0 B23R2.245519601 CN(C/C=C/C#CC(C)(C)C)Cc1cccc2c1cccc2 593356c44ae103d67f3b66fb39a3aaf7 [0,0,0,0,0,0|0,0,0]=0 1 B23R2.245519601 CN(C/C=C/C#CC(C)(C)C)Cc1cccc2c1cccn2 0f2586fd02c92cc606cfc48d555ceedb [0,0,0,0,0,0|1,0,0]=1 2 B23R2.245519601 CN(C/C=C/C#CC(C)(C)C)Cc1cccc2c1ccnc2 18cf16553e46e0642fd5a07f5c7a3db8 [0,0,0,0,0,0|1,0,0]=1 3 B23R2.245519601 CN(C/C=C/C#CC(C)(C)C)Cc1cccc2c1nccc2 73177e5a4b218a8ae1fcee5e4ed330b4 [0,0,0,0,0,0|1,0,0]=1 4 B23R2.245519601 CN(C/C=C/C#CC(C)(C)C)Cc1ccnc2c1cccc2 56301a040515df68ac8aa3074f1c2ef9 [0,0,0,0,0,0|1,0,0]=1 5 B23R2.245519601 CN(CC=CC#CC(C)(C)C)Cc1cccc2c1cccc2 444c8911dd921c4789a8e4f1d9095885 [0,0,0,0,0,0|0,0,0]=0 6 B23R2.245519601 CN(CC=CC#CC(C)(C)C)Cc1cccc2c1cccn2 7a574dbd3c8b70e9f0de258840190704 [0,0,0,0,0,0|1,0,0]=1 7 B23R2.245519601 CN(CC=CC#CC(C)(C)C)Cc1cccc2c1ccnc2 24be04a6d6181f79e8dab7d336005915 [0,0,0,0,0,0|1,0,0]=1 8 B23R2.245519601 CN(CC=CC#CC(C)(C)C)Cc1cccc2c1nccc2 c2de47014ec5cbdd7a594985def7a6ae [0,0,0,0,0,0|1,0,0]=1 9 B23R2.245519601 CN(CC=CC#CC(C)(C)C)Cc1ccnc2c1cccc2 8343a909a0364653de791f628c3966d3 [0,0,0,0,0,0|1,0,0]=1 10 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1cccc2c1cccc2 2d5f573a15890bef71f7dc4160e84f98 [1,0,0,0,0,0|0,0,0]=1 11 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1cccc2c1cccn2 bbd02e783ee4f08c499aa95c6fdd64b3 [1,0,0,0,0,0|1,0,0]=2 12 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1cccc2c1ccnc2 74bcee18e8de468a09cc6fad9790ae75 [1,0,0,0,0,0|1,0,0]=2 13 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1cccc2c1cncc2 706708ce07f9436a012765801357ab70 [1,0,0,0,0,0|1,0,0]=2 14 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1cccc2c1nccc2 d391a6f64cc9e7ecbb53ea14b5de2f43 [1,0,0,0,0,0|1,0,0]=2 15 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1cccc2c1nccn2 2c0b507386cbc3199c92178605c823a9 [1,0,0,0,0,0|2,0,0]=3 16 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1ccnc2c1cccc2 0ff812eb1c222b8feb969395132b34eb [1,0,0,0,0,0|1,0,0]=2 17 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1cncc2c1cccc2 693b83c0b488b0e3ff41a03066028c97 [1,0,0,0,0,0|1,0,0]=2 18 B22R2.95511992 CC(C)(C)C#C/C=C/CNCc1nccc2c1cccc2 176ea08bd8a3d313a7bdcde33ce9a847 [1,0,0,0,0,0|1,0,0]=2 19 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cccc2c1cccc2 5732b49f8ea4d64dc712adf85f425529 [1,0,0,0,0,0|1,0,0]=2 20 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cccc2c1cccn2 fd5260adbbabbc6ee3e067202c9d4174 [1,0,0,0,0,0|2,0,0]=3 21 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cccc2c1ccnc2 788c63f061ebf5104bbee1ee3c4162ca [1,0,0,0,0,0|2,0,0]=3 22 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cccc2c1cncc2 1a4bf99c586df317d39652c8490a6eaf [1,0,0,0,0,0|2,0,0]=3 23 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cccc2c1nccc2 ae9b16980a83455ad16b850a02b1401b [1,0,0,0,0,0|2,0,0]=3 24 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cccc2c1nccn2 1f54af317d6f34917d28c77c30f47a45 [1,0,0,0,0,0|3,0,0]=4 25 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1ccnc2c1cccc2 2cfded501a8452331ed22c2ccd56c914 [1,0,0,0,0,0|2,0,0]=3 26 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cncc2c1cccc2 8cf97a300e5dd818ebf1b307ba4f911c [1,0,0,0,0,0|2,0,0]=3 27 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1cncc2c1nccc2 d4e44329cddf39be302c9242001110ea [1,0,0,0,0,0|3,0,0]=4 28 B22R2.95511992 CC(C)(C)C#C/C=C/COCc1nccc2c1cccc2 9dfb8a86741ba054370deb07b594d4bf [1,0,0,0,0,0|2,0,0]=3 29 B22R2.95511992 CC(C)(C)C#CC=CCNCc1cccc2c1cccc2 e11ca4fcf86c221eadad43f7ee0bc43a [1,0,0,0,0,0|0,0,0]=1 30 B22R2.95511992 CC(C)(C)C#CC=CCNCc1cccc2c1cccn2 bf2e64092a978c0de210a1bef6008ab1 [1,0,0,0,0,0|1,0,0]=2 31 B22R2.95511992 CC(C)(C)C#CC=CCNCc1cccc2c1ccnc2 700ee41917a8e77b9076cf8efbd1812d [1,0,0,0,0,0|1,0,0]=2 32 B22R2.95511992 CC(C)(C)C#CC=CCNCc1cccc2c1cncc2 61b0d230b05e46ba229fdd4e74a87493 [1,0,0,0,0,0|1,0,0]=2 33 B22R2.95511992 CC(C)(C)C#CC=CCNCc1cccc2c1nccc2 cf16cf4f65ddcb04fdedd6a53d435483 [1,0,0,0,0,0|1,0,0]=2 34 B22R2.95511992 CC(C)(C)C#CC=CCNCc1cccc2c1nccn2 c5c1da1461506e509106e2b44d6f3ea8 [1,0,0,0,0,0|2,0,0]=3 35 B22R2.95511992 CC(C)(C)C#CC=CCNCc1ccnc2c1cccc2 882b8b4ad00fda346c9989f929eab289 [1,0,0,0,0,0|1,0,0]=2 36 B22R2.95511992 CC(C)(C)C#CC=CCNCc1cncc2c1cccc2 4dab19e68bdce9f8721ee461347fbbff [1,0,0,0,0,0|1,0,0]=2 37 B22R2.95511992 CC(C)(C)C#CC=CCNCc1nccc2c1cccc2 03f53cd9e238ec3189848797d978fd0f [1,0,0,0,0,0|1,0,0]=2 38 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cccc2c1cccc2 74facc1cb1dc52ab5d7778f43f2c2306 [1,0,0,0,0,0|1,0,0]=2 39 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cccc2c1cccn2 9dea9fda80811fdf21ae931e3754d2e7 [1,0,0,0,0,0|2,0,0]=3 40 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cccc2c1ccnc2 60d0578e63e3c3a1fd28296f3a4a7116 [1,0,0,0,0,0|2,0,0]=3 41 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cccc2c1cncc2 c2b59d3206f9fe83e8a9ce8d37f6741d [1,0,0,0,0,0|2,0,0]=3 42 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cccc2c1nccc2 62cb7f29239d937705a569ddc5d8e597 [1,0,0,0,0,0|2,0,0]=3 43 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cccc2c1nccn2 22326c787a66cea35768fe93613ce670 [1,0,0,0,0,0|3,0,0]=4 44 B22R2.95511992 CC(C)(C)C#CC=CCOCc1ccnc2c1cccc2 551f4cbf67fdd815b70f0e40bcdc10dc [1,0,0,0,0,0|2,0,0]=3 45 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cncc2c1cccc2 61d0567d3839df74e46c045694186ec2 [1,0,0,0,0,0|2,0,0]=3 46 B22R2.95511992 CC(C)(C)C#CC=CCOCc1cncc2c1nccc2 6102ffc125ed5b5eb6d9f20636077245 [1,0,0,0,0,0|3,0,0]=4 47 B22R2.95511992 CC(C)(C)C#CC=CCOCc1nccc2c1cccc2 fed4040a48f72d1f39115901f3db6d56 [1,0,0,0,0,0|2,0,0]=3 48 B24R2.10507591 CN(C/C=C/C#CC(C)(C)C)Cc1ccnc2c1cccc2Br 8b41a810e09c69f894892ee46e45cb5f [0,1,0,0,0,0|1,0,0]=2 49 B24R2.10507591 CN(CC=CC#CC(C)(C)C)Cc1ccnc2c1cccc2Br e543b3c0fffedf5bc84540cb73628f9b [0,1,0,0,0,0|1,0,0]=2 50 B24R2.405994175 CC(CNC(=O)C#CC(C)(C)C)Cc1cccc2c1cccc2 bd4fddce57527d50ee32f260ec1ad294 [0,1,0,0,0,0|2,0,0]=3 51 B24R2.405994175 CC(CNC(=O)C#CC(C)(C)O)Cc1cccc2c1cccc2 0fc36a7b1a2c32d4752afafc0066ca4b [0,1,0,0,0,0|3,0,0]=4 52 B24R2.406006725 CC(c1cccc2c1cccc2)N(C)C/C=C/C#CC(C)(C)C ddb630b86ca90d71893fdc3f7975d918 [0,1,0,0,0,0|0,0,0]=1 53 B24R2.406006725 CC(c1cccc2c1cccc2)N(C)CC=CC#CC(C)(C)C 26e0e4325c4fa9d888f787500e57d09c [0,1,0,0,0,0|0,0,0]=1 54 B24R2.406006725 CC(c1cccc2c1ccnc2)N(C)C/C=C/C#CC(C)(C)C 657940992c5b3123bc7646d3c2c434cb [0,1,0,0,0,0|1,0,0]=2 55 B24R2.406006725 CC(c1cccc2c1ccnc2)N(C)CC=CC#CC(C)(C)C 35d7dbe0549d300686d8b0d1332bd1c1 [0,1,0,0,0,0|1,0,0]=2 56 B24R2.406006725 C[C@H](c1cccc2c1cccc2)N(C)C/C=C/C#CC(C)(C)C e9e4fba611a54c5dcad23a711b9e876a [0,1,0,0,0,0|0,0,0]=1 57 B24R2.406006725 C[C@H](c1cccc2c1cccc2)N(C)CC=CC#CC(C)(C)C 3542e7baddccf8ebc03fc10c83f1d42b [0,1,0,0,0,0|0,0,0]=1 58 B24R2.406020753 CN(Cc1cccc2c1cccc2)C(=O)NCC#CC(C)(C)C 374d44d02ca7d705ecceb0911e565c7f [0,1,0,0,0,0|1,0,2]=4 59 B24R2.406020753 CN(Cc1cccc2c1cccc2)C(=S)NCC#CC(C)(C)C 637dd344e31aeb68a947a9f92ccd6e83 [0,1,0,0,0,0|1,0,2]=4 60 B24R2.406202407 CN(C/C=C/C(=O)OC(C)(C)C)Cc1cccc2c1cccc2 bab9703219041b4c5b5135efc023618f [0,1,0,0,0,0|1,0,1]=3 61 B24R2.406202407 CN(C/C=C/C(=O)OC(C)(C)C)Cc1cccc2c1cccn2 36726bda7fe88129594a8bc5de837243 [0,1,0,0,0,0|2,0,1]=4 62 B24R2.406202407 CN(C/C=C/C(=O)OC(C)(C)C)Cc1cccc2c1ccnc2 c2aea28dfc4672f56b920d595d4a32d3 [0,1,0,0,0,0|2,0,1]=4 63 B24R2.406202407 CN(C/C=C/C(=O)OC(C)(C)C)Cc1cccc2c1nccc2 e79b5515d7f27bf39367db27d7f77170 [0,1,0,0,0,0|2,0,1]=4 64 B24R2.406202407 CN(C/C=C/C(=O)OC(C)(C)C)Cc1ccnc2c1cccc2 e5ce496cbe10d5aeb71f58365366a7d5 [0,1,0,0,0,0|2,0,1]=4 65 B24R2.645529637 CCN(C/C=C/C#CC(C)(C)C)Cc1ccnc2c1cccc2 038cacbfc8e54593952ea47ef2b803fa [0,1,0,0,0,0|1,0,0]=2 66 B24R2.645529637 CCN(CC=CC#CC(C)(C)C)Cc1ccnc2c1cccc2 da6a894a3ba60dd04385529119933ee6 [0,1,0,0,0,0|1,0,0]=2 67 B24R3.5572937 CC(C)(C)C#C/C=C/CN1Cc2cccc3c2c(ccc3)C1 c84e340db8db460f0e638a38ca8b0941 [0,0,0,1,0,0|0,0,0]=1 68 B24R3.5572937 CC(C)(C)C#CC=CCN1Cc2cccc3c2c(ccc3)C1 c199c539087597bb4ee2c6dd7f709339 [0,0,0,1,0,0|0,0,0]=1 69 B22R2.15463 CN(C/C=C/C#CC(C)(C)C)Cc1c[nH]c2c1cccc2 9453ee9604be968dfa8df9234376cb68 [0,0,0,0,1,0|1,0,0]=2 70 B22R2.15463 CN(C/C=C/C#CC(C)(C)C)Cc1cnc2n1cccc2 13fc7fc6c62a1d4c867b4c7159b5eb65 [0,0,0,0,1,0|2,0,0]=3 71 B22R2.15463 CN(C/C=C/C#CC(C)(C)C)Cc1csc2c1cccc2 5b9f9e74fcb58ac934efbd7576a60ad1 [0,0,0,0,1,0|1,0,0]=2 72 B22R2.15463 CN(C/C=C/C#CC(C)(C)C)Cc1nnc2n1cccc2 33aee5ebf2649d93f1d55e412b4737e5 [0,0,0,0,1,0|3,0,0]=4 73 B22R2.15463 CN(CC=CC#CC(C)(C)C)Cc1c[nH]c2c1cccc2 1e13f80c1a64509008aa974d3211b9bf [0,0,0,0,1,0|1,0,0]=2 74 B22R2.15463 CN(CC=CC#CC(C)(C)C)Cc1cnc2n1cccc2 4a3042583772c57d4527bdf788086e29 [0,0,0,0,1,0|2,0,0]=3 75 B22R2.15463 CN(CC=CC#CC(C)(C)C)Cc1csc2c1cccc2 dadf6488c06c229790cef1f1e35928a8 [0,0,0,0,1,0|1,0,0]=2 76 B22R2.15463 CN(CC=CC#CC(C)(C)C)Cc1nnc2n1cccc2 e9cdee7db28a121604b3a7ba719f6071 [0,0,0,0,1,0|3,0,0]=4 77 B22R2.35086890 CN(C/C=C/C#CC(C)(C)C)Cc1cccc2c1CCC2 e439f3a59d98fb2a3ddb897e24430155 [0,0,0,0,1,0|0,0,3]=4 78 B22R2.35086890 CN(C/C=C/C#CC(C)(C)C)Cc1cccc2c1cc[nH]2 4e0d232ea727db2723368f583984d028 [0,0,0,0,1,0|1,0,0]=2 79 B22R2.35086890 CN(C/C=C/C#CC(C)(C)C)Cc1ccnc2c1cc[nH]2 51509bf1eb3791277add82325a54b09d [0,0,0,0,1,0|2,0,0]=3 80 B22R2.35086890 CN(CC=CC#CC(C)(C)C)Cc1cccc2c1CCC2 38fe7cfc01f6c3af26e7b371c6b51523 [0,0,0,0,1,0|0,0,3]=4 81 B22R2.35086890 CN(CC=CC#CC(C)(C)C)Cc1cccc2c1cc[nH]2 76b27805a6f4efb5319e063f726fa32c [0,0,0,0,1,0|1,0,0]=2 82 B22R2.35086890 CN(CC=CC#CC(C)(C)C)Cc1ccnc2c1cc[nH]2 7bdd2853adf32834e9adfb45ac5cb390 [0,0,0,0,1,0|2,0,0]=3 83 B22R2.126813201 CN(CCCSC(C)(C)C)Cc1cccc2c1cccc2 a37d9b6acbfd94ee1d3bfca69f3a453e [0,0,0,0,1,0|1,0,2]=4 84 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 04f5a9e057a57d8bc133eaac0fd844c4 [0,0,0,0,1,0|0,0,0]=1 85 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1cccn2 c4165c2f2432d39f89f2c213b44d9765 [0,0,0,0,1,0|1,0,0]=2 86 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1ccnc2 8d8e64c0e957129369436a828fcd2635 [0,0,0,0,1,0|1,0,0]=2 87 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1nccc2 ef62cd4c9ed71bbc166c1f1c86a812cb [0,0,0,0,1,0|1,0,0]=2 88 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1ccnc2c1cccc2 0712f08f59c6fbb7f6409b423e7dedd1 [0,0,0,0,1,0|1,0,0]=2 89 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1cncc2c1cccc2 40321a86ab4bb80a0ab3e2d7c3f8610c [0,0,0,0,1,0|1,0,0]=2 90 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1nccc2c1cccc2 f613176414444df5db196e38fc8fe2e5 [0,0,0,0,1,0|1,0,0]=2 91 B22R2.126863981 CN(C/C=C/C#CC(C)(C)C)c1ncnc2c1cccc2 b641f9b98a0904c33f3a09a7cb864e30 [0,0,0,0,1,0|2,0,0]=3 92 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1cccc2c1cccc2 824584379bd71c124f8606e49ec5b09a [0,0,0,0,1,0|0,0,0]=1 93 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1cccc2c1cccn2 5353d58d905e8290b1e04d4fb9f5e9e6 [0,0,0,0,1,0|1,0,0]=2 94 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1cccc2c1ccnc2 8575abf09aa0d4ce10db1c7f7ba6e117 [0,0,0,0,1,0|1,0,0]=2 95 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1cccc2c1nccc2 d189047c3b9b398bcd006a0c001d77ee [0,0,0,0,1,0|1,0,0]=2 96 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1ccnc2c1cccc2 d849cc4f8a3d48f580a287a6e377f760 [0,0,0,0,1,0|1,0,0]=2 97 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1cncc2c1cccc2 74985cc130cd44455cf84f2baa68ea50 [0,0,0,0,1,0|1,0,0]=2 98 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1nccc2c1cccc2 405779cef31c2d0963ac442e32b8a442 [0,0,0,0,1,0|1,0,0]=2 99 B22R2.126863981 CN(CC=CC#CC(C)(C)C)c1ncnc2c1cccc2 eefdd9b633c6af0ccaf3a5b46528d9fd [0,0,0,0,1,0|2,0,0]=3 100 B21R2.12605813 CCCC/C=C/CN(C)Cc1cccc2c1cccc2 62ef5d1bdfeec7c45931cf35d9d3b10e [2,0,0,0,0,0|0,0,2]=4 101 B21R2.12605813 CCCC/C=C\CN(C)Cc1cccc2c1cccc2 21bff88d44f07442b930565945edbf9c [2,0,0,0,0,0|0,0,2]=4 102 B23R2.181040 CC(C)(C)C#C/C=C/COCc1nccc2c1ccc(c2)Br afb253a95f8b7fba52aa2b985ceb1f7e [1,1,0,0,0,0|2,0,0]=4 103 B23R2.181040 CC(C)(C)C#CC=CCOCc1nccc2c1ccc(c2)Br 9ff3b9f8b216568bd6645ef374dfd935 [1,1,0,0,0,0|2,0,0]=4 104 B23R2.181040 Cc1cc2cccc(c2cn1)COC/C=C/C#CC(C)(C)C 04abb5ff78cb9be19ac245a386b8fa6f [1,1,0,0,0,0|2,0,0]=4 105 B23R2.181040 Cc1cc2cccc(c2cn1)COCC=CC#CC(C)(C)C b26342a16f16beea8cb8d6e1599de8e8 [1,1,0,0,0,0|2,0,0]=4 106 B23R2.377218 CC(C)(C)C#C/C=C/CNCc1cc(=O)[nH]c2c1cccc2 fe473314a3c9fb920663535cda6882a2 [1,1,0,0,0,0|1,0,0]=3 107 B23R2.377218 CC(C)(C)C#C/C=C/CNCc1cc(cc2c1cncc2)F 5777984bd58c921bb0ab1c49f23fb9c0 [1,1,0,0,0,0|1,0,0]=3 108 B23R2.377218 CC(C)(C)C#C/C=C/COCc1cc(=O)[nH]c2c1cccc2 ec1da3eaf182ec0149210fb57f329cf2 [1,1,0,0,0,0|2,0,0]=4 109 B23R2.377218 CC(C)(C)C#C/C=C/COCc1cc(cc2c1cccc2)Br 648b65e3b61bea8726e66fba2b38692b [1,1,0,0,0,0|1,0,0]=3 110 B23R2.377218 CC(C)(C)C#C/C=C/COCc1cc(cc2c1nccc2)Cl b438feda3a08267d994aae80e3ca54f4 [1,1,0,0,0,0|2,0,0]=4 111 B23R2.377218 CC(C)(C)C#CC=CCNCc1cc(=O)[nH]c2c1cccc2 30d34f2d68da620ef87ae09c363a15c9 [1,1,0,0,0,0|1,0,0]=3 112 B23R2.377218 CC(C)(C)C#CC=CCNCc1cc(cc2c1cncc2)F 06c38a14d6155db478bbcf6e4e59eaf0 [1,1,0,0,0,0|1,0,0]=3 113 B23R2.377218 CC(C)(C)C#CC=CCOCc1cc(=O)[nH]c2c1cccc2 9be5a88d379d61d1811ff210ce3e6909 [1,1,0,0,0,0|2,0,0]=4 114 B23R2.377218 CC(C)(C)C#CC=CCOCc1cc(cc2c1cccc2)Br 4cd8e3e8ac185a38c18c820b0ebd0ea1 [1,1,0,0,0,0|1,0,0]=3 115 B23R2.377218 CC(C)(C)C#CC=CCOCc1cc(cc2c1nccc2)Cl c7b71d6fa12dc2b3828c6841d5bd0c5a [1,1,0,0,0,0|2,0,0]=4 116 B23R2.377218 Cc1cc(c2ccccc2c1)COC/C=C/C#CC(C)(C)C 6bce4bf83e05b79d7909cce2c8791938 [1,1,0,0,0,0|1,0,0]=3 117 B23R2.377218 Cc1cc(c2ccccc2c1)COCC=CC#CC(C)(C)C c872e84b66c5cab4437329f7c7571efe [1,1,0,0,0,0|1,0,0]=3 118 B23R2.377218 Cc1cc(c2ccccc2n1)COC/C=C/C#CC(C)(C)C 2bb378cc96d1c42246e0b68417f64c77 [1,1,0,0,0,0|2,0,0]=4 119 B23R2.377218 Cc1cc(c2ccccc2n1)COCC=CC#CC(C)(C)C 87eadb82bc8f364f5ac7c910aeb53548 [1,1,0,0,0,0|2,0,0]=4 120 B23R2.398499 CC(C)(C)C#C/C=C/COCc1c(ccc2c1nccc2)Cl df388827972c81e01ff44037780eb677 [1,1,0,0,0,0|2,0,0]=4 121 B23R2.398499 CC(C)(C)C#CC=CCOCc1c(ccc2c1nccc2)Cl 092bee4b6685e0f183dd04448b77752a [1,1,0,0,0,0|2,0,0]=4 122 B23R2.398499 Cc1ccc2ncccc2c1CNC/C=C/C#CC(C)(C)C 8442e10a7520051e16db59f1105e6bbe [1,1,0,0,0,0|1,0,0]=3 123 B23R2.398499 Cc1ccc2ncccc2c1CNCC=CC#CC(C)(C)C 7f6504fd8357d3492c8594633c26bc1b [1,1,0,0,0,0|1,0,0]=3 124 B23R2.5060898 CC(C)(C)C#C/C=C/CNCc1ccnc2c1cc(cc2)Br 5a6a162d878b31748c1e184a59d960d7 [1,1,0,0,0,0|1,0,0]=3 125 B23R2.5060898 CC(C)(C)C#CC=CCNCc1ccnc2c1cc(cc2)Br 32e8431914b3034c8e9a1e560218413b [1,1,0,0,0,0|1,0,0]=3 126 B23R2.7871872 CC(C)(C)C#C/C=C/COCc1cccc2c1cccc2Br 8fa1d76ef4d24b16e8553e92bd288566 [1,1,0,0,0,0|1,0,0]=3 127 B23R2.7871872 CC(C)(C)C#C/C=C/COCc1ccnc2c1cccc2Br 7e8246d377709ae31c0303b87589d35c [1,1,0,0,0,0|2,0,0]=4 128 B23R2.7871872 CC(C)(C)C#CC=CCOCc1cccc2c1cccc2Br 43596d783d0f7bf9f762a4fcb9267d08 [1,1,0,0,0,0|1,0,0]=3 129 B23R2.7871872 CC(C)(C)C#CC=CCOCc1ccnc2c1cccc2Br 771e3d658dc0ea92dc07558f3154d66b [1,1,0,0,0,0|2,0,0]=4 130 B23R2.8044420 CC(C)(C)C#C/C=C/CNCc1ccc(c2c1cccc2)Br 2e0d9eb54a55a21c6f968b0089fb27d2 [1,1,0,0,0,0|0,0,0]=2 131 B23R2.8044420 CC(C)(C)C#C/C=C/CNCc1ccc(c2c1cccc2)F a0030b776743906fe049d7249a0a18a6 [1,1,0,0,0,0|0,0,0]=2 132 B23R2.8044420 CC(C)(C)C#C/C=C/CNCc1ccc(c2c1nccc2)Br f590672eae37e0fcc8ed647fffc0dbec [1,1,0,0,0,0|1,0,0]=3 133 B23R2.8044420 CC(C)(C)C#C/C=C/CNCc1n[nH]c(=O)c2c1cccc2 d68085ad4dc089a3429d2c02caefbd44 [1,1,0,0,0,0|2,0,0]=4 134 B23R2.8044420 CC(C)(C)C#C/C=C/COCc1ccc(c2c1cccc2)Br 89833cb612787155f2925fc8c5804e27 [1,1,0,0,0,0|1,0,0]=3 135 B23R2.8044420 CC(C)(C)C#C/C=C/COCc1ccc(c2c1cccc2)F a4ae4e9b88a6ce847f565b89f936c8d8 [1,1,0,0,0,0|1,0,0]=3 136 B23R2.8044420 CC(C)(C)C#C/C=C/COCc1ccc(c2c1cccn2)F 0abe99354204705c46b60babe0ac75c7 [1,1,0,0,0,0|2,0,0]=4 137 B23R2.8044420 CC(C)(C)C#C/C=C/COCc1ccc(c2c1cncc2)F dd49127ce401bbeb3bc6d1e89aabb6c7 [1,1,0,0,0,0|2,0,0]=4 138 B23R2.8044420 CC(C)(C)C#C/C=C/COCc1ccc(c2c1nccc2)Br d95cf32683dd9851677ffdfcd631cef2 [1,1,0,0,0,0|2,0,0]=4 139 B23R2.8044420 CC(C)(C)C#CC=CCNCc1ccc(c2c1cccc2)Br 3aeb5147bfba4c1efce5a77a54b964e6 [1,1,0,0,0,0|0,0,0]=2 140 B23R2.8044420 CC(C)(C)C#CC=CCNCc1ccc(c2c1cccc2)F 337e84e7cb7b41ad4ea0a0891a16a606 [1,1,0,0,0,0|0,0,0]=2 141 B23R2.8044420 CC(C)(C)C#CC=CCNCc1ccc(c2c1nccc2)Br 81e341dd64d31ebe5ec82cb2e65cba38 [1,1,0,0,0,0|1,0,0]=3 142 B23R2.8044420 CC(C)(C)C#CC=CCNCc1n[nH]c(=O)c2c1cccc2 b54b66e6bedfe4b7b816b34cd9adfe37 [1,1,0,0,0,0|2,0,0]=4 143 B23R2.8044420 CC(C)(C)C#CC=CCOCc1ccc(c2c1cccc2)Br 7561a0d9f82eda60f18e44453c7b5eeb [1,1,0,0,0,0|1,0,0]=3 144 B23R2.8044420 CC(C)(C)C#CC=CCOCc1ccc(c2c1cccc2)F 4e50bcdd3dcdb3a98a7f19b23fd063f5 [1,1,0,0,0,0|1,0,0]=3 145 B23R2.8044420 CC(C)(C)C#CC=CCOCc1ccc(c2c1cccn2)F 9caa615a716914275a43a36123e92bdc [1,1,0,0,0,0|2,0,0]=4 146 B23R2.8044420 CC(C)(C)C#CC=CCOCc1ccc(c2c1cncc2)F 6fc79672a3db984acf861e651c14afa0 [1,1,0,0,0,0|2,0,0]=4 147 B23R2.8044420 CC(C)(C)C#CC=CCOCc1ccc(c2c1nccc2)Br db42755d2dd1efbdc7981ff3e45c6f64 [1,1,0,0,0,0|2,0,0]=4 148 B23R2.8044420 Cc1ccc(c2c1cccc2)COC/C=C/C#CC(C)(C)C e12f0c1e747ea188012e9603fc8bcaa0 [1,1,0,0,0,0|1,0,0]=3 149 B23R2.8044420 Cc1ccc(c2c1cccc2)COCC=CC#CC(C)(C)C a4c0077c5e39b6aeb04ce6feed2622e3 [1,1,0,0,0,0|1,0,0]=3 150 B23R2.8044420 Cc1ccc(c2c1nccc2)CNC/C=C/C#CC(C)(C)C dd43ad1dedda5e181b80b831e5b2cf6c [1,1,0,0,0,0|1,0,0]=3 151 B23R2.8044420 Cc1ccc(c2c1nccc2)CNCC=CC#CC(C)(C)C 6531d7c9766b86ee661f2fa89fa0c351 [1,1,0,0,0,0|1,0,0]=3 152 B23R2.8044420 Cc1ccc(c2c1nccc2)COC/C=C/C#CC(C)(C)C 289117f178737e1a6cdce9eb1d3574e1 [1,1,0,0,0,0|2,0,0]=4 153 B23R2.8044420 Cc1ccc(c2c1nccc2)COCC=CC#CC(C)(C)C 13cacd8d8aca8c0a3723b1a1be9126c2 [1,1,0,0,0,0|2,0,0]=4 154 B23R2.8956528 CC(C)(C)OC(=O)/C=C/CNCc1cccc2c1cccc2 b5f599ceb1f52c7cf5ad60bf8dbebd2f [1,1,0,0,0,0|1,0,1]=4 155 B23R2.53161218 CC(C)(C)C#C/C=C/COCc1cccc2c1c(ccc2)Br 047e937e564c68c5c4a8065576a5a4a6 [1,1,0,0,0,0|1,0,0]=3 156 B23R2.53161218 CC(C)(C)C#CC=CCOCc1cccc2c1c(ccc2)Br 4c51f636f829c9e8b1d7fd5809625006 [1,1,0,0,0,0|1,0,0]=3 157 B23R2.53161218 Cc1cccc2c1c(ccc2)COC/C=C/C#CC(C)(C)C 9c0a2b9de3be862d23ecb0f272593d8a [1,1,0,0,0,0|1,0,0]=3 158 B23R2.53161218 Cc1cccc2c1c(ccc2)COCC=CC#CC(C)(C)C 7f9d11516668a666dc8032bf0d3e59b8 [1,1,0,0,0,0|1,0,0]=3 159 B23R2.59582297 CC(C)(C)C#CC(=O)NCCCc1cccc2c1cccc2 a747f9408b3abb2d967bdd0ce591562a [1,1,0,0,0,0|2,0,0]=4 160 B23R2.245541889 CC(NC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 37f6fa3e3061cf45d8c754171991f8f5 [1,1,0,0,0,0|0,0,0]=2 161 B23R2.245541889 CC(NCC=CC#CC(C)(C)C)c1cccc2c1cccc2 ea623a6ac96c71e6b82094d370e06916 [1,1,0,0,0,0|0,0,0]=2 162 B23R2.245541889 CC(OC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 23615f4de5bb614fddb601e132b898c4 [1,1,0,0,0,0|1,0,0]=3 163 B23R2.245541889 CC(OC/C=C/C#CC(C)(C)C)c1cccc2c1nccc2 be0ca3710ea9094902203a82ca497429 [1,1,0,0,0,0|2,0,0]=4 164 B23R2.245541889 CC(OCC=CC#CC(C)(C)C)c1cccc2c1cccc2 0998c7c892052bc69aef837feef4c3d4 [1,1,0,0,0,0|1,0,0]=3 165 B23R2.245541889 CC(OCC=CC#CC(C)(C)C)c1cccc2c1nccc2 d5715c85eb4349bf7795b9ee375e0e5c [1,1,0,0,0,0|2,0,0]=4 166 B23R2.245541889 C[C@@H](NC/C=C/C#CC(C)(C)C)c1cccc2c1CCC=C2 e47abc19acd30ac45dbf2e0bb2c647b6 [1,1,0,0,0,0|0,0,2]=4 167 B23R2.245541889 C[C@@H](NC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 d3a9ad0b9878a8a06db380752a065fb8 [1,1,0,0,0,0|0,0,0]=2 168 B23R2.245541889 C[C@@H](NC/C=C/C#CC(C)(C)C)c1cccc2c1nccc2 54ea9dfe13c818609aef7d675242f69c [1,1,0,0,0,0|1,0,0]=3 169 B23R2.245541889 C[C@@H](NCC=CC#CC(C)(C)C)c1cccc2c1CCC=C2 34a50cbf864571346b5bf3ab0d67cabf [1,1,0,0,0,0|0,0,2]=4 170 B23R2.245541889 C[C@@H](NCC=CC#CC(C)(C)C)c1cccc2c1cccc2 48e938b14f1e2d2b134f7adcfd9c61ec [1,1,0,0,0,0|0,0,0]=2 171 B23R2.245541889 C[C@@H](NCC=CC#CC(C)(C)C)c1cccc2c1nccc2 d7e925fb826a6350b80f948af1bea76f [1,1,0,0,0,0|1,0,0]=3 172 B23R2.245541889 C[C@@H](OC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 d19a51c7ea10d4fc331a778dc4359856 [1,1,0,0,0,0|1,0,0]=3 173 B23R2.245541889 C[C@@H](OCC=CC#CC(C)(C)C)c1cccc2c1cccc2 377d3bb976e9e73ce4f8a7a47ad57942 [1,1,0,0,0,0|1,0,0]=3 174 B23R2.245541889 C[C@H](NC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 2aac12641a5575c00f024bd65f7f4c75 [1,1,0,0,0,0|0,0,0]=2 175 B23R2.245541889 C[C@H](NC/C=C/C#CC(C)(C)C)c1cccc2c1cccn2 67d1a5408e8421ef04602a86b5d86aac [1,1,0,0,0,0|1,0,0]=3 176 B23R2.245541889 C[C@H](NC/C=C/C#CC(C)(C)C)c1cccc2c1cncc2 894f39a56326dad0c18e94bf25e4947b [1,1,0,0,0,0|1,0,0]=3 177 B23R2.245541889 C[C@H](NCC=CC#CC(C)(C)C)c1cccc2c1cccc2 e1776a04f4850ad0ac757c2ce03be759 [1,1,0,0,0,0|0,0,0]=2 178 B23R2.245541889 C[C@H](NCC=CC#CC(C)(C)C)c1cccc2c1cccn2 0c8ec397b404e0bd3f807ec6f80db31e [1,1,0,0,0,0|1,0,0]=3 179 B23R2.245541889 C[C@H](NCC=CC#CC(C)(C)C)c1cccc2c1cncc2 d78fc2abf391230037bb81961c4b60e0 [1,1,0,0,0,0|1,0,0]=3 180 B23R2.245541889 C[C@H](OC/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 84b274ecf0eab87e599a04e836cec8b5 [1,1,0,0,0,0|1,0,0]=3 181 B23R2.245541889 C[C@H](OCC=CC#CC(C)(C)C)c1cccc2c1cccc2 d0104b7895b78486de11520d285667d2 [1,1,0,0,0,0|1,0,0]=3 182 B23R2.8018831 Cc1[nH]c2ccccc2c1CN(C)C/C=C/C#CC(C)(C)C 80051191ea4c212907d96a8c9f5b1b8e [0,1,0,0,1,0|1,0,0]=3 183 B23R2.8018831 Cc1[nH]c2ccccc2c1CN(C)CC=CC#CC(C)(C)C 47011b0c767482eb3028dab2fcf7e69f [0,1,0,0,1,0|1,0,0]=3 184 B23R2.39473300 Cc1ccc2[nH]cc(c2c1)CN(C)C/C=C/C#CC(C)(C)C 2f87c27f274a8e72912ae3d034b64dfc [0,1,0,0,1,0|1,0,0]=3 185 B23R2.39473300 Cc1ccc2[nH]cc(c2c1)CN(C)CC=CC#CC(C)(C)C 0eb5c639002974332123678b7e543ff6 [0,1,0,0,1,0|1,0,0]=3 186 B23R2.245604269 CN(CC(=O)OCC(C)(C)C)Cc1cccc2c1cccc2 d1bc556af24d305d9d44dfc58559328a [0,1,0,0,1,0|1,0,1]=4 187 B23R2.245614507 CN(CCC(=O)NC(C)(C)C)Cc1cccc2c1cccc2 9247b7a5795a65c4c80549d7be543ecd [0,1,0,0,1,0|1,0,1]=4 188 B23R2.245614507 CN(CCC(=O)OC(C)(C)C)Cc1cccc2c1cccc2 52ea196f7a6ff937bd5992a9f1a12685 [0,1,0,0,1,0|1,0,1]=4 189 B23R2.245614507 CN(COC(=O)CC(C)(C)C)Cc1cccc2c1cccc2 bcb647bd9e709c9eada8a778143970dd [0,1,0,0,1,0|1,0,1]=4 190 B23R2.245614507 CN(COC(=O)OC(C)(C)C)Cc1cccc2c1cccc2 3f1a2fe4b259896b8730c8cfd7ea444b [0,1,0,0,1,0|2,0,0]=4 191 B23R2.181083 CN(C/C=C/C#CC(C)(C)C)c1nccc2c1cnc(c2)Br cb4b608452e4e0e37016ad4c40f6fc29 [0,1,0,0,1,0|2,0,0]=4 192 B23R2.181083 CN(CC=CC#CC(C)(C)C)c1nccc2c1cnc(c2)Br b2bce08b9382911fb4c3f5b4520bc534 [0,1,0,0,1,0|2,0,0]=4 193 B23R2.377261 CN(C/C=C/C#CC(C)(C)C)c1nc(cc2c1cccc2)Cl 453af81ed4ee9a180f3b8ea795cf1e25 [0,1,0,0,1,0|1,0,0]=3 194 B23R2.377261 CN(C/C=C/C#CC(C)(C)C)c1nc(nc2c1cccc2)Cl ba53347f7d137bedbce669f8fdb08dbf [0,1,0,0,1,0|2,0,0]=4 195 B23R2.377261 CN(CC=CC#CC(C)(C)C)c1nc(cc2c1cccc2)Cl 6fbef68863a51c4f4d3b7d9ec63a79f0 [0,1,0,0,1,0|1,0,0]=3 196 B23R2.377261 CN(CC=CC#CC(C)(C)C)c1nc(nc2c1cccc2)Cl 150757939e6d9a56f3c8c6e53cfaa1b2 [0,1,0,0,1,0|2,0,0]=4 197 B23R2.5060937 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1cc(nc2)Cl 9c28c2b17ed931c639c0d9e84d6add35 [0,1,0,0,1,0|1,0,0]=3 198 B23R2.5060937 CN(C/C=C/C#CC(C)(C)C)c1ccnc2c1cc(cc2)Br 674ace5a4d42bb7a790607b331b2e817 [0,1,0,0,1,0|1,0,0]=3 199 B23R2.5060937 CN(CC=CC#CC(C)(C)C)c1cccc2c1cc(nc2)Cl 5b8127aae53d2ce11c9144aedf90c083 [0,1,0,0,1,0|1,0,0]=3 200 B23R2.5060937 CN(CC=CC#CC(C)(C)C)c1ccnc2c1cc(cc2)Br b3745e14025bc11dd6b4f503f9769599 [0,1,0,0,1,0|1,0,0]=3 201 B23R2.7871912 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1ccnc2Cl 53a1a0b94e50856e76001c9f77f824fa [0,1,0,0,1,0|1,0,0]=3 202 B23R2.7871912 CN(CC=CC#CC(C)(C)C)c1cccc2c1ccnc2Cl 892ed8a8acff12b31166e42d6dd018ac [0,1,0,0,1,0|1,0,0]=3 203 B23R2.8044463 CN(C/C=C/C#CC(C)(C)C)c1nnc(c2c1cccc2)Cl 22e3f36a8fbcba28ef0d80f57eba94a9 [0,1,0,0,1,0|2,0,0]=4 204 B23R2.8044463 CN(CC=CC#CC(C)(C)C)c1nnc(c2c1cccc2)Cl 9819e936b504cc32fa4ccccc6d7d8a41 [0,1,0,0,1,0|2,0,0]=4 205 B23R2.59562087 CN(C/C=C/C(=O)OC(C)(C)C)c1cccc2c1cccc2 f25978b1f70abf4198294f515534277c [0,1,0,0,1,0|1,0,1]=4 206 B23R2.377682347 CCN(C/C=C/C#CC(C)(C)C)c1cccc2c1cccc2 e25e847db8efdb881e511c02b940097e [0,1,0,0,1,0|0,0,0]=2 207 B23R2.377682347 CCN(CC=CC#CC(C)(C)C)c1cccc2c1cccc2 8ef04a97a3c52175392fbd865b49943c [0,1,0,0,1,0|0,0,0]=2 208 B25R2.1083264877 CC(C)(C)C#C/C=C/CNC(CO)Cc1cccc2c1cccc2 1a8c1e35177f3d9da79e14e36f37c1cb [0,1,0,0,0,1|1,0,0]=3 209 B25R2.1083264877 CC(C)(C)C#CC=CCNC(CO)Cc1cccc2c1cccc2 ffa8c306f5b82f1a3f75df4e2bed4265 [0,1,0,0,0,1|1,0,0]=3 210 B25R2.225414443 COc1ccc(c2c1nccc2)CN(C)C/C=C/C#CC(C)(C)C c9633d8b6293205519554bc60af7230a [0,2,0,0,0,0|1,0,0]=3 211 B25R2.225414443 COc1ccc(c2c1nccc2)CN(C)CC=CC#CC(C)(C)C 68c63477056bda4c5d695005eb81ba36 [0,2,0,0,0,0|1,0,0]=3 212 B25R2.319464222 CC(c1cccc2c1cccc2)N(C)C/C=C/C(=O)OC(C)(C)C e17577651a0b018636613f5c5da49df6 [0,2,0,0,0,0|1,0,1]=4 213 B25R2.319464222 C[C@H](c1cccc2c1cccc2)N(C)C/C=C/C(=O)OC(C)(C)C c5334982fda81099306694ecba03f202 [0,2,0,0,0,0|1,0,1]=4 214 B25R2.733465727 CCCN(C/C=C/C#CC(C)(C)C)Cc1ccnc2c1cccc2 26334b6d1d470c8e2e4986e94b4463c2 [0,2,0,0,0,0|1,0,0]=3 215 B25R2.733465727 CCCN(CC=CC#CC(C)(C)C)Cc1ccnc2c1cccc2 0015b75274cb1b763db622263151c1d0 [0,2,0,0,0,0|1,0,0]=3 216 B25R2.1276250411 CC(C)N(C/C=C/C#CC(C)(C)C)Cc1ccnc2c1cccc2 550878741e99bfad599cb38441c8aeaa [0,2,0,0,0,0|1,0,0]=3 217 B25R2.1276250411 CC(C)N(CC=CC#CC(C)(C)C)Cc1ccnc2c1cccc2 d13b51a5413bb8b1dd3cab663db7a4c0 [0,2,0,0,0,0|1,0,0]=3 218 B23R2.477863 CN(C/C=C/C#CC(C)(C)C)CCn1ccc2c1cccc2 dfdc3917d2bed601164ad95d6dd2d15d [0,0,1,1,0,0|1,0,1]=4 219 B23R2.477863 CN(CC=CC#CC(C)(C)C)CCn1ccc2c1cccc2 5f64b3641a314f687649655672ed5ad5 [0,0,1,1,0,0|1,0,1]=4 220 B23R2.15687077 CN(C/C=C/C#CC(C)(C)C)Cc1ccc2ccccc2c1 0e4eb17d386fbdd74d83d043612b0bd1 [0,0,1,1,0,0|0,0,0]=2 221 B23R2.15687077 CN(C/C=C/C#CC(C)(C)C)Cc1ccc2ccccc2n1 1e318c71a96469475ea158d8ce185a76 [0,0,1,1,0,0|1,0,0]=3 222 B23R2.15687077 CN(C/C=C/C#CC(C)(C)C)Cc1ccc2ncccc2c1 e148ebd639627d93a84bdbabc20d7e51 [0,0,1,1,0,0|1,0,0]=3 223 B23R2.15687077 CN(CC=CC#CC(C)(C)C)Cc1ccc2ccccc2c1 7fe347881012d20326f0b20a4a5f6ef6 [0,0,1,1,0,0|0,0,0]=2 224 B23R2.15687077 CN(CC=CC#CC(C)(C)C)Cc1ccc2ccccc2n1 8bbbfd65e60fbcd7878963b759e7e0c6 [0,0,1,1,0,0|1,0,0]=3 225 B23R2.15687077 CN(CC=CC#CC(C)(C)C)Cc1ccc2ncccc2c1 2b64c8f8b897eb78262ce67619ced3b0 [0,0,1,1,0,0|1,0,0]=3 226 B23R3.4213894 CC(C)(C)C#C/C=C/CN1Cc2cccc3c2c1ccc3 3f0f8fe256384600f2622872f21a28a2 [1,0,0,1,0,0|0,0,0]=2 227 B23R3.4213894 CC(C)(C)C#CC=CCN1Cc2cccc3c2c1ccc3 7c3195d27799bf147a9e03b892737c5e [1,0,0,1,0,0|0,0,0]=2 228 B25R3.411778002 CC(C)(C)OC(=O)/C=C/CN1Cc2cccc3c2c(ccc3)C1 f02092f74f8d1e90ec4f3d93fd150771 [0,1,0,1,0,0|1,0,1]=4 229 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1[nH]nc2c1cccc2 1a158ae654c1f7cc22475748081cc5a8 [1,0,0,0,1,0|2,0,0]=4 230 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1c[nH]c2c1cccc2 eb5822a0f40b504fc0ce876665cbcdf0 [1,0,0,0,1,0|1,0,0]=3 231 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1c[nH]c2c1cccn2 f171bf5237077b986eb063dbd24f0acc [1,0,0,0,1,0|2,0,0]=4 232 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1cnc2n1cccc2 e4c068b16c9e7018203710170ae6fd9f [1,0,0,0,1,0|2,0,0]=4 233 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1cnn2c1cccc2 9eb9fbded78db8c8a5fc80c3a18d464b [1,0,0,0,1,0|2,0,0]=4 234 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1coc2c1cccc2 9409e17708fa8090b2191e0fe6faf514 [1,0,0,0,1,0|1,0,0]=3 235 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1csc2c1cccc2 807e16d39c86f19fabc73a714521f55c [1,0,0,0,1,0|1,0,0]=3 236 B21R2.2827 CC(C)(C)C#C/C=C/CNCc1noc2c1cccc2 9fa3791b5107f764a4b5d63c0b085eae [1,0,0,0,1,0|2,0,0]=4 237 B21R2.2827 CC(C)(C)C#C/C=C/COCc1c[nH]c2c1cccc2 543674f765fb93ac5acf4a0da8f814ea [1,0,0,0,1,0|2,0,0]=4 238 B21R2.2827 CC(C)(C)C#C/C=C/COCc1csc2c1cccc2 4d9a163324a2da456699f49e1189d0b4 [1,0,0,0,1,0|2,0,0]=4 239 B21R2.2827 CC(C)(C)C#CC=CCNCc1[nH]nc2c1cccc2 ff41efd55b38726f8f3ffa9cb8097c0f [1,0,0,0,1,0|2,0,0]=4 240 B21R2.2827 CC(C)(C)C#CC=CCNCc1c[nH]c2c1cccc2 8e8496f150afe80e1d02c0162cd93b1c [1,0,0,0,1,0|1,0,0]=3 241 B21R2.2827 CC(C)(C)C#CC=CCNCc1c[nH]c2c1cccn2 9cee9d308ca5c2ad4b495e657a54817a [1,0,0,0,1,0|2,0,0]=4 242 B21R2.2827 CC(C)(C)C#CC=CCNCc1cnc2n1cccc2 a7b98245ce81e9da9e283ccd7ade7e90 [1,0,0,0,1,0|2,0,0]=4 243 B21R2.2827 CC(C)(C)C#CC=CCNCc1cnn2c1cccc2 c339afac9d817506d1ae9964b03ffe26 [1,0,0,0,1,0|2,0,0]=4 244 B21R2.2827 CC(C)(C)C#CC=CCNCc1coc2c1cccc2 7bc4c9c1639f41ad69453815039f9569 [1,0,0,0,1,0|1,0,0]=3 245 B21R2.2827 CC(C)(C)C#CC=CCNCc1csc2c1cccc2 b3069a5a03090d2d19a406a4ea3c0236 [1,0,0,0,1,0|1,0,0]=3 246 B21R2.2827 CC(C)(C)C#CC=CCNCc1noc2c1cccc2 bd5073f8f4527e57bd47199898f2a38f [1,0,0,0,1,0|2,0,0]=4 247 B21R2.2827 CC(C)(C)C#CC=CCOCc1c[nH]c2c1cccc2 43999cb547b9c68f0fe40d1955bf0bd6 [1,0,0,0,1,0|2,0,0]=4 248 B21R2.2827 CC(C)(C)C#CC=CCOCc1csc2c1cccc2 9fe522bf6e98601f64ba1f3acc35127a [1,0,0,0,1,0|2,0,0]=4 249 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1[nH]cc2 10a6736734ca9b68e2c56c5867b14756 [1,0,0,0,1,0|1,0,0]=3 250 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1[nH]nc2 74e595309b48d9e0dd8cbf50a9ef6434 [1,0,0,0,1,0|2,0,0]=4 251 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1cc[nH]2 41240d5f9139063e209cea6697e52c69 [1,0,0,0,1,0|1,0,0]=3 252 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1ccs2 30b49abfc1cadd2583fce731c836bede [1,0,0,0,1,0|1,0,0]=3 253 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1cn[nH]2 8d60ff36a53f4bc971c152c960f6004c [1,0,0,0,1,0|2,0,0]=4 254 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1occ2 27c23d630500248f653c2656d88c700c [1,0,0,0,1,0|1,0,0]=3 255 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1scc2 4620f743c52a7f012f010d945a3ae342 [1,0,0,0,1,0|1,0,0]=3 256 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2c1scn2 bb2ea4d93ab21f354ff99ed52395d801 [1,0,0,0,1,0|2,0,0]=4 257 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccc2n1ncc2 e251bc43b697bc5c8794881a8e9fbeae [1,0,0,0,1,0|2,0,0]=4 258 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccn2c1ccn2 820af8cb626df6a5ebc831d5456340a0 [1,0,0,0,1,0|2,0,0]=4 259 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1cccn2c1ncc2 869dec5f6ef546e632306e148c29c542 [1,0,0,0,1,0|2,0,0]=4 260 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1ccnc2c1cc[nH]2 08c8b407d13355287717714b0b78278b [1,0,0,0,1,0|2,0,0]=4 261 B21R2.12349703 CC(C)(C)C#C/C=C/CNCc1nccc2c1cc[nH]2 c3635ce34e51495a7daba1915ccfdd5a [1,0,0,0,1,0|2,0,0]=4 262 B21R2.12349703 CC(C)(C)C#C/C=C/COCc1cccc2c1[nH]cc2 77c9348781d90181991565826ec0164f [1,0,0,0,1,0|2,0,0]=4 263 B21R2.12349703 CC(C)(C)C#C/C=C/COCc1cccc2c1cc[nH]2 38d371c226b4b2d0eff179c13ea31157 [1,0,0,0,1,0|2,0,0]=4 264 B21R2.12349703 CC(C)(C)C#C/C=C/COCc1cccc2c1ccs2 2b77c002e9475deb3a4279a49dd8ead9 [1,0,0,0,1,0|2,0,0]=4 265 B21R2.12349703 CC(C)(C)C#C/C=C/COCc1cccc2c1occ2 9572e8c9827adf538fb2e4fcde99658e [1,0,0,0,1,0|2,0,0]=4 266 B21R2.12349703 CC(C)(C)C#C/C=C/COCc1cccc2c1scc2 5f8abd817afb38e17bd1b02118baa7ad [1,0,0,0,1,0|2,0,0]=4 267 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1[nH]cc2 ea9216c159cf8e4f1cc5a5c8008feb1f [1,0,0,0,1,0|1,0,0]=3 268 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1[nH]nc2 4f16ed198f060474b31a380e65631832 [1,0,0,0,1,0|2,0,0]=4 269 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1cc[nH]2 34242763c02a5fb736fe09e369b32014 [1,0,0,0,1,0|1,0,0]=3 270 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1ccs2 717d0b378e77733e7105391e26775087 [1,0,0,0,1,0|1,0,0]=3 271 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1cn[nH]2 008aae994ea1654b2b31a2a7f726c96f [1,0,0,0,1,0|2,0,0]=4 272 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1occ2 fa919b2c4832fb436cd497f0d01023c7 [1,0,0,0,1,0|1,0,0]=3 273 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1scc2 87111933d7a0a253360b1bb2ea2994e2 [1,0,0,0,1,0|1,0,0]=3 274 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2c1scn2 068b330d00726bb0d6359a970cbc28eb [1,0,0,0,1,0|2,0,0]=4 275 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccc2n1ncc2 deb3f33e237695f86be301c7202297e2 [1,0,0,0,1,0|2,0,0]=4 276 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccn2c1ccn2 7c796ab7d0dcee9b68f9610e6df7de31 [1,0,0,0,1,0|2,0,0]=4 277 B21R2.12349703 CC(C)(C)C#CC=CCNCc1cccn2c1ncc2 e62c9b82262da222e9dc99a9b1be1a40 [1,0,0,0,1,0|2,0,0]=4 278 B21R2.12349703 CC(C)(C)C#CC=CCNCc1ccnc2c1cc[nH]2 0c4132525b6c9f72f676683d5027c153 [1,0,0,0,1,0|2,0,0]=4 279 B21R2.12349703 CC(C)(C)C#CC=CCNCc1nccc2c1cc[nH]2 956a114b3da959ccad7c4a8b128ace52 [1,0,0,0,1,0|2,0,0]=4 280 B21R2.12349703 CC(C)(C)C#CC=CCOCc1cccc2c1[nH]cc2 d11e750e47ab2fb44172ae80616cf688 [1,0,0,0,1,0|2,0,0]=4 281 B21R2.12349703 CC(C)(C)C#CC=CCOCc1cccc2c1cc[nH]2 5efb76ca749d2d4af13ec84afa5af118 [1,0,0,0,1,0|2,0,0]=4 282 B21R2.12349703 CC(C)(C)C#CC=CCOCc1cccc2c1ccs2 716969f0431aa273f963c01e766b1603 [1,0,0,0,1,0|2,0,0]=4 283 B21R2.12349703 CC(C)(C)C#CC=CCOCc1cccc2c1occ2 669bca65a26ac57de7dd80b738d531fd [1,0,0,0,1,0|2,0,0]=4 284 B21R2.12349703 CC(C)(C)C#CC=CCOCc1cccc2c1scc2 309960be2a4b6a6950aef1c9deed40b7 [1,0,0,0,1,0|2,0,0]=4 285 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1C=CCO2 b0ecd0b405e3746f7fa6d22bb89cfe47 [1,0,0,0,1,0|1,0,1]=4 286 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1cccn2 1235c38c100ecf2acd82d155e6dd1980 [1,0,0,0,1,0|1,0,0]=3 287 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1ccnc2 2f037dfd831873e8e5edf63c825c449e [1,0,0,0,1,0|1,0,0]=3 288 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1cncc2 52812e79325e417540ac995241c196b5 [1,0,0,0,1,0|1,0,0]=3 289 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1cncn2 e4e9a1d2ef0354fb5310e494c0567eb3 [1,0,0,0,1,0|2,0,0]=4 290 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1cnnc2 fe82efb4bb43cad704fc1b10bc1945bc [1,0,0,0,1,0|2,0,0]=4 291 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1nccc2 130dc4c34dbbb27b86b62848e0a87f29 [1,0,0,0,1,0|1,0,0]=3 292 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1nccn2 cb49b0bbac67f1f51d9b8771f4a1f9cb [1,0,0,0,1,0|2,0,0]=4 293 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cccc2c1ncnc2 5e7a16b19265d19c3c0d04e9c0b46bde [1,0,0,0,1,0|2,0,0]=4 294 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1ccnc2c1cccc2 b3d1efda3ad61d65eee6cc53d4e47714 [1,0,0,0,1,0|1,0,0]=3 295 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1ccnc2c1ccnc2 ff38704ab0e29323354537a7c958f73b [1,0,0,0,1,0|2,0,0]=4 296 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1ccnc2c1cncc2 3b182e13a6cb7fcb07c29f8691f75822 [1,0,0,0,1,0|2,0,0]=4 297 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1ccnc2c1nccc2 1fd3294e0fcc6d655d82816a5c8ce95f [1,0,0,0,1,0|2,0,0]=4 298 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cncc2c1cccc2 e3d920fe1311ecd60afdac53ab78d5cb [1,0,0,0,1,0|1,0,0]=3 299 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cncc2c1nccc2 04f527f3bb077491022693ddbfcf98e1 [1,0,0,0,1,0|2,0,0]=4 300 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1cnnc2c1cccc2 dea46e677a1d8e24323435c2c459b97c [1,0,0,0,1,0|2,0,0]=4 301 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1nccc2c1cccc2 790aff1e6e56376d0181bdc065e9a511 [1,0,0,0,1,0|1,0,0]=3 302 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1nccc2c1cccn2 7da8a47de315c1bf3572d00f8236dcd7 [1,0,0,0,1,0|2,0,0]=4 303 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1nccc2c1ccnc2 f2ca69b3f13fabfd5179ff4f1179e65d [1,0,0,0,1,0|2,0,0]=4 304 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1nccc2c1cncc2 fbef4c464e51edc26e159e95a9408cce [1,0,0,0,1,0|2,0,0]=4 305 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1nccc2c1nccc2 63c6f70c7a446e5fb2fa079c23b814fd [1,0,0,0,1,0|2,0,0]=4 306 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1ncnc2c1cccc2 d0298a67b3e6762accae3bc41a618c39 [1,0,0,0,1,0|2,0,0]=4 307 B21R2.49254128 CC(C)(C)C#C/C=C/CNc1nncc2c1cccc2 9a41d0d3a7b2625ab87fee78e44d00b7 [1,0,0,0,1,0|2,0,0]=4 308 B21R2.49254128 CC(C)(C)C#C/C=C/COc1cccc2c1cccc2 91ed9f3c90cb4a5e351fac81d8a4e146 [1,0,0,0,1,0|1,0,0]=3 309 B21R2.49254128 CC(C)(C)C#C/C=C/COc1cccc2c1cccn2 15715429a20928f9889ce952e9168c43 [1,0,0,0,1,0|2,0,0]=4 310 B21R2.49254128 CC(C)(C)C#C/C=C/COc1cccc2c1ccnc2 986c9237f3a739bae9d45ed7ed2d8e71 [1,0,0,0,1,0|2,0,0]=4 311 B21R2.49254128 CC(C)(C)C#C/C=C/COc1cccc2c1cncc2 ba638deb2eb535dc97073fca53dcfcae [1,0,0,0,1,0|2,0,0]=4 312 B21R2.49254128 CC(C)(C)C#C/C=C/COc1cccc2c1nccc2 4b03ed7ae51c44aa3528a5797e6ed76a [1,0,0,0,1,0|2,0,0]=4 313 B21R2.49254128 CC(C)(C)C#C/C=C/COc1ccnc2c1cccc2 edab752a2af7216cdd33c1f3f24b46bd [1,0,0,0,1,0|2,0,0]=4 314 B21R2.49254128 CC(C)(C)C#C/C=C/COc1cncc2c1cccc2 c6a7e354918317bc6212d6af99598d51 [1,0,0,0,1,0|2,0,0]=4 315 B21R2.49254128 CC(C)(C)C#C/C=C/COc1nccc2c1cccc2 8955e8169169c188cfa69a822853bd78 [1,0,0,0,1,0|2,0,0]=4 316 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1C=CCO2 de5a8328267a5fcba3b5de3a7a90749f [1,0,0,0,1,0|1,0,1]=4 317 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1cccn2 d6211ca7b45e830471c888fcc42116d2 [1,0,0,0,1,0|1,0,0]=3 318 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1ccnc2 542e539092f59d2e04beb4c718955a94 [1,0,0,0,1,0|1,0,0]=3 319 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1cncc2 1d2aa7df62013cb3fc44faaeae142e15 [1,0,0,0,1,0|1,0,0]=3 320 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1cncn2 bd2cb1e8b5c257b180b7817ea8bc771a [1,0,0,0,1,0|2,0,0]=4 321 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1cnnc2 59ece8a17f1b6cefd2ed6a7679bbbaad [1,0,0,0,1,0|2,0,0]=4 322 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1nccc2 3c4afb405ea99cbb8279b2c0e0e035c4 [1,0,0,0,1,0|1,0,0]=3 323 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1nccn2 99b37ae659ff66b7f4375d0fbc0474a0 [1,0,0,0,1,0|2,0,0]=4 324 B21R2.49254128 CC(C)(C)C#CC=CCNc1cccc2c1ncnc2 06070ca044c017c60a12a8f2b60c8753 [1,0,0,0,1,0|2,0,0]=4 325 B21R2.49254128 CC(C)(C)C#CC=CCNc1ccnc2c1cccc2 bb9b8182a202d80083540fbfd9932698 [1,0,0,0,1,0|1,0,0]=3 326 B21R2.49254128 CC(C)(C)C#CC=CCNc1ccnc2c1ccnc2 57563cfd31b2a3bd2fd9ace67e9c5d4b [1,0,0,0,1,0|2,0,0]=4 327 B21R2.49254128 CC(C)(C)C#CC=CCNc1ccnc2c1cncc2 e78bd603a8adb2413de0413d369ca662 [1,0,0,0,1,0|2,0,0]=4 328 B21R2.49254128 CC(C)(C)C#CC=CCNc1ccnc2c1nccc2 281bf13b2e4b3c73573317fe462219b1 [1,0,0,0,1,0|2,0,0]=4 329 B21R2.49254128 CC(C)(C)C#CC=CCNc1cncc2c1cccc2 f6be6343987ca5edd199ebdc6f6dafba [1,0,0,0,1,0|1,0,0]=3 330 B21R2.49254128 CC(C)(C)C#CC=CCNc1cncc2c1nccc2 3605916f23b650924acff3044777dacc [1,0,0,0,1,0|2,0,0]=4 331 B21R2.49254128 CC(C)(C)C#CC=CCNc1cnnc2c1cccc2 3d3b35ec8220e4ddef49d662104feca4 [1,0,0,0,1,0|2,0,0]=4 332 B21R2.49254128 CC(C)(C)C#CC=CCNc1nccc2c1cccc2 2af94d75252dcf313dc065d333ed4499 [1,0,0,0,1,0|1,0,0]=3 333 B21R2.49254128 CC(C)(C)C#CC=CCNc1nccc2c1cccn2 adfe0aeefacc796fb748ab08a6064179 [1,0,0,0,1,0|2,0,0]=4 334 B21R2.49254128 CC(C)(C)C#CC=CCNc1nccc2c1ccnc2 483624bc97e971fe836ddb3a17d69e64 [1,0,0,0,1,0|2,0,0]=4 335 B21R2.49254128 CC(C)(C)C#CC=CCNc1nccc2c1cncc2 6e72b8a3dfcc0d722076916b608fcd04 [1,0,0,0,1,0|2,0,0]=4 336 B21R2.49254128 CC(C)(C)C#CC=CCNc1nccc2c1nccc2 b7d1e22e88f133d010e22228ccb12ea0 [1,0,0,0,1,0|2,0,0]=4 337 B21R2.49254128 CC(C)(C)C#CC=CCNc1ncnc2c1cccc2 322ee8a86fb727c5b42f7a1c21f79792 [1,0,0,0,1,0|2,0,0]=4 338 B21R2.49254128 CC(C)(C)C#CC=CCNc1nncc2c1cccc2 879103bcd44cc68859b774963da51cd9 [1,0,0,0,1,0|2,0,0]=4 339 B21R2.49254128 CC(C)(C)C#CC=CCOc1cccc2c1cccc2 b4a0f66836b4e7e97639a2c116315c1e [1,0,0,0,1,0|1,0,0]=3 340 B21R2.49254128 CC(C)(C)C#CC=CCOc1cccc2c1cccn2 ef36c06ea38235355c742590ef7e4d89 [1,0,0,0,1,0|2,0,0]=4 341 B21R2.49254128 CC(C)(C)C#CC=CCOc1cccc2c1ccnc2 b74176b81f6bc6ae5e81b40d92134b63 [1,0,0,0,1,0|2,0,0]=4 342 B21R2.49254128 CC(C)(C)C#CC=CCOc1cccc2c1cncc2 d34450f155466629179a92b203b068d5 [1,0,0,0,1,0|2,0,0]=4 343 B21R2.49254128 CC(C)(C)C#CC=CCOc1cccc2c1nccc2 c0f79f0ab787b76ea1080bef98a8bf31 [1,0,0,0,1,0|2,0,0]=4 344 B21R2.49254128 CC(C)(C)C#CC=CCOc1ccnc2c1cccc2 9dc0dba1e61a13e6b6ffe83a05fdb848 [1,0,0,0,1,0|2,0,0]=4 345 B21R2.49254128 CC(C)(C)C#CC=CCOc1cncc2c1cccc2 8c87caf057ddce7f0c79e4541d90629a [1,0,0,0,1,0|2,0,0]=4 346 B21R2.49254128 CC(C)(C)C#CC=CCOc1nccc2c1cccc2 ff0ecc38826f5bc624591867104587c6 [1,0,0,0,1,0|2,0,0]=4 347 B21R2.49254128 CC(C)(C)C#CCNCCc1cccc2c1cccc2 745c8e08713e4f81ba47f9bbbd803945 [1,0,0,0,1,0|1,0,1]=4 348 B21R2.49254128 CC(C)(C)C#CCOCCc1cccc2c1cccc2 88b2b62b4ab3d89f700e4f646bde0f04 [1,0,0,0,1,0|1,0,1]=4 349 B21R2.27907 CN(C/C=C/C#CC(C)(C)C)c1n[nH]c2c1cccc2 a79c87a2e9fc05867ba844249993fbb2 [0,0,0,0,2,0|2,0,0]=4 350 B21R2.27907 CN(CC=CC#CC(C)(C)C)c1n[nH]c2c1cccc2 7448d48b94308ea463a92332861434a2 [0,0,0,0,2,0|2,0,0]=4 351 B21R2.20003910 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1[nH]nc2 7edda435cdf42ee96b4bad694d68983c [0,0,0,0,2,0|2,0,0]=4 352 B21R2.20003910 CN(C/C=C/C#CC(C)(C)C)c1cccc2c1cn[nH]2 ee44818588d71e5a0df5700cd8fd2c5f [0,0,0,0,2,0|2,0,0]=4 353 B21R2.20003910 CN(CC=CC#CC(C)(C)C)c1cccc2c1[nH]nc2 01dc85e2950a68bc4ca8f0559002f30f [0,0,0,0,2,0|2,0,0]=4 354 B21R2.20003910 CN(CC=CC#CC(C)(C)C)c1cccc2c1cn[nH]2 578686c409b7212f0e453f5607ddabd0 [0,0,0,0,2,0|2,0,0]=4 355 B21R2.63028977 CN(CC#CC(C)(C)C)Cc1cccc2c1cccn2 1bc01f9dacd7cd810d58c3bb84369a28 [0,0,0,0,2,0|1,0,0]=3 356 B21R2.63028977 CN(CC#CC(C)(C)C)Cc1cccc2c1nccc2 b9c0e5577c693b8dd0834ecd17493dbc [0,0,0,0,2,0|1,0,0]=3 357 B21R2.63028977 CN(CCOC(C)(C)C)Cc1cccc2c1cccc2 b0f69aca073feef7728628728662da77 [0,0,0,0,2,0|1,0,1]=4 358 B21R2.63028977 CN(CCSC(C)(C)C)Cc1cccc2c1cccc2 e3c4ec8c229d94a59b7115776c7f584a [0,0,0,0,2,0|1,0,1]=4 359 B23R1.21986 C=CCc1ccccc1OCCN(C)C/C=C/C#CC(C)(C)C e7d9f72ed9c9ca5255e9f53c0e2bca89 [0,0,1,0,0,1|0,0,2]=4 360 B23R1.21986 C=CCc1ccccc1OCCN(C)CC=CC#CC(C)(C)C 70a9d8740d560aad78a3da845daf8b44 [0,0,1,0,0,1|0,0,2]=4 361 B23R2.177048297 CC(C)(C)C#C/C=C/CNCCc1cccc2c1cccc2 e8a96ba8c37e4516add5328102a9b0ea [1,0,0,0,0,1|0,0,0]=2 362 B23R2.177048297 CC(C)(C)C#C/C=C/COCCc1cccc2c1cccc2 901acf9c81f63b9958a72063ea30bf60 [1,0,0,0,0,1|1,0,0]=3 363 B23R2.177048297 CC(C)(C)C#CC=CCNCCc1cccc2c1cccc2 cc18e44ed650ca15d7e840a659c2f01f [1,0,0,0,0,1|0,0,0]=2 364 B23R2.177048297 CC(C)(C)C#CC=CCOCCc1cccc2c1cccc2 ea6e6283b5116c7299c8e83df021df99 [1,0,0,0,0,1|1,0,0]=3 365 B23R2.17219 CC(Cc1c[nH]c2c1cccc2)OC/C=C/C#CC(C)(C)C 9a9c21b9fd85381c1e9867d6cc8bada7 [0,0,0,0,1,1|2,0,0]=4 366 B23R2.17219 CC(Cc1c[nH]c2c1cccc2)OCC=CC#CC(C)(C)C 7c66f1b1e8fb3644e2df31d3bd88b09a [0,0,0,0,1,1|2,0,0]=4 367 B23R2.17219 CC(Cn1ccc2c1cccc2)NC/C=C/C#CC(C)(C)C 89591f07921bf9903f06113e06b1baf1 [0,0,0,0,1,1|2,0,0]=4 368 B23R2.17219 CC(Cn1ccc2c1cccc2)NCC=CC#CC(C)(C)C 1afd35880183055dc35c7bf89becb6a2 [0,0,0,0,1,1|2,0,0]=4 369 B25R2.658763903 CC(CNC/C=C/C#CC(C)(C)C)Cc1cccc2c1cccc2 5557136cdd57c8d2f3625383e318b925 [0,0,0,0,0,2|1,0,0]=3 370 B25R2.658763903 CC(CNCC=CC#CC(C)(C)C)Cc1cccc2c1cccc2 35f047fd26170e5ae0ee22f233cf9d75 [0,0,0,0,0,2|1,0,0]=3