0,1|1,0,1]=4 1433 B16R1.980 C#CCN(C)C(=O)CSc1cccc(c1)Cl f6e363c0cfa93aef9ff929600f50e815 [0,1,0,0,0,1|1,0,1]=4 1434 B16R1.980 C#CCN(C)C(=O)CSc1cccc(c1)F 84f86143ec3f4129405aa7ed9aa1868d [0,1,0,0,0,1|1,0,1]=4 1435 B16R1.980 C#CCN(C)C(=O)NCc1cccc(c1)Br ae0d75471fd1a1e700863ccca3fa7239 [0,1,0,0,0,1|1,0,1]=4 1436 B16R1.980 C#CCN(C)C(=O)NCc1cccc(c1)C ed2224b974340444dfffd5e5e656d246 [0,1,0,0,0,1|1,0,1]=4 1437 B16R1.980 C#CCN(C)C(=O)NCc1cccc(c1)Cl 52cb1e815550488ee032b0f575bfb308 [0,1,0,0,0,1|1,0,1]=4 1438 B16R1.980 C#CCN(C)C(=O)NCc1cccc(c1)F f4fb9585943aefa4d8acf10d67ab13e6 [0,1,0,0,0,1|1,0,1]=4 1439 B16R1.980 C#CCN(C)C(=O)NCc1cccc(c1)I b477f60deff4fb554191ba2835c0f45f [0,1,0,0,0,1|1,0,1]=4 1440 B16R1.980 C#CCN(C)C(=O)NCc1cccc(c1)O 8cf8bfecc635615981525c390981a780 [0,1,0,0,0,1|1,0,1]=4 1441 B16R1.980 C#CCN(C)C(=S)NCc1cccc(c1)Br 376329d12d52f53ad1944de36abee48b [0,1,0,0,0,1|1,0,1]=4 1442 B16R1.980 C#CCN(C)C(=S)NCc1cccc(c1)C 01d0d9264380f2a98a0d33e157f10159 [0,1,0,0,0,1|1,0,1]=4 1443 B16R1.980 C#CCN(C)C(=S)NCc1cccc(c1)Cl 3aaf7f6c4720a7b77f44e30dd8f4dbb7 [0,1,0,0,0,1|1,0,1]=4 1444 B16R1.980 C#CCN(C)C(=S)NCc1cccc(c1)F 6fe41d1545f3f417dd0be06b8f268349 [0,1,0,0,0,1|1,0,1]=4 1445 B16R1.980 C#CCN(C)C(=S)NCc1cccc(c1)I d83b1f2f2e36e11559d9a73999f305d2 [0,1,0,0,0,1|1,0,1]=4 1446 B16R1.980 C#CCN(C)C(=S)NCc1cccc(c1)O f393450682a0ed0afe85d5364808c3db [0,1,0,0,0,1|1,0,1]=4 1447 B16R1.1516 C#CCCN(C)C(=O)CCc1ccccc1 248eeb4d207b24b915f046326dcba104 [0,1,0,0,0,1|1,0,1]=4 1448 B16R1.1516 C#CCCN(C)C(=O)COc1ccccc1 523ac1980e81d774250a0fcc9b8fae81 [0,1,0,0,0,1|1,0,1]=4 1449 B16R1.1516 C#CCCN(C)C(=O)CSc1ccccc1 84f5c594bd90d93cc8a315f93ed26079 [0,1,0,0,0,1|1,0,1]=4 1450 B16R1.1516 C#CCCN(C)C(=O)NCc1ccccc1 19f5c95310a54f4d1dc2d48ad4dc979c [0,1,0,0,0,1|1,0,1]=4 1451 B16R1.1516 C#CCCN(C)C(=S)NCc1ccccc1 1ef76d5fabdede85e18a9db1fbac011c [0,1,0,0,0,1|1,0,1]=4 1452 B16R1.1516 C#CCCN(C)C(C)CCc1ccccc1 583b2a03617d41ec9e5d622da90ba3a0 [0,1,0,0,0,1|0,0,0]=2 1453 B16R1.1516 C#CCCN(C)C(C)COc1ccccc1 5c284a2ea850504d8fb3578027306eb7 [0,1,0,0,0,1|0,0,0]=2 1454 B16R1.1516 C#CCNC(=O)C(C)NCc1ccccc1 8af7c80061bfb96012fc5de1631dce64 [0,1,0,0,0,1|2,0,0]=4 1455 B16R1.1516 C#CCNC(=O)C(C)OCc1ccccc1 2bd089a1ee14ff6cd982e0ec9b5e36de [0,1,0,0,0,1|2,0,0]=4 1456 B16R1.1516 C#CCNC(=O)C(C)SCc1ccccc1 c3b51911a632e4a733985ed6e88117f4 [0,1,0,0,0,1|2,0,0]=4 1457 B16R1.1516 C#CCNC(=O)[C@@H](C)OCc1ccccc1 b1837928b6bb78d3f2b5a6dc898692ae [0,1,0,0,0,1|2,0,0]=4 1458 B16R1.1516 C#CCNC(=O)[C@H](C)OCc1ccccc1 c1d8b07f918d2446cfa3522da4d06f8a [0,1,0,0,0,1|2,0,0]=4 1459 B16R1.1516 C=CCCN(C)C(C)CCc1ccccc1 dd5b2e407c42d2e1117576f6c824afcd [0,1,0,0,0,1|0,0,2]=4 1460 B16R1.1516 C=CCCN(C)C(C)COc1ccccc1 5fbed2fdb8b23b0745aa6c1f4661f0ca [0,1,0,0,0,1|0,0,2]=4 1461 B16R1.1516 CC(CCc1ccccc1)N(C)CCC#N c14c2fd005e038f4d7c4b27af34b4df4 [0,1,0,0,0,1|0,0,1]=3 1462 B16R1.1516 CC(CCc1ccccc1)N(C)CCCO c1622d7129b2ac75d7c6b132ccef9920 [0,1,0,0,0,1|0,0,2]=4 1463 B16R1.1516 CC(COc1ccccc1)N(C)CCC#N 90ca034d21cad598b0640ca5fc751675 [0,1,0,0,0,1|0,0,1]=3 1464 B16R1.1516 CCCCN(C)C(C)CCc1ccccc1 fe38ee236caeb8c6efd41c12a81f80bf [0,1,0,0,0,1|0,0,2]=4 1465 B16R1.1516 CCCCN(C)C(C)COc1ccccc1 1c6489682ec8dbef259707517b918cbd [0,1,0,0,0,1|0,0,2]=4 1466 B16R1.1516 COCCN(C)C(C)COc1ccccc1 178e63f318590af430b2ff363d28f033 [0,1,0,0,0,1|0,0,2]=4 1467 B16R1.1672 CC(CCc1ccccc1)N(C)[C@@H](C)CO 1b868fc39b25bb11b56837b2c4be0da0 [0,1,0,0,0,1|1,0,1]=4 1468 B16R1.1672 CC(CCc1ccccc1)N(C)[C@H](C)CO 1c9b89166540380b3ac7c02aa49699a6 [0,1,0,0,0,1|1,0,1]=4 1469 B16R1.1672 CC(CO)N(C)C(C)CCc1ccccc1 b71ae2bcd7a2eb8315c4de95dbb9c872 [0,1,0,0,0,1|1,0,1]=4 1470 B16R1.1672 CC(CO)N(C)C(C)COc1ccccc1 cc0ba43452e532fda87d56fc96220816 [0,1,0,0,0,1|1,0,1]=4 1471 B16R1.1672 CC(COc1ccccc1)N(C)[C@@H](C)CO 58e6906d59ae0d8616c63d97b345f57c [0,1,0,0,0,1|1,0,1]=4 1472 B16R1.1672 CC(COc1ccccc1)N(C)[C@H](C)CO 7c722b19462599736951ff10eabe4b63 [0,1,0,0,0,1|1,0,1]=4 1473 B16R1.1672 CCC(C)N(C)C(C)CCc1ccccc1 e56a9050f9009e07d4dbfd2b3e673439 [0,1,0,0,0,1|0,0,2]=4 1474 B16R1.1672 CCC(C)N(C)C(C)COc1ccccc1 9cfe0c5b4bda687eb7950804f2004c8b [0,1,0,0,0,1|0,0,2]=4 1475 B16R1.4553 C#CCN(C)C(=O)CCc1ccccc1Br 45a7e4e2436f03e6cfb3244e31c1bbe4 [0,1,0,0,0,1|1,0,1]=4 1476 B16R1.4553 C#CCN(C)C(=O)CCc1ccccc1C 3b2e32014ae3e1e60b4fbb076c032bfc [0,1,0,0,0,1|1,0,1]=4 1477 B16R1.4553 C#CCN(C)C(=O)CCc1ccccc1Cl c02857d46a734be7fed10d3f598889d5 [0,1,0,0,0,1|1,0,1]=4 1478 B16R1.4553 C#CCN(C)C(=O)CCc1ccccc1F 0807307dd46cbd4b55c742960d30b36b [0,1,0,0,0,1|1,0,1]=4 1479 B16R1.4553 C#CCN(C)C(=O)CCc1ccccc1I aee3b595ab2664d3a37321e5b6ed6442 [0,1,0,0,0,1|1,0,1]=4 1480 B16R1.4553 C#CCN(C)C(=O)CCc1ccccc1O d3944667be70e0872f891478e3325c5e [0,1,0,0,0,1|1,0,1]=4 1481 B16R1.4553 C#CCN(C)C(=O)COc1ccccc1Br c6ddd1e0ba51f7ea3dd317251a1a5a02 [0,1,0,0,0,1|1,0,1]=4 1482 B16R1.4553 C#CCN(C)C(=O)COc1ccccc1C e181e3581b5fa97a49c5299d947f7adf [0,1,0,0,0,1|1,0,1]=4 1483 B16R1.4553 C#CCN(C)C(=O)COc1ccccc1Cl 7789c8fdf1a1d767deee15360554ca3c [0,1,0,0,0,1|1,0,1]=4 1484 B16R1.4553 C#CCN(C)C(=O)COc1ccccc1F f094651df18bca0309bfaebd03442fe2 [0,1,0,0,0,1|1,0,1]=4 1485 B16R1.4553 C#CCN(C)C(=O)COc1ccccc1I 8740877e9f8bbdf564e8a35d046b0360 [0,1,0,0,0,1|1,0,1]=4 1486 B16R1.4553 C#CCN(C)C(=O)CSc1ccccc1Br de7b5df043c7b481b447889bd84685e8 [0,1,0,0,0,1|1,0,1]=4 1487 B16R1.4553 C#CCN(C)C(=O)CSc1ccccc1C 58a4f42f1ee08a6bd6bf8fde28392332 [0,1,0,0,0,1|1,0,1]=4 1488 B16R1.4553 C#CCN(C)C(=O)CSc1ccccc1Cl 3a3cf620bfefa396903f1f4a8a48dfa1 [0,1,0,0,0,1|1,0,1]=4 1489 B16R1.4553 C#CCN(C)C(=O)CSc1ccccc1O 0a39a9f33dacdb624ca758c024b106dd [0,1,0,0,0,1|1,0,1]=4 1490 B16R1.4553 C#CCN(C)C(=O)NCc1ccccc1Br d8dabfd176204f7e530adc9dd50648dd [0,1,0,0,0,1|1,0,1]=4 1491 B16R1.4553 C#CCN(C)C(=O)NCc1ccccc1C 27bf3ad8e0a6917e201eb80c2e37d7ae [0,1,0,0,0,1|1,0,1]=4 1492 B16R1.4553 C#CCN(C)C(=O)NCc1ccccc1Cl 87993b059fad5eb769a604ce6d3dc6aa [0,1,0,0,0,1|1,0,1]=4 1493 B16R1.4553 C#CCN(C)C(=O)NCc1ccccc1F 8ea383f9d265b7c67c026880afad0383 [0,1,0,0,0,1|1,0,1]=4 1494 B16R1.4553 C#CCN(C)C(=O)NCc1ccccc1I 95df3c401109cb1fa160893cd6139902 [0,1,0,0,0,1|1,0,1]=4 1495 B16R1.4553 C#CCN(C)C(=O)NCc1ccccc1O b246be2fc71f3bce3c6de407d181c5ab [0,1,0,0,0,1|1,0,1]=4 1496 B16R1.4553 C#CCN(C)C(=S)NCc1ccccc1Br 456ae308b34a249e91d199e92635f167 [0,1,0,0,0,1|1,0,1]=4 1497 B16R1.4553 C#CCN(C)C(=S)NCc1ccccc1C 39a205e7b3045b5c239e4ac137bad794 [0,1,0,0,0,1|1,0,1]=4 1498 B16R1.4553 C#CCN(C)C(=S)NCc1ccccc1Cl b1258a5a56c28df86dff55f5867b1a56 [0,1,0,0,0,1|1,0,1]=4 1499 B16R1.4553 C#CCN(C)C(=S)NCc1ccccc1F 10baa853fd5d26dbc5e61cb487951958 [0,1,0,0,0,1|1,0,1]=4 1500 B16R1.4553 C#CCN(C)C(=S)NCc1ccccc1I 811d4fc1211e16153b5c8f99f7b264c7 [0,1,0,0,0,1|1,0,1]=4 1501 B16R1.4553 C#CCN(C)C(=S)NCc1ccccc1O de3558ec14bc16cf4041d84ba20802ae [0,1,0,0,0,1|1,0,1]=4 1502 B16R1.6944 CC(C)CN(C)C(C)CCc1ccccc1 6a5f0a0ed70ac4a682b23b243fbc6e02 [0,1,0,0,0,1|0,0,2]=4 1503 B16R1.6944 CC(C)CN(C)C(C)COc1ccccc1 d003523c93e9f6accdc42c50e969491b [0,1,0,0,0,1|0,0,2]=4 1504 B16R1.6944 CC(CCc1ccccc1)N(C)CC(=O)O eda4e7f19a4bd6aed2fba124e3f69e67 [0,1,0,0,0,1|1,0,1]=4 1505 B16R1.6944 CC(COc1ccccc1)N(C)CC(=O)N 1583dfb3e6d071744ff8a5b3b64dcbdd [0,1,0,0,0,1|1,0,1]=4 1506 B16R1.6944 CC(COc1ccccc1)N(C)CC(=O)O b3bbeb94d9f55d3a825654742ca6ae83 [0,1,0,0,0,1|1,0,1]=4 1507 B16R1.6944 CC(COc1ccccc1)N(C)CC(F)F a34e56b0b681fddca176498ab680f123 [0,1,0,0,0,1|1,0,1]=4 1508 B16R1.6944 CC(COc1ccccc1)N(C)C[C@H](C)O c25022c90503e507b109f42e6d0ef31a [0,1,0,0,0,1|0,0,2]=4 1509 B16R1.6944 CC(O)CN(C)C(C)COc1ccccc1 f614d7eab073d8de0cb9052899516747 [0,1,0,0,0,1|0,0,2]=4 1510 B16R1.658 C#CCCN(C)C(=O)Cc1ccc(cc1)Br c09286a58a239f50ced73e8bb38e6f51 [0,2,0,0,0,0|1,0,1]=4 1511 B16R1.658 C#CCCN(C)C(=O)Cc1ccc(cc1)C e35d0942eda2bee662eb99ec082f4a90 [0,2,0,0,0,0|1,0,1]=4 1512 B16R1.658 C#CCCN(C)C(=O)Cc1ccc(cc1)Cl 97f4f348eea1c6ae6b618c7cc89dfe32 [0,2,0,0,0,0|1,0,1]=4 1513 B16R1.658 C#CCCN(C)C(=O)Cc1ccc(cc1)F 15af169a8be1f4afd466214502efcd15 [0,2,0,0,0,0|1,0,1]=4 1514 B16R1.658 C#CCCN(C)C(=O)Cc1ccc(cc1)I 4dc6ca715d17f0ffabc766a1d6bfda45 [0,2,0,0,0,0|1,0,1]=4 1515 B16R1.658 C#CCCN(C)C(=O)Cc1ccc(cc1)O 29bdb018009e5ad6db71df09f925f738 [0,2,0,0,0,0|1,0,1]=4 1516 B16R1.658 C#CCCN(C)C(=O)Cc1ccc(cc1)S 42d2aa674804ffaa04bf5343b8a7a25c [0,2,0,0,0,0|1,0,1]=4 1517 B16R1.658 C=CCCN(C)C(C)Cc1ccc(cc1)F ebc728af53783299c4fbec73b55a5ea2 [0,2,0,0,0,0|0,0,2]=4 1518 B16R1.658 CCCCN(C)C(C)Cc1ccc(cc1)F 633d35826453f3e72f735ed0de6197a9 [0,2,0,0,0,0|0,0,2]=4 1519 B16R1.685 C#CCN(C)C(=O)C(C)c1ccc(cc1)C e750f25b244f1bb97f72616477e8d853 [0,2,0,0,0,0|1,0,1]=4 1520 B16R1.685 C#CCN(C)C(=O)C(C)c1ccc(cc1)I d7a79e873cbac16cd0b063a7b282cade [0,2,0,0,0,0|1,0,1]=4 1521 B16R1.685 C#CCN(C)C(=O)C(F)c1ccc(cc1)Br dfc873672328b795c119d3b186c43e24 [0,2,0,0,0,0|1,0,1]=4 1522 B16R1.685 C#CCN(C)C(=O)C(F)c1ccc(cc1)C b09de31f559bbc8f67c5fd164cf8c950 [0,2,0,0,0,0|1,0,1]=4 1523 B16R1.685 C#CCN(C)C(=O)C(F)c1ccc(cc1)Cl 6e1fe954124ab78d0ef582edeef5050a [0,2,0,0,0,0|1,0,1]=4 1524 B16R1.685 C#CCN(C)C(=O)C(F)c1ccc(cc1)F 443d9b21cbe2561f09f11206d2403f58 [0,2,0,0,0,0|1,0,1]=4 1525 B16R1.685 C#CCN(C)C(=O)C(O)c1ccc(cc1)Br 22ff6f791c187b15842ba2b9c9dae6aa [0,2,0,0,0,0|1,0,1]=4 1526 B16R1.685 C#CCN(C)C(=O)C(O)c1ccc(cc1)C 820869cce08f61d2c3dd98f37860d35a [0,2,0,0,0,0|1,0,1]=4 1527 B16R1.685 C#CCN(C)C(=O)C(O)c1ccc(cc1)Cl c83f241ce2b1975daf9cb83197703f06 [0,2,0,0,0,0|1,0,1]=4 1528 B16R1.685 C#CCN(C)C(=O)C(O)c1ccc(cc1)F 3b8b33b95b5594097525d42bbca60710 [0,2,0,0,0,0|1,0,1]=4 1529 B16R1.685 C#CCN(C)C(=O)C(O)c1ccc(cc1)O d8ad07ef98eda9285836cc8814eb71fb [0,2,0,0,0,0|1,0,1]=4 1530 B16R1.685 C#CCN(C)C(=O)[C@@H](C)c1ccc(cc1)C 09a66ae9bdb37fb83b6f7773b3946ce7 [0,2,0,0,0,0|1,0,1]=4 1531 B16R1.685 C#CCN(C)C(=O)[C@@H](O)c1ccc(cc1)Br bc876ecca5de2aa6ad2c8090c160bd39 [0,2,0,0,0,0|1,0,1]=4 1532 B16R1.685 C#CCN(C)C(=O)[C@@H](O)c1ccc(cc1)Cl 9cfe0960b0e68e18f83342a240bfb20d [0,2,0,0,0,0|1,0,1]=4 1533 B16R1.685 C#CCN(C)C(=O)[C@@H](O)c1ccc(cc1)F 618725ab1c6260bb126a5986858ac338 [0,2,0,0,0,0|1,0,1]=4 1534 B16R1.685 C#CCN(C)C(=O)[C@@H](O)c1ccc(cc1)O 7d6b17ca454854dfcf3aee71ac4aa2cf [0,2,0,0,0,0|1,0,1]=4 1535 B16R1.685 C#CCN(C)C(=O)[C@H](C)c1ccc(cc1)C a298c919a9c75fa746425818c2cc3224 [0,2,0,0,0,0|1,0,1]=4 1536 B16R1.685 C#CCN(C)C(=O)[C@H](O)c1ccc(cc1)Br 0b6393177e8e321f2f2358584a398588 [0,2,0,0,0,0|1,0,1]=4 1537 B16R1.685 C#CCN(C)C(=O)[C@H](O)c1ccc(cc1)C a7b1ab138fca69e266907a171639820f [0,2,0,0,0,0|1,0,1]=4 1538 B16R1.685 C#CCN(C)C(=O)[C@H](O)c1ccc(cc1)Cl e6fa91d606be3a7d5652df537f1b102e [0,2,0,0,0,0|1,0,1]=4 1539 B16R1.685 C#CCN(C)C(=O)[C@H](O)c1ccc(cc1)F 4ae54f272497c3e486e90419073b0df7 [0,2,0,0,0,0|1,0,1]=4 1540 B16R1.685 C#CCN(C)C(=O)[C@H](O)c1ccc(cc1)O d1b5bbdf5a65ead0eaa1285a200a3cb8 [0,2,0,0,0,0|1,0,1]=4 1541 B16R1.685 C#CCN(C)C(C)C(=O)c1ccc(cc1)F 8c028e03d221da8526fbf7d58621f595 [0,2,0,0,0,0|0,0,1]=3 1542 B16R1.1065 CC(C)CN(C)C(C)Cc1ccc(cc1)F 54d503cb5a9bdd154ed1c8247f938742 [0,2,0,0,0,0|0,0,2]=4 1543 B16R1.1065 CC(Cc1ccc(cc1)F)N(C)CC(=O)N 2a11f188d77818561a38a4acfd9327fe [0,2,0,0,0,0|1,0,1]=4 1544 B16R1.1065 CC(Cc1ccc(cc1)F)N(C)CC(=O)O cbbaa495cedb88e1be226b3e80ec3b22 [0,2,0,0,0,0|1,0,1]=4 1545 B16R1.1065 CC(Cc1ccc(cc1)F)N(C)CC(F)F ba8ade0f1cdb8b6df880b933610e0fe8 [0,2,0,0,0,0|1,0,1]=4 1546 B16R1.1065 CC(Cc1ccc(cc1)F)N(C)C[C@H](C)O bd35a2517bf0703c7eeb51f199f60c6b [0,2,0,0,0,0|0,0,2]=4 1547 B16R1.1065 CC(O)CN(C)C(C)Cc1ccc(cc1)F 786481094f2bf6beff867c0198df3815 [0,2,0,0,0,0|0,0,2]=4 1548 B16R1.4958 C#CCN(C)C(=O)Cc1ccc(cc1)C#C 030d4f7a15c9905f58f86616ef24b763 [0,2,0,0,0,0|1,0,1]=4 1549 B16R1.4958 C#CCN(C)C(=O)Cc1ccc(cc1)C#N b9b432761076f6511e44b88d5e2eb705 [0,2,0,0,0,0|1,0,1]=4 1550 B16R1.4958 C#CCN(C)C(=O)Cc1ccc(cc1)C=O b2c2c032d866029f47faba5c93c72678 [0,2,0,0,0,0|1,0,1]=4 1551 B16R1.4958 C#CCN(C)C(=O)Cc1ccc(cc1)CC 61659747dadb6b4c4ee04df065639fbe [0,2,0,0,0,0|1,0,1]=4 1552 B16R1.4958 C#CCN(C)C(=O)Cc1ccc(cc1)CO 8826922e1d7cd291106bafeabf1e330f [0,2,0,0,0,0|1,0,1]=4 1553 B16R1.4958 C#CCN(C)C(=O)Cc1ccc(cc1)OC e96822a20d58035037e2ecae97a685a6 [0,2,0,0,0,0|1,0,1]=4 1554 B16R1.4958 C#CCN(C)C(=O)Cc1ccc(cc1)SC 7ea277a7740fa002cc374c2034fbf4dd [0,2,0,0,0,0|1,0,1]=4 1555 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Br)C ee0e1b069d71bb12ce6f6662442287a1 [0,2,0,0,0,0|1,0,1]=4 1556 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Br)Cl bf1366d3269b75065e5546b3d8d2931c [0,2,0,0,0,0|1,0,1]=4 1557 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Br)F b6bbc901d75344c1d1f4c25913e6fede [0,2,0,0,0,0|1,0,1]=4 1558 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)C)Br b1bc9c65fdb32938462b4220a1f3987e [0,2,0,0,0,0|1,0,1]=4 1559 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)C)C 411bb029a9476ab9137924c2ad4cff3e [0,2,0,0,0,0|1,0,1]=4 1560 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)C)Cl 90ec64866c2ed8f83e3af23db5953609 [0,2,0,0,0,0|1,0,1]=4 1561 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)C)F 479678e0966212031eb0fef4ebcae17b [0,2,0,0,0,0|1,0,1]=4 1562 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)C)O 0bdf33cedadba6e230eb58044c7626df [0,2,0,0,0,0|1,0,1]=4 1563 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Cl)Br 7e41ceba5b1d0c3563bab93d16a94ce0 [0,2,0,0,0,0|1,0,1]=4 1564 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Cl)C 743a3ff021fbeedb94961245d11fc72a [0,2,0,0,0,0|1,0,1]=4 1565 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Cl)Cl e7627dcf3cc1b12a74d943bf2a8ddd48 [0,2,0,0,0,0|1,0,1]=4 1566 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Cl)F 64619575472c34bb41524c575a98822c [0,2,0,0,0,0|1,0,1]=4 1567 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)Cl)O 1d7a5134c7e271089ac19f0199b40094 [0,2,0,0,0,0|1,0,1]=4 1568 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)F)Br 8db3e8cfb309abbd1fdcff9500ad3f78 [0,2,0,0,0,0|1,0,1]=4 1569 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)F)C 12b1f4d90bed3c5b57bd67233a75f5a3 [0,2,0,0,0,0|1,0,1]=4 1570 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)F)Cl 4c3738e8bbc72d50e47399716d14566a [0,2,0,0,0,0|1,0,1]=4 1571 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)F)F ea7624ff3770ffee13367629cdaae19d [0,2,0,0,0,0|1,0,1]=4 1572 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)F)I dd3777ce189c425112ef82b908d2564d [0,2,0,0,0,0|1,0,1]=4 1573 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)F)O d51e597d7c45b881e88b90eefe72c679 [0,2,0,0,0,0|1,0,1]=4 1574 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)I)O 2e4c17868a5f27f0ab18d01090b2b833 [0,2,0,0,0,0|1,0,1]=4 1575 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)O)C 33f576ea5a25afda4e422ef0130c3042 [0,2,0,0,0,0|1,0,1]=4 1576 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)O)Cl b9f13fca0d8b3f0fe4d81847a6d26498 [0,2,0,0,0,0|1,0,1]=4 1577 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)O)F fbd235d52bbd2c30266f9dec505f5944 [0,2,0,0,0,0|1,0,1]=4 1578 B16R1.4970 C#CCN(C)C(=O)Cc1ccc(c(c1)O)O 352c8bc73ab30a77e5d97942b051c832 [0,2,0,0,0,0|1,0,1]=4 1579 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1Br)Br 5923feaf478e381ae3d43e8e53f3f09b [0,2,0,0,0,0|1,0,1]=4 1580 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1Br)Cl 910d5bb457c66ab92e44e5437d3cd2fc [0,2,0,0,0,0|1,0,1]=4 1581 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1Br)F 2318e76b8e5558448d36906f7d5a6ce7 [0,2,0,0,0,0|1,0,1]=4 1582 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1Br)O 598f9b8fa9d72ff7082e02275043512a [0,2,0,0,0,0|1,0,1]=4 1583 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1C)Br 6ccc0add7001bc4171c30ae1b71e815a [0,2,0,0,0,0|1,0,1]=4 1584 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1C)C 913f6f9c0a43c321e02cf757f2bb5aee [0,2,0,0,0,0|1,0,1]=4 1585 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1C)Cl 2f7a668fd11d1877b719592629f84c47 [0,2,0,0,0,0|1,0,1]=4 1586 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1C)F e65f9b853dae8316b3ad83c10a80f76b [0,2,0,0,0,0|1,0,1]=4 1587 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1Cl)Cl 22859d282b0b5176affd71cd3b806e84 [0,2,0,0,0,0|1,0,1]=4 1588 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1F)Br e7026cad472083e21502236960c47960 [0,2,0,0,0,0|1,0,1]=4 1589 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1F)C 799517537d511acf92d832cae34ae24e [0,2,0,0,0,0|1,0,1]=4 1590 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1F)Cl 40b42f357b7143bef3738e8925cf8138 [0,2,0,0,0,0|1,0,1]=4 1591 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1F)F 55eb5567cbcfbdb2a24422e76e604432 [0,2,0,0,0,0|1,0,1]=4 1592 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1F)I cc88862ae152fd1be3fb502b4376ac8c [0,2,0,0,0,0|1,0,1]=4 1593 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1F)O f1d38efaa0853484b45a37fe49c6a5b2 [0,2,0,0,0,0|1,0,1]=4 1594 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1I)Br f29877a7d2e00cdc50924e5797d0cede [0,2,0,0,0,0|1,0,1]=4 1595 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1I)C f02dea51499693383f07339c1c31bf8d [0,2,0,0,0,0|1,0,1]=4 1596 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1I)Cl f2fb456fb9c94bd5f13cbc84a8f5866a [0,2,0,0,0,0|1,0,1]=4 1597 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1O)Br 2fa4009d5f342e865702dc5fff4e821f [0,2,0,0,0,0|1,0,1]=4 1598 B16R1.66351 C#CCN(C)C(=O)Cc1ccc(cc1O)F 656490590fd5b56e3ea9fbd9d96ab223 [0,2,0,0,0,0|1,0,1]=4 1599 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1Br)C b21d96fdc3350b98975f7811a708f06f [0,2,0,0,0,0|1,0,1]=4 1600 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1Br)Cl 6269c0c730efd3b64014c65024e36fa3 [0,2,0,0,0,0|1,0,1]=4 1601 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1Br)F a01757776b0ef513789fa90155b9a2f4 [0,2,0,0,0,0|1,0,1]=4 1602 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1C)Br 8b9d11414ba2e5d73e0be200f3e2357e [0,2,0,0,0,0|1,0,1]=4 1603 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1C)C 68550783854f65e927da2c208c2c675e [0,2,0,0,0,0|1,0,1]=4 1604 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1C)F cc2d691e47961218838d064428223384 [0,2,0,0,0,0|1,0,1]=4 1605 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1C)I 59231cf09822c41aee2226d059a6e943 [0,2,0,0,0,0|1,0,1]=4 1606 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1Cl)Br e5dbc201463cceeaaa0bc1c6cad0558f [0,2,0,0,0,0|1,0,1]=4 1607 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1Cl)C 1a1534899a2bb10ed012fab2ca13e508 [0,2,0,0,0,0|1,0,1]=4 1608 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1Cl)Cl 9719bae84bbe9b4f3f2b0e0499e826bc [0,2,0,0,0,0|1,0,1]=4 1609 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1Cl)F bd292a5e9d50249357cf2406218df666 [0,2,0,0,0,0|1,0,1]=4 1610 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1F)Br 81b4ca154b00652c5d4f4fd033e5b5c8 [0,2,0,0,0,0|1,0,1]=4 1611 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1F)C be93f4d2843d80163186a08a5e0d4ec0 [0,2,0,0,0,0|1,0,1]=4 1612 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1F)Cl 71ae9e46082f4567b48a30af34ffde6f [0,2,0,0,0,0|1,0,1]=4 1613 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1F)F 0f68b3f3fc28beb1828ffed9dbd95c59 [0,2,0,0,0,0|1,0,1]=4 1614 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1F)I 77731d0d61d7fd13537297521fe00a48 [0,2,0,0,0,0|1,0,1]=4 1615 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1I)F ae65c27b58bf91bc6ea92f439e41a237 [0,2,0,0,0,0|1,0,1]=4 1616 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1O)Br 416f261796044ff132a58724548836b3 [0,2,0,0,0,0|1,0,1]=4 1617 B16R1.33 C#CCN(C)C(=O)Cc1cccc(c1O)C b48c15de9e70bd07e6326bd38bc83e7d [0,2,0,0,0,0|1,0,1]=4 1618 B16R1.659 C#CCCN(C)C(=O)Cc1cccc(c1)Br 2d81bcfa8575c79f3c0c4abb233e633c [0,2,0,0,0,0|1,0,1]=4 1619 B16R1.659 C#CCCN(C)C(=O)Cc1cccc(c1)C dc3c7e9cf08fd1fd68bf2d2b23a3ce28 [0,2,0,0,0,0|1,0,1]=4 1620 B16R1.659 C#CCCN(C)C(=O)Cc1cccc(c1)Cl b882ae08e2becea2998808a1457fde07 [0,2,0,0,0,0|1,0,1]=4 1621 B16R1.659 C#CCCN(C)C(=O)Cc1cccc(c1)F 27316c045382967899e4be2ceaa86ae6 [0,2,0,0,0,0|1,0,1]=4 1622 B16R1.659 C#CCCN(C)C(=O)Cc1cccc(c1)I 88595bce3ac557cc2375199205c3f7f1 [0,2,0,0,0,0|1,0,1]=4 1623 B16R1.659 C#CCCN(C)C(=O)Cc1cccc(c1)O 6edc60b9ed30e42e85686851954d0c47 [0,2,0,0,0,0|1,0,1]=4 1624 B16R1.659 C#CCCN(C)C(=O)Cc1cccc(c1)S 998faab3968bded9f8937663f683bbac [0,2,0,0,0,0|1,0,1]=4 1625 B16R1.659 C=CCCN(C)C(C)Cc1cccc(c1)F 0a10f82965aea7e0a959dedf1ba7ab9a [0,2,0,0,0,0|0,0,2]=4 1626 B16R1.659 CC(Cc1cccc(c1)F)N(C)CCC#N 1cfa97e0946e6c8932204146e1f376f0 [0,2,0,0,0,0|0,0,1]=3 1627 B16R1.659 CC(Cc1cccc(c1)F)N(C)CCCO 57c1f51ebbf785722d3f68f88ac331ed [0,2,0,0,0,0|0,0,2]=4 1628 B16R1.686 C#CCN(C)C(=O)C(C)c1cccc(c1)C c7f6d4ab213fabd22508826b4ff1cc6e [0,2,0,0,0,0|1,0,1]=4 1629 B16R1.686 C#CCN(C)C(=O)C(C)c1cccc(c1)Cl 90684cc7c1ad3413138cacb0d0f91254 [0,2,0,0,0,0|1,0,1]=4 1630 B16R1.686 C#CCN(C)C(=O)C(C)c1cccc(c1)F a08ab4b95d9517d3e768d8280847ae50 [0,2,0,0,0,0|1,0,1]=4 1631 B16R1.686 C#CCN(C)C(=O)C(F)c1cccc(c1)Br 1debc5c997f7dd145f7660d3fe535456 [0,2,0,0,0,0|1,0,1]=4 1632 B16R1.686 C#CCN(C)C(=O)C(F)c1cccc(c1)C 705d3e174e37969d027233040df5600d [0,2,0,0,0,0|1,0,1]=4 1633 B16R1.686 C#CCN(C)C(=O)C(F)c1cccc(c1)Cl cf7ef157a39d6e8cc92282ebfe79728d [0,2,0,0,0,0|1,0,1]=4 1634 B16R1.686 C#CCN(C)C(=O)C(F)c1cccc(c1)F b97192436b28e980f9d2afc9ac0c9e06 [0,2,0,0,0,0|1,0,1]=4 1635 B16R1.686 C#CCN(C)C(=O)C(O)c1cccc(c1)Br d03e4e917d3c19a59069be8bfd435f96 [0,2,0,0,0,0|1,0,1]=4 1636 B16R1.686 C#CCN(C)C(=O)C(O)c1cccc(c1)C c2c3bd4880df24759be02da31f584fa9 [0,2,0,0,0,0|1,0,1]=4 1637 B16R1.686 C#CCN(C)C(=O)C(O)c1cccc(c1)Cl 42bbef325f494e1d77f4eb35778e9d0d [0,2,0,0,0,0|1,0,1]=4 1638 B16R1.686 C#CCN(C)C(=O)C(O)c1cccc(c1)F 55d565819522da66a5d86146ca0c7509 [0,2,0,0,0,0|1,0,1]=4 1639 B16R1.686 C#CCN(C)C(=O)C(O)c1cccc(c1)O 7099f7a4515ee6abaa959cd1ba0d89d8 [0,2,0,0,0,0|1,0,1]=4 1640 B16R1.686 C#CCN(C)C(=O)[C@@H](C)c1cccc(c1)C ee128129bdff24b0686ee737923708e8 [0,2,0,0,0,0|1,0,1]=4 1641 B16R1.686 C#CCN(C)C(=O)[C@@H](O)c1cccc(c1)Br 637147ffe92fb77a385dcad2b4ac458b [0,2,0,0,0,0|1,0,1]=4 1642 B16R1.686 C#CCN(C)C(=O)[C@@H](O)c1cccc(c1)Cl c405e2154fdbab2b67f40d81b9333a57 [0,2,0,0,0,0|1,0,1]=4 1643 B16R1.686 C#CCN(C)C(=O)[C@H](C)c1cccc(c1)C fc591810a10c61196ed8b2a4281fa8e6 [0,2,0,0,0,0|1,0,1]=4 1644 B16R1.686 C#CCN(C)C(=O)[C@H](O)c1cccc(c1)Br 7316b8b6645cc2643c0c89472a5389d1 [0,2,0,0,0,0|1,0,1]=4 1645 B16R1.686 C#CCN(C)C(=O)[C@H](O)c1cccc(c1)Cl 9950cec4582d3f594ff85cffce64cbd8 [0,2,0,0,0,0|1,0,1]=4 1646 B16R1.686 C#CCN(C)C(C)C(=O)c1cccc(c1)Cl d9266e50abdcb03d6f1589aa12d58660 [0,2,0,0,0,0|0,0,1]=3 1647 B16R1.686 C#CCN(C)C(C)C(=O)c1cccc(c1)F b1216b43d7a724fa3818720f5e053762 [0,2,0,0,0,0|0,0,1]=3 1648 B16R1.686 CC(C(=O)c1cccc(c1)Cl)N(C)CC#N 6a98e080abf5a32ca58e2c5eb212d007 [0,2,0,0,0,0|1,0,1]=4 1649 B16R1.1160 CC(CO)N(C)C(C)Cc1cccc(c1)F ef0dcd9b7861af9769acbf39581e68dc [0,2,0,0,0,0|1,0,1]=4 1650 B16R1.1160 CC(Cc1cccc(c1)F)N(C)[C@@H](C)CO d640f6924d046d949d7a5ca4f97fda85 [0,2,0,0,0,0|1,0,1]=4 1651 B16R1.1160 CC(Cc1cccc(c1)F)N(C)[C@H](C)CO 1a7e1c1224aea101d614e415d8fcf3fc [0,2,0,0,0,0|1,0,1]=4 1652 B16R1.1160 CCC(C)N(C)C(C)Cc1cccc(c1)F 0780cb4c9e2fccc6308f2d08999a9198 [0,2,0,0,0,0|0,0,2]=4 1653 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Br)Br 9b98095f7a65bf33917c70be1c43725b [0,2,0,0,0,0|1,0,1]=4 1654 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Br)F 128cf0ac223615d661ed4cb2a3bde6dd [0,2,0,0,0,0|1,0,1]=4 1655 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Br)I abed3c80f9d694a0d176bb38e688c471 [0,2,0,0,0,0|1,0,1]=4 1656 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1C)F d326c648f81c1cd0ef72d0e79a4ba7b4 [0,2,0,0,0,0|1,0,1]=4 1657 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Cl)Br 306327117c29decc03c88eb658eae692 [0,2,0,0,0,0|1,0,1]=4 1658 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Cl)C c3ebf79da7d8ff01ac2b61cd0db071cd [0,2,0,0,0,0|1,0,1]=4 1659 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Cl)Cl eb0334c2d65582d9bc0892acc93855da [0,2,0,0,0,0|1,0,1]=4 1660 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Cl)F 4e8b43b412837279fa77c55094188445 [0,2,0,0,0,0|1,0,1]=4 1661 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1Cl)O 05120c53413a635e369a8c084948d5e7 [0,2,0,0,0,0|1,0,1]=4 1662 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1F)Br b118146df0ef2434b8ffa831fc3f063c [0,2,0,0,0,0|1,0,1]=4 1663 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1F)C 420179772d863d636d1d82f9e71b92af [0,2,0,0,0,0|1,0,1]=4 1664 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1F)Cl 5fa808b930a13fc113f73bd706ab5502 [0,2,0,0,0,0|1,0,1]=4 1665 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1F)F 155a62d3c4bc4a22332aab46478dd5a0 [0,2,0,0,0,0|1,0,1]=4 1666 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1F)O ee1b7f5369660194db38e6e183542f28 [0,2,0,0,0,0|1,0,1]=4 1667 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1I)Br 17ebc0dd49e674a09f1e88db47201009 [0,2,0,0,0,0|1,0,1]=4 1668 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1I)C 6b7294e58962487256e14ae3fe9b6338 [0,2,0,0,0,0|1,0,1]=4 1669 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1O)Br 22b949de646ca7eddde484f13b9cd035 [0,2,0,0,0,0|1,0,1]=4 1670 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1O)Cl 7fc09d9e2f64263d117412e193d03672 [0,2,0,0,0,0|1,0,1]=4 1671 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1O)F caaad85a9547edf6b756a9e1ced247d5 [0,2,0,0,0,0|1,0,1]=4 1672 B16R1.4954 C#CCN(C)C(=O)Cc1cc(ccc1O)O e2b9bec024d41be6492dce892142b226 [0,2,0,0,0,0|1,0,1]=4 1673 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)Br)Br 1d5755cade7719ef8592ef5792465b61 [0,2,0,0,0,0|1,0,1]=4 1674 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)Br)C 213c6fb5a0f4df360490c9c334d67d33 [0,2,0,0,0,0|1,0,1]=4 1675 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)Br)Cl 65b76256d4f5e190b9ebd680cbc50241 [0,2,0,0,0,0|1,0,1]=4 1676 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)Br)F f8035dbfd0d6a1dc8f8b9f46e95fe778 [0,2,0,0,0,0|1,0,1]=4 1677 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)C)C 1b373505b8405c072070ee974d992bd2 [0,2,0,0,0,0|1,0,1]=4 1678 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)Cl)Cl 40465805bf42af1a39398800ec1a7ef7 [0,2,0,0,0,0|1,0,1]=4 1679 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)Cl)F cb5591ab50d215fca658e1e365368d1f [0,2,0,0,0,0|1,0,1]=4 1680 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)Cl)O 97addc0b356cc597614aee43613e1bb2 [0,2,0,0,0,0|1,0,1]=4 1681 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)F)C 6362f1f1d304023ccbb6d1b9e46cec80 [0,2,0,0,0,0|1,0,1]=4 1682 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)F)F a68a9dab0c41594a698537e4a178da0c [0,2,0,0,0,0|1,0,1]=4 1683 B16R1.4956 C#CCN(C)C(=O)Cc1cc(cc(c1)O)O 3055e00ed676e5f09086e931165805f6 [0,2,0,0,0,0|1,0,1]=4 1684 B16R1.4966 C#CCN(C)C(=O)Cc1cccc(c1)C#N 2ee58e290c939d4da006b4ee7780eb1c [0,2,0,0,0,0|1,0,1]=4 1685 B16R1.4966 C#CCN(C)C(=O)Cc1cccc(c1)C=O f422a781e28c05186648ad87e40b80a3 [0,2,0,0,0,0|1,0,1]=4 1686 B16R1.4966 C#CCN(C)C(=O)Cc1cccc(c1)CC fd28d46bc503f433ea72ceef700522c0 [0,2,0,0,0,0|1,0,1]=4 1687 B16R1.4966 C#CCN(C)C(=O)Cc1cccc(c1)CO 4b4551dc689bfa3dae3e8dd212ac807e [0,2,0,0,0,0|1,0,1]=4 1688 B16R1.4966 C#CCN(C)C(=O)Cc1cccc(c1)OC ba959abf7f0a150dbcbe5f6f12ab5285 [0,2,0,0,0,0|1,0,1]=4 1689 B16R1.11234 CC(C)CN(C)C(C)Cc1cccc(c1)F 3281f1d373ffa64b27a7e6055e29ebd9 [0,2,0,0,0,0|0,0,2]=4 1690 B16R1.11234 CC(Cc1cccc(c1)F)N(C)CC(=O)N 0709345653b08f96c354d676feff152e [0,2,0,0,0,0|1,0,1]=4 1691 B16R1.11234 CC(Cc1cccc(c1)F)N(C)CC(=O)O 03a646553466ed6693842d8d73560b08 [0,2,0,0,0,0|1,0,1]=4 1692 B16R1.11234 CC(Cc1cccc(c1)F)N(C)CC(F)F c5929e5beedba64817eb4f4679664dd9 [0,2,0,0,0,0|1,0,1]=4 1693 B16R1.11234 CC(Cc1cccc(c1)F)N(C)C[C@H](C)O aabba9b187981ad24619ee3578929a43 [0,2,0,0,0,0|0,0,2]=4 1694 B16R1.11234 CC(O)CN(C)C(C)Cc1cccc(c1)F c6f22e0badc6d2dfe4cdb50af0922e53 [0,2,0,0,0,0|0,0,2]=4 1695 B16R1.750 CC(C)CN(C)C(CO)Cc1ccccc1 e5a7617f2f590a527a3e7961fb671ea5 [0,2,0,0,0,0|0,0,2]=4 1696 B16R1.750 CC(C)CN(C)[C@H](CO)Cc1ccccc1 ce962114078e5c4acc424ba0e90275da [0,2,0,0,0,0|0,0,2]=4 1697 B16R1.750 CC(O)CN(C)C(CO)Cc1ccccc1 0d13a66c5e2490a4774de9dc26a53e20 [0,2,0,0,0,0|0,0,2]=4 1698 B16R1.750 CC(O)CN(C)[C@H](CO)Cc1ccccc1 379b4de7834449ef9c6871374c49fe6c [0,2,0,0,0,0|0,0,2]=4 1699 B16R1.750 CN(CC(=O)N)C(CO)Cc1ccccc1 e538b6b813a0dcd70c04affd1d8847a3 [0,2,0,0,0,0|1,0,1]=4 1700 B16R1.750 CN(CC(=O)N)[C@H](CO)Cc1ccccc1 ba436bce76be4f6e1321df6d907f6fda [0,2,0,0,0,0|1,0,1]=4 1701 B16R1.750 CN(CC(=O)O)C(CO)Cc1ccccc1 651183ab5356a70612651947d21ff733 [0,2,0,0,0,0|1,0,1]=4 1702 B16R1.750 CN(CC(=O)O)[C@H](CO)Cc1ccccc1 4822e6498174b03cdc708dd18e7e862f [0,2,0,0,0,0|1,0,1]=4 1703 B16R1.750 CN(CC(F)F)C(CO)Cc1ccccc1 bc2a9f5427ae22681a7d2c56cdff74b5 [0,2,0,0,0,0|1,0,1]=4 1704 B16R1.750 CN(CC(F)F)[C@H](CO)Cc1ccccc1 3f8ffffaf61445ab3b3cb0c8d4087957 [0,2,0,0,0,0|1,0,1]=4 1705 B16R1.750 CN(C[N+](=O)[O-])C(CO)Cc1ccccc1 89a760e0bb96d6e3b3b8e6e01fd009e2 [0,2,0,0,0,0|2,0,0]=4 1706 B16R1.750 CN(C[N+](=O)[O-])[C@H](CO)Cc1ccccc1 66c1f9587e5acb6359f3472c2ae60d0f [0,2,0,0,0,0|2,0,0]=4 1707 B16R1.750 C[C@@H](O)CN(C)C(CO)Cc1ccccc1 40a1182e0cb7938d33f5343d55c590d0 [0,2,0,0,0,0|0,0,2]=4 1708 B16R1.750 C[C@@H](O)CN(C)[C@H](CO)Cc1ccccc1 92467db33dde8cac086c1b6beea2a459 [0,2,0,0,0,0|0,0,2]=4 1709 B16R1.750 C[C@H](O)CN(C)C(CO)Cc1ccccc1 e5bb97da2b0b743d4d0af616828d498e [0,2,0,0,0,0|0,0,2]=4 1710 B16R1.750 C[C@H](O)CN(C)[C@H](CO)Cc1ccccc1 81ac4d96fc06080d11eaccefe335bd39 [0,2,0,0,0,0|0,0,2]=4 1711 B16R1.1127 C=C(C#N)CN(C)C(C)Cc1ccccn1 3c150a384fe47cdce1e849bc14be8d39 [0,2,0,0,0,0|1,0,1]=4 1712 B16R1.1127 CNC(=O)CN(C)C(C)Cc1ccccc1 0a9926f539ef41403320f42867322920 [0,2,0,0,0,0|0,0,2]=4 1713 B16R1.126 C#CCCN(C)C(C=O)Cc1ccccc1 b881f6ad1f201289aedd820ea6b3c1c7 [0,2,0,0,0,0|0,0,1]=3 1714 B16R1.126 C#CCCN(C)C(CO)Cc1ccccc1 28c8c266f813069bc97101d033cdcec4 [0,2,0,0,0,0|0,0,0]=2 1715 B16R1.126 C#CCCN(C)[C@H](CO)Cc1ccccc1 a06ac47136a47ff146bf5561d52da30a [0,2,0,0,0,0|0,0,0]=2 1716 B16R1.126 C#CCNC(=O)[C@@H](Cc1ccccc1)OC b5193eb24ba732bf5cdc2b02b6c5c0fb [0,2,0,0,0,0|2,0,0]=4 1717 B16R1.126 C#CCNC(=O)[C@H](Cc1ccccc1)OC e51cdd9c35ee0d6398b5de098d202cd3 [0,2,0,0,0,0|2,0,0]=4 1718 B16R1.126 C/C=C/CN(C)C(CO)Cc1ccccc1 ba819efa117bb7bc17c0baa2e2f516ce [0,2,0,0,0,0|0,0,2]=4 1719 B16R1.126 C/C=C/CN(C)[C@H](CO)Cc1ccccc1 590734b5ac01e5d302e0c6e0f048f0b2 [0,2,0,0,0,0|0,0,2]=4 1720 B16R1.126 C/C=C\CN(C)C(CO)Cc1ccccc1 836a605a86184f93a388528802bee36d [0,2,0,0,0,0|0,0,2]=4 1721 B16R1.126 C/C=C\CN(C)[C@H](CO)Cc1ccccc1 c4b63481237bcc936d2c6b1b2361dd75 [0,2,0,0,0,0|0,0,2]=4 1722 B16R1.126 C=CCCN(C)C(CO)Cc1ccccc1 f3d4d22c22da44862b27e4114a91ee37 [0,2,0,0,0,0|0,0,2]=4 1723 B16R1.126 C=CCCN(C)[C@H](CO)Cc1ccccc1 dea350b39ba9705000465e2c96096e04 [0,2,0,0,0,0|0,0,2]=4 1724 B16R1.126 CN(C/C=C/Cl)C(CO)Cc1ccccc1 4b8bc51dd86f93ed413e28c67a30a1a5 [0,2,0,0,0,0|0,0,2]=4 1725 B16R1.126 CN(C/C=C/Cl)[C@H](CO)Cc1ccccc1 2a39c569923133d52a01f776ffc276f2 [0,2,0,0,0,0|0,0,2]=4 1726 B16R1.126 CN(C/C=C\Cl)C(CO)Cc1ccccc1 636b5f15d041aacb8a5d7996fc352376 [0,2,0,0,0,0|0,0,2]=4 1727 B16R1.126 CN(C/C=C\Cl)[C@H](CO)Cc1ccccc1 fcb781e9a23bc9f7c11c00ce634d6dd0 [0,2,0,0,0,0|0,0,2]=4 1728 B16R1.126 CN(C/C=C\O)C(CO)Cc1ccccc1 5efc4d1ecc3de9f950d74c5192908347 [0,2,0,0,0,0|0,0,2]=4 1729 B16R1.126 CN(C/C=C\O)[C@H](CO)Cc1ccccc1 56c8a1dd71b5bf3bbdedb3fed94db76c [0,2,0,0,0,0|0,0,2]=4 1730 B16R1.126 CN(CCC#N)C(C=O)Cc1ccccc1 7d23785e14ea33ef1c9980bc570bb970 [0,2,0,0,0,0|0,0,2]=4 1731 B16R1.126 CN(CCC#N)C(CO)Cc1ccccc1 72c3369056552272ae88be2cda3db4dc [0,2,0,0,0,0|0,0,1]=3 1732 B16R1.126 CN(CCC#N)[C@H](CO)Cc1ccccc1 34d7f85864e63a8cb9ac1f2e7edb0018 [0,2,0,0,0,0|0,0,1]=3 1733 B16R1.126 CN(CCC=O)C(CO)Cc1ccccc1 fb0c7922d467195246df304695b4a7a6 [0,2,0,0,0,0|0,0,2]=4 1734 B16R1.126 CN(CCC=O)[C@H](CO)Cc1ccccc1 ef4c4915ad0c39285756172353b9d166 [0,2,0,0,0,0|0,0,2]=4 1735 B16R1.126 COCCN(C)C(CO)Cc1ccccc1 fdb21f2c9fc94441b32c56dfea12667d [0,2,0,0,0,0|0,0,2]=4 1736 B16R1.126 COCCN(C)[C@H](CO)Cc1ccccc1 42b1250218f79f30c1f226b0e2363d81 [0,2,0,0,0,0|0,0,2]=4 1737 B16R1.126 CSCCN(C)C(CO)Cc1ccccc1 7181951c68a48a568e7ad2486e6b7bbf [0,2,0,0,0,0|0,0,2]=4 1738 B16R1.126 CSCCN(C)[C@H](CO)Cc1ccccc1 c4a6fc4a74e3948af93f437c7458ca46 [0,2,0,0,0,0|0,0,2]=4 1739 B16R1.1216 C#CCCCN(C)C(C)Cc1ccccn1 508c59dfbabc89f7a26143e05fe31294 [0,2,0,0,0,0|1,0,0]=3 1740 B16R1.1216 C#CCCCN(C)C(C)Cc1cccnc1 41cd5f6afa790cd253df04ea9447bc6d [0,2,0,0,0,0|1,0,0]=3 1741 B16R1.1216 C#CCCCN(C)C(C)Cc1cnccn1 0d40218f8d92309c5fbda0a093ea3156 [0,2,0,0,0,0|2,0,0]=4 1742 B16R1.1216 C=CCCCN(C)C(C)Cc1ccccc1 2e9ade1e1adbb96274737e40f5f846e5 [0,2,0,0,0,0|0,0,2]=4 1743 B16R1.1216 CC(Cc1ccccn1)N(C)CC=CC#N 2f4b5a31679de1498a5fad15bb7fe722 [0,2,0,0,0,0|1,0,1]=4 1744 B16R1.1216 CC(Cc1ccccn1)N(C)CCCC#N 5b144557be428fa4d35e328383ae0f02 [0,2,0,0,0,0|1,0,1]=4 1745 B16R1.1216 CC(Cc1cccnc1)N(C)CC=CC#N e1525faa5fdeb0e6508410d4cb95b4c2 [0,2,0,0,0,0|1,0,1]=4 1746 B16R1.1216 CC(Cc1cccnc1)N(C)CCCC#N f4363151a755470f1c18a799038da576 [0,2,0,0,0,0|1,0,1]=4 1747 B16R1.1244 C#CCCN(C)C(=O)C(F)c1ccccc1 37eb66cf9f3f4b007d948a78ae196c93 [0,2,0,0,0,0|1,0,1]=4 1748 B16R1.1244 C#CCCN(C)C(=O)C(O)c1ccccc1 954dcbc7c030984cd93dc919a51d4a9b [0,2,0,0,0,0|1,0,1]=4 1749 B16R1.1244 C#CCCN(C)C(=O)[C@@H](O)c1ccccc1 1252b15a5324a67a19d6f80ded2544d3 [0,2,0,0,0,0|1,0,1]=4 1750 B16R1.1244 C#CCCN(C)C(=O)[C@H](F)c1ccccc1 d2990c0e00268640cefaad25e144781a [0,2,0,0,0,0|1,0,1]=4 1751 B16R1.1244 C#CCCN(C)C(=O)[C@H](O)c1ccccc1 f75afb7caa1320326d19ed7b558356f3 [0,2,0,0,0,0|1,0,1]=4 1752 B16R1.1284 CC(Cc1ccccc1)N(C)CCC(=O)O 18086a1db4672c193aeb028f61cc30d6 [0,2,0,0,0,0|0,0,2]=4 1753 B16R1.4510 C#CCCN(CC)C(C)Cc1cccnc1 2d41f1dd85dd72839b92893824c24bb3 [0,2,0,0,0,0|1,0,0]=3 1754 B16R1.4510 CCN(CCC#N)C(C)Cc1cccnc1 54d2ec8a14f5c946dd19386e84b664cb [0,2,0,0,0,0|1,0,1]=4 1755 B16R1.7523 C#CCCN(C)C(=O)Cc1ccccc1Br e386018ee4f6af40fec1c86d9dcb4cb7 [0,2,0,0,0,0|1,0,1]=4 1756 B16R1.7523 C#CCCN(C)C(=O)Cc1ccccc1C aced851c4b3094cd748b0591f25152ef [0,2,0,0,0,0|1,0,1]=4 1757 B16R1.7523 C#CCCN(C)C(=O)Cc1ccccc1Cl cf8e9da880c65fb59ca98e82dfac8553 [0,2,0,0,0,0|1,0,1]=4 1758 B16R1.7523 C#CCCN(C)C(=O)Cc1ccccc1F c565d22ce4daf937c215cc2ad5de3544 [0,2,0,0,0,0|1,0,1]=4 1759 B16R1.7523 C#CCCN(C)C(=O)Cc1ccccc1I 85fcd1a8d7ece9e40f60325170661e9c [0,2,0,0,0,0|1,0,1]=4 1760 B16R1.7523 C#CCCN(C)C(=O)Cc1ccccc1O fa8faf7bf4bf1624575b6282ae15d602 [0,2,0,0,0,0|1,0,1]=4 1761 B16R1.951 C#CCN(C)C(CC)C(=O)c1ccccc1 57060d79093b705511e3526b5fcf6332 [0,2,0,0,0,0|0,0,1]=3 1762 B16R1.951 C#CCN(C)C(CC)C(=O)c1ccccn1 3396d61e89795f75268ebf9a3f73094b [0,2,0,0,0,0|1,0,1]=4 1763 B16R1.4559 C#CCN(C)C(=O)C(C#N)c1ccccc1 294ded4473a4bdfdd04598fdcfba6676 [0,2,0,0,0,0|1,0,1]=4 1764 B16R1.4559 C#CCN(C)C(=O)C(CC)c1ccccc1 8cdd3e9ba9c857d9c676b864338b6536 [0,2,0,0,0,0|1,0,1]=4 1765 B16R1.4559 C#CCN(C)C(=O)C(CO)c1ccccc1 3cc983b6785a5c9be2ac8c542535e752 [0,2,0,0,0,0|1,0,1]=4 1766 B16R1.4559 C#CCN(C)C(=O)C(OC)c1ccccc1 d7d7e89366120594871c1cf5b45d8e6d [0,2,0,0,0,0|1,0,1]=4 1767 B16R1.4559 C#CCN(C)C(=O)[C@@H](CC)c1ccccc1 7625eea1c7c14a7707a60dcfc6233325 [0,2,0,0,0,0|1,0,1]=4 1768 B16R1.4559 C#CCN(C)C(=O)[C@@H](CO)c1ccccc1 90849b0d4402518be053376a0d68b54c [0,2,0,0,0,0|1,0,1]=4 1769 B16R1.4559 C#CCN(C)C(=O)[C@@H](OC)c1ccccc1 101e339e5dafefa3012e691de39ccede [0,2,0,0,0,0|1,0,1]=4 1770 B16R1.4559 C#CCN(C)C(=O)[C@H](CC)c1ccccc1 ebe6d63a47d25426e01960a82d9e3b07 [0,2,0,0,0,0|1,0,1]=4 1771 B16R1.4559 C#CCN(C)C(=O)[C@H](CO)c1ccccc1 6633650339c0586197cb471b15367b55 [0,2,0,0,0,0|1,0,1]=4 1772 B16R1.4559 C#CCN(C)C(=O)[C@H](OC)c1ccccc1 704cc950c9931385cf638a4cbd512c5c [0,2,0,0,0,0|1,0,1]=4 1773 B16R1.13247 C#CCN(C)C(=O)C(C)c1ccccc1Br f30e1a0bab982913e7dc125815c8f0f3 [0,2,0,0,0,0|1,0,1]=4 1774 B16R1.13247 C#CCN(C)C(=O)C(C)c1ccccc1C fe522e4a860a3bad9ec18ba0873b3b0c [0,2,0,0,0,0|1,0,1]=4 1775 B16R1.13247 C#CCN(C)C(=O)C(C)c1ccccc1Cl 44c95e829b347ccdeeb8ed17153eba19 [0,2,0,0,0,0|1,0,1]=4 1776 B16R1.13247 C#CCN(C)C(=O)C(C)c1ccccc1F dfffa96190887363de44464d58b140ae [0,2,0,0,0,0|1,0,1]=4 1777 B16R1.13247 C#CCN(C)C(=O)C(C)c1ccccc1I 1410941bdd67a97aef76ab1471c08cee [0,2,0,0,0,0|1,0,1]=4 1778 B16R1.13247 C#CCN(C)C(=O)C(F)c1ccccc1Br 103112abdca891ac1cfdc01d14d6f3e3 [0,2,0,0,0,0|1,0,1]=4 1779 B16R1.13247 C#CCN(C)C(=O)C(F)c1ccccc1C fdbd5f4df32d4104d62797610600bd5c [0,2,0,0,0,0|1,0,1]=4 1780 B16R1.13247 C#CCN(C)C(=O)C(F)c1ccccc1Cl 5b121ce6c950f2a57696e67c24c6a8fd [0,2,0,0,0,0|1,0,1]=4 1781 B16R1.13247 C#CCN(C)C(=O)C(F)c1ccccc1F 4dca1cc90e2143d505377fc42843990b [0,2,0,0,0,0|1,0,1]=4 1782 B16R1.13247 C#CCN(C)C(=O)C(O)c1ccccc1Br 11e52d27500b02c552c33c2bc5d3d9b8 [0,2,0,0,0,0|1,0,1]=4 1783 B16R1.13247 C#CCN(C)C(=O)C(O)c1ccccc1C 2bb6fd4ef28f8fcc96b5991268a98c87 [0,2,0,0,0,0|1,0,1]=4 1784 B16R1.13247 C#CCN(C)C(=O)C(O)c1ccccc1Cl 6cf6572db7426cf6c3b8a528ae7e2115 [0,2,0,0,0,0|1,0,1]=4 1785 B16R1.13247 C#CCN(C)C(=O)C(O)c1ccccc1F 2ab745b0ae50e5cd5708fdabc03cc324 [0,2,0,0,0,0|1,0,1]=4 1786 B16R1.13247 C#CCN(C)C(=O)[C@@H](O)c1ccccc1Cl 85f17103a21be3219d2ee88f917c1a3d [0,2,0,0,0,0|1,0,1]=4 1787 B16R1.13247 C#CCN(C)C(=O)[C@H](O)c1ccccc1Cl 50cf00c9def7ebd95bb8ff22faccba55 [0,2,0,0,0,0|1,0,1]=4 1788 B16R1.13247 C#CCN(C)C(=O)[C@H](O)c1ccccc1F 50c3fb5d587fefeaf47b04adabbad431 [0,2,0,0,0,0|1,0,1]=4 1789 B16R1.13247 C#CCN(C)C(C)C(=O)c1ccccc1F 700e54ae382f8341115ec13980ed53b9 [0,2,0,0,0,0|0,0,1]=3 1790 B16R1.14944 C#CCN(C)C(=O)C(C)(O)c1ccccc1 fd19771305eed9c730bc837e7d9689ca [0,2,0,0,0,0|1,0,1]=4 1791 B16R1.14944 C#CCN(C)C(=O)C(F)(F)c1ccccc1 9a723a69a0525b6d7053b36d748fc25e [0,2,0,0,0,0|1,0,1]=4 1792 B16R1.14944 C#CCN(C)C(=O)[C@@](C)(O)c1ccccc1 e4fa2dece33ce133d6c4cc0f2e5b6d09 [0,2,0,0,0,0|1,0,1]=4 1793 B16R1.1616 CCN(CC#N)C(C=O)Cc1ccccc1 ad39343515465ee582e2c41a25494583 [0,2,0,0,0,0|1,0,1]=4 1794 B16R1.3308 C#CC(=O)N(C)C(CO)Cc1ccccc1 c58a8290796b16abc15d3dd4e694662c [0,2,0,0,0,0|0,0,1]=3 1795 B16R1.3308 C#CC(=O)N(C)[C@H](CO)Cc1ccccc1 9c625ff000420b01afb0e0595291535f [0,2,0,0,0,0|0,0,1]=3 1796 B16R1.3308 C=CC(C)N(C)C(CO)Cc1ccccc1 d68b999323b29a7f2bd804aa9a6afca9 [0,2,0,0,0,0|0,0,2]=4 1797 B16R1.3308 C=CC(C)N(C)[C@H](CO)Cc1ccccc1 d37abb6bc97b20870e79b4f932e2fbb5 [0,2,0,0,0,0|0,0,2]=4 1798 B16R1.3308 CC(C=O)N(C)C(CO)Cc1ccccc1 08569698e7e72ef4dfe7c890650e6075 [0,2,0,0,0,0|1,0,1]=4 1799 B16R1.3308 CC(C=O)N(C)[C@H](CO)Cc1ccccc1 057562994d49b1d0358807f19327926f [0,2,0,0,0,0|1,0,1]=4 1800 B16R1.3308 C[C@H](C=O)N(C)C(CO)Cc1ccccc1 881d057c27f37a61223cad8d20fbfcb2 [0,2,0,0,0,0|1,0,1]=4 1801 B16R1.3308 C[C@H](C=O)N(C)[C@H](CO)Cc1ccccc1 82d47457410c5d8a5708b5181890e408 [0,2,0,0,0,0|1,0,1]=4 1802 B16R1.13650 C#CCN(C)C(Cc1ccccc1)C(=O)O d6221d97f0080da75732aa8cf75cca3a [0,2,0,0,0,0|0,0,1]=3 1803 B16R1.13650 C#CCN(C)[C@@H](Cc1ccccc1)C(=O)O aa12d01877a49aa27dcad9653dfe2746 [0,2,0,0,0,0|0,0,1]=3 1804 B16R1.13650 C#CCN(C)[C@H](Cc1ccccc1)C(=O)O f902e967d87951cfc20d4815ca86986a [0,2,0,0,0,0|0,0,1]=3 1805 B16R1.13650 CN(CC#N)C(Cc1ccccc1)C(=O)O ce460616381e714b491359eb3d370be2 [0,2,0,0,0,0|1,0,1]=4 1806 B16R1.13650 CN(CC#N)[C@@H](Cc1ccccc1)C(=O)O b48cbf700208316cad47a06f2bf0e5de [0,2,0,0,0,0|1,0,1]=4 1807 B16R1.13650 CN(CC#N)[C@H](Cc1ccccc1)C(=O)O a6d9cfefe9bf60b19b6afae284e4aa2c [0,2,0,0,0,0|1,0,1]=4 1808 B16R1.366 CCC(C)(C)N(C)C(C)Cc1ccccc1 3548b38162b718f1652705931e01c5aa [0,2,0,0,0,0|0,0,2]=4 1809 B16R1.568 CC(Cc1ccccn1)N(C)C(C#N)C=O 6b3c0d05dafab4df282fd87d38313162 [0,2,0,0,0,0|2,0,0]=4 1810 B16R1.568 CC(Cc1cccnc1)N(C)C(C#N)C=O 891fd82a6644812ed575b1af61dcad7a [0,2,0,0,0,0|2,0,0]=4 1811 B16R1.5808 C#CC(=O)N(CC)C(C)Cc1cccnc1 6e6f00101fcb77c233ee5accfe7b6b95 [0,2,0,0,0,0|1,0,1]=4 1812 B16R1.4629 C#CCN(CC#C)C(C)Cc1ccccc1 124753fb53d8c93bee40ae6857e30a94 [0,2,0,0,0,0|0,0,0]=2 1813 B16R1.4629 C#CCN(CC#N)C(C)Cc1ccccc1 55de80a3495d9d12791f9bd074b62449 [0,2,0,0,0,0|0,0,0]=2 1814 B16R1.4629 C#CCN(CC=C)C(C)Cc1ccccc1 5095fc0e61a9a74ede57a1b953f5c857 [0,2,0,0,0,0|0,0,0]=2 1815 B16R1.4629 C#CCN(CC=O)C(C)Cc1ccccc1 a219da89c4a3962dce41207ffaef54bd [0,2,0,0,0,0|0,0,0]=2 1816 B16R1.4629 C#CCN(CCC)C(C)Cc1ccccc1 e35c2d2d94c8cdcfb9ef1f6f516b005b [0,2,0,0,0,0|0,0,0]=2 1817 B16R1.4629 C#CCN(CCF)C(C)Cc1ccccc1 aedd9e334f0f09f6c49f824eac23596a [0,2,0,0,0,0|0,0,0]=2 1818 B16R1.4629 C#CCN(CCO)C(C)Cc1ccccc1 4c6aeddd9efb41c3f2f2b0b44b399ae1 [0,2,0,0,0,0|0,0,0]=2 1819 B16R1.4629 C#CCN(CCS)C(C)Cc1ccccc1 812b12c3b330c9d5844373d2f1a89dbc [0,2,0,0,0,0|0,0,0]=2 1820 B16R1.4629 C#CCN(COC)C(C)Cc1ccccc1 d9ec21ac2b9032d3e271bf0c986f0d34 [0,2,0,0,0,0|0,0,0]=2 1821 B16R1.4629 C#CCN(CSC)C(C)Cc1ccccc1 3ceca3a2d32a0b5eced0c830523edcce [0,2,0,0,0,0|0,0,0]=2 1822 B16R1.4629 C=CCN(CC=C)C(C)Cc1ccccc1 3eda6bfcab2c7bd74a011f9052aff565 [0,2,0,0,0,0|0,0,2]=4 1823 B16R1.4629 C=CCN(CCC)C(C)Cc1ccccc1 7fb2f6ce67501e958c90a763eafb88e0 [0,2,0,0,0,0|0,0,2]=4 1824 B16R1.4629 C=CCN(CCO)C(C)Cc1ccccc1 85b384e3f51edc6cfbea4c0e0aaf5902 [0,2,0,0,0,0|0,0,2]=4 1825 B16R1.13398 C#CCN(C(=O)C)C(C)Cc1ccccc1 9c327aba43a2ef33b538fe1a17d463fa [0,2,0,0,0,0|0,0,0]=2 1826 B16R1.13398 C#CCN(C(C)C)C(C)Cc1ccccc1 f24bacad1a6a7ea6a6f6872f11bce884 [0,2,0,0,0,0|0,0,0]=2 1827 B16R1.4968 C#CCN(C)C(=O)Cc1ccccc1C#C b6e2ff3a7b05ee781eab04f56f661558 [0,2,0,0,0,0|1,0,1]=4 1828 B16R1.4968 C#CCN(C)C(=O)Cc1ccccc1C#N 0c9abb3f451cf59adf3fd9dc613e7c5d [0,2,0,0,0,0|1,0,1]=4 1829 B16R1.4968 C#CCN(C)C(=O)Cc1ccccc1C=O b6ae5b0234b0e9cbbfc117c7e841623f [0,2,0,0,0,0|1,0,1]=4 1830 B16R1.4968 C#CCN(C)C(=O)Cc1ccccc1CC bbd1467560fd916fe56dcf71cdbfe19e [0,2,0,0,0,0|1,0,1]=4 1831 B16R1.4968 C#CCN(C)C(=O)Cc1ccccc1OC 1e4d7aa599dc668d96cd0a0ceefd727b [0,2,0,0,0,0|1,0,1]=4 1832 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1Br)Br e516500eca0bc61e519b4f6132214a26 [0,2,0,0,0,0|1,0,1]=4 1833 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1Br)C 8c912909973271b169d51e7956587928 [0,2,0,0,0,0|1,0,1]=4 1834 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1Br)Cl 087456c1d05280543cbd579d1dda468d [0,2,0,0,0,0|1,0,1]=4 1835 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1Br)F 87761661618943b1aba10880941a3ebc [0,2,0,0,0,0|1,0,1]=4 1836 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1Br)O 4344dbc220a89f4a455143f2253dab78 [0,2,0,0,0,0|1,0,1]=4 1837 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1C)C 88c53a0d6f3ac54c59561c528c1bd871 [0,2,0,0,0,0|1,0,1]=4 1838 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1Cl)Cl 54d198f33c824e1164376ba5f998e541 [0,2,0,0,0,0|1,0,1]=4 1839 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1Cl)F 58f63e33f3b35c40b6b6429b215a5416 [0,2,0,0,0,0|1,0,1]=4 1840 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1F)C b53176feb638fbccd9396ac6d162177c [0,2,0,0,0,0|1,0,1]=4 1841 B16R1.106639 C#CCN(C)C(=O)Cc1c(cccc1I)Cl 13173b88a25468c074b5877d5c3d7c1b [0,2,0,0,0,0|1,0,1]=4 1842 B14R1.633 C#CCN(C)C(C)CCc1ccco1 2baf3284a07eae99ed158d73164680ed [0,0,1,1,0,0|1,0,1]=4 1843 B14R2.33 C=CCN1C[C@@H]1Cc2ccccc2 6a120c1ee3718116180e566a52d77d8a [1,0,0,1,0,0|0,0,2]=4 1844 B14R2.33 CCCN1C[C@@H]1Cc2ccccc2 9cabf1e713d64c43ca15e6fcbeb63215 [1,0,0,1,0,0|0,0,2]=4 1845 B14R2.33 CSCN1C[C@@H]1Cc2ccccc2 3b59126e9f09203b5355a5984af1cfff [1,0,0,1,0,0|1,0,1]=4 1846 B14R2.33 FCCN1C[C@@H]1Cc2ccccc2 e0451f884f4834241ef411dc5b9616bb [1,0,0,1,0,0|1,0,1]=4 1847 B14R2.33 N#CCN1C[C@@H]1Cc2ccccc2 ebc392e17bf0478a4c85a27abe79b120 [1,0,0,1,0,0|1,0,0]=3 1848 B14R2.33 O=CCN1C[C@@H]1Cc2ccccc2 258de585df1352d416f006471848c182 [1,0,0,1,0,0|1,0,1]=4 1849 B14R2.33 OCCN1C[C@@H]1Cc2ccccc2 9e66c13ed8613ad5bd08eacb97040ff5 [1,0,0,1,0,0|1,0,1]=4 1850 B14R2.33 SCCN1C[C@@H]1Cc2ccccc2 8b7083cb654a9854e4aaba420fbf4a27 [1,0,0,1,0,0|1,0,1]=4 1851 B14R2.41 C#CCN1CC(C1)c2ccccc2 92c9d01dae6b3f3f5128700ef31ceb6b [1,0,0,1,0,0|0,0,0]=2 1852 B14R2.41 C#CCN1CC(C1)c2ccccn2 dcac11f49bf5face2ba4a8e6fffbd4c6 [1,0,0,1,0,0|1,0,0]=3 1853 B14R2.41 C#CCN1CC(C1)c2cccnc2 0847a761f0f03afef19c7a3ade9b6f84 [1,0,0,1,0,0|1,0,0]=3 1854 B14R2.41 C#CCN1CC(C1)c2ccncc2 cfb637ad3e1b73f21273df743f351bae [1,0,0,1,0,0|1,0,0]=3 1855 B14R2.41 C#CCN1CC(C1)c2cnccn2 e8c88079c08263820fbdcea34f6d991d [1,0,0,1,0,0|2,0,0]=4 1856 B14R2.41 C=CCN1CC(C1)c2ccccc2 78f4f45cfaea7c8c57233513b40d9749 [1,0,0,1,0,0|0,0,2]=4 1857 B14R2.41 CCCN1CC(C1)c2ccccc2 3b675b32ffcdacbac520ebf6e0e9e314 [1,0,0,1,0,0|0,0,2]=4 1858 B14R2.41 COCN1CC(C1)c2ccccc2 c1121eab496650a26f6e333c18db40ae [1,0,0,1,0,0|1,0,1]=4 1859 B14R2.41 CSCN1CC(C1)c2ccccc2 5ff1fbe064bc57d45760ac73d33d14b9 [1,0,0,1,0,0|1,0,1]=4 1860 B14R2.41 FCCN1CC(C1)c2ccccc2 d8619ef849fe4c71c85e3fbfba4cc5fe [1,0,0,1,0,0|1,0,1]=4 1861 B14R2.41 N#CCN1CC(C1)c2ccccc2 296117ca93b082cc2e7872e19fb77f2f [1,0,0,1,0,0|1,0,0]=3 1862 B14R2.41 N#CCN1CC(C1)c2ccccn2 9b810406a3db0adff6194b27a2a3f6d2 [1,0,0,1,0,0|2,0,0]=4 1863 B14R2.41 N#CCN1CC(C1)c2cccnc2 bbccd4e42e1a060f0129259c698980f6 [1,0,0,1,0,0|2,0,0]=4 1864 B14R2.41 N#CCN1CC(C1)c2ccncc2 e6d719b9ceb0c78e48509f0040693391 [1,0,0,1,0,0|2,0,0]=4 1865 B14R2.41 O=CCN1CC(C1)c2ccccc2 b273c4bb0a921f540951637b70f7bbc9 [1,0,0,1,0,0|1,0,1]=4 1866 B14R2.41 OCCN1CC(C1)c2ccccc2 1db2626791f11c806faee1e44e359efe [1,0,0,1,0,0|1,0,1]=4 1867 B14R2.41 SCCN1CC(C1)c2ccccc2 b5eae6e5660ba36346305a50cc265d6a [1,0,0,1,0,0|1,0,1]=4 1868 B14R2.101 C1=CCN(C1)CCc2ccccc2 68fc03187ccbb7bba04dccbffa93f5d4 [1,0,0,1,0,0|0,0,2]=4 1869 B14R2.101 c1ccc(cc1)CCN2CCSC2 2630cb61a487ede3a130c32d2a11f610 [1,0,0,1,0,0|1,0,1]=4 1870 B14R2.112 C#CCN1CCc2ccccc2C1 14ded276741d61b2ed020d55dfe3891f [1,0,0,1,0,0|0,0,0]=2 1871 B14R2.112 C#CCN1CCc2cccnc2C1 357427958f80e4b5a505265681c95d9e [1,0,0,1,0,0|1,0,0]=3 1872 B14R2.112 C#CCN1CCc2ccncc2C1 f1626ed69acdf1f2a8d8b3cc5ec342c3 [1,0,0,1,0,0|1,0,0]=3 1873 B14R2.112 C#CCN1CCc2cnccc2C1 7b4f32872a551f84c3f780360858d6a0 [1,0,0,1,0,0|1,0,0]=3 1874 B14R2.112 C#CCN1CCc2ncccc2C1 7cf4974810d7511f600e36221875f39b [1,0,0,1,0,0|1,0,0]=3 1875 B14R2.112 C#CCN1CCc2nccnc2C1 6feb1bcee5a159ef4fd8dcf1b06a3532 [1,0,0,1,0,0|2,0,0]=4 1876 B14R2.112 C#CCN1CCc2ncncc2C1 2dc6954c804b3c0766cefeb4d1239e82 [1,0,0,1,0,0|2,0,0]=4 1877 B14R2.112 C=CCN1CCc2ccccc2C1 ce7a664ff699c3ec5ccc21089cfe442c [1,0,0,1,0,0|0,0,2]=4 1878 B14R2.112 CCCN1CCc2ccccc2C1 fa2533650d99b08c7034d2e1e53459e0 [1,0,0,1,0,0|0,0,2]=4 1879 B14R2.112 COCN1CCc2ccccc2C1 0f4f3d3c9e282474dae5929d5ef9655a [1,0,0,1,0,0|1,0,1]=4 1880 B14R2.112 CSCN1CCc2ccccc2C1 edf8ce13282a3e7d83f5c7bc0bb09ac6 [1,0,0,1,0,0|1,0,1]=4 1881 B14R2.112 FCCN1CCc2ccccc2C1 33d0f296ac7a39e784b113c6bd160681 [1,0,0,1,0,0|1,0,1]=4 1882 B14R2.112 N#CCN1CCc2ccccc2C1 fa5e40bbd9e10036ad02de443529707a [1,0,0,1,0,0|1,0,0]=3 1883 B14R2.112 N#CCN1CCc2cccnc2C1 bff46478639b78f42bc028de09fc249b [1,0,0,1,0,0|2,0,0]=4 1884 B14R2.112 N#CCN1CCc2ccncc2C1 0e8d89f3a9c7d7866605f21a089770f7 [1,0,0,1,0,0|2,0,0]=4 1885 B14R2.112 N#CCN1CCc2cnccc2C1 acd942f4c1705e4e649fc4ff0223cec0 [1,0,0,1,0,0|2,0,0]=4 1886 B14R2.112 N#CCN1CCc2ncccc2C1 deee52a7d3e5091e156766454e5d6e79 [1,0,0,1,0,0|2,0,0]=4 1887 B14R2.112 O=CCN1CCc2ccccc2C1 935259649f544737ed78159536ecce15 [1,0,0,1,0,0|1,0,1]=4 1888 B14R2.112 OCCN1CCc2ccccc2C1 3fadb5a95a7cc89696b30aada372edc1 [1,0,0,1,0,0|1,0,1]=4 1889 B14R2.112 SCCN1CCc2ccccc2C1 8240d4a84da308d88667f3cb56a78490 [1,0,0,1,0,0|1,0,1]=4 1890 B14R2.436 FC1CN(C1)CCc2ccccc2 5907cd58d375cb4291ac33ab6d69d6e4 [1,0,0,1,0,0|1,0,1]=4 1891 B14R2.436 OC1CN(C1)CCc2ccccc2 588f1671ef57dfde09b691d9b7464f29 [1,0,0,1,0,0|1,0,1]=4 1892 B14R2.2899 CN(CCc1ccccc1)C2CC2 90b28eb140c61070bbcbeb4e8550b119 [1,0,0,1,0,0|0,0,2]=4 1893 B14R2.33858 C=CCN(C)C1Cc2c1cccc2 be50af4af00a3ea2628846b6753bd84a [1,0,0,1,0,0|0,0,2]=4 1894 B14R2.33858 CCCN(C)C1Cc2c1cccc2 9d36cc7ce9f0192a8e2d7bbd29459028 [1,0,0,1,0,0|0,0,2]=4 1895 B14R2.33858 CN(CCF)C1Cc2c1cccc2 289656231d42652db1117d341c68de4f [1,0,0,1,0,0|1,0,1]=4 1896 B14R2.39 C#CCN1C(C1c2ccccc2)C d78649972d36b52eb869b5ea916ee628 [1,0,0,1,0,0|0,0,0]=2 1897 B14R2.39 C#CCN1[C@@H]([C@@H]1c2ccccc2)C 2f2eacf4f237b303b639730ed1892aa5 [1,0,0,1,0,0|0,0,0]=2 1898 B14R2.39 C=CCN1C(C1c2ccccc2)C 4a229f9e4484f1e663363d4c649c40aa [1,0,0,1,0,0|0,0,2]=4 1899 B14R2.39 C=CCN1[C@@H]([C@@H]1c2ccccc2)C 0b8851d4dae14aeb8ee069021bb29ca5 [1,0,0,1,0,0|0,0,2]=4 1900 B14R2.39 CC1C(N1CC#N)c2ccccc2 f7c400b04c4de5ddc4d17583f9300913 [1,0,0,1,0,0|1,0,0]=3 1901 B14R2.39 CC1C(N1CC=O)c2ccccc2 163499e40915c7d46021f3a160a00315 [1,0,0,1,0,0|1,0,1]=4 1902 B14R2.39 CC1C(N1CCF)c2ccccc2 3f7280ce4d879015ac5637a82afee230 [1,0,0,1,0,0|1,0,1]=4 1903 B14R2.39 CC1C(N1CCO)c2ccccc2 bd868bb57c8d54ede280ab7282e29553 [1,0,0,1,0,0|1,0,1]=4 1904 B14R2.39 CC1C(N1CCS)c2ccccc2 c16cd87723a064b94d49ce1f742624ec [1,0,0,1,0,0|1,0,1]=4 1905 B14R2.39 CCCN1C(C1c2ccccc2)C 4dcec3b181f800e43f281523e76b0bb2 [1,0,0,1,0,0|0,0,2]=4 1906 B14R2.39 CCCN1[C@@H]([C@@H]1c2ccccc2)C 9f098a5c1f548944ce0f82dec604ad70 [1,0,0,1,0,0|0,0,2]=4 1907 B14R2.39 COCN1C(C1c2ccccc2)C d01096f282caf9730948f73b479b35b1 [1,0,0,1,0,0|1,0,1]=4 1908 B14R2.39 COCN1[C@@H]([C@@H]1c2ccccc2)C 16545974ba2aaee054b4e97248fdad81 [1,0,0,1,0,0|1,0,1]=4 1909 B14R2.39 CSCN1C(C1c2ccccc2)C 265424e8fb2c836f23178f159c1d097a [1,0,0,1,0,0|1,0,1]=4 1910 B14R2.39 CSCN1[C@@H]([C@@H]1c2ccccc2)C ccebca0372db0ba6465a27ed7186b3b3 [1,0,0,1,0,0|1,0,1]=4 1911 B14R2.39 C[C@@H]1[C@@H](N1CC#N)c2ccccc2 da966aeba0d00c9f53e30ddb2f35d8b3 [1,0,0,1,0,0|1,0,0]=3 1912 B14R2.39 C[C@@H]1[C@@H](N1CC=O)c2ccccc2 1565d673b8797c50c8140e61b987b635 [1,0,0,1,0,0|1,0,1]=4 1913 B14R2.39 C[C@@H]1[C@@H](N1CCF)c2ccccc2 747df96406e758574117627f00cc1034 [1,0,0,1,0,0|1,0,1]=4 1914 B14R2.39 C[C@@H]1[C@@H](N1CCO)c2ccccc2 57e60f40b85baa15c5436e56678c83e7 [1,0,0,1,0,0|1,0,1]=4 1915 B14R2.39 C[C@@H]1[C@@H](N1CCS)c2ccccc2 c24f3b2450cac012d21229baaf43e6e9 [1,0,0,1,0,0|1,0,1]=4 1916 B14R2.66 C#CCCN1CC1c2ccccc2 f2341c82b2958169c8a271d16e217eed [1,0,0,1,0,0|2,0,0]=4 1917 B14R2.66 C#CCCN1C[C@@H]1c2ccccc2 92cbe399184a02df3f0a24b84b8a86fb [1,0,0,1,0,0|2,0,0]=4 1918 B14R2.66 C#CCNC1CC1c2ccccc2 dae9bf69e66611dc712c978d0910c867 [1,0,0,1,0,0|0,0,0]=2 1919 B14R2.66 C#CCN[C@@H]1C[C@H]1c2ccccc2 002b76a1f8239cdab786ea27c4cd9abe [1,0,0,1,0,0|0,0,0]=2 1920 B14R2.66 C#CCN[C@H]1C[C@@H]1c2ccccc2 c5f02df6aba368861573fe95307c02f0 [1,0,0,1,0,0|0,0,0]=2 1921 B14R2.66 C#CCOC1CC1c2ccccc2 e410165409854a8bdcb43b6a6f843b62 [1,0,0,1,0,0|1,0,0]=3 1922 B14R2.66 C#CCO[C@@H]1C[C@H]1c2ccccc2 dda99209571dcd94e18314b1904a244e [1,0,0,1,0,0|1,0,0]=3 1923 B14R2.66 C=CCNC1CC1c2ccccc2 e82939fa6e6c3674589acc2d2ab11ea0 [1,0,0,1,0,0|0,0,2]=4 1924 B14R2.66 C=CCN[C@@H]1C[C@H]1c2ccccc2 fdacdf524dd49c9b87b2bc8c1cfa7f42 [1,0,0,1,0,0|0,0,2]=4 1925 B14R2.66 C=CCN[C@H]1C[C@@H]1c2ccccc2 0f842dfb85d29d1608484bee5cec5973 [1,0,0,1,0,0|0,0,2]=4 1926 B14R2.66 CCCNC1CC1c2ccccc2 c263b45addc4c7b23135cffd6e94271e [1,0,0,1,0,0|0,0,2]=4 1927 B14R2.66 CCCN[C@@H]1C[C@H]1c2ccccc2 fa009cb3e5240f8052ce9f217f13cc24 [1,0,0,1,0,0|0,0,2]=4 1928 B14R2.66 CCCN[C@H]1C[C@@H]1c2ccccc2 eab0a0bea86fceaa044713d34cf26f94 [1,0,0,1,0,0|0,0,2]=4 1929 B14R2.66 COCNC1CC1c2ccccc2 fd8bb61e0146f59dd3d44353141fb741 [1,0,0,1,0,0|1,0,1]=4 1930 B14R2.66 COCN[C@@H]1C[C@H]1c2ccccc2 1cd4c32e2450fe06e8e48c778da7ea2c [1,0,0,1,0,0|1,0,1]=4 1931 B14R2.66 COCN[C@H]1C[C@@H]1c2ccccc2 de94dc9a844084fd02e3753953507986 [1,0,0,1,0,0|1,0,1]=4 1932 B14R2.66 CSCNC1CC1c2ccccc2 9893012b7035f1411a7612d019a0be42 [1,0,0,1,0,0|1,0,1]=4 1933 B14R2.66 CSCN[C@@H]1C[C@H]1c2ccccc2 b347bc3316795ef78d3f2119c65a95a0 [1,0,0,1,0,0|1,0,1]=4 1934 B14R2.66 CSCN[C@H]1C[C@@H]1c2ccccc2 8d23cff301e5c5925c61ebae740aa0a3 [1,0,0,1,0,0|1,0,1]=4 1935 B14R2.66 FCCNC1CC1c2ccccc2 45e849fbc6ddbede9b2f2a02fb1ca4d3 [1,0,0,1,0,0|1,0,1]=4 1936 B14R2.66 FCCN[C@@H]1C[C@H]1c2ccccc2 c55ec77b6b617be24787417759d6a1fa [1,0,0,1,0,0|1,0,1]=4 1937 B14R2.66 FCCN[C@H]1C[C@@H]1c2ccccc2 33294924ef6b2a3efcbc130f627a7bbc [1,0,0,1,0,0|1,0,1]=4 1938 B14R2.66 N#CCNC1CC1c2ccccc2 402d7a8b81f37ef087b238084f00fa96 [1,0,0,1,0,0|1,0,0]=3 1939 B14R2.66 N#CCN[C@@H]1C[C@H]1c2ccccc2 ec88faa6003a0765fdb9db1d3610ee36 [1,0,0,1,0,0|1,0,0]=3 1940 B14R2.66 N#CCN[C@H]1C[C@@H]1c2ccccc2 2810b2a09b7646289a7805eb003317b0 [1,0,0,1,0,0|1,0,0]=3 1941 B14R2.66 N#CCOC1CC1c2ccccc2 d01433ba98747c1e4a8c8200a8ff798e [1,0,0,1,0,0|2,0,0]=4 1942 B14R2.66 N#CCO[C@@H]1C[C@H]1c2ccccc2 15afea3d13d9500ca80fe5945ec0d294 [1,0,0,1,0,0|2,0,0]=4 1943 B14R2.66 O=CCNC1CC1c2ccccc2 0210b7374bb3637e32936ab201f279c2 [1,0,0,1,0,0|1,0,1]=4 1944 B14R2.66 O=CCN[C@@H]1C[C@H]1c2ccccc2 0ee22434253c40747ae91d67df126731 [1,0,0,1,0,0|1,0,1]=4 1945 B14R2.66 O=CCN[C@H]1C[C@@H]1c2ccccc2 6ea102d544ecd377632d32e9c69475e9 [1,0,0,1,0,0|1,0,1]=4 1946 B14R2.66 OCCNC1CC1c2ccccc2 56510722f611fab9fd9fc6f5ca4cfd54 [1,0,0,1,0,0|1,0,1]=4 1947 B14R2.66 OCCN[C@@H]1C[C@H]1c2ccccc2 469de11e1fcf4abc2b5d49b070d74126 [1,0,0,1,0,0|1,0,1]=4 1948 B14R2.66 OCCN[C@H]1C[C@@H]1c2ccccc2 ee9ab284fcead8805d176c29b854bc5f [1,0,0,1,0,0|1,0,1]=4 1949 B14R2.66 SCCNC1CC1c2ccccc2 8444a83aca917b5ef479077372e6b104 [1,0,0,1,0,0|1,0,1]=4 1950 B14R2.66 SCCN[C@@H]1C[C@H]1c2ccccc2 275be3eb2b0ee04d6f606115d65fd111 [1,0,0,1,0,0|1,0,1]=4 1951 B14R2.66 SCCN[C@H]1C[C@@H]1c2ccccc2 525cb74558bb8ec2329a7d4c7dd28ed2 [1,0,0,1,0,0|1,0,1]=4 1952 B14R2.67 C#CCCN1Cc2ccccc2C1 f70ba2d76af1653747899e3df85a5a21 [1,0,0,1,0,0|2,0,0]=4 1953 B14R2.67 C#CCNC1Cc2cccnc2C1 e3a2c3372d1d59a4bbc16adcb5babe1f [1,0,0,1,0,0|1,0,0]=3 1954 B14R2.67 C#CCNC1Cc2ccncc2C1 2e8430c544852c1a236e6da608683ccb [1,0,0,1,0,0|1,0,0]=3 1955 B14R2.67 C#CCOC1Cc2ccccc2C1 c2d1966e64493a35fe2aefa4c6349516 [1,0,0,1,0,0|1,0,0]=3 1956 B14R2.67 C#CCOC1Cc2cccnc2C1 929ce718cf60f1a9d4bb0fb5e7149f29 [1,0,0,1,0,0|2,0,0]=4 1957 B14R2.67 FCCNC1Cc2ccccc2C1 d68c3ee64a3e0904d72d697128958c10 [1,0,0,1,0,0|1,0,1]=4 1958 B14R2.67 N#CCNC1Cc2cccnc2C1 562b0de8f21021e2e69af192e54aaa95 [1,0,0,1,0,0|2,0,0]=4 1959 B14R2.67 N#CCNC1Cc2ccncc2C1 08dbe4dd82d60764640b10c7ad4e82fd [1,0,0,1,0,0|2,0,0]=4 1960 B14R2.67 N#CCOC1Cc2ccccc2C1 e63686915667ddc36d4259deb6089d2e [1,0,0,1,0,0|2,0,0]=4 1961 B14R2.67 OCCNC1Cc2ccccc2C1 ce4950509955a53c6169040d62a8dfa5 [1,0,0,1,0,0|1,0,1]=4 1962 B14R2.517 C#CCN1c2ncccc2CC1C c81bfff429d348b26b56fc43cdcb688e [1,0,0,1,0,0|1,0,0]=3 1963 B14R2.517 C=CCN1c2ccccc2CC1C 68fb8509f09f84dad9acca3541949a55 [1,0,0,1,0,0|0,0,2]=4 1964 B14R2.517 C=CCN1c2ccccc2C[C@@H]1C 847dd877c56eb0bde99c94b08af7dccb [1,0,0,1,0,0|0,0,2]=4 1965 B14R2.517 C=CCN1c2ccccc2C[C@H]1C a450668e607e4b21bd8c1a9c7504932c [1,0,0,1,0,0|0,0,2]=4 1966 B14R2.517 CC1Cc2ccccc2N1CC#N 386087f82c803bf46a70f1daeec739fe [1,0,0,1,0,0|1,0,0]=3 1967 B14R2.517 CC1Cc2ccccc2N1CC=O b5119a20a274992a2f30af5a1814033d [1,0,0,1,0,0|1,0,1]=4 1968 B14R2.517 CC1Cc2ccccc2N1CCF 7259991a9716259499edfae47ad73fed [1,0,0,1,0,0|1,0,1]=4 1969 B14R2.517 CC1Cc2ccccc2N1CCO bda25589eb032d2cfad03240a182492e [1,0,0,1,0,0|1,0,1]=4 1970 B14R2.517 CC1Cc2ccccc2N1CCS 653e4ce39a029b24f7f81c43331df736 [1,0,0,1,0,0|1,0,1]=4 1971 B14R2.517 CC1Cc2cccnc2N1CC#N b141e6060a1c36866b44bfa996f8dde0 [1,0,0,1,0,0|2,0,0]=4 1972 B14R2.517 CCCN1c2ccccc2CC1C 966c933bb1cdf1d755c116956f9658f2 [1,0,0,1,0,0|0,0,2]=4 1973 B14R2.517 CCCN1c2ccccc2C[C@@H]1C 884a5063d6e4883bea657ca6db09beb5 [1,0,0,1,0,0|0,0,2]=4 1974 B14R2.517 CCCN1c2ccccc2C[C@H]1C d882c2225d08121c2e9902fed6d77427 [1,0,0,1,0,0|0,0,2]=4 1975 B14R2.517 COCN1c2ccccc2CC1C 3264cd35654184f2cc7c0d0699c46953 [1,0,0,1,0,0|1,0,1]=4 1976 B14R2.517 COCN1c2ccccc2C[C@@H]1C 9ea131af82f3748a3bea4bba3bdd4467 [1,0,0,1,0,0|1,0,1]=4 1977 B14R2.517 COCN1c2ccccc2C[C@H]1C a192f330d773f4e3cfac298bb56baef5 [1,0,0,1,0,0|1,0,1]=4 1978 B14R2.517 CSCN1c2ccccc2CC1C 0ee96a69f5f9a71460ef1b23f2e0a7cc [1,0,0,1,0,0|1,0,1]=4 1979 B14R2.517 CSCN1c2ccccc2C[C@@H]1C 4eaa6db081c9d99f062873992bd094b6 [1,0,0,1,0,0|1,0,1]=4 1980 B14R2.517 CSCN1c2ccccc2C[C@H]1C c9da6f1d67ba991f516b80f9c6e4d978 [1,0,0,1,0,0|1,0,1]=4 1981 B14R2.517 C[C@@H]1Cc2ccccc2N1CC#N d785694bd67d36548320c5ce9995ddc0 [1,0,0,1,0,0|1,0,0]=3 1982 B14R2.517 C[C@@H]1Cc2ccccc2N1CC=O 78ef0f75d42c0fe0569029ef84d06dd9 [1,0,0,1,0,0|1,0,1]=4 1983 B14R2.517 C[C@@H]1Cc2ccccc2N1CCF b4f92f105a82c9fc4b3c52d3691421e6 [1,0,0,1,0,0|1,0,1]=4 1984 B14R2.517 C[C@@H]1Cc2ccccc2N1CCO 86e05767697537f1eca3b33217787baa [1,0,0,1,0,0|1,0,1]=4 1985 B14R2.517 C[C@@H]1Cc2ccccc2N1CCS 98b456bc26be288b0265a0ef5509dfee [1,0,0,1,0,0|1,0,1]=4 1986 B14R2.517 C[C@H]1Cc2ccccc2N1CC#N 625410e5ce3725980a7183eb87103286 [1,0,0,1,0,0|1,0,0]=3 1987 B14R2.517 C[C@H]1Cc2ccccc2N1CC=O e0415d2cb8bf0887b2072d2d4fa641b5 [1,0,0,1,0,0|1,0,1]=4 1988 B14R2.517 C[C@H]1Cc2ccccc2N1CCF 247def97670b13c54ea69e3167ffb03e [1,0,0,1,0,0|1,0,1]=4 1989 B14R2.517 C[C@H]1Cc2ccccc2N1CCO c9ee95bc4d48fc947657fb5aa339e384 [1,0,0,1,0,0|1,0,1]=4 1990 B14R2.517 C[C@H]1Cc2ccccc2N1CCS 67fcced966907229139f007d2de26a04 [1,0,0,1,0,0|1,0,1]=4 1991 B14R2.958 CCN(C)[C@@H]1C[C@H]1c2ccccc2 2e6c707828f156d1aa08062c8266c26e [1,0,0,1,0,0|0,0,1]=3 1992 B14R2.958 CCN(C)[C@H]1C[C@@H]1c2ccccc2 963617a43e085702fb9199d7b6e5561b [1,0,0,1,0,0|0,0,1]=3 1993 B14R2.958 CN(C=O)[C@@H]1C[C@H]1c2ccccc2 053253936846ae5cf0a56d171a662462 [1,0,0,1,0,0|1,0,1]=4 1994 B14R2.958 CN(C=O)[C@H]1C[C@@H]1c2ccccc2 3d6fcc397bd0c13300780f77de6f59e2 [1,0,0,1,0,0|1,0,1]=4 1995 B14R2.958 CN(CF)[C@@H]1C[C@H]1c2ccccc2 06997b93133a384c8a6b97ab153504a5 [1,0,0,1,0,0|1,0,0]=3 1996 B14R2.958 CN(CF)[C@H]1C[C@@H]1c2ccccc2 b772bafd089d7a3a0b4bf8a4105096b2 [1,0,0,1,0,0|1,0,0]=3 1997 B14R2.958 CN(CO)[C@@H]1C[C@H]1c2ccccc2 b13f5f9add1a71065d8791c0a93b47d6 [1,0,0,1,0,0|1,0,0]=3 1998 B14R2.958 CN(CO)[C@H]1C[C@@H]1c2ccccc2 6666f62260263014b55fb779fa8a5e06 [1,0,0,1,0,0|1,0,0]=3 1999 B14R2.972 C#CC(C)N1Cc2ccccc2C1 df004ea743f2ef2faf54dd24604ef29b [1,0,0,1,0,0|2,0,0]=4 2000 B14R2.1128 CC1Cc2ccccc2CN1C=O 7169952a2f0504cd2f0d2470124aa2fd [1,0,0,1,0,0|1,0,1]=4 2001 B14R2.1128 CC1Cc2ccccc2CN1CF 6994d7c56cc5a76e98f8b5723d611e75 [1,0,0,1,0,0|1,0,0]=3 2002 B14R2.1128 CC1Cc2ccccc2CN1CO d824aee8a92c4f44bc7fbfac228e2ee7 [1,0,0,1,0,0|1,0,0]=3 2003 B14R2.1128 CCN1Cc2ccccc2CC1C aef6e010d25187b24157284ca051c273 [1,0,0,1,0,0|0,0,1]=3 2004 B14R2.1128 CCN1Cc2ccccc2C[C@@H]1C 5377270915d2249e4ae41157aa4e5add [1,0,0,1,0,0|0,0,1]=3 2005 B14R2.1128 CCN1Cc2ccccc2C[C@H]1C 89e87024068a2b2540293db2155139c9 [1,0,0,1,0,0|0,0,1]=3 2006 B14R2.1128 C[C@@H]1Cc2ccccc2CN1C=O 850728f0f70c6a60e8bb380aa1e1ac23 [1,0,0,1,0,0|1,0,1]=4 2007 B14R2.1128 C[C@@H]1Cc2ccccc2CN1CF 6ce14e1296eb9bb08b2c1b78116fbf51 [1,0,0,1,0,0|1,0,0]=3 2008 B14R2.1128 C[C@@H]1Cc2ccccc2CN1CO c82740a5ec323a6f00b7d8672e76d119 [1,0,0,1,0,0|1,0,0]=3 2009 B14R2.1128 C[C@H]1Cc2ccccc2CN1C=O 73f07f459b47002436eb0be3300c0321 [1,0,0,1,0,0|1,0,1]=4 2010 B14R2.1128 C[C@H]1Cc2ccccc2CN1CF 7ae58ea6446c6984f3adda986dfddeed [1,0,0,1,0,0|1,0,0]=3 2011 B14R2.1128 C[C@H]1Cc2ccccc2CN1CO 3a548ee3e966a3876480fcfe3c2d51c8 [1,0,0,1,0,0|1,0,0]=3 2012 B14R2.35 C#CCN1CCC1c2ccccc2 e793d78aa9d47f9349de407e94aa17a3 [0,0,0,1,1,0|0,0,0]=2 2013 B14R2.35 C=CCN1CCC1c2ccccc2 62f13b61751e8215bea2643a7020ff7c [0,0,0,1,1,0|0,0,2]=4 2014 B14R2.35 CCCN1CCC1c2ccccc2 a5c6c05f8dcf9200240b19e703ed5cea [0,0,0,1,1,0|0,0,2]=4 2015 B14R2.35 COCN1CCC1c2ccccc2 1b76efdbb72062a36ccbfdf05e073956 [0,0,0,1,1,0|1,0,1]=4 2016 B14R2.35 CSCN1CCC1c2ccccc2 f8228657acdec29fec2f145f2995dcf7 [0,0,0,1,1,0|1,0,1]=4 2017 B14R2.35 FCCN1CCC1c2ccccc2 2782d594dce87ff8d7edade27654dd2b [0,0,0,1,1,0|1,0,1]=4 2018 B14R2.35 N#CCN1CCC1c2ccccc2 2d5c61ca98ef342afc8347c75f8806f0 [0,0,0,1,1,0|1,0,0]=3 2019 B14R2.35 O=CCN1CCC1c2ccccc2 3674678022130a2c6c07e447df1c1444 [0,0,0,1,1,0|1,0,1]=4 2020 B14R2.35 OCCN1CCC1c2ccccc2 62b7cb2029c494faa8ae7a22239afc22 [0,0,0,1,1,0|1,0,1]=4 2021 B14R2.35 SCCN1CCC1c2ccccc2 ea27c16ed23bf0fa00eb267f29fb78f7 [0,0,0,1,1,0|1,0,1]=4 2022 B14R2.44 C#CCN1Cc2ccccc2[C@H]1C 8c220aeeb91a5d8fb5b863030092d10d [0,0,0,1,1,0|0,0,0]=2 2023 B14R2.44 C=CCN1Cc2ccccc2[C@H]1C 7b0adf75e669c8152610f6f853dfbcf9 [0,0,0,1,1,0|0,0,2]=4 2024 B14R2.44 CCCN1Cc2ccccc2[C@H]1C 5faeafb5c778eb318a4eb2132d3db609 [0,0,0,1,1,0|0,0,2]=4 2025 B14R2.44 COCN1Cc2ccccc2[C@H]1C f8b33a08f2faa522507a97655674cc0d [0,0,0,1,1,0|1,0,1]=4 2026 B14R2.44 CSCN1Cc2ccccc2[C@H]1C 3f72503a2409f1d18375249a8e8788cf [0,0,0,1,1,0|1,0,1]=4 2027 B14R2.44 C[C@@H]1c2ccccc2CN1CC#N 641b372f63b8e796adb5852007425f25 [0,0,0,1,1,0|1,0,0]=3 2028 B14R2.44 C[C@@H]1c2ccccc2CN1CC=O 297c6c9f68f276601a628a4b8715baa4 [0,0,0,1,1,0|1,0,1]=4 2029 B14R2.44 C[C@@H]1c2ccccc2CN1CCF 485c7e5b0e3b4a1adbaf7699ec73a3ac [0,0,0,1,1,0|1,0,1]=4 2030 B14R2.44 C[C@@H]1c2ccccc2CN1CCO 021828af470fbfec5fc766211838500c [0,0,0,1,1,0|1,0,1]=4 2031 B14R2.44 C[C@@H]1c2ccccc2CN1CCS a9675783281d1cfdd7cedc207f925b6e [0,0,0,1,1,0|1,0,1]=4 2032 B14R2.114 CC(c1ccccc1)N2CCSC2 f06fab00ab9711bc498a021cdc0df97f [0,0,0,1,1,0|1,0,1]=4 2033 B14R2.114 C[C@@H](c1ccccc1)N2CCSC2 21d4bb1e708dabba588fda9d6659062b [0,0,0,1,1,0|1,0,1]=4 2034 B14R2.114 C[C@H](c1ccccc1)N2CCSC2 f05e98a166ec8434a222b5800f7230b4 [0,0,0,1,1,0|1,0,1]=4 2035 B14R2.422 CC(c1ccccc1)N2CC(C2)F 8e55e2b9a544cf7ad6a6325a75d4dd26 [0,0,0,1,1,0|1,0,1]=4 2036 B14R2.422 CC(c1ccccc1)N2CC(C2)O 7e8bd9b8540f04523d55227a46461ece [0,0,0,1,1,0|1,0,1]=4 2037 B14R2.422 C[C@@H](c1ccccc1)N2CC(C2)F d37763ff0f760e130acd7071d25559a2 [0,0,0,1,1,0|1,0,1]=4 2038 B14R2.422 C[C@@H](c1ccccc1)N2CC(C2)O c91f42062846695833f22b7ae1d908d5 [0,0,0,1,1,0|1,0,1]=4 2039 B14R2.422 C[C@H](c1ccccc1)N2CC(C2)F b7e89361d089d6ecffefb8cd90673045 [0,0,0,1,1,0|1,0,1]=4 2040 B14R2.422 C[C@H](c1ccccc1)N2CC(C2)O 6edb90931089f2b1f365dbf3a4b251e7 [0,0,0,1,1,0|1,0,1]=4 2041 B14R2.583 C#CCN1Cc2ccnn2C[C@@H]1C 9e16922c95838fa1ad10b06bc35fbda2 [0,0,0,1,1,0|2,0,0]=4 2042 B14R2.583 C#CCN1Cc2ccnn2C[C@H]1C 9457018a18bb5a2b1f0da8b38e9790f8 [0,0,0,1,1,0|2,0,0]=4 2043 B14R2.583 C#CCN1Cc2nccn2CC1C 1ab544aaef149f2dd7d8efd6c0d87407 [0,0,0,1,1,0|2,0,0]=4 2044 B16R2.92 C#CCN1CCC(C1)Cc2ccccc2 18efcdb9ed6e755731804fed08566420 [0,0,0,1,0,1|0,0,0]=2 2045 B16R2.92 C#CCN1CCC(C1)Cc2cnccn2 ac6300a8edef1fb79fd4fda9be74ee1b [0,0,0,1,0,1|2,0,0]=4 2046 B16R2.92 C#CCN1CCC(C1)Oc2ccccc2 7047e10e30d9f537708bf851b01690dc [0,0,0,1,0,1|1,0,0]=3 2047 B16R2.92 C#CCN1CCC(C1)Oc2ccccn2 0a9c9c47728c6b442ba6a38ac707aefa [0,0,0,1,0,1|2,0,0]=4 2048 B16R2.92 C#CCN1CCC(C1)Oc2cccnc2 2e60d9968384239fbb7a07c9fffe5d10 [0,0,0,1,0,1|2,0,0]=4 2049 B16R2.92 C#CCN1CCC(C1)Oc2ccncc2 14ede445b86afd1e4c1e656e90693af1 [0,0,0,1,0,1|2,0,0]=4 2050 B16R2.92 C#CCN1CC[C@@H](C1)Oc2ccccc2 656f84cdac89a77b5c77b39ddb79a6d3 [0,0,0,1,0,1|1,0,0]=3 2051 B16R2.92 C#CCN1CC[C@@H](C1)Oc2ccccn2 7b1774448688828342eadd121bf0bf48 [0,0,0,1,0,1|2,0,0]=4 2052 B16R2.92 C#CCN1CC[C@H](C1)Oc2ccccc2 bdf3a7602b9fd5f90bb648afa104b819 [0,0,0,1,0,1|1,0,0]=3 2053 B16R2.92 C#CCN1CC[C@H](C1)Oc2ccccn2 a2bc962718fa0b72113fab4ffac41775 [0,0,0,1,0,1|2,0,0]=4 2054 B16R2.92 C=CCN1CCC(C1)Cc2ccccc2 161739fc16ac141827ff61c6c7329acc [0,0,0,1,0,1|0,0,2]=4 2055 B16R2.92 CCCN1CCC(C1)Cc2ccccc2 46a1979c0c7b2048d75f75f7be930b9c [0,0,0,1,0,1|0,0,2]=4 2056 B16R2.92 COCN1CCC(C1)Cc2ccccc2 a25124f451dd7908db6383fb6526ef20 [0,0,0,1,0,1|1,0,1]=4 2057 B16R2.92 CSCN1CCC(C1)Cc2ccccc2 b31304b591e54d1cbe4b177c1ab9b794 [0,0,0,1,0,1|1,0,1]=4 2058 B16R2.92 FCCN1CCC(C1)Cc2ccccc2 b69acd850ebfe96705e7c6a4dba1fb57 [0,0,0,1,0,1|1,0,1]=4 2059 B16R2.92 N#CCN1CCC(C1)Cc2ccccc2 1fce1767a47313303ab66b73487e5ae8 [0,0,0,1,0,1|1,0,0]=3 2060 B16R2.92 N#CCN1CCC(C1)Oc2ccccc2 8adc79af3eb0cbf1fe3e12ec5f1327a7 [0,0,0,1,0,1|2,0,0]=4 2061 B16R2.92 N#CCN1CC[C@@H](C1)Oc2ccccc2 ee84aec7bae329600e51c5e276c6c733 [0,0,0,1,0,1|2,0,0]=4 2062 B16R2.92 N#CCN1CC[C@H](C1)Oc2ccccc2 66700c28dc52ba95ea599f2b540d1656 [0,0,0,1,0,1|2,0,0]=4 2063 B16R2.92 O=CCN1CCC(C1)Cc2ccccc2 a973673b60a10a8969054d81c7e11b36 [0,0,0,1,0,1|1,0,1]=4 2064 B16R2.92 OCCN1CCC(C1)Cc2ccccc2 2c1ce520573d36f7c02e7c1bcd76bc16 [0,0,0,1,0,1|1,0,1]=4 2065 B16R2.92 SCCN1CCC(C1)Cc2ccccc2 febe0889a86e6065068d0349e93a5293 [0,0,0,1,0,1|1,0,1]=4 2066 B16R2.725 C#CCC(=O)N1C[C@@H]1Cc2ccccc2 1d0b8e192127a0bbef74d7a5e7506701 [0,0,0,1,0,1|2,0,0]=4 2067 B16R2.734 C#CCN(C)CC1Cc2ccccc2C1 a79123bba5a4b79eae221d48153c4c90 [0,0,0,1,0,1|0,0,0]=2 2068 B16R2.734 C#CCN(C)CC1Cc2ccccc2O1 ae3cb12a2dceee9a02d365f91592cb22 [0,0,0,1,0,1|1,0,0]=3 2069 B16R2.734 C=CCN(C)CC1Cc2ccccc2C1 e25ec62f28d42067d76a17bdec0d9aa9 [0,0,0,1,0,1|0,0,2]=4 2070 B16R2.734 CC(CC#N)OC1Cc2ccccc2C1 a4427b7ef548432e521482c49bdd7a71 [0,0,0,1,0,1|2,0,0]=4 2071 B16R2.734 CCCN(C)CC1Cc2ccccc2C1 5c46574f5dbf2fa6b9ecef9cf0bf0c5a [0,0,0,1,0,1|0,0,2]=4 2072 B16R2.734 CN(CC#N)CC1Cc2ccccc2C1 7b43d0aa3d1c85f1ad83e40472028239 [0,0,0,1,0,1|1,0,0]=3 2073 B16R2.734 CN(CC#N)CC1Cc2ccccc2O1 c8b0dfa8b3f3995d8ac907e20aaf8fa6 [0,0,0,1,0,1|2,0,0]=4 2074 B16R2.734 CN(CC=O)CC1Cc2ccccc2C1 f70686e617ea9ef6ed3f9683b4d29016 [0,0,0,1,0,1|1,0,1]=4 2075 B16R2.734 CN(CCF)CC1Cc2ccccc2C1 93e84ba643b892a85cce82d66cbececa [0,0,0,1,0,1|1,0,1]=4 2076 B16R2.734 CN(CCO)CC1Cc2ccccc2C1 0a2c46dbd2712cb12a7790388a6005e3 [0,0,0,1,0,1|1,0,1]=4 2077 B16R2.734 CN(CCS)CC1Cc2ccccc2C1 f2d3e4a48c04ed2523f2a3eb3c410eb9 [0,0,0,1,0,1|1,0,1]=4 2078 B16R2.734 COCN(C)CC1Cc2ccccc2C1 ec835f5cb454e5225506ce3722a34eed [0,0,0,1,0,1|1,0,1]=4 2079 B16R2.734 CSCN(C)CC1Cc2ccccc2C1 4aee886e414645747575f7422512063c [0,0,0,1,0,1|1,0,1]=4 2080 B16R2.789 CC(CC#N)NC1CC1c2ccccc2 f74f1002df85e7a2f17f8b179bbe2dc7 [0,0,0,1,0,1|2,0,0]=4 2081 B16R2.789 CC(CC#N)N[C@@H]1C[C@H]1c2ccccc2 ea57d998b1c370427cc5dc438450f1da [0,0,0,1,0,1|2,0,0]=4 2082 B16R2.789 CC(CC#N)N[C@H]1C[C@@H]1c2ccccc2 09816977c969cc627ebcc6ad6cfb4175 [0,0,0,1,0,1|2,0,0]=4 2083 B16R2.789 CC(CC#N)OC1CC1c2ccccc2 7c2c13f4302c1cbb2b6a0d5954fa396a [0,0,0,1,0,1|2,0,0]=4 2084 B16R2.789 CC(CC#N)O[C@@H]1C[C@H]1c2ccccc2 e7a9577bed72843694faf115c761ae93 [0,0,0,1,0,1|2,0,0]=4 2085 B16R2.3806 C#CCN1CC(C(C1)c2ccccc2)C 33fc2a98bfbf35af9a40cce87f1eab2d [0,0,0,1,0,1|0,0,0]=2 2086 B16R2.3806 C=CCN1CC(C(C1)c2ccccc2)C 2da25712647c0105412e0f1a3d552429 [0,0,0,1,0,1|0,0,2]=4 2087 B16R2.3806 CC1CN(CC1c2ccccc2)CC#N 3fb60d7e7e527167f681408e5b61b260 [0,0,0,1,0,1|1,0,0]=3 2088 B16R2.3806 CC1CN(CC1c2ccccc2)CC=O 3e73018602f7eb13b274c272d69e3261 [0,0,0,1,0,1|1,0,1]=4 2089 B16R2.3806 CC1CN(CC1c2ccccc2)CCF 990bcb134ec09737bbadaf456ee446ec [0,0,0,1,0,1|1,0,1]=4 2090 B16R2.3806 CC1CN(CC1c2ccccc2)CCO 75a98c6d068eadec0c8881098c39477d [0,0,0,1,0,1|1,0,1]=4 2091 B16R2.3806 CC1CN(CC1c2ccccc2)CCS f7b955205ebea6d7c7293ec4341124d0 [0,0,0,1,0,1|1,0,1]=4 2092 B16R2.3806 CCCN1CC(C(C1)c2ccccc2)C 513a4779854f13c319e6bba3d74688b0 [0,0,0,1,0,1|0,0,2]=4 2093 B16R2.3806 COCN1CC(C(C1)c2ccccc2)C 0d6dba6c7fe0fdc47a502bd80c1503d2 [0,0,0,1,0,1|1,0,1]=4 2094 B16R2.3806 CSCN1CC(C(C1)c2ccccc2)C 4655d7131e20c3c1a0c9be112769293a [0,0,0,1,0,1|1,0,1]=4 2095 B16R2.11248 C#CCN1CC(C1)(O)Cc2ccccc2 b20812f09e7373e1e19ab6b2078574e7 [0,0,0,1,0,1|1,0,0]=3 2096 B16R2.11248 N#CCN1CC(C1)(O)Cc2ccccc2 9f9524b0f068144246095ff2fa0017d4 [0,0,0,1,0,1|2,0,0]=4 2097 B16R2.28951 CC(CC#N)N1C(C1c2ccccc2)C 1cee409efb364ccf5cb6a3c479779866 [0,0,0,1,0,1|2,0,0]=4 2098 B16R2.28951 CC(CC#N)N1[C@@H]([C@@H]1c2ccccc2)C 33d237ced8a9ffabc199c4d6632650c0 [0,0,0,1,0,1|2,0,0]=4 2099 B16R2.29842 CC(CC#N)N1c2ccccc2CC1C e6a1300fddc1da37731aacc8efc06808 [0,0,0,1,0,1|2,0,0]=4 2100 B16R2.29842 CC(CC#N)N1c2ccccc2C[C@@H]1C 6bfd75e9905c2355a9d6f9a16b57321f [0,0,0,1,0,1|2,0,0]=4 2101 B16R2.29842 CC(CC#N)N1c2ccccc2C[C@H]1C 6657c9da697193b4f3cbec8d3f83a587 [0,0,0,1,0,1|2,0,0]=4 2102 B16R2.71 CN1CCCCC1CNc2ccccc2 92ac63ca6d805106c0febb13b2f5509c [0,0,0,1,0,1|0,0,2]=4 2103 B16R2.71 CN1CCOCC1CNc2ccccc2 6b9e2cd4b01a3b2ef878eca37ba1345c [0,0,0,1,0,1|1,0,1]=4 2104 B16R2.71 CN1CCOC[C@H]1CNc2ccccc2 1fbbbdc6678869dd0ba562089dda5e37 [0,0,0,1,0,1|1,0,1]=4 2105 B16R2.762 C=CCN(C)C1CC(C1)c2ccccc2 88b4c876a567ab5e082af0d19339b851 [0,0,0,1,0,1|0,0,2]=4 2106 B16R2.767 C=CCN(C)C1CCc2ccccc2C1 df80d66e6923360c8b96972964e234b6 [0,0,0,1,0,1|0,0,2]=4 2107 B16R2.2238 CC(CCc1ccccc1)N2CC=CC2 c5a1c4ae7f7f5298c8dce53ab2f59c27 [0,0,0,1,0,1|0,0,2]=4 2108 B16R2.2238 CC(CCc1ccccc1)N2CCSC2 e67237e92c856f5c1c250b8314813afc [0,0,0,1,0,1|1,0,1]=4 2109 B16R2.2238 CC(CNc1ccccc1)N2CCCC2 42b8a0b09cbcd0c176d713632f7f7d3a [0,0,0,1,0,1|0,0,2]=4 2110 B16R2.2238 CC(COc1ccccc1)N2CC=CC2 2de9cfd187308debfd52e5c0e23d978a [0,0,0,1,0,1|0,0,2]=4 2111 B16R2.2238 CC(COc1ccccc1)N2CCSC2 dbeec670940bc41b74dba322d25b9f89 [0,0,0,1,0,1|1,0,1]=4 2112 B16R2.3322 CC(CCc1ccccc1)N2CC(C2)F 0a7b08e05180cc639b62b9fb61d5219e [0,0,0,1,0,1|1,0,1]=4 2113 B16R2.3322 CC(CCc1ccccc1)N2CC(C2)O ece71e3034fd915b0e0bf770f4db60ac [0,0,0,1,0,1|1,0,1]=4 2114 B16R2.3322 CC(COc1ccccc1)N2CC(C2)F 70c8afc3e8ec89d2298e3083d0f2f8aa [0,0,0,1,0,1|1,0,1]=4 2115 B16R2.3322 CC(COc1ccccc1)N2CC(C2)O 86854649ba567c376665619dfddaee69 [0,0,0,1,0,1|1,0,1]=4 2116 B16R2.44151 CC(CCc1ccccc1)N(C)C2CC2 cf05636f416a0ce0c326ca6aa4b6243c [0,0,0,1,0,1|0,0,2]=4 2117 B16R2.44151 CC(COc1ccccc1)N(C)C2CC2 664f3cdc01ccf2adb0f64d13efec8849 [0,0,0,1,0,1|0,0,2]=4 2118 B16R2.249491 C#CCN(C)C(=O)C1Cc2c1cccc2 6ee45617077879a1a1370c61780af36b [0,0,0,1,0,1|1,0,1]=4 2119 B16R2.133 CC(Cc1ccc(cc1)F)N2CC=CC2 c653655adde9e987dc0622ef4a322bdc [0,1,0,1,0,0|0,0,2]=4 2120 B16R2.133 CC(Cc1ccc(cc1)F)N2CCSC2 e781319dc3680e2267ad7723167cf014 [0,1,0,1,0,0|1,0,1]=4 2121 B16R2.755 C#CCN(C)C1Cc2ccc(cc2C1)Br b76c87b753ca2937815458012e9985b4 [0,1,0,1,0,0|0,0,0]=2 2122 B16R2.755 C=CCN(C)C1Cc2ccc(cc2C1)Br 40ae1dbb1627fb6a8c51e0c7a3ef9f57 [0,1,0,1,0,0|0,0,2]=4 2123 B16R2.755 CCCN(C)C1Cc2ccc(cc2C1)Br 4be0fe632295103c1693218de78a51d6 [0,1,0,1,0,0|0,0,2]=4 2124 B16R2.755 CN(CC#N)C1Cc2ccc(cc2C1)Br 1c787e4fa93546573dd64d7c949a0d97 [0,1,0,1,0,0|1,0,0]=3 2125 B16R2.755 CN(CC=O)C1Cc2ccc(cc2C1)Br a73c44af5a8a0c02dd9da8ca94453829 [0,1,0,1,0,0|1,0,1]=4 2126 B16R2.755 CN(CCF)C1Cc2ccc(cc2C1)Br c3480f415194e8b76ac65d012f5b7712 [0,1,0,1,0,0|1,0,1]=4 2127 B16R2.755 CN(CCS)C1Cc2ccc(cc2C1)Br 6932054afdaeaf9bd6a4b7f107ce7a77 [0,1,0,1,0,0|1,0,1]=4 2128 B16R2.755 COCN(C)C1Cc2ccc(cc2C1)Br c2d63fe6dcb80934e7ad1e65cd9c0c54 [0,1,0,1,0,0|1,0,1]=4 2129 B16R2.755 CSCN(C)C1Cc2ccc(cc2C1)Br df71339d6386a972a62441a162801baa [0,1,0,1,0,0|1,0,1]=4 2130 B16R2.1134 CC(Cc1ccc(cc1)F)N2CC(C2)O 78628bac27227fa2d69d054927cb8afd [0,1,0,1,0,0|1,0,1]=4 2131 B16R2.253 CC(Cc1cccc(c1)F)N2CC=CC2 07fa113bc4127388f7b5ca60eb6ff8b6 [0,1,0,1,0,0|0,0,2]=4 2132 B16R2.253 CC(Cc1cccc(c1)F)N2CCSC2 e36ccc5dd3b271e0782814deb39d3f20 [0,1,0,1,0,0|1,0,1]=4 2133 B16R2.6501 C#CCN1Cc2ccc(cc2CC1C)Br 174a193bfc8c6f912c54a3d66009034d [0,1,0,1,0,0|0,0,0]=2 2134 B16R2.6501 C#CCN1Cc2ccc(cc2C[C@@H]1C)Br c5f9902ec996b03bbe1ded1f3f9de73c [0,1,0,1,0,0|0,0,0]=2 2135 B16R2.6501 C#CCN1Cc2ccc(cc2C[C@H]1C)Br cf463031e04b902cfb566968b4624e0b [0,1,0,1,0,0|0,0,0]=2 2136 B16R2.6501 C=CCN1Cc2ccc(cc2CC1C)Br 053692bbca24cdfd148f2010797fee8b [0,1,0,1,0,0|0,0,2]=4 2137 B16R2.6501 C=CCN1Cc2ccc(cc2C[C@@H]1C)Br 240597e9dee8a26d0edfe9ee367411e0 [0,1,0,1,0,0|0,0,2]=4 2138 B16R2.6501 C=CCN1Cc2ccc(cc2C[C@H]1C)Br 14556004916ea90130392f4e1aa51ba1 [0,1,0,1,0,0|0,0,2]=4 2139 B16R2.6501 CC1Cc2cc(ccc2CN1CC#N)Br 23abe598a0065412f3969360160853ba [0,1,0,1,0,0|1,0,0]=3 2140 B16R2.6501 CC1Cc2cc(ccc2CN1CC=O)Br 287ca5888d600269e1b2ebbfd1494ed4 [0,1,0,1,0,0|1,0,1]=4 2141 B16R2.6501 CC1Cc2cc(ccc2CN1CCF)Br 805275a36b74b3bba9ae2df580e9de60 [0,1,0,1,0,0|1,0,1]=4 2142 B16R2.6501 CC1Cc2cc(ccc2CN1CCO)Br 8cb7f07681fc90a3d6d59171af44d8dd [0,1,0,1,0,0|1,0,1]=4 2143 B16R2.6501 CC1Cc2cc(ccc2CN1CCS)Br 806251d42e022b3d69d88dd60e007e03 [0,1,0,1,0,0|1,0,1]=4 2144 B16R2.6501 CCCN1Cc2ccc(cc2CC1C)Br c06e59179f12f39b8a6281dbde651d60 [0,1,0,1,0,0|0,0,2]=4 2145 B16R2.6501 CCCN1Cc2ccc(cc2C[C@@H]1C)Br deaf64b4ac7d54f545a3048f5942dbef [0,1,0,1,0,0|0,0,2]=4 2146 B16R2.6501 CCCN1Cc2ccc(cc2C[C@H]1C)Br 750d489c8baaf81968158e5b1eaada1e [0,1,0,1,0,0|0,0,2]=4 2147 B16R2.6501 COCN1Cc2ccc(cc2CC1C)Br ea91615657de2726c5fe4c5b2089587f [0,1,0,1,0,0|1,0,1]=4 2148 B16R2.6501 COCN1Cc2ccc(cc2C[C@@H]1C)Br fea4dc0fb61e4e67155ad346960e74bd [0,1,0,1,0,0|1,0,1]=4 2149 B16R2.6501 COCN1Cc2ccc(cc2C[C@H]1C)Br b48bdad64d399202857179278346ae0b [0,1,0,1,0,0|1,0,1]=4 2150 B16R2.6501 CSCN1Cc2ccc(cc2CC1C)Br 7b70387caa59b057369a4441d928499a [0,1,0,1,0,0|1,0,1]=4 2151 B16R2.6501 CSCN1Cc2ccc(cc2C[C@@H]1C)Br 1f267bcd7ff562cc9a7b7d46167daee9 [0,1,0,1,0,0|1,0,1]=4 2152 B16R2.6501 CSCN1Cc2ccc(cc2C[C@H]1C)Br dc5fc348f191bcfa62645c9ff6e1528c [0,1,0,1,0,0|1,0,1]=4 2153 B16R2.6501 C[C@@H]1Cc2cc(ccc2CN1CC#N)Br c3fcb8372bf673654dc9dd5b6530b313 [0,1,0,1,0,0|1,0,0]=3 2154 B16R2.6501 C[C@@H]1Cc2cc(ccc2CN1CC=O)Br 96ff145303d8170bdc84e6853fb84969 [0,1,0,1,0,0|1,0,1]=4 2155 B16R2.6501 C[C@@H]1Cc2cc(ccc2CN1CCF)Br 087b5f666b35442ca829a825630d7a99 [0,1,0,1,0,0|1,0,1]=4 2156 B16R2.6501 C[C@@H]1Cc2cc(ccc2CN1CCO)Br c028ad46fe339b14b171317387691423 [0,1,0,1,0,0|1,0,1]=4 2157 B16R2.6501 C[C@@H]1Cc2cc(ccc2CN1CCS)Br 120352fcb1782eb3ac35ff85af854757 [0,1,0,1,0,0|1,0,1]=4 2158 B16R2.6501 C[C@H]1Cc2cc(ccc2CN1CC#N)Br b9f0ae7da592c9752e166d0cc144c767 [0,1,0,1,0,0|1,0,0]=3 2159 B16R2.6501 C[C@H]1Cc2cc(ccc2CN1CC=O)Br 8187a5a3f579e9fab1ef6f9f54cef640 [0,1,0,1,0,0|1,0,1]=4 2160 B16R2.6501 C[C@H]1Cc2cc(ccc2CN1CCF)Br 26b193dfa1b552457b357b35e419254c [0,1,0,1,0,0|1,0,1]=4 2161 B16R2.6501 C[C@H]1Cc2cc(ccc2CN1CCO)Br b389d2c23c93d0697b380218ce03ad43 [0,1,0,1,0,0|1,0,1]=4 2162 B16R2.6501 C[C@H]1Cc2cc(ccc2CN1CCS)Br c98f9c5183cff92db552c3f7149ce71b [0,1,0,1,0,0|1,0,1]=4 2163 B16R2.19253 C#CCN1Cc2c(cccc2CC1C)Br f905fadd6d1eb85ff26fd6a15ad1f336 [0,1,0,1,0,0|0,0,0]=2 2164 B16R2.19253 C=CCN1Cc2c(cccc2CC1C)Br 2c4134228ee0a36da8ffb9445460be18 [0,1,0,1,0,0|0,0,2]=4 2165 B16R2.19253 CC1Cc2cccc(c2CN1CC#N)Br 1be8108bab6898203aa6d1b902c78d07 [0,1,0,1,0,0|1,0,0]=3 2166 B16R2.19253 CC1Cc2cccc(c2CN1CC=O)Br e4df5e3d4b118ccc5815fbbe6b4cd54b [0,1,0,1,0,0|1,0,1]=4 2167 B16R2.19253 CC1Cc2cccc(c2CN1CCF)Br 9ea9900cad989422084af450f3ae2535 [0,1,0,1,0,0|1,0,1]=4 2168 B16R2.19253 CC1Cc2cccc(c2CN1CCO)Br 5ecee84b889b78d2bd6c75ceeb1f8583 [0,1,0,1,0,0|1,0,1]=4 2169 B16R2.19253 CC1Cc2cccc(c2CN1CCS)Br 3071b437eeff57770b7ae09e90a2f45a [0,1,0,1,0,0|1,0,1]=4 2170 B16R2.19253 COCN1Cc2c(cccc2CC1C)Br 1787991e73a670645704ae2b52ee6dc8 [0,1,0,1,0,0|1,0,1]=4 2171 B16R2.19253 CSCN1Cc2c(cccc2CC1C)Br 4c21b56bf069b2a9906a0c9fe3ce4323 [0,1,0,1,0,0|1,0,1]=4 2172 B16R2.25765 CC(Cc1cccc(c1)F)N2CC(C2)O 51db3428a29b06100003984b2d0ba207 [0,1,0,1,0,0|1,0,1]=4 2173 B16R2.2843 CC(Cc1ccccc1)N2CNC(=O)C2 e4cc0f6d81972f3c936e99b87df8b6f0 [0,1,0,1,0,0|1,0,1]=4 2174 B16R2.2843 CC1CCN(C1)C(C)Cc2ccccc2 efb6587d1df9264c039fc8db02d8e920 [0,1,0,1,0,0|0,0,2]=4 2175 B16R2.3989 C=C(Br)CN1Cc2ccccc2CC1C 82e9088d9172c3aeca3278b71120477a [0,1,0,1,0,0|0,0,2]=4 2176 B16R2.3989 C=C(Br)CN1Cc2ccccc2C[C@@H]1C 44a2d106adce17583a9efff927efb6c5 [0,1,0,1,0,0|0,0,2]=4 2177 B16R2.3989 C=C(Br)CN1Cc2ccccc2C[C@H]1C fa40ac891456eae50ed29fbaf3cea9a1 [0,1,0,1,0,0|0,0,2]=4 2178 B16R2.3989 C=C(C)CN1Cc2ccccc2CC1C df13b5f02ef255b7c760883dc3fa50fd [0,1,0,1,0,0|0,0,2]=4 2179 B16R2.3989 C=C(C)CN1Cc2ccccc2C[C@@H]1C b2cf4bc6565965dec48708d0c353f947 [0,1,0,1,0,0|0,0,2]=4 2180 B16R2.3989 C=C(C)CN1Cc2ccccc2C[C@H]1C 8b815e9e2b2e5b2a948412be19269bc5 [0,1,0,1,0,0|0,0,2]=4 2181 B16R2.3989 C=C(Cl)CN1Cc2ccccc2CC1C 697807d1c0339c76ea12936a47685c6d [0,1,0,1,0,0|0,0,2]=4 2182 B16R2.3989 C=C(Cl)CN1Cc2ccccc2C[C@@H]1C 81a1db874d6d9f003f9feef4046f2d10 [0,1,0,1,0,0|0,0,2]=4 2183 B16R2.3989 C=C(Cl)CN1Cc2ccccc2C[C@H]1C 95501a37f71eaebed44559985163cf93 [0,1,0,1,0,0|0,0,2]=4 2184 B16R2.3989 C=C(F)CN1Cc2ccccc2CC1C c019da9293117aaac8819582d5cabd1c [0,1,0,1,0,0|0,0,2]=4 2185 B16R2.3989 C=C(F)CN1Cc2ccccc2C[C@@H]1C c5d247a993978a66372608fdbd37ad0d [0,1,0,1,0,0|0,0,2]=4 2186 B16R2.3989 C=C(F)CN1Cc2ccccc2C[C@H]1C 8582ed5b8600f7bc5206e3b25c6cfdd1 [0,1,0,1,0,0|0,0,2]=4 2187 B16R2.3989 CC(C)CN1Cc2ccccc2CC1C 43fe00183767d4cdaf8df8a712275788 [0,1,0,1,0,0|0,0,2]=4 2188 B16R2.3989 CC(C)CN1Cc2ccccc2C[C@@H]1C e910aebc3372d98bc4e2e71eab841ce3 [0,1,0,1,0,0|0,0,2]=4 2189 B16R2.3989 CC(C)CN1Cc2ccccc2C[C@H]1C 30dd96c346955d69047c594e8b610d11 [0,1,0,1,0,0|0,0,2]=4 2190 B16R2.3989 CC(O)CN1Cc2ccccc2CC1C 896226275c2e178d002a0bd096b4b8c8 [0,1,0,1,0,0|0,0,2]=4 2191 B16R2.3989 CC(O)CN1Cc2ccccc2C[C@@H]1C 46fea4e83ee4455c42ddd6aeac460a72 [0,1,0,1,0,0|0,0,2]=4 2192 B16R2.3989 CC(O)CN1Cc2ccccc2C[C@H]1C 786fe7d5030816c0c3f10a55c0063616 [0,1,0,1,0,0|0,0,2]=4 2193 B16R2.3989 CC1Cc2ccccc2CN1CC(=O)N f04c43afa927bf181407442a8f099579 [0,1,0,1,0,0|1,0,1]=4 2194 B16R2.3989 CC1Cc2ccccc2CN1CC(=O)O 4b4b955fc810263838abdf7c03bbf576 [0,1,0,1,0,0|1,0,1]=4 2195 B16R2.3989 CC1Cc2ccccc2CN1CC(F)F caadfde282d8368ae8991a9de1028fa7 [0,1,0,1,0,0|1,0,1]=4 2196 B16R2.3989 CC1Cc2ccccc2CN1CN(C)C 32f30508d2f9593b89c7d35b28e429c0 [0,1,0,1,0,0|1,0,1]=4 2197 B16R2.3989 CC1Cc2ccccc2CN1C[C@@H](C)O f53c6af56c4b3bb10dc221fb4a8e8fb6 [0,1,0,1,0,0|0,0,2]=4 2198 B16R2.3989 CC1Cc2ccccc2CN1C[C@H](C)O c31bcc61890bf4f4d7ff0a791fd4560e [0,1,0,1,0,0|0,0,2]=4 2199 B16R2.3989 CC1Cc2ccccc2CN1C[N+](=O)[O-] decdfa93ff75ea55b92d3f42343b57e6 [0,1,0,1,0,0|2,0,0]=4 2200 B16R2.3989 C[C@@H](O)CN1Cc2ccccc2C[C@@H]1C ef13c0b42a58cfac1569b09fd2a43a79 [0,1,0,1,0,0|0,0,2]=4 2201 B16R2.3989 C[C@@H]1Cc2ccccc2CN1CC(=O)N 7602cf6c6e3cd31d35e629f13c9e1009 [0,1,0,1,0,0|1,0,1]=4 2202 B16R2.3989 C[C@@H]1Cc2ccccc2CN1CC(=O)O f88e36befd83236a9efc0adc5877f24f [0,1,0,1,0,0|1,0,1]=4 2203 B16R2.3989 C[C@@H]1Cc2ccccc2CN1CC(F)F 7951e548bccd78bce997f3f1b370b764 [0,1,0,1,0,0|1,0,1]=4 2204 B16R2.3989 C[C@@H]1Cc2ccccc2CN1CN(C)C 81edf76744f1c1872a3112c204e77c55 [0,1,0,1,0,0|1,0,1]=4 2205 B16R2.3989 C[C@@H]1Cc2ccccc2CN1C[C@@H](C)O 4feb672677e545c822a132458ef1d0a1 [0,1,0,1,0,0|0,0,2]=4 2206 B16R2.3989 C[C@@H]1Cc2ccccc2CN1C[N+](=O)[O-] 730396ae84beb81617e2ce1753e303e5 [0,1,0,1,0,0|2,0,0]=4 2207 B16R2.3989 C[C@H](O)CN1Cc2ccccc2C[C@@H]1C 40a451da5af52f23a59a62799f2ee4f0 [0,1,0,1,0,0|0,0,2]=4 2208 B16R2.3989 C[C@H](O)CN1Cc2ccccc2C[C@H]1C 5b35b6798ee999e5d4acc93857ef7f9a [0,1,0,1,0,0|0,0,2]=4 2209 B16R2.3989 C[C@H]1Cc2ccccc2CN1CC(=O)N 98f21cd27ba2161b440f270e97211b9c [0,1,0,1,0,0|1,0,1]=4 2210 B16R2.3989 C[C@H]1Cc2ccccc2CN1CC(=O)O 8e41e5b55d829591ad6df6a2ddd4bb07 [0,1,0,1,0,0|1,0,1]=4 2211 B16R2.3989 C[C@H]1Cc2ccccc2CN1CC(F)F 845d2d536162254f0126a753c849a950 [0,1,0,1,0,0|1,0,1]=4 2212 B16R2.3989 C[C@H]1Cc2ccccc2CN1CN(C)C 9888041119f4287db81cc11a5b1096b6 [0,1,0,1,0,0|1,0,1]=4 2213 B16R2.3989 C[C@H]1Cc2ccccc2CN1C[N+](=O)[O-] 7bd881f42c2b91b1c4a0159ddb210955 [0,1,0,1,0,0|2,0,0]=4 2214 B16R2.11580 C=C(Br)CN(C)[C@@H]1C[C@H]1c2ccccc2 30185753106c864f0a2bd2a851dccdeb [0,1,0,1,0,0|0,0,2]=4 2215 B16R2.11580 C=C(Br)CN(C)[C@H]1C[C@@H]1c2ccccc2 572dd453b0648f155340b3f0be45b4f6 [0,1,0,1,0,0|0,0,2]=4 2216 B16R2.11580 C=C(C)CN(C)[C@@H]1C[C@H]1c2ccccc2 0d5d1b0a6d30eb8f82b4d54bdabe9651 [0,1,0,1,0,0|0,0,2]=4 2217 B16R2.11580 C=C(C)CN(C)[C@H]1C[C@@H]1c2ccccc2 a4e5ffdda80c27c60f62bc79a4e50a19 [0,1,0,1,0,0|0,0,2]=4 2218 B16R2.11580 C=C(Cl)CN(C)[C@@H]1C[C@H]1c2ccccc2 e5e19b29282e590f3d7796cc3603118e [0,1,0,1,0,0|0,0,2]=4 2219 B16R2.11580 C=C(Cl)CN(C)[C@H]1C[C@@H]1c2ccccc2 4f4e2767c13352a2ec8f8b300de3cd20 [0,1,0,1,0,0|0,0,2]=4 2220 B16R2.11580 CC(C)CN(C)[C@@H]1C[C@H]1c2ccccc2 39c2f3f83846ca4565ef786adbbd36bf [0,1,0,1,0,0|0,0,2]=4 2221 B16R2.11580 CC(C)CN(C)[C@H]1C[C@@H]1c2ccccc2 20b4ba6368b54d2c3801280bf05e1744 [0,1,0,1,0,0|0,0,2]=4 2222 B16R2.11580 CC(O)CN(C)[C@@H]1C[C@H]1c2ccccc2 a7682a5eb3f6510d04e2c44ba8785f18 [0,1,0,1,0,0|0,0,2]=4 2223 B16R2.11580 CC(O)CN(C)[C@H]1C[C@@H]1c2ccccc2 b292b290ad55312e7bcf2d1b14ae9055 [0,1,0,1,0,0|0,0,2]=4 2224 B16R2.11580 CN(C)CN(C)[C@@H]1C[C@H]1c2ccccc2 53971587711c0d375dc13b6fd9715e77 [0,1,0,1,0,0|1,0,1]=4 2225 B16R2.11580 CN(C)CN(C)[C@H]1C[C@@H]1c2ccccc2 b3e87dca6d53d4e67463dbd2d0a5dc2f [0,1,0,1,0,0|1,0,1]=4 2226 B16R2.11580 CN(CC(=O)N)[C@@H]1C[C@H]1c2ccccc2 662c5cc59aee25984cce159c7bf37253 [0,1,0,1,0,0|1,0,1]=4 2227 B16R2.11580 CN(CC(=O)N)[C@H]1C[C@@H]1c2ccccc2 9adb8af62f40b7e330b973a56502bd8b [0,1,0,1,0,0|1,0,1]=4 2228 B16R2.11580 CN(CC(=O)O)[C@@H]1C[C@H]1c2ccccc2 aa8c3fb86e2cab2b2924d8191da9d5d0 [0,1,0,1,0,0|1,0,1]=4 2229 B16R2.11580 CN(CC(=O)O)[C@H]1C[C@@H]1c2ccccc2 ed20877c0534d5b185e430a6f9acac69 [0,1,0,1,0,0|1,0,1]=4 2230 B16R2.11580 CN(CC(F)F)[C@@H]1C[C@H]1c2ccccc2 a7cc427989a25ec0647f693b51589e3f [0,1,0,1,0,0|1,0,1]=4 2231 B16R2.11580 CN(CC(F)F)[C@H]1C[C@@H]1c2ccccc2 baa0fc9d8b4369ef126d5534c2cddf4e [0,1,0,1,0,0|1,0,1]=4 2232 B16R2.11580 CN(C[N+](=O)[O-])[C@@H]1C[C@H]1c2ccccc2 8687ce7c8c45affc77ec4a72b71d6cba [0,1,0,1,0,0|2,0,0]=4 2233 B16R2.11580 CN(C[N+](=O)[O-])[C@H]1C[C@@H]1c2ccccc2 a52c19043026491c36a0a243c0f97024 [0,1,0,1,0,0|2,0,0]=4 2234 B16R2.11580 C[C@@H](O)CN(C)[C@@H]1C[C@H]1c2ccccc2 912faf1ed13d734003c55fa440f717de [0,1,0,1,0,0|0,0,2]=4 2235 B16R2.11580 C[C@@H](O)CN(C)[C@H]1C[C@@H]1c2ccccc2 ea3a753c8711156dfc840def6fa97c31 [0,1,0,1,0,0|0,0,2]=4 2236 B16R2.11580 C[C@H](O)CN(C)[C@@H]1C[C@H]1c2ccccc2 37e9cde743422190d65c2474c653acb2 [0,1,0,1,0,0|0,0,2]=4 2237 B16R2.11580 C[C@H](O)CN(C)[C@H]1C[C@@H]1c2ccccc2 2edcf3e15a63ea8d858749ec28e171d2 [0,1,0,1,0,0|0,0,2]=4 2238 B16R2.11592 CN(CC(=O)N)C1Cc2ccccc2C1 81b56d91d3cc296949508f14ead29f6f [0,1,0,1,0,0|1,0,1]=4 2239 B16R2.11592 CN(CC(F)F)C1Cc2ccccc2C1 344f9b7388cff045c88e3fe6bafbc6ed [0,1,0,1,0,0|1,0,1]=4 2240 B16R2.27733 CC(Cc1ccccc1)N2CC(C2)(C)C f47830e7a46dd234bbbc82c2a3b3c6d6 [0,1,0,1,0,0|0,0,2]=4 2241 B16R2.27733 CC(Cc1ccccc1)N2CC(C2)(C)O 1d7488904b7638e2c9957e28ee7d8b2d [0,1,0,1,0,0|0,0,2]=4 2242 B16R2.27733 CC(Cc1ccccc1)N2CC(C2)(F)F f55ce08cf8980e05046e5b9b488e497d [0,1,0,1,0,0|1,0,1]=4 2243 B16R2.88 CC(Cc1ccccc1)N2CCSCC2 a459280b199db826c16b0438df1782c8 [0,1,0,1,0,0|0,0,2]=4 2244 B16R2.1056 C#CCCN1Cc2ccccc2CC1C cbe0d1b850596480c04eaec91c88072c [0,1,0,1,0,0|0,0,0]=2 2245 B16R2.1056 C#CCCN1Cc2ccccc2C[C@@H]1C 6ed518d2da829ae233accd84b5f09a04 [0,1,0,1,0,0|0,0,0]=2 2246 B16R2.1056 C#CCCN1Cc2ccccc2C[C@H]1C 15c5c147d5d15d54f37fab1fdf7c0478 [0,1,0,1,0,0|0,0,0]=2 2247 B16R2.1056 C/C=C/CN1Cc2ccccc2CC1C 9f34ff31b4b1e9416a0a86ac6fce748c [0,1,0,1,0,0|0,0,2]=4 2248 B16R2.1056 C/C=C/CN1Cc2ccccc2C[C@@H]1C 251b614a2fda1254b176b7e854183ce1 [0,1,0,1,0,0|0,0,2]=4 2249 B16R2.1056 C/C=C/CN1Cc2ccccc2C[C@H]1C cbe74f298d56172b46ed320805ea907d [0,1,0,1,0,0|0,0,2]=4 2250 B16R2.1056 C/C=C\CN1Cc2ccccc2CC1C 08e51c01833010323182b621c1c5fc3b [0,1,0,1,0,0|0,0,2]=4 2251 B16R2.1056 C/C=C\CN1Cc2ccccc2C[C@@H]1C c666b33352cb81970da58f4de97deddc [0,1,0,1,0,0|0,0,2]=4 2252 B16R2.1056 C/C=C\CN1Cc2ccccc2C[C@H]1C 2ed118b2d015ff3b0b127ad60b96182d [0,1,0,1,0,0|0,0,2]=4 2253 B16R2.1056 C=CCCN1Cc2ccccc2CC1C 4adddf41718d4a11cf807d2478f03e98 [0,1,0,1,0,0|0,0,2]=4 2254 B16R2.1056 C=CCCN1Cc2ccccc2C[C@@H]1C 83e9620784af0ce731c50b945199ceb2 [0,1,0,1,0,0|0,0,2]=4 2255 B16R2.1056 C=CCCN1Cc2ccccc2C[C@H]1C 41447e65c14ace60fd57494b35e4a26b [0,1,0,1,0,0|0,0,2]=4 2256 B16R2.1056 CC1Cc2ccccc2CN1C/C=C/Cl 27e269cbde8f28013d5496a57588d44a [0,1,0,1,0,0|0,0,2]=4 2257 B16R2.1056 CC1Cc2ccccc2CN1C/C=C\Cl fa593b56e27c70f10bb1259382c64a49 [0,1,0,1,0,0|0,0,2]=4 2258 B16R2.1056 CC1Cc2ccccc2CN1C/C=C\O 1a0a4b2e6b8b5ffe4d980559ef6df090 [0,1,0,1,0,0|0,0,2]=4 2259 B16R2.1056 CC1Cc2ccccc2CN1CCC#N fbdda16114119832c26ff1e17363f55e [0,1,0,1,0,0|0,0,1]=3 2260 B16R2.1056 CC1Cc2ccccc2CN1CCC=O b0a612654cc772992d8a40019e4274a7 [0,1,0,1,0,0|0,0,2]=4 2261 B16R2.1056 CC1Cc2ccccc2CN1CCCF 3bd66430d3373177d7c45d033ace7806 [0,1,0,1,0,0|0,0,2]=4 2262 B16R2.1056 CC1Cc2ccccc2CN1CCCO 3058bbeaebc8abc778a53f9b329d9c9a [0,1,0,1,0,0|0,0,2]=4 2263 B16R2.1056 CC1Cc2ccccc2CN1CCCS 6febb3f5a4302588554d7650f045ace6 [0,1,0,1,0,0|0,0,2]=4 2264 B16R2.1056 CC1Cc2ccccc2CN1CSC#N 832adc30096d64b01c97451b639f3152 [0,1,0,1,0,0|1,0,0]=3 2265 B16R2.1056 CCCCN1Cc2ccccc2CC1C 6ac6af147df57987a8311fefb2c40fd1 [0,1,0,1,0,0|0,0,2]=4 2266 B16R2.1056 CCCCN1Cc2ccccc2C[C@@H]1C a6f9ebb665696f852a17eda5ee59c79a [0,1,0,1,0,0|0,0,2]=4 2267 B16R2.1056 CCCCN1Cc2ccccc2C[C@H]1C 4695ff68202e9071d79d866229b2a6b5 [0,1,0,1,0,0|0,0,2]=4 2268 B16R2.1056 CCOCN1Cc2ccccc2CC1C 19b66d66eb82aecbab8bd2858706e2e5 [0,1,0,1,0,0|0,0,2]=4 2269 B16R2.1056 CCOCN1Cc2ccccc2C[C@@H]1C d136c329d60d5fa56cfb6d182e9dcbfd [0,1,0,1,0,0|0,0,2]=4 2270 B16R2.1056 CCOCN1Cc2ccccc2C[C@H]1C 69e5fcf233329c6233e7795207a95690 [0,1,0,1,0,0|0,0,2]=4 2271 B16R2.1056 COCCN1Cc2ccccc2CC1C f4bfe8c9f57424501e7c6520871ac0d7 [0,1,0,1,0,0|0,0,2]=4 2272 B16R2.1056 COCCN1Cc2ccccc2C[C@@H]1C dd8f9a7a63e60c419104c9b0a26f3fc3 [0,1,0,1,0,0|0,0,2]=4 2273 B16R2.1056 COCCN1Cc2ccccc2C[C@H]1C 643787aab2112093859bd37e6f3eda74 [0,1,0,1,0,0|0,0,2]=4 2274 B16R2.1056 CSCCN1Cc2ccccc2CC1C 7dab70ad02c0059d0baa00ee1398ef7b [0,1,0,1,0,0|0,0,2]=4 2275 B16R2.1056 CSCCN1Cc2ccccc2C[C@@H]1C 49761845b6f5342bb8a077c0c3a814f6 [0,1,0,1,0,0|0,0,2]=4 2276 B16R2.1056 CSCCN1Cc2ccccc2C[C@H]1C e22fa54ba97a852bd44ef4233abd1a8f [0,1,0,1,0,0|0,0,2]=4 2277 B16R2.1056 C[C@@H]1Cc2ccccc2CN1C/C=C/Cl c3d5d2df642a8954bc23bedf40c93047 [0,1,0,1,0,0|0,0,2]=4 2278 B16R2.1056 C[C@@H]1Cc2ccccc2CN1C/C=C\Cl 485174c0020da3f7a36a7fd45b604bba [0,1,0,1,0,0|0,0,2]=4 2279 B16R2.1056 C[C@@H]1Cc2ccccc2CN1C/C=C\O 8cc365d82b20d62a260e2f47c5d0978d [0,1,0,1,0,0|0,0,2]=4 2280 B16R2.1056 C[C@@H]1Cc2ccccc2CN1CCC#N 5e179dbf45f333f0b9c73c2be5fe28a3 [0,1,0,1,0,0|0,0,1]=3 2281 B16R2.1056 C[C@@H]1Cc2ccccc2CN1CCC=O 20d808ca7e30dcb4517f04a9da7bf11b [0,1,0,1,0,0|0,0,2]=4 2282 B16R2.1056 C[C@@H]1Cc2ccccc2CN1CCCF e492cce6b34e6f9ca820d02732b0b53c [0,1,0,1,0,0|0,0,2]=4 2283 B16R2.1056 C[C@@H]1Cc2ccccc2CN1CCCO d05a12061bd6e39de8a1c5776f7fdebf [0,1,0,1,0,0|0,0,2]=4 2284 B16R2.1056 C[C@@H]1Cc2ccccc2CN1CCCS dc12b687a8499084e327807013a0a816 [0,1,0,1,0,0|0,0,2]=4 2285 B16R2.1056 C[C@@H]1Cc2ccccc2CN1CSC#N 182f33b247b97a7708f8dd939002eb3f [0,1,0,1,0,0|1,0,0]=3 2286 B16R2.1056 C[C@H]1Cc2ccccc2CN1C/C=C/Cl 14d7ea1859578b0f541285c9c0d98b90 [0,1,0,1,0,0|0,0,2]=4 2287 B16R2.1056 C[C@H]1Cc2ccccc2CN1C/C=C\Cl 853d66ec297448d79de7b1e7fb8cd7dc [0,1,0,1,0,0|0,0,2]=4 2288 B16R2.1056 C[C@H]1Cc2ccccc2CN1C/C=C\O 24a58e5ea4b17bbdd4048b2e3f5a787a [0,1,0,1,0,0|0,0,2]=4 2289 B16R2.1056 C[C@H]1Cc2ccccc2CN1CCC#N 6eb11c3c66c2c8c64137baa5c9becdf4 [0,1,0,1,0,0|0,0,1]=3 2290 B16R2.1056 C[C@H]1Cc2ccccc2CN1CCC=O b6bff2fb6a53216b3e8df456d1fdc9c8 [0,1,0,1,0,0|0,0,2]=4 2291 B16R2.1056 C[C@H]1Cc2ccccc2CN1CCCF 9706d166a5e6396980af852e776b1a6f [0,1,0,1,0,0|0,0,2]=4 2292 B16R2.1056 C[C@H]1Cc2ccccc2CN1CCCO 7fec912a80e39fffb3407b34ed003f96 [0,1,0,1,0,0|0,0,2]=4 2293 B16R2.1056 C[C@H]1Cc2ccccc2CN1CCCS ed8b473e7f0858522e0a604bb81ca1d3 [0,1,0,1,0,0|0,0,2]=4 2294 B16R2.1056 C[C@H]1Cc2ccccc2CN1CSC#N fd5c926b0fc5228c3a74528aea40da67 [0,1,0,1,0,0|1,0,0]=3 2295 B16R2.1895 CCC1CN(C1)C(C)Cc2ccccc2 7acb9ff070414f4f2eb94f593cbe08eb [0,1,0,1,0,0|0,0,2]=4 2296 B16R2.1895 COC1CN(C1)C(C)Cc2ccccc2 6bba23327bf9a944d9553573d224606b [0,1,0,1,0,0|0,0,2]=4 2297 B16R2.1895 CSC1CN(C1)C(C)Cc2ccccc2 84361b342a9970430d95fe4477e6ec32 [0,1,0,1,0,0|0,0,2]=4 2298 B16R2.2114 C#CCCN(C)[C@@H]1C[C@H]1c2ccccc2 0de8f4d930f64d2c7cf32f089384c1f0 [0,1,0,1,0,0|0,0,0]=2 2299 B16R2.2114 C#CCCN(C)[C@H]1C[C@@H]1c2ccccc2 a5c590b664886db55a6cb7827cef3960 [0,1,0,1,0,0|0,0,0]=2 2300 B16R2.2114 C/C=C/CN(C)[C@@H]1C[C@H]1c2ccccc2 e543ea7441abcfafc6ac1a574950e01f [0,1,0,1,0,0|0,0,2]=4 2301 B16R2.2114 C/C=C/CN(C)[C@H]1C[C@@H]1c2ccccc2 72400277a3d1d0c6a56a5ee6705a786f [0,1,0,1,0,0|0,0,2]=4 2302 B16R2.2114 C/C=C\CN(C)[C@@H]1C[C@H]1c2ccccc2 d54b86a49b8fd88ac3736ac4f3b00447 [0,1,0,1,0,0|0,0,2]=4 2303 B16R2.2114 C/C=C\CN(C)[C@H]1C[C@@H]1c2ccccc2 4d09c182bdd3e68b9e77277c82657690 [0,1,0,1,0,0|0,0,2]=4 2304 B16R2.2114 C=CCCN(C)[C@@H]1C[C@H]1c2ccccc2 4a08e1729eae75640dca19ed7263d713 [0,1,0,1,0,0|0,0,2]=4 2305 B16R2.2114 C=CCCN(C)[C@H]1C[C@@H]1c2ccccc2 ec638336b71736501072e7111f28dd72 [0,1,0,1,0,0|0,0,2]=4 2306 B16R2.2114 CCCCN(C)[C@@H]1C[C@H]1c2ccccc2 99a510d882684e708bffc2037ba655e8 [0,1,0,1,0,0|0,0,2]=4 2307 B16R2.2114 CCCCN(C)[C@H]1C[C@@H]1c2ccccc2 975f039271626deb5f944af7c2ee9259 [0,1,0,1,0,0|0,0,2]=4 2308 B16R2.2114 CN(C/C=C/Cl)[C@@H]1C[C@H]1c2ccccc2 1690d1ec0eb8cf338f275e83afb8150b [0,1,0,1,0,0|0,0,2]=4 2309 B16R2.2114 CN(C/C=C/Cl)[C@H]1C[C@@H]1c2ccccc2 8d06190eb425c88ca36410955b275883 [0,1,0,1,0,0|0,0,2]=4 2310 B16R2.2114 CN(C/C=C\Cl)[C@@H]1C[C@H]1c2ccccc2 92c109baa30900b69c817890600386d4 [0,1,0,1,0,0|0,0,2]=4 2311 B16R2.2114 CN(C/C=C\Cl)[C@H]1C[C@@H]1c2ccccc2 97b7fce2de1d721eef8eecf3720495c1 [0,1,0,1,0,0|0,0,2]=4 2312 B16R2.2114 CN(C/C=C\O)[C@@H]1C[C@H]1c2ccccc2 3632dbb82dd25cc5a7acf17de87c8f21 [0,1,0,1,0,0|0,0,2]=4 2313 B16R2.2114 CN(C/C=C\O)[C@H]1C[C@@H]1c2ccccc2 6c7c51cc1b7d03e78406e5b2c6a96135 [0,1,0,1,0,0|0,0,2]=4 2314 B16R2.2114 CN(CCC#N)[C@@H]1C[C@H]1c2ccccc2 937fc0a6e7435e16fa3305e7dd8d7d67 [0,1,0,1,0,0|0,0,1]=3 2315 B16R2.2114 CN(CCC#N)[C@H]1C[C@@H]1c2ccccc2 e1eab2ce8c8f119fb08bcbc07dc52d85 [0,1,0,1,0,0|0,0,1]=3 2316 B16R2.2114 CN(CCC=O)[C@@H]1C[C@H]1c2ccccc2 bbe23895e3cfd2d424ab1a59fe5880d2 [0,1,0,1,0,0|0,0,2]=4 2317 B16R2.2114 CN(CCC=O)[C@H]1C[C@@H]1c2ccccc2 2acdae1af283a13b7058c8f2219cc9a4 [0,1,0,1,0,0|0,0,2]=4 2318 B16R2.2114 CN(CCCF)[C@@H]1C[C@H]1c2ccccc2 bb64d8dcedde72ddd76117727f5c34e2 [0,1,0,1,0,0|0,0,2]=4 2319 B16R2.2114 CN(CCCF)[C@H]1C[C@@H]1c2ccccc2 c4634c0b1e88b1e528a908ef0ec58b07 [0,1,0,1,0,0|0,0,2]=4 2320 B16R2.2114 CN(CCCO)[C@@H]1C[C@H]1c2ccccc2 f99630c11ce8f664252e6e96984062ff [0,1,0,1,0,0|0,0,2]=4 2321 B16R2.2114 CN(CCCO)[C@H]1C[C@@H]1c2ccccc2 f05da37ffd110c0c6452c769b9edaa4e [0,1,0,1,0,0|0,0,2]=4 2322 B16R2.2114 CN(CCCS)[C@@H]1C[C@H]1c2ccccc2 60de9df5ed094dee831b37b368b630dc [0,1,0,1,0,0|0,0,2]=4 2323 B16R2.2114 CN(CCCS)[C@H]1C[C@@H]1c2ccccc2 1c08f94f98de9dda94cc7d64e0ab9a3b [0,1,0,1,0,0|0,0,2]=4 2324 B16R2.2114 COCCN(C)[C@@H]1C[C@H]1c2ccccc2 9ef1be7817675f13b4168ded400e0da3 [0,1,0,1,0,0|0,0,2]=4 2325 B16R2.2114 COCCN(C)[C@H]1C[C@@H]1c2ccccc2 e9c1ca0113f581df3083913a52e31215 [0,1,0,1,0,0|0,0,2]=4 2326 B16R2.2114 CSCCN(C)[C@@H]1C[C@H]1c2ccccc2 9257523deca9f5c1e694314d25f0e139 [0,1,0,1,0,0|0,0,2]=4 2327 B16R2.2114 CSCCN(C)[C@H]1C[C@@H]1c2ccccc2 113cd1a007629de224ff09aa5ef9f604 [0,1,0,1,0,0|0,0,2]=4 2328 B16R2.2128 C=CCCN(C)C1Cc2ccccc2C1 874a1889823e06e789802c4a59901ffb [0,1,0,1,0,0|0,0,2]=4 2329 B16R2.757 C#CCN(C)C1Cc2ccccc2C1O 9e8ec0bc2f950f1f2da5d86427f1c7dc [0,1,0,1,0,0|0,0,0]=2 2330 B16R2.757 C#CCN(C)C1Cc2cccnc2C1=O 3da482ad19e4033f85092a16d1d1d4fc [0,1,0,1,0,0|1,0,1]=4 2331 B16R2.757 C#CCN(C)[C@@H]1Cc2ccccc2[C@@H]1O 8290282058b79523e62f5fa85a7c6cba [0,1,0,1,0,0|0,0,0]=2 2332 B16R2.757 C#CCN(C)[C@H]1Cc2ccccc2[C@@H]1O bd2b8c799f2e718793f603796c23d812 [0,1,0,1,0,0|0,0,0]=2 2333 B16R2.757 C#CCN(C)c1nc2ccccc2n1C bd6cb1d84980ec794cd3b845c7cb556a [0,1,0,1,0,0|1,0,1]=4 2334 B16R2.757 C=CCN(C)C1Cc2ccccc2C1O de08f4c7f9b7cc82f2d2604b82076c26 [0,1,0,1,0,0|0,0,2]=4 2335 B16R2.757 C=CCN(C)[C@@H]1Cc2ccccc2[C@@H]1O 406dc8a39f32ec748b8849a94b6d9868 [0,1,0,1,0,0|0,0,2]=4 2336 B16R2.757 C=CCN(C)[C@H]1Cc2ccccc2[C@@H]1O 15f4e757170f892d19f2c35c4f87023c [0,1,0,1,0,0|0,0,2]=4 2337 B16R2.757 CCCN(C)C1Cc2ccccc2C1O 668ed8938aebc9f94c4259979571b4ff [0,1,0,1,0,0|0,0,2]=4 2338 B16R2.757 CCCN(C)[C@@H]1Cc2ccccc2[C@@H]1O 16f465fad69c570911cafbd07d5cbac9 [0,1,0,1,0,0|0,0,2]=4 2339 B16R2.757 CCCN(C)[C@H]1Cc2ccccc2[C@@H]1O fcd12ae5b619846d11bfa831a4d861e0 [0,1,0,1,0,0|0,0,2]=4 2340 B16R2.757 CN(CC#N)C1Cc2ccccc2C1O d2dbcf2caf344909f2b786ab18a0dcb0 [0,1,0,1,0,0|1,0,0]=3 2341 B16R2.757 CN(CC#N)[C@@H]1Cc2ccccc2[C@@H]1O 0481a510cfe833bf88c9f448a30206a5 [0,1,0,1,0,0|1,0,0]=3 2342 B16R2.757 CN(CC#N)[C@H]1Cc2ccccc2[C@@H]1O 02911c25310ae6c14bbb8412b0d13d4b [0,1,0,1,0,0|1,0,0]=3 2343 B16R2.757 CN(CC=O)[C@H]1Cc2ccccc2[C@@H]1O d0b99f57403d323014ab3f36fb585e63 [0,1,0,1,0,0|1,0,1]=4 2344 B16R2.757 CN(CCF)C1Cc2ccccc2C1O a575933d5673c2979fc20d4e8f530ec1 [0,1,0,1,0,0|1,0,1]=4 2345 B16R2.757 CN(CCF)[C@@H]1Cc2ccccc2[C@@H]1O 2ae850199d4a0bcf4534904f973e2fa1 [0,1,0,1,0,0|1,0,1]=4 2346 B16R2.757 CN(CCF)[C@H]1Cc2ccccc2[C@@H]1O b5baa74a7a181621f02ce2e30da491a6 [0,1,0,1,0,0|1,0,1]=4 2347 B16R2.757 CN(CCO)[C@H]1Cc2ccccc2[C@@H]1O f4f901684b137444bc2a12c6a0dfa517 [0,1,0,1,0,0|1,0,1]=4 2348 B16R2.757 CN(CCS)[C@H]1Cc2ccccc2[C@@H]1O a62b3baf2ca5503aa5578a0b84b15ece [0,1,0,1,0,0|1,0,1]=4 2349 B16R2.757 COCN(C)[C@H]1Cc2ccccc2[C@@H]1O 664e83f6de22ee2d6290373565d286b8 [0,1,0,1,0,0|1,0,1]=4 2350 B16R2.757 CSCN(C)[C@H]1Cc2ccccc2[C@@H]1O c16211b0414f371deafa1b548bda3cb2 [0,1,0,1,0,0|1,0,1]=4 2351 B16R2.59 C#CCN1CCCC1Cc2ccccc2 e3a7d82305879b39088ea1605e5e8f14 [0,1,0,1,0,0|0,0,0]=2 2352 B16R2.59 C#CCN1CCCC1Cc2cccnc2 5353ffcbcf38a2e586d16c2558c672e5 [0,1,0,1,0,0|1,0,0]=3 2353 B16R2.59 C#CCN1CCC[C@@H]1Cc2ccccc2 35147547b0b07f1069de9b584b39217d [0,1,0,1,0,0|0,0,0]=2 2354 B16R2.59 C=CCN1CCCC1Cc2ccccc2 7cadbaf1c5c6392678d43895b22003da [0,1,0,1,0,0|0,0,2]=4 2355 B16R2.59 C=CCN1CCC[C@@H]1Cc2ccccc2 8a158b27d2db3a5178bbaf7c34098ac4 [0,1,0,1,0,0|0,0,2]=4 2356 B16R2.59 CCCN1CCCC1Cc2ccccc2 7a66f2912703cc749832d1a8ea566044 [0,1,0,1,0,0|0,0,2]=4 2357 B16R2.59 CCCN1CCC[C@@H]1Cc2ccccc2 b130e1994c673e771f5c1c85a9baf224 [0,1,0,1,0,0|0,0,2]=4 2358 B16R2.59 COCN1CCCC1Cc2ccccc2 0c1fbf2eae38e723cdb263ab578abb36 [0,1,0,1,0,0|1,0,1]=4 2359 B16R2.59 COCN1CCC[C@@H]1Cc2ccccc2 4558e16ecec3d337e73e83c3debc3a68 [0,1,0,1,0,0|1,0,1]=4 2360 B16R2.59 CSCN1CCCC1Cc2ccccc2 586c4361117145f2ac515b3dfcec85bd [0,1,0,1,0,0|1,0,1]=4 2361 B16R2.59 CSCN1CCC[C@@H]1Cc2ccccc2 000eb2f097726310bbee7694ab3645d7 [0,1,0,1,0,0|1,0,1]=4 2362 B16R2.59 FCCN1CCCC1Cc2ccccc2 ab4395048011bca451069fde97f7e8f1 [0,1,0,1,0,0|1,0,1]=4 2363 B16R2.59 FCCN1CCC[C@@H]1Cc2ccccc2 3a2499ad2f08e069eca4abd6ab136b9f [0,1,0,1,0,0|1,0,1]=4 2364 B16R2.59 N#CCN1CCCC1Cc2ccccc2 8827172cb71b91a691f3e592cb25b64f [0,1,0,1,0,0|1,0,0]=3 2365 B16R2.59 N#CCN1CCCC1Cc2cccnc2 2239725306ce4e47103c8789ddabd544 [0,1,0,1,0,0|2,0,0]=4 2366 B16R2.59 N#CCN1CCC[C@@H]1Cc2ccccc2 746d3e6f6a31cadc523de23f8c454e26 [0,1,0,1,0,0|1,0,0]=3 2367 B16R2.59 O=CCN1CCCC1Cc2ccccc2 df6eb1576370bab3e95ce660a2b3d65e [0,1,0,1,0,0|1,0,1]=4 2368 B16R2.59 O=CCN1CCC[C@@H]1Cc2ccccc2 5fc55bd2a602fbcbc4c156f8285f5ea8 [0,1,0,1,0,0|1,0,1]=4 2369 B16R2.59 OCCN1CCCC1Cc2ccccc2 484003f8a500f27143b0185b2acd1f05 [0,1,0,1,0,0|1,0,1]=4 2370 B16R2.59 OCCN1CCC[C@@H]1Cc2ccccc2 7e01401f4e3f8181a65d7deaaba494c7 [0,1,0,1,0,0|1,0,1]=4 2371 B16R2.59 SCCN1CCCC1Cc2ccccc2 e067f62eb54c29e22df2fb57c62ce07e [0,1,0,1,0,0|1,0,1]=4 2372 B16R2.59 SCCN1CCC[C@@H]1Cc2ccccc2 770f0be0388ae40e244bb0bbd4ff11e9 [0,1,0,1,0,0|1,0,1]=4 2373 B16R2.64 C#CCN1Cc2ccccc2CC1CO ab56542348e0f85ffdbf67af686e686b [0,1,0,1,0,0|0,0,0]=2 2374 B16R2.64 C#CCN1Cc2ccccc2C[C@@H]1CO 2c36652b30395fc17961b248db1e56aa [0,1,0,1,0,0|0,0,0]=2 2375 B16R2.64 C#CCN1Cc2ccccc2C[C@H]1CO f272fa8b17a82e9ab32a7fbad408fb2d [0,1,0,1,0,0|0,0,0]=2 2376 B16R2.64 C=CCN1Cc2ccccc2CC1CO f37cbb57b15ab2f072ba736b9249e932 [0,1,0,1,0,0|0,0,2]=4 2377 B16R2.64 C=CCN1Cc2ccccc2C[C@@H]1CO 790255c998e2dc79304cd99224f64fbb [0,1,0,1,0,0|0,0,2]=4 2378 B16R2.64 C=CCN1Cc2ccccc2C[C@H]1CO 6b384ddb4ee7fff6b98ba7b4c311c0dd [0,1,0,1,0,0|0,0,2]=4 2379 B16R2.64 CCCN1Cc2ccccc2CC1CO ba3d6b5e3d2e1ae000497e4b5aa33c1a [0,1,0,1,0,0|0,0,2]=4 2380 B16R2.64 CCCN1Cc2ccccc2C[C@@H]1CO f1b7c63a9f2fcc4d3ef019381bb65ddc [0,1,0,1,0,0|0,0,2]=4 2381 B16R2.64 CCCN1Cc2ccccc2C[C@H]1CO c5669614e4ebefa91d3d7bf45ac15e7b [0,1,0,1,0,0|0,0,2]=4 2382 B16R2.64 COCN1Cc2ccccc2CC1CO 0c2ebf5d3aa9dd627f7e70e4aabf7517 [0,1,0,1,0,0|1,0,1]=4 2383 B16R2.64 COCN1Cc2ccccc2C[C@@H]1CO 0b6ccbe9a2d18bb8fe18305aa3ced0fa [0,1,0,1,0,0|1,0,1]=4 2384 B16R2.64 COCN1Cc2ccccc2C[C@H]1CO 361d3127dc01cabae8de83de817142f5 [0,1,0,1,0,0|1,0,1]=4 2385 B16R2.64 CSCN1Cc2ccccc2CC1CO 13a25bdfbcaed0e9b7454416f04b570a [0,1,0,1,0,0|1,0,1]=4 2386 B16R2.64 CSCN1Cc2ccccc2C[C@@H]1CO b465bae69d9a17acafbf07f6ae263918 [0,1,0,1,0,0|1,0,1]=4 2387 B16R2.64 CSCN1Cc2ccccc2C[C@H]1CO e01e94688eeeb5f19061cebba0621462 [0,1,0,1,0,0|1,0,1]=4 2388 B16R2.64 N#CCN1Cc2ccccc2CC1CO aa208048bca0deac1ed42a96ef7eb4db [0,1,0,1,0,0|1,0,0]=3 2389 B16R2.64 N#CCN1Cc2ccccc2C[C@@H]1CO fcca08d2b1c57f1522f2335c6755968f [0,1,0,1,0,0|1,0,0]=3 2390 B16R2.64 N#CCN1Cc2ccccc2C[C@H]1CO 6502d0e7fb078f684820080795bfc7fd [0,1,0,1,0,0|1,0,0]=3 2391 B16R2.64 O=CCN1Cc2ccccc2CC1CO 0a3bfeeebca93369f7bfe4733e2d3d18 [0,1,0,1,0,0|1,0,1]=4 2392 B16R2.64 O=CCN1Cc2ccccc2C[C@@H]1CO 399f37e279913c95a3d5f2d94a7b9d5b [0,1,0,1,0,0|1,0,1]=4 2393 B16R2.64 O=CCN1Cc2ccccc2C[C@H]1CO a0158bdf5dbe912191c6abb7a22a99c5 [0,1,0,1,0,0|1,0,1]=4 2394 B16R2.64 OCC1Cc2ccccc2CN1CCF dd89bd2a16985c2eb647f88164702a16 [0,1,0,1,0,0|1,0,1]=4 2395 B16R2.64 OCC1Cc2ccccc2CN1CCS 485095eea0f623aedb696f694cd66caa [0,1,0,1,0,0|1,0,1]=4 2396 B16R2.64 OCCN1Cc2ccccc2CC1CO a771e84996a366335a2b4af9d3c6d2f8 [0,1,0,1,0,0|1,0,1]=4 2397 B16R2.64 OCCN1Cc2ccccc2C[C@@H]1CO 614a0b4f60fa102729c25d5ff1c8db28 [0,1,0,1,0,0|1,0,1]=4 2398 B16R2.64 OCCN1Cc2ccccc2C[C@H]1CO 650fb254f9c8e1a092c59ca5c7495319 [0,1,0,1,0,0|1,0,1]=4 2399 B16R2.64 OC[C@@H]1Cc2ccccc2CN1CCF 3138539a1be5fabf28caccee2dcc090e [0,1,0,1,0,0|1,0,1]=4 2400 B16R2.64 OC[C@@H]1Cc2ccccc2CN1CCS 682a400f1dfb8c4dfb33be60925c5a91 [0,1,0,1,0,0|1,0,1]=4 2401 B16R2.64 OC[C@H]1Cc2ccccc2CN1CCF e510f663d323a22a1aaa0dc5ee169554 [0,1,0,1,0,0|1,0,1]=4 2402 B16R2.64 OC[C@H]1Cc2ccccc2CN1CCS 90cee57e81410e265a12dc5ce1f264ec [0,1,0,1,0,0|1,0,1]=4 2403 B16R2.101 OC[C@H](Cc1ccccc1)N2CCSC2 594919d72aed09a4e25af6c61e97f183 [0,1,0,1,0,0|1,0,1]=4 2404 B16R2.678 OC[C@H](Cc1ccccc1)N2CC(C2)F 7fda95a3e2f0076d38ce428351e23fa7 [0,1,0,1,0,0|1,0,1]=4 2405 B16R2.678 OC[C@H](Cc1ccccc1)N2CC(C2)O 10944d9c53b0ae45f24ba3f283326fe3 [0,1,0,1,0,0|1,0,1]=4 2406 B16R2.2175 C#CC(=O)N(C)[C@@H]1C[C@H]1c2ccccc2 4234092e047d9b4945d4e480680b3eef [0,1,0,1,0,0|0,0,1]=3 2407 B16R2.2175 C#CC(=O)N(C)[C@H]1C[C@@H]1c2ccccc2 8eb65032aa6223c14d03cb6ef8cf6d61 [0,1,0,1,0,0|0,0,1]=3 2408 B16R2.2175 C=CC(C)N(C)[C@@H]1C[C@H]1c2ccccc2 85a31cdcd6476ae9c3623dc3c12fe4f1 [0,1,0,1,0,0|0,0,2]=4 2409 B16R2.2175 C=CC(C)N(C)[C@H]1C[C@@H]1c2ccccc2 07c22f3ebca7fc7a867f0e2738378195 [0,1,0,1,0,0|0,0,2]=4 2410 B16R2.2175 CC(C=O)N(C)[C@@H]1C[C@H]1c2ccccc2 d9b5e4ac59cc89e87d55b3df7d420917 [0,1,0,1,0,0|1,0,1]=4 2411 B16R2.2175 CC(C=O)N(C)[C@H]1C[C@@H]1c2ccccc2 35ce128331cfb3da16a89551f4b6ddbf [0,1,0,1,0,0|1,0,1]=4 2412 B16R2.2175 CCC(C)N(C)[C@@H]1C[C@H]1c2ccccc2 2d3c1c20461e2105ff394ad5ecb6ef32 [0,1,0,1,0,0|0,0,2]=4 2413 B16R2.2175 CCC(C)N(C)[C@H]1C[C@@H]1c2ccccc2 0361f49e4e8559d7f5752ae560b5ea8f [0,1,0,1,0,0|0,0,2]=4 2414 B16R2.2175 C[C@H](C=O)N(C)[C@@H]1C[C@H]1c2ccccc2 b8af91f190060ee3a2cb38fddff09358 [0,1,0,1,0,0|1,0,1]=4 2415 B16R2.2175 C[C@H](C=O)N(C)[C@H]1C[C@@H]1c2ccccc2 8dbafcbe1d6269d82fd310c4b24de29a [0,1,0,1,0,0|1,0,1]=4 2416 B16R2.33941 C#CC(=O)N1Cc2ccccc2CC1C b634e0d2dffe0e9b8f19b6bb8341d429 [0,1,0,1,0,0|0,0,1]=3 2417 B16R2.33941 C#CC(=O)N1Cc2ccccc2C[C@@H]1C 99b257968deed41397b678c71dfc6bcb [0,1,0,1,0,0|0,0,1]=3 2418 B16R2.33941 C#CC(=O)N1Cc2ccccc2C[C@H]1C fea36359cb653e1111a38d45179f6c7f [0,1,0,1,0,0|0,0,1]=3 2419 B16R2.33941 C=CC(C)N1Cc2ccccc2CC1C d88ccee4c50ded684519f53edea0a6d7 [0,1,0,1,0,0|0,0,2]=4 2420 B16R2.33941 C=CC(C)N1Cc2ccccc2C[C@@H]1C 5ab3d0ca45383cba820403a0ee1142d6 [0,1,0,1,0,0|0,0,2]=4 2421 B16R2.33941 C=CC(C)N1Cc2ccccc2C[C@H]1C 134d4172bd3a5540dc7eabd7e7040b95 [0,1,0,1,0,0|0,0,2]=4 2422 B16R2.33941 CC(C=O)N1Cc2ccccc2CC1C 4fba182f8e0c7f04259e4ba6b6f4a8bf [0,1,0,1,0,0|1,0,1]=4 2423 B16R2.33941 CC(C=O)N1Cc2ccccc2C[C@@H]1C e75c248f5a305fde5336f49efe3fe791 [0,1,0,1,0,0|1,0,1]=4 2424 B16R2.33941 CC(C=O)N1Cc2ccccc2C[C@H]1C 7b96412a903368ddec008d88ae3dbae7 [0,1,0,1,0,0|1,0,1]=4 2425 B16R2.33941 CC(CO)N1Cc2ccccc2CC1C 0856892b9cac9257eb8b3bbbe2ee1b7f [0,1,0,1,0,0|1,0,1]=4 2426 B16R2.33941 CC(CO)N1Cc2ccccc2C[C@@H]1C b620c9c940b6588376e8d01e807a4d76 [0,1,0,1,0,0|1,0,1]=4 2427 B16R2.33941 CC(CO)N1Cc2ccccc2C[C@H]1C 22465294ac6231ed61cb2b363cdbd060 [0,1,0,1,0,0|1,0,1]=4 2428 B16R2.33941 CC1Cc2ccccc2CN1[C@@H](C)CO 2433c0f62367def9a8952e96bc6af90f [0,1,0,1,0,0|1,0,1]=4 2429 B16R2.33941 CC1Cc2ccccc2CN1[C@H](C)C=O 4f3dcab2eeedf07bc01339b12482d1e7 [0,1,0,1,0,0|1,0,1]=4 2430 B16R2.33941 CC1Cc2ccccc2CN1[C@H](C)CO 50461206cf7235e752996dd797c64929 [0,1,0,1,0,0|1,0,1]=4 2431 B16R2.33941 CCC(C)N1Cc2ccccc2CC1C 5de467aed82d527162c6af88f45b4e5d [0,1,0,1,0,0|0,0,2]=4 2432 B16R2.33941 CCC(C)N1Cc2ccccc2C[C@@H]1C 0d94c03d0117da2a1a59811f5b0a5484 [0,1,0,1,0,0|0,0,2]=4 2433 B16R2.33941 CCC(C)N1Cc2ccccc2C[C@H]1C 72facb0c4d7d81db14330dd82f47d58f [0,1,0,1,0,0|0,0,2]=4 2434 B16R2.33941 C[C@@H](CO)N1Cc2ccccc2C[C@@H]1C 711f76c988f1f12b324e340aede0e5b2 [0,1,0,1,0,0|1,0,1]=4 2435 B16R2.33941 C[C@@H]1Cc2ccccc2CN1[C@@H](C)CO 38e82652e2cb820015ad59a287510796 [0,1,0,1,0,0|1,0,1]=4 2436 B16R2.33941 C[C@H](C=O)N1Cc2ccccc2C[C@@H]1C 725b328780cf7160d88e56f4e9b1ba17 [0,1,0,1,0,0|1,0,1]=4 2437 B16R2.33941 C[C@H](C=O)N1Cc2ccccc2C[C@H]1C da405f7a088e42a3f97326060dfbed82 [0,1,0,1,0,0|1,0,1]=4 2438 B16R2.33941 C[C@H](CO)N1Cc2ccccc2C[C@@H]1C 029bb5de277bf5139d9af91f219d23a6 [0,1,0,1,0,0|1,0,1]=4 2439 B16R2.33941 C[C@H](CO)N1Cc2ccccc2C[C@H]1C ffc88710c0ec212000df8c9a9808a9d1 [0,1,0,1,0,0|1,0,1]=4 2440 B16R2.172 CCN1CCCCC1Cc2ccccc2 d00636a9f63b42e3082c7fc57c47135b [0,1,0,1,0,0|0,0,2]=4 2441 B16R2.172 CCN1CCCC[C@@H]1Cc2ccccc2 8716cdf6b32dca74c72cbdd7e869122c [0,1,0,1,0,0|0,0,2]=4 2442 B16R2.172 CCN1CCCC[C@H]1Cc2ccccc2 03cf54dbfc1bd102f33a80bef9b60663 [0,1,0,1,0,0|0,0,2]=4 2443 B16R2.172 CCN1CCOCC1Cc2ccccc2 f2c41cae139ba4a1f2d948b368da758c [0,1,0,1,0,0|1,0,1]=4 2444 B16R2.172 CCN1CCOC[C@@H]1Cc2ccccc2 1af2c914f6f66a598afb451c0e391e9a [0,1,0,1,0,0|1,0,1]=4 2445 B16R2.172 CCN1CCOC[C@H]1Cc2ccccc2 ba3dc841ede9bf8ecf67b6d30aa0da83 [0,1,0,1,0,0|1,0,1]=4 2446 B16R2.172 FCN1CCCCC1Cc2ccccc2 2a191de162c85228a5c52ed082519a0c [0,1,0,1,0,0|0,0,2]=4 2447 B16R2.172 FCN1CCCC[C@@H]1Cc2ccccc2 ded736361c484b42a54d138682514c44 [0,1,0,1,0,0|0,0,2]=4 2448 B16R2.172 FCN1CCCC[C@H]1Cc2ccccc2 00889c594c8302b11e0cb0e63d0665a6 [0,1,0,1,0,0|0,0,2]=4 2449 B16R2.172 FCN1CCOCC1Cc2ccccc2 49b3aabe5dfeac4acf776038b5438928 [0,1,0,1,0,0|1,0,1]=4 2450 B16R2.172 FCN1CCOC[C@@H]1Cc2ccccc2 c218199b3c9731febd345b0301db4c6b [0,1,0,1,0,0|1,0,1]=4 2451 B16R2.172 FCN1CCOC[C@H]1Cc2ccccc2 f973ba8816da1d5bce55cb40bf953c5d [0,1,0,1,0,0|1,0,1]=4 2452 B16R2.172 OCN1CCCCC1Cc2ccccc2 cfa79c3e6940c989456daccff993f7cc [0,1,0,1,0,0|0,0,2]=4 2453 B16R2.172 OCN1CCCC[C@@H]1Cc2ccccc2 e94a4b72ffa73380e24a7c5b28110b2b [0,1,0,1,0,0|0,0,2]=4 2454 B16R2.172 OCN1CCCC[C@H]1Cc2ccccc2 095c82bba0aeddb670a3bda3d036cf00 [0,1,0,1,0,0|0,0,2]=4 2455 B16R2.172 OCN1CCOCC1Cc2ccccc2 4e386a54482bb23386ac4a3b2d260031 [0,1,0,1,0,0|1,0,1]=4 2456 B16R2.172 OCN1CCOC[C@@H]1Cc2ccccc2 d72e6ccdd29028ce6447f67f3cf194fc [0,1,0,1,0,0|1,0,1]=4 2457 B16R2.172 OCN1CCOC[C@H]1Cc2ccccc2 1c882736bff601094fd5df8e97c28eb5 [0,1,0,1,0,0|1,0,1]=4 2458 B16R3.5925 C1=CCN(C1)C2Cc3ccccc3C2 0d7629a3a755cdd52c734824314fb0ac [0,0,0,2,0,0|0,0,2]=4 2459 B16R3.5925 c1ccc2c(c1)CC(C2)N3CCSC3 31f3ad5996717bc789c6291edbfd0bee [0,0,0,2,0,0|1,0,1]=4 2460 B16R3.32875 OC1CN(C1)C2Cc3ccccc3C2 90da3afcf61d9a1149f8c3f7071ae90b [0,0,0,2,0,0|1,0,1]=4 2461 B12R1.51 C#CCN(C)CCc1c[nH]cn1 ecc90598396e85791f5d352807a47498 [1,0,0,0,1,0|2,0,0]=4 2462 B12R1.51 C#CCN(C)CCc1cccs1 43d6bd4bafef9d760953529db1a2252a [1,0,0,0,1,0|1,0,0]=3 2463 B12R1.51 C#CCN(C)CCc1ccsc1 7113754375045476145f283c6cd11493 [1,0,0,0,1,0|1,0,0]=3 2464 B12R1.51 C#CCN(C)CCc1cn[nH]c1 1daa8ad1b60181a3626c7cb42c963af6 [1,0,0,0,1,0|2,0,0]=4 2465 B12R1.51 C#CCN(C)CCc1cscn1 0ea178bd9da07de61db5b4cb5709ec04 [1,0,0,0,1,0|2,0,0]=4 2466 B12R1.51 C#CCN(C)CCn1cccc1 85ec94b676c60be22929e0ef66ead00c [1,0,0,0,1,0|1,0,0]=3 2467 B12R1.51 C#CCN(C)CCn1cccn1 dd66ebff2f99fa1678d020bb4a6c761d [1,0,0,0,1,0|2,0,0]=4 2468 B12R1.51 C#CCN(C)CCn1ccnc1 ab27f3c7c05d2bde41a92880445820f9 [1,0,0,0,1,0|2,0,0]=4 2469 B12R1.51 CN(CC#N)CCc1cccs1 3f575bcf02aa0500a6f7271f457a0029 [1,0,0,0,1,0|2,0,0]=4 2470 B12R1.51 CN(CC#N)CCc1ccsc1 c663f9cf092a348e0d164ba4d1f54c7a [1,0,0,0,1,0|2,0,0]=4 2471 B12R1.51 CN(CC#N)CCn1cccc1 c2a08356711a03a19292d051f9639f16 [1,0,0,0,1,0|2,0,0]=4 2472 B12R1.30 C#CCCN(C)c1ccccc1 26c0497305b10abd73ca8cb441cc00c7 [1,0,0,0,1,0|2,0,0]=4 2473 B12R1.30 C#CCNC(=O)c1ccccc1 5992adae17a1dd7824373a9ef813d750 [1,0,0,0,1,0|1,0,1]=4 2474 B12R1.30 C#CCNC(C)c1ccccc1 8ed5828c2e258c30367c2a46a0344f1e [1,0,0,0,1,0|0,0,0]=2 2475 B12R1.30 C#CCNC(C)c1ccccn1 4298989a128b5a6841bac7e23a0354aa [1,0,0,0,1,0|1,0,0]=3 2476 B12R1.30 C#CCNC(C)c1cccnc1 6ebe0dd03d736579935a567552ceea44 [1,0,0,0,1,0|1,0,0]=3 2477 B12R1.30 C#CCNC(C)c1cccnn1 92e9a2121fb6cf555aba6aa9217cd68e [1,0,0,0,1,0|2,0,0]=4 2478 B12R1.30 C#CCNC(C)c1ccncc1 104668a9ea4f40854c97edbd8d393f60 [1,0,0,0,1,0|1,0,0]=3 2479 B12R1.30 C#CCNC(C)c1ccncn1 2975bce08ab393a00b1630042fe83911 [1,0,0,0,1,0|2,0,0]=4 2480 B12R1.30 C#CCNC(C)c1ccnnc1 0c302e880366f840bb7c91f8e8cda738 [1,0,0,0,1,0|2,0,0]=4 2481 B12R1.30 C#CCNC(C)c1cnccn1 8b3c2fefdc05d27a6919dc4c0b683c4a [1,0,0,0,1,0|2,0,0]=4 2482 B12R1.30 C#CCNC(C)c1cncnc1 605f4b23febe350decac85b69c4a07a0 [1,0,0,0,1,0|2,0,0]=4 2483 B12R1.30 C#CCNC(C)c1ncccn1 ccd3e92ceda259fca4a58d2294d3e358 [1,0,0,0,1,0|2,0,0]=4 2484 B12R1.30 C#CCN[C@@H](C)c1ccccc1 c2e57a43b39094fb9cc8c5d89eda2aec [1,0,0,0,1,0|0,0,0]=2 2485 B12R1.30 C#CCN[C@@H](C)c1ccccn1 341a7b97c54032ef6cc5876956ea059f [1,0,0,0,1,0|1,0,0]=3 2486 B12R1.30 C#CCN[C@@H](C)c1cccnc1 8f573fe768361e3d7c0a88b9dea1ffc9 [1,0,0,0,1,0|1,0,0]=3 2487 B12R1.30 C#CCN[C@@H](C)c1ccncc1 c319a4179f5e36f7701e5fb020357b77 [1,0,0,0,1,0|1,0,0]=3 2488 B12R1.30 C#CCN[C@@H](C)c1cncnc1 85673db1de9135078766108b3bb08469 [1,0,0,0,1,0|2,0,0]=4 2489 B12R1.30 C#CCN[C@H](C)c1ccccc1 0027d86dcd1350148f8559798567d252 [1,0,0,0,1,0|0,0,0]=2 2490 B12R1.30 C#CCN[C@H](C)c1ccccn1 6dc8aa600cebb97d8f32894292c6e305 [1,0,0,0,1,0|1,0,0]=3 2491 B12R1.30 C#CCN[C@H](C)c1cccnc1 2610035a3d9c472ce43c3e6cfb235316 [1,0,0,0,1,0|1,0,0]=3 2492 B12R1.30 C#CCN[C@H](C)c1ccncc1 4828225d1ab8b3f66ed7eeeced04658f [1,0,0,0,1,0|1,0,0]=3 2493 B12R1.30 C#CCN[C@H](C)c1cncnc1 02f6b66887ab5096f162a6908ad75fca [1,0,0,0,1,0|2,0,0]=4 2494 B12R1.30 C#CCOC(C)c1ccccc1 29a457d91187748bd9fba937b2dce22a [1,0,0,0,1,0|1,0,0]=3 2495 B12R1.30 C#CCOC(C)c1ccccn1 8def24808c4348444663c62ba62bb945 [1,0,0,0,1,0|2,0,0]=4 2496 B12R1.30 C#CCOC(C)c1cccnc1 1031bae6a744c2674fe153a0be096d49 [1,0,0,0,1,0|2,0,0]=4 2497 B12R1.30 C#CCOC(C)c1ccncc1 45ce7fe3b8085f843f87873e2662af3c [1,0,0,0,1,0|2,0,0]=4 2498 B12R1.30 C#CCO[C@@H](C)c1ccccc1 a17750258d0bbb03a82d71c12a4ef66f [1,0,0,0,1,0|1,0,0]=3 2499 B12R1.30 C#CCO[C@@H](C)c1ccccn1 a1f8da7c5d8064f757b9140efba40b08 [1,0,0,0,1,0|2,0,0]=4 2500 B12R1.30 C#CCO[C@@H](C)c1cccnc1 e275418fc7e164614e3ca31d756e8f27 [1,0,0,0,1,0|2,0,0]=4 2501 B12R1.30 C#CCO[C@@H](C)c1ccncc1 70d71652731d1313ac31291597a39a5f [1,0,0,0,1,0|2,0,0]=4 2502 B12R1.30 C#CCO[C@H](C)c1ccccc1 daa23676a75f018b9eb1a615337c3d8a [1,0,0,0,1,0|1,0,0]=3 2503 B12R1.30 C#CCO[C@H](C)c1ccccn1 daa38fa58a128af6d343fb26f391c887 [1,0,0,0,1,0|2,0,0]=4 2504 B12R1.30 C#CCO[C@H](C)c1cccnc1 ea646f6373002ec3a2c6d33539b6863c [1,0,0,0,1,0|2,0,0]=4 2505 B12R1.30 C#CCO[C@H](C)c1ccncc1 134b9b2d7c0f92c79fb88072ac09db40 [1,0,0,0,1,0|2,0,0]=4 2506 B12R1.30 C=CCNC(C)c1ccccc1 fa2a8c61f42c61d4674c5e223d49122c [1,0,0,0,1,0|0,0,2]=4 2507 B12R1.30 C=CCN[C@@H](C)c1ccccc1 600f83b5cdc08e60e339b69a1a0c1bbe [1,0,0,0,1,0|0,0,2]=4 2508 B12R1.30 C=CCN[C@H](C)c1ccccc1 d607bf8a84d857931725e26673643b18 [1,0,0,0,1,0|0,0,2]=4 2509 B12R1.30 CC(NCC#N)c1ccccc1 85ca8869c6ae0debccfd66d74dfbe1ee [1,0,0,0,1,0|1,0,0]=3 2510 B12R1.30 CC(NCC#N)c1ccccn1 a9ec91ed37d65c2c6da5622288d0690e [1,0,0,0,1,0|2,0,0]=4 2511 B12R1.30 CC(NCC#N)c1cccnc1 0278633e99d6f7c425c410780262bfe6 [1,0,0,0,1,0|2,0,0]=4 2512 B12R1.30 CC(NCC#N)c1ccncc1 7d4240ca51090bf562a18cef3eb5e5d2 [1,0,0,0,1,0|2,0,0]=4 2513 B12R1.30 CC(NCC=O)c1ccccc1 d9b90894b15660347d656ab520d55286 [1,0,0,0,1,0|1,0,1]=4 2514 B12R1.30 CC(NCCF)c1ccccc1 a4890edd7f21677f225a27bfc036a9e4 [1,0,0,0,1,0|1,0,1]=4 2515 B12R1.30 CC(NCCO)c1ccccc1 15ebe2893003a0c55ecacb3da2e2c5b8 [1,0,0,0,1,0|1,0,1]=4 2516 B12R1.30 CC(NCCS)c1ccccc1 c90c5f78811b5a3e744fa24aabe1d478 [1,0,0,0,1,0|1,0,1]=4 2517 B12R1.30 CC(OCC#N)c1ccccc1 1ec1dc9da1f2b2c8e841a4b7ee7f537f [1,0,0,0,1,0|2,0,0]=4 2518 B12R1.30 CCCNC(C)c1ccccc1 37d48536a03c5d64ae70e596dd73ed85 [1,0,0,0,1,0|0,0,2]=4 2519 B12R1.30 CCCN[C@@H](C)c1ccccc1 604408ade040f4a9c55069b166a57921 [1,0,0,0,1,0|0,0,2]=4 2520 B12R1.30 CCCN[C@H](C)c1ccccc1 b93dc36e1ac43b4dfb18fc821dba383a [1,0,0,0,1,0|0,0,2]=4 2521 B12R1.30 COCNC(C)c1ccccc1 da3a97833b329d52bf380d21525de137 [1,0,0,0,1,0|1,0,1]=4 2522 B12R1.30 COCN[C@@H](C)c1ccccc1 b0afc671726e2aa3bbf25811f588d87b [1,0,0,0,1,0|1,0,1]=4 2523 B12R1.30 COCN[C@H](C)c1ccccc1 9e08f5d5391d04ef9dca8846d7c418b1 [1,0,0,0,1,0|1,0,1]=4 2524 B12R1.30 CSCNC(C)c1ccccc1 6f92386efe5ddba474bf8f6e5b5463ff [1,0,0,0,1,0|1,0,1]=4 2525 B12R1.30 CSCN[C@@H](C)c1ccccc1 845e66030d932d6618c275454e4a088a [1,0,0,0,1,0|1,0,1]=4 2526 B12R1.30 CSCN[C@H](C)c1ccccc1 30f91454a02398d41f15145ae4807b21 [1,0,0,0,1,0|1,0,1]=4 2527 B12R1.30 C[C@@H](NCC#N)c1ccccc1 79a0e920b4d897eb15d12e8b6b71cbe9 [1,0,0,0,1,0|1,0,0]=3 2528 B12R1.30 C[C@@H](NCC#N)c1ccccn1 31e3a4f8ecfc4a47f723a987c48020d8 [1,0,0,0,1,0|2,0,0]=4 2529 B12R1.30 C[C@@H](NCC#N)c1cccnc1 b0aa1f85c57c967de6e4fdb728385c10 [1,0,0,0,1,0|2,0,0]=4 2530 B12R1.30 C[C@@H](NCC#N)c1ccncc1 02535e0fa22f1c5ec78721c5f33befa0 [1,0,0,0,1,0|2,0,0]=4 2531 B12R1.30 C[C@@H](NCC=O)c1ccccc1 de3c0d8a847d9265ee59861806469e38 [1,0,0,0,1,0|1,0,1]=4 2532 B12R1.30 C[C@@H](NCCF)c1ccccc1 6855a77d5eca1f1b4bab257a19ad71b3 [1,0,0,0,1,0|1,0,1]=4 2533 B12R1.30 C[C@@H](NCCO)c1ccccc1 4d75c0848045c856d6629664b5c37bb2 [1,0,0,0,1,0|1,0,1]=4 2534 B12R1.30 C[C@@H](NCCS)c1ccccc1 f68ec1897d41d2f78889d11e1a576659 [1,0,0,0,1,0|1,0,1]=4 2535 B12R1.30 C[C@@H](OCC#N)c1ccccc1 b7bf8cbcee7c14c575bc4d4a84868d53 [1,0,0,0,1,0|2,0,0]=4 2536 B12R1.30 C[C@H](NCC#N)c1ccccc1 04ab453e311f4e57bddb16b9d73b093d [1,0,0,0,1,0|1,0,0]=3 2537 B12R1.30 C[C@H](NCC#N)c1ccccn1 bc5da37c07a0a8a477c4b315b4b99aed [1,0,0,0,1,0|2,0,0]=4 2538 B12R1.30 C[C@H](NCC#N)c1cccnc1 e7f17e5e9f316ee1aa635650165778ec [1,0,0,0,1,0|2,0,0]=4 2539 B12R1.30 C[C@H](NCC#N)c1ccncc1 c3325c6d18c04b7047f0f8ccb8e404bd [1,0,0,0,1,0|2,0,0]=4 2540 B12R1.30 C[C@H](NCC=O)c1ccccc1 a3dc214a4fba86b355b0ede6b011be4e [1,0,0,0,1,0|1,0,1]=4 2541 B12R1.30 C[C@H](NCCF)c1ccccc1 da1d01952688d248cad72e73d81548b6 [1,0,0,0,1,0|1,0,1]=4 2542 B12R1.30 C[C@H](NCCO)c1ccccc1 1afbfcd53073af538ea2805bff509aa6 [1,0,0,0,1,0|1,0,1]=4 2543 B12R1.30 C[C@H](NCCS)c1ccccc1 8f0e850ed93fd86c5c98f711b3615cfc [1,0,0,0,1,0|1,0,1]=4 2544 B12R1.30 C[C@H](OCC#N)c1ccccc1 dec9f32ff56faa2d18e3e3c1709f800a [1,0,0,0,1,0|2,0,0]=4 2545 B12R1.53 C#CCNC(C)Cc1c[nH]cn1 2514906d995c3282706a053ded5c6075 [1,0,0,0,1,0|2,0,0]=4 2546 B12R1.53 C#CCNC(C)Cc1ccc[nH]1 ce5b2f795979c6671799ef3dbd34acbb [1,0,0,0,1,0|1,0,0]=3 2547 B12R1.53 C#CCNC(C)Cc1ccco1 433b638c337faae618fdeac3897cbd0b [1,0,0,0,1,0|1,0,0]=3 2548 B12R1.53 C#CCNC(C)Cc1ccsc1 ea77e9ca7b86300de7ce4b0c01bb16db [1,0,0,0,1,0|1,0,0]=3 2549 B12R1.53 C#CCNC(C)Cn1cccn1 41a94b7724ed1572722b935959689158 [1,0,0,0,1,0|2,0,0]=4 2550 B12R1.53 C#CCN[C@@H](C)Cc1c[nH]cn1 10b662b13fc0d7863ef00c1ac7772197 [1,0,0,0,1,0|2,0,0]=4 2551 B12R1.53 C#CCN[C@H](C)Cc1c[nH]cn1 68ef1abc5c15741f33240a23081e2a26 [1,0,0,0,1,0|2,0,0]=4 2552 B12R1.53 C#CCOC(C)Cc1ccco1 7b6d60eaee6444885a812dac217ae2cb [1,0,0,0,1,0|2,0,0]=4 2553 B12R1.53 C#CCOC(C)Cc1ccsc1 13a775db6116d5b2c1f878f02b7158ae [1,0,0,0,1,0|2,0,0]=4 2554 B12R1.53 CC(Cc1ccc[nH]1)NCC#N 5b86a25570440af5d7c90a2ea26e84f8 [1,0,0,0,1,0|2,0,0]=4 2555 B12R1.53 CC(Cc1ccco1)NCC#N 871c7f151cadc917c74e0fad65752804 [1,0,0,0,1,0|2,0,0]=4 2556 B12R1.53 CC(Cc1ccsc1)NCC#N 2455d2e6ab6523c4be3123362f63386f [1,0,0,0,1,0|2,0,0]=4 2557 B12R1.34 CC(c1ccccc1)N(C)C=O e079bef7522e1ef5cc00bc8636c131a1 [1,0,0,0,1,0|1,0,1]=4 2558 B12R1.34 CC(c1ccccn1)N(C)CF 650bcbad752d4ed2c6e5b45bdc1475da [1,0,0,0,1,0|2,0,0]=4 2559 B12R1.34 CC(c1ccccn1)N(C)CO 3d9a740e19e6f0528378c7eda90c604c [1,0,0,0,1,0|2,0,0]=4 2560 B12R1.34 CC(c1ccncc1)N(C)CO a7770587018126a41da4df23d67a9cf4 [1,0,0,0,1,0|2,0,0]=4 2561 B12R1.34 CCN(C)C(C)c1ccccn1 e1b322344e042da4d3c870ba415567e2 [1,0,0,0,1,0|1,0,1]=4 2562 B12R1.34 CCN(C)C(C)c1ccncc1 02ec4b5351d7312edffcfac49b9e4dc2 [1,0,0,0,1,0|1,0,1]=4 2563 B12R1.34 CCN(C)[C@@H](C)c1ccncc1 e6ade88ac5a50ca1ec24028b19c8dcc7 [1,0,0,0,1,0|1,0,1]=4 2564 B12R1.34 C[C@@H](c1ccccc1)N(C)C=O 43f258a4426e518211b56116828aebcd [1,0,0,0,1,0|1,0,1]=4 2565 B12R1.34 C[C@@H](c1ccncc1)N(C)CO 94c5c36d3ab85028872e70aa157414f1 [1,0,0,0,1,0|2,0,0]=4 2566 B12R1.34 C[C@H](c1ccccc1)N(C)C=O aead6dfaf118bd90be7abe9a0f430aad [1,0,0,0,1,0|1,0,1]=4 2567 B12R1.55 C#CCN(C)C(C)c1cccs1 d9c23e190b0163dc9be8dbb80517f1d9 [0,0,0,0,2,0|1,0,0]=3 2568 B12R1.55 C#CCN(C)C(C)c1ccon1 592499985c7f5dd56c7ec5bbd0922c78 [0,0,0,0,2,0|2,0,0]=4 2569 B12R1.55 C#CCN(C)C(C)c1cscn1 73a7a7af12a18a3b66bf44fe8f601ff5 [0,0,0,0,2,0|2,0,0]=4 2570 B12R1.55 C#CCN(C)C(C)c1nccs1 a42f7ad96f9af1c5e32df7fbe6c4a3a2 [0,0,0,0,2,0|2,0,0]=4 2571 B12R1.55 CC(c1cccs1)N(C)CC#N e03263a874a3118ba8d50dcaf670a25f [0,0,0,0,2,0|2,0,0]=4 2572 B14R1.520 C#CCC(=O)NCCc1ccccc1 8b73323257f3ed0a984968f5a39676b1 [1,0,0,0,0,1|2,0,0]=4 2573 B14R1.520 C#CCC(C)OCCc1ccccc1 69c7a81abbaebf7973dd56206d0d80db [1,0,0,0,0,1|1,0,0]=3 2574 B14R1.520 C#CCC(C)OCCc1ccccn1 c53cb6a721217d1371a191123f5013c5 [1,0,0,0,0,1|2,0,0]=4 2575 B14R1.520 C#CCC(C)OCCc1cccnc1 5d4f30b80aed2fccfe07cc193131bd60 [1,0,0,0,0,1|2,0,0]=4 2576 B14R1.520 C#CCC(C)OCCc1ccncc1 9bd6a948040eefd145fd3f7bcfa5c73f [1,0,0,0,0,1|2,0,0]=4 2577 B14R1.520 C#CCN(C)C/C=C/c1ccccc1 303f73751a3c2693a27cc97dc6d813d5 [1,0,0,0,0,1|0,0,1]=3 2578 B14R1.520 C#CCN(C)CCCc1ccccc1 ea83ef3c73b86f4ca8287a9f1aea2f52 [1,0,0,0,0,1|0,0,0]=2 2579 B14R1.520 C#CCN(C)CCCc1ccccn1 d58f164da844857606b9662c0538c471 [1,0,0,0,0,1|1,0,0]=3 2580 B14R1.520 C#CCN(C)CCCc1cccnc1 0baec125ce6092979ab1b59983d701ea [1,0,0,0,0,1|1,0,0]=3 2581 B14R1.520 C#CCN(C)CCCc1ccncc1 795e666c8ccb3c0c6924c379eaf3cca1 [1,0,0,0,0,1|1,0,0]=3 2582 B14R1.520 C#CCN(C)CCOc1ccccc1 f70a05355bf551b53201cfeb1ec18e4f [1,0,0,0,0,1|0,0,0]=2 2583 B14R1.520 C#CCN(C)CCSc1ccccc1 68edc6b9f02b152b8e09093014676c0d [1,0,0,0,0,1|0,0,0]=2 2584 B14R1.520 C#CCN(C)CCSc1ccccn1 9cd45fc900b8b0f675ccbe7f6e1e7d9b [1,0,0,0,0,1|1,0,0]=3 2585 B14R1.520 C#CCN(C)COCc1ccccc1 a46ce86675f7ab3a35007e2ee44b3ad2 [1,0,0,0,0,1|0,0,0]=2 2586 B14R1.520 C=CCN(C)CCCc1ccccc1 9ac1bd654c73d516370c46fc01d2b99e [1,0,0,0,0,1|0,0,2]=4 2587 B14R1.520 C=CCN(C)CCOc1ccccc1 93bbabbfb12a4e9bd119f07cbc1d6e98 [1,0,0,0,0,1|0,0,2]=4 2588 B14R1.520 C=CCN(C)CCSc1ccccc1 2c56f1b588838db0b2a5365e31e24012 [1,0,0,0,0,1|0,0,2]=4 2589 B14R1.520 C=CCN(C)COCc1ccccc1 501fa00ac7d926bfbea0dc6819968dde [1,0,0,0,0,1|0,0,2]=4 2590 B14R1.520 C=CCN(C)CSCc1ccccc1 057c63df38a5e8bc461596da76cf121c [1,0,0,0,0,1|0,0,2]=4 2591 B14R1.520 CC(CC#N)NCCc1ccccc1 2f19812035ce62396f4b9ec0006c0550 [1,0,0,0,0,1|2,0,0]=4 2592 B14R1.520 CC(CC#N)OCCc1ccccc1 223ecfd4ea9e8a071f82fa336d5be29a [1,0,0,0,0,1|2,0,0]=4 2593 B14R1.520 CCCN(C)CCCc1ccccc1 767c7ad7e64a03c2cdf396255b07d4ad [1,0,0,0,0,1|0,0,2]=4 2594 B14R1.520 CCCN(C)CCOc1ccccc1 2085378d5f8edb3638aede6a1cf7c568 [1,0,0,0,0,1|0,0,2]=4 2595 B14R1.520 CCCN(C)CCSc1ccccc1 dab610692d766269271b808aa6ac95e3 [1,0,0,0,0,1|0,0,2]=4 2596 B14R1.520 CN(CC#N)C/C=C/c1ccccc1 b53e980fab3470e2d10307e7d274e1de [1,0,0,0,0,1|1,0,1]=4 2597 B14R1.520 CN(CC#N)CC=Cc1ccccc1 ac501fcfec0b14cc3c07cd95810a89a9 [1,0,0,0,0,1|1,0,1]=4 2598 B14R1.520 CN(CC#N)CCCc1ccccc1 acb0407dbe8d6186f7137e249845909b [1,0,0,0,0,1|1,0,0]=3 2599 B14R1.520 CN(CC#N)CCCc1ccccn1 5326e053e795bf5528124d57995a1b9b [1,0,0,0,0,1|2,0,0]=4 2600 B14R1.520 CN(CC#N)CCCc1cccnc1 21f5d9572cafc627cef755bbd618f9ca [1,0,0,0,0,1|2,0,0]=4 2601 B14R1.520 CN(CC#N)CCCc1ccncc1 0d93b31ea82e800abecc2a72b587f448 [1,0,0,0,0,1|2,0,0]=4 2602 B14R1.520 CN(CC#N)CCOc1ccccc1 f6f13f9966de97f23c794e6d27b8e8c0 [1,0,0,0,0,1|1,0,0]=3 2603 B14R1.520 CN(CC#N)CCSc1ccccc1 21b53f02726db9ee78a7d5ac3fa42daa [1,0,0,0,0,1|1,0,0]=3 2604 B14R1.520 CN(CC#N)CCSc1ccccn1 8a028346e13cb44a82157ecff8c42af7 [1,0,0,0,0,1|2,0,0]=4 2605 B14R1.520 CN(CC#N)COCc1ccccc1 84d842138089426f15c437206ba22bef [1,0,0,0,0,1|1,0,0]=3 2606 B14R1.520 CN(CC#N)CSCc1ccccc1 e9d2972aed07ebb117f0b9d78ab0f220 [1,0,0,0,0,1|1,0,0]=3 2607 B14R1.520 CN(CC=O)CCOc1ccccc1 ea16ee40a7a8611c878a218e0f23b653 [1,0,0,0,0,1|1,0,1]=4 2608 B14R1.520 CN(CCF)CCCc1ccccc1 eb2a2d52ee6e6cf8c860524cc6bb259f [1,0,0,0,0,1|1,0,1]=4 2609 B14R1.520 CN(CCF)CCOc1ccccc1 1699e42f00d3652f37c82b08fb4c1d5e [1,0,0,0,0,1|1,0,1]=4 2610 B14R1.520 CN(CCF)CCSc1ccccc1 a2be5f61e9b743903a3d681249538b0e [1,0,0,0,0,1|1,0,1]=4 2611 B14R1.520 CN(CCF)COCc1ccccc1 bcf5da0b051e0ec103db7e6bae58ffba [1,0,0,0,0,1|1,0,1]=4 2612 B14R1.520 CN(CCO)CCCc1ccccc1 d89aa5fd829b76f3194c191fdaf8fea8 [1,0,0,0,0,1|1,0,1]=4 2613 B14R1.520 CN(CCO)CCNc1ccccc1 ea9b0693fcaf42ceb3b460b9c051bf50 [1,0,0,0,0,1|1,0,1]=4 2614 B14R1.520 CN(CCO)CCOc1ccccc1 a913001e191f3112ca567b4c07311168 [1,0,0,0,0,1|1,0,1]=4 2615 B14R1.520 CN(CCO)CCSc1ccccc1 41d76be290528ce7f03b567902798a56 [1,0,0,0,0,1|1,0,1]=4 2616 B14R1.520 CN(CCS)CCOc1ccccc1 fc26daebeaac778599d272da451c4a54 [1,0,0,0,0,1|1,0,1]=4 2617 B14R1.520 COCN(C)CCOc1ccccc1 e86c17739d50f05cf4d5a21fe7139eef [1,0,0,0,0,1|1,0,1]=4 2618 B14R1.520 CSCN(C)CCOc1ccccc1 d02c7130e1b9d222b7ac9da1e6dccef6 [1,0,0,0,0,1|1,0,1]=4 2619 B14R1.520 C[C@@H](CC#N)OCCc1ccccc1 4924043c0beef45a53c8e78252cc5857 [1,0,0,0,0,1|2,0,0]=4 2620 B14R1.520 C[C@H](CC#N)OCCc1ccccc1 90aff714fbc4c1be33e942c44f16c98b [1,0,0,0,0,1|2,0,0]=4 2621 B16R1.934 C#CCN(C)CCN(C)Cc1ccccc1 9326e36db02893f362b8297594e6d053 [0,0,0,0,0,2|1,0,0]=3 2622 B16R1.934 CN(CC#N)CCN(C)Cc1ccccc1 bb0ae959778b8ea7c46ad9b1ae949457 [0,0,0,0,0,2|2,0,0]=4 2623 B16R1.1570 C#CCC(=O)NC(C)CCc1ccccc1 eb96e774f8afe61c0f5cc0239180fc14 [0,0,0,0,0,2|2,0,0]=4 2624 B16R1.1570 C#CCC(=O)NC(C)COc1ccccc1 0d248507d267a27d93c4dbb49a5316cf [0,0,0,0,0,2|2,0,0]=4 2625 B16R1.1570 C#CCC(=O)N[C@@H](C)CCc1ccccc1 e6e03dda5b480361c9225a68c4468f59 [0,0,0,0,0,2|2,0,0]=4 2626 B16R1.1570 C#CCC(=O)N[C@H](C)CCc1ccccc1 9baac17b3d2b8780e008078096d5ec36 [0,0,0,0,0,2|2,0,0]=4 2627 B16R1.1570 C#CCN(C)CC(=O)CCc1ccccc1 c04c0b70846b3d8c30d9ea19c8388e1c [0,0,0,0,0,2|1,0,1]=4 2628 B16R1.1570 C#CCN(C)CC(=O)NCc1ccccc1 a38457c52fb1972bb6a0543e97842133 [0,0,0,0,0,2|1,0,1]=4 2629 B16R1.1570 C#CCN(C)CC(=O)OCc1ccccc1 daa2930f37c304d1770c4a820a151676 [0,0,0,0,0,2|1,0,1]=4 2630 B16R1.1570 C#CCN(C)CC(O)COc1ccccc1 f9a505188ef4e38f216e08d904c58369 [0,0,0,0,0,2|1,0,0]=3 2631 B16R1.1570 CC(CC#N)NC(C)CCc1ccccc1 cf215e69743cc8d21076a973778494cc [0,0,0,0,0,2|2,0,0]=4 2632 B16R1.1570 CC(CC#N)NC(C)COc1ccccc1 476944116cc88b78fb133c1eb738e8d7 [0,0,0,0,0,2|2,0,0]=4 2633 B16R1.1570 CC(CC#N)N[C@@H](C)CCc1ccccc1 d751c1a39f019827d10e91639de46d09 [0,0,0,0,0,2|2,0,0]=4 2634 B16R1.1570 CC(CC#N)N[C@H](C)CCc1ccccc1 d2b68b58d97eec8a76747e693a580ee4 [0,0,0,0,0,2|2,0,0]=4 2635 B16R1.1570 CC(CC#N)OC(C)CCc1ccccc1 f717f07f5d63a9933d8283a41a0133a4 [0,0,0,0,0,2|2,0,0]=4 2636 B16R1.1570 CC(CC#N)O[C@@H](C)CCc1ccccc1 350e2c4bdaf8f8d2afbcb4f96c4c6919 [0,0,0,0,0,2|2,0,0]=4 2637 B16R1.1570 CC(CC#N)O[C@H](C)CCc1ccccc1 e0b4223b361f3d1326400f8e1b3dd818 [0,0,0,0,0,2|2,0,0]=4 2638 B16R1.1570 CN(CC#N)CC(O)COc1ccccc1 f43fd1ad505da27d03758a22cb03254f [0,0,0,0,0,2|2,0,0]=4 2639 B16R1.14049 C#CCN(C)C(=O)/C=C/Cc1ccccc1 724ac807a672d8cf18c169b2adb54a2d [0,0,0,0,0,2|1,0,1]=4 2640 B16R1.14049 C#CCN(C)C(=O)C/C=C/c1ccccc1 a8b26328c8c3d4c92c4a80b0ffe8a8ba [0,0,0,0,0,2|1,0,1]=4 2641 B16R1.14049 C#CCN(C)C(=O)CC=Cc1ccccc1 c963a93edafc411818461bee833985fa [0,0,0,0,0,2|1,0,1]=4 2642 B16R1.14049 C#CCN(C)C(=O)CCCc1ccccc1 e8ac6cb77bf39034d3fcb3770dcc6960 [0,0,0,0,0,2|1,0,1]=4 2643 B16R1.14049 C#CCN(C)C(=O)CCOc1ccccc1 504afbacaca32dfc04a46281835bf2b6 [0,0,0,0,0,2|1,0,1]=4 2644 B16R1.14049 C#CCN(C)C(=O)CCSc1ccccc1 370b9b9f7ba5ec844d3fa052b0252ef6 [0,0,0,0,0,2|1,0,1]=4 2645 B16R1.14049 C#CCN(C)C(=O)COCc1ccccc1 38d7ee659bbfa5dc4dac31f834355d28 [0,0,0,0,0,2|1,0,1]=4 2646 B16R1.14049 C#CCN(C)C(=O)CSCc1ccccc1 2dc714b2415ff8e49e4117f5b7b22ac8 [0,0,0,0,0,2|1,0,1]=4 2647 B16R1.14049 C#CCN(C)C(=O)NCCc1ccccc1 552b3a3ae497973284a1cce3a9cff84e [0,0,0,0,0,2|1,0,1]=4 2648 B16R1.14049 C#CCN(C)C(=S)NCCc1ccccc1 3931af916c96f1f941f527e883f23f58 [0,0,0,0,0,2|1,0,1]=4 2649 B16R1.14049 C=CCN(C)C(C)COCc1ccccc1 cefbcb335b76a618415537cc7b1f406b [0,0,0,0,0,2|0,0,2]=4 2650 B16R1.14049 C=CCN(C)[C@H](C)COCc1ccccc1 7a741cd8ea5125b313dae9f2aeb5f55b [0,0,0,0,0,2|0,0,2]=4