0 B11R1.180 C#CCNCc1ccoc1C 0f88adc41c64f75781cade2ba0dc7317 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.180 C#CCOCc1ccoc1C 67e4720f39ef057106c3f9e2ac473250 [0,0,0,0,0,0|1,1,2]=4 2 B11R1.180 C=CCNCc1ccoc1C ec84c9be9601d314c60e96deb09b826e [0,0,0,0,0,0|2,0,2]=4 3 B11R1.180 C=CCOCc1ccoc1C ccdf1f111165433cc2488d6fabf2ec8e [0,0,0,0,0,0|1,1,2]=4 4 B11R1.180 CCCCNc1c[nH]nc1C 7ba866d779bf74527404416d30183b5b [0,0,0,0,0,0|4,0,0]=4 5 B11R1.180 CCCCNc1cccn1C 832204d8dcb1af64b9a1e1bacf002b6c [0,0,0,0,0,0|4,0,0]=4 6 B11R1.180 CCCCNc1ccnn1C a3196577538969e3bb6f52df20715e6e [0,0,0,0,0,0|4,0,0]=4 7 B11R1.180 CCCCNc1ccsc1C 4b33baa6cbbf646d868e98b53b0470a5 [0,0,0,0,0,0|2,1,0]=3 8 B11R1.180 CCCCNc1cnoc1C 06e1e007241ba9f44cae98a7dd8c0607 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.180 CCCCNc1conc1C d01012fdbc395cb97b7a5a509c81d146 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.180 CCCCNc1cscc1C 5c336951b5fdc8b35a2bf4f94bff34c9 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.180 CCCCNc1csnc1C a71b8f19381ae2f86a3a73f8b33685a4 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.180 CCCCNc1nc[nH]c1C e43fb204ee6be9b704d66c54c6556238 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.180 CCCCNc1sccc1C b5489a4a5937f782ef16c288eda79112 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.180 CCCCNc1scnc1C a953d1ca90e919ae12ebf72c94309d02 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.180 CCCCOc1cccn1C 3d38f62a78a4cbc2c835f47b4346f2ef [0,0,0,0,0,0|3,1,0]=4 16 B11R1.180 CCCCOc1ccnn1C f4545c004733ab5578cd758bc8b4794e [0,0,0,0,0,0|3,1,0]=4 17 B11R1.180 CCCCOc1cn[nH]c1C cbc563a5e634dd456a93ddf84cf678da [0,0,0,0,0,0|3,1,0]=4 18 B11R1.180 CCCNCc1cccn1C 03b7e0880aeb897b9c2d7fe9e6746740 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.180 CCCNCc1ccnn1C 02a04c17cdfae46dbf2999b505a6577e [0,0,0,0,0,0|4,0,0]=4 20 B11R1.180 CCCNCc1ccoc1C 9b7aca05722c487e12991f3dd96e11a5 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.180 CCCNCc1ccsc1Br d092f3e072c3bd8ab8f486594492dbe0 [0,0,0,0,0,0|3,1,0]=4 22 B11R1.180 CCCNCc1ccsc1Cl c8e070f7ec2a3db227d0b6fffeb2259d [0,0,0,0,0,0|3,1,0]=4 23 B11R1.180 CCCNCc1cn[nH]c1C 6dc461c5ec27ff0bdf81ba5770cb4bb2 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.180 CCCNCc1cnoc1C 79bde8d385cc22817cef55cc6423fffa [0,0,0,0,0,0|3,0,0]=3 25 B11R1.180 CCCNCc1conc1C 2e4139fa527bca6eae4f45fd4112dd60 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.180 CCCNCc1nc[nH]c1C b4ee81087d6d861bb39eaf8e0b9fec16 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.180 CCCNCc1ncoc1C 6d29ef65f19496e8aed372eb2d4a8834 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.180 CCCNCc1occc1C 297d9026c2421572c3fef990f3888ecd [0,0,0,0,0,0|4,0,0]=4 29 B11R1.180 CCCNCc1scnc1C c2523451deed12d729c1b04cfc7b37a1 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.180 CCCOCc1c[nH]nc1C 13ecc368c1e41c6eb26effbab4e16c1a [0,0,0,0,0,0|3,1,0]=4 31 B11R1.180 CCCOCc1cccn1C 3f039c6ca2029fab4442f6776b28e5ad [0,0,0,0,0,0|3,1,0]=4 32 B11R1.180 CCCOCc1ccnn1C 056491d84ce79051af505f30b7e0efdf [0,0,0,0,0,0|3,1,0]=4 33 B11R1.180 CCCOCc1ccoc1C b1737bdc651811f3eec4c295512263cc [0,0,0,0,0,0|1,1,0]=2 34 B11R1.180 CCCOCc1ccsc1Br 985f21b203d9feec00e11ab57362f21f [0,0,0,0,0,0|2,2,0]=4 35 B11R1.180 CCCOCc1ccsc1Cl 9dca3ad0cb6ff71b2def9c016a36a893 [0,0,0,0,0,0|2,2,0]=4 36 B11R1.180 CCCOCc1cnoc1C 08219f3eaef3ef2eab702e1be1dbf4f2 [0,0,0,0,0,0|2,1,0]=3 37 B11R1.180 CCCOCc1cscc1C 0f70923c664481648ce69b60291255fb [0,0,0,0,0,0|3,1,0]=4 38 B11R1.180 CCCOCc1nc[nH]c1C 85b1c42f98bee0f5c3b0b32c335c2ac6 [0,0,0,0,0,0|3,1,0]=4 39 B11R1.180 CCCOCc1ncoc1C 8aa4d87f3069c06b031eec5ba6b30f14 [0,0,0,0,0,0|2,1,0]=3 40 B11R1.180 CCCOCc1ncsc1C acc9fcff4d686116621f10969b0f707e [0,0,0,0,0,0|2,2,0]=4 41 B11R1.180 CCCOCc1occc1C 41560230818bf69c71c16c988d078fb0 [0,0,0,0,0,0|3,1,0]=4 42 B11R1.180 CCCOCc1ocnc1C 218849497850e36b842606f5c4cde9c9 [0,0,0,0,0,0|3,1,0]=4 43 B11R1.180 CCCOCc1sccc1C f1db515b4bc7ba1569929001c68c4beb [0,0,0,0,0,0|3,1,0]=4 44 B11R1.180 CCCOCc1scnc1C 0f93c70fa6bce92185614499be1b9f8e [0,0,0,0,0,0|3,1,0]=4 45 B11R1.180 CCOCNc1cnoc1C 847e13770946342f1728e047c27390eb [0,0,0,0,0,0|4,0,0]=4 46 B11R1.180 COCCNc1ccsc1C 219f44c9bda3381e21d30ebf02a73b51 [0,0,0,0,0,0|3,1,0]=4 47 B11R1.180 COCCNc1cnoc1C 430675b7d483ff8b22fb4419389ef56b [0,0,0,0,0,0|4,0,0]=4 48 B11R1.180 COCCNc1ncoc1C ac2b8d69da68cf126265710cd0d2920d [0,0,0,0,0,0|4,0,0]=4 49 B11R1.180 COCNCc1ccoc1C 5360e413a6f512dd75cee418b6c0e6d4 [0,0,0,0,0,0|3,0,0]=3 50 B11R1.180 COCNCc1cnoc1C 41244a32cc7dfdffa0217a657f6425e8 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.180 COCNCc1ncoc1C d96671b84bdc7a91521243d015ec645e [0,0,0,0,0,0|4,0,0]=4 52 B11R1.180 COCOCc1ccoc1C c4a1a94e4ddd0b66d18e5dae394021e7 [0,0,0,0,0,0|2,1,0]=3 53 B11R1.180 COCOCc1cnoc1C b0a10c6e5b6f6d13c8416696330929e8 [0,0,0,0,0,0|3,1,0]=4 54 B11R1.180 COCOCc1ncoc1C 602814d6014ebf0c0ce5d1853ffae6b6 [0,0,0,0,0,0|3,1,0]=4 55 B11R1.180 CSCCNc1ccsc1C 5719a61f72422499ab32c6cdfca459ec [0,0,0,0,0,0|3,1,0]=4 56 B11R1.180 CSCCNc1cnoc1C f613b527850e81876e0b0d117d3165fb [0,0,0,0,0,0|4,0,0]=4 57 B11R1.180 CSCNCc1ccoc1C f61a64662685daa3bbf506f43feb739a [0,0,0,0,0,0|3,0,0]=3 58 B11R1.180 CSCNCc1cnoc1C 5cdb1c3ba722efb2634f70776c419aaa [0,0,0,0,0,0|4,0,0]=4 59 B11R1.180 CSCNCc1ncoc1C 8c276553353ae9a5a7f99e2e9cc05e58 [0,0,0,0,0,0|4,0,0]=4 60 B11R1.180 CSCOCc1ccoc1C c3f7c354536b3376450f24dada3cc39d [0,0,0,0,0,0|2,1,0]=3 61 B11R1.180 CSCOCc1cnoc1C fdba0f8d44e5c92c2fffe5914f5642c8 [0,0,0,0,0,0|3,1,0]=4 62 B11R1.180 CSCOCc1ncoc1C 261f3fdf89dedce6e1e1bb8c73cdbf21 [0,0,0,0,0,0|3,1,0]=4 63 B11R1.180 Cc1occc1CNCC#N fc132e1baa1f2ef1e82c42585b6fd6cd [0,0,0,0,0,0|3,0,1]=4 64 B11R1.180 Cc1occc1CNCC=O 4212b4f4e050c29e596b6eab4a090e81 [0,0,0,0,0,0|3,0,1]=4 65 B11R1.180 Cc1occc1CNCCF d94ca0baf15a92916089730ee9d752fd [0,0,0,0,0,0|3,0,0]=3 66 B11R1.180 Cc1occc1CNCCO d4c3f8f5eecd5b2cdd03064d37af6a76 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.180 Cc1occc1CNCCS d9f97e12b82a36a654281c39f47b7552 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.180 Cc1occc1COCC#N 59b736366643ac2bbab14169f1f26971 [0,0,0,0,0,0|2,1,1]=4 69 B11R1.180 Cc1occc1COCC=O 4f4c3353bd6eaa2a6bfacd9f9525f421 [0,0,0,0,0,0|2,1,1]=4 70 B11R1.180 Cc1occc1COCCF 3021869965a6c0b01786a5dbaade5e02 [0,0,0,0,0,0|2,1,0]=3 71 B11R1.180 Cc1occc1COCCS 91882e98a7348377767cb84a1410f6a2 [0,0,0,0,0,0|2,1,0]=3 72 B11R1.180 Cc1ocnc1CNCCBr 21295d4acc13c2b0903923b4b30e8293 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.180 Cc1ocnc1CNCCF 90efc05aaa6e60f6a0cde0ce9332582f [0,0,0,0,0,0|4,0,0]=4 74 B11R1.180 Cc1ocnc1CNCCI 77997c58a288389a304c558e9ee9f2f0 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.180 Cc1ocnc1CNCCO 35bc37ad87359796ab6fb46a274690dc [0,0,0,0,0,0|4,0,0]=4 76 B11R1.180 Cc1ocnc1CNCCS d2ac13d6e5fb554b705dbdb7723131bf [0,0,0,0,0,0|4,0,0]=4 77 B11R1.180 Cc1ocnc1COCCF 8aafcd164bda2c5fb74619acbf8429bc [0,0,0,0,0,0|3,1,0]=4 78 B11R1.180 Cc1ocnc1COCCS fcc20905781869b3be9715ea6f40ab0e [0,0,0,0,0,0|3,1,0]=4 79 B11R1.180 Cc1oncc1CNCCF 0c92432690354e90028093a32a993e9b [0,0,0,0,0,0|4,0,0]=4 80 B11R1.180 Cc1oncc1CNCCO 2a729cdb364ba03039f774ed5f264bcf [0,0,0,0,0,0|4,0,0]=4 81 B11R1.180 Cc1oncc1CNCCS 24f3f8bddb7b437cfb0d9b1aa7c885ff [0,0,0,0,0,0|4,0,0]=4 82 B11R1.180 Cc1oncc1COCCF e4b5a66e2fff526b55abef912be7e51d [0,0,0,0,0,0|3,1,0]=4 83 B11R1.180 Cc1oncc1COCCS 66428072dff8807248065ecc50894f4d [0,0,0,0,0,0|3,1,0]=4 84 B11R1.180 Cc1oncc1NCCCCl 2f4030062b0c73677bf019e7d06cfdd0 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.180 Cc1oncc1NCCCF e1c70c16f124c8adc7df2b9f3b70602a [0,0,0,0,0,0|4,0,0]=4 86 B11R1.180 Cc1oncc1NCCCO db90b49d86ae2366f137105a813f7eb2 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.180 Cc1oncc1NCCCS 3ac1fdcf15a48aac0385bc8b0a757caa [0,0,0,0,0,0|4,0,0]=4 88 B11R1.180 Cc1sccc1NCCCCl b1fbe0c950a7c04a78400fa8001004d9 [0,0,0,0,0,0|3,1,0]=4 89 B11R1.180 Cc1sccc1NCCCF 4147f2fbc75f304ffc1cf03a19d65200 [0,0,0,0,0,0|3,1,0]=4 90 B11R1.180 Cc1sccc1NCCCO 7b64a2800d735c7156cd91e5ce0c349d [0,0,0,0,0,0|3,1,0]=4 91 B11R1.180 Cc1sccc1NCCCS 25e344f87018c6a16f4a60ed0dc6d7e0 [0,0,0,0,0,0|3,1,0]=4 92 B10R1.21 CCCCNc1ccoc1 640322940a87afc9d827bccc7d39ae5e [1,0,0,0,0,0|2,0,0]=3 93 B10R1.21 CCCCNc1ccon1 1d9d6f5bb9f6f4fb68fa3ea6f9775ccf [1,0,0,0,0,0|3,0,0]=4 94 B10R1.21 CCCCNc1ccsc1 c64d8e4067791c5f42e37c69db44e430 [1,0,0,0,0,0|2,1,0]=4 95 B10R1.21 CCCCNc1cnoc1 474ec08f2cd5668c618cfc570fa683ea [1,0,0,0,0,0|3,0,0]=4 96 B10R1.21 CCCCNc1cocn1 5e3b989a44937a5b280cf60b71051b69 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.21 CCCCOc1ccsc1 770f8463a70d6c9063754e6f8e52cc5c [1,0,0,0,0,0|1,2,0]=4 98 B10R1.21 CCCCOc1cnoc1 6a0fd273c0dcce1610f7a86307d56b4d [1,0,0,0,0,0|2,1,0]=4 99 B10R1.21 CCCNCc1cc[nH]c1 4f9270308a7b6b414b088262dd2b2c1b [1,0,0,0,0,0|3,0,0]=4 100 B10R1.21 CCCNCc1ccoc1 77a12cc2355259eba3cfabf094f8d919 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.21 CCCNCc1ccon1 b53b608ddf693d3fc343683f463fb7fb [1,0,0,0,0,0|3,0,0]=4 102 B10R1.21 CCCNCc1ccsc1 66232677ec2023d5a802635b8a1a6d73 [1,0,0,0,0,0|2,1,0]=4 103 B10R1.21 CCCNCc1cnoc1 963df51a2c52fd8246246a64fb287d32 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.21 CCCNCc1cocn1 bcb4047e77ac4a450a61a0c44cb5b21f [1,0,0,0,0,0|3,0,0]=4 105 B10R1.21 CCCOCc1cc[nH]c1 1c6e3834cbfb57fddc05135d2d1d0cc0 [1,0,0,0,0,0|2,1,0]=4 106 B10R1.21 CCCOCc1ccoc1 350ab1ab3ec612f4eb7fb879044afc2a [1,0,0,0,0,0|1,1,0]=3 107 B10R1.21 CCCOCc1ccon1 0508f50b820a2ac57642da204033d6af [1,0,0,0,0,0|2,1,0]=4 108 B10R1.21 CCCOCc1ccsc1 c1bc026f3b06598ff523439403fe1fe6 [1,0,0,0,0,0|1,2,0]=4 109 B10R1.21 CCCOCc1cnoc1 13b3b6fb4f7bd579698ee3e4721f7f7a [1,0,0,0,0,0|2,1,0]=4 110 B10R1.21 CCCOCc1cocn1 0f71bb305c19415a7537676a4224728c [1,0,0,0,0,0|2,1,0]=4 111 B10R1.21 CCOCCc1ccoc1 036407c3a22d5cc5d73147c1dce3e7e4 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.21 COCCNc1ccoc1 9d6bf01177d31be17a28caf95f550025 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.21 COCNCc1ccoc1 b9bee659116f1fbfd5e48ad504ac6d3a [1,0,0,0,0,0|3,0,0]=4 114 B10R1.21 CSCCNc1ccoc1 1d0567434f0a48bd98518f53a448361e [1,0,0,0,0,0|3,0,0]=4 115 B10R1.21 CSCNCc1ccoc1 9ad7cde6fc8060ab0463b8cc53c45142 [1,0,0,0,0,0|3,0,0]=4 116 B10R1.21 CSCOCc1ccoc1 ba96e166b002fa1da107846027ed2a16 [1,0,0,0,0,0|2,1,0]=4 117 B10R1.21 ClCCCNc1ccoc1 45cbe26bd89149fd3b41290c34621bb6 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.21 FCCNCc1ccoc1 88527084bc9c645453ef6e2c7422530b [1,0,0,0,0,0|3,0,0]=4 119 B10R1.21 FCCOCc1ccoc1 10bfd977f72341b62d2bfca992e3d43b [1,0,0,0,0,0|2,1,0]=4 120 B10R1.21 OCCCNc1ccoc1 a2c22332826702b9812fcc31344f26aa [1,0,0,0,0,0|3,0,0]=4 121 B10R1.21 OCCNCc1ccoc1 e28b91217cb847e46f31456c51055291 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.21 SCCNCc1ccoc1 1e09f98aead9483e49c58b3836e927e3 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.21 SCCOCc1ccoc1 98d19ae76b74624ea52c5c78c7b3cddf [1,0,0,0,0,0|2,1,0]=4 124 B10R1.29 CCCNc1c[nH]nc1C 2a3c6954ff42dd1962bdfa3411b5f776 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.29 CCCNc1ccnn1C ac2723158833494ae34194bb87079e2a [1,0,0,0,0,0|3,0,0]=4 126 B10R1.29 CCCNc1ccsc1C a372e2f3816660711e96911387a99aaa [1,0,0,0,0,0|1,1,0]=3 127 B10R1.29 CCCNc1cnoc1C 84d95d6abf6ae0156f5c87f1ea982d71 [1,0,0,0,0,0|2,0,0]=3 128 B10R1.29 CCCNc1conc1C bb60cf7c9c66e5a810c9734f7729da9e [1,0,0,0,0,0|3,0,0]=4 129 B10R1.29 CCCNc1cscc1C e30ea8bbf40bd7ba51b0312f1cf20d8b [1,0,0,0,0,0|3,0,0]=4 130 B10R1.29 CCCNc1csnc1C ac8d73c2619da3bc0e71cf48be00d4c1 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.29 CCCNc1scnc1C 8ea9fcb5aa8469e9b9552a4f260d83dd [1,0,0,0,0,0|3,0,0]=4 132 B10R1.29 CCCOc1cccn1C 77a3a251f2ad5d72ac49e0d4902500cc [1,0,0,0,0,0|2,1,0]=4 133 B10R1.29 CCCOc1ccnn1C 4f9c9cf7f6632f8ccce0de7ef6f0fe94 [1,0,0,0,0,0|2,1,0]=4 134 B10R1.29 CCCOc1cn[nH]c1C f5b400612a01431fc0336f504e2b02da [1,0,0,0,0,0|2,1,0]=4 135 B10R1.29 CCNCc1ccoc1C 37875bf99e24435822de4bec2aaa3263 [1,0,0,0,0,0|2,0,0]=3 136 B10R1.29 CCNCc1cnoc1C 86c68718ee9a3babc5642fd92ed3b26f [1,0,0,0,0,0|3,0,0]=4 137 B10R1.29 CCNCc1ncoc1C 1fde5cae72cb3a5574bf15138744fb93 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.29 CCOCc1ccoc1C eae898938246cdd68c7bd43fc9c7f9c1 [1,0,0,0,0,0|1,1,0]=3 139 B10R1.29 CCOCc1cnoc1C 757f95ea1f7f57b953d726800521ae4e [1,0,0,0,0,0|2,1,0]=4 140 B10R1.29 CCOCc1ncoc1C 9a2a1aa1173211c6287b8fde5c32c63d [1,0,0,0,0,0|2,1,0]=4 141 B10R1.29 COCNc1ccsc1C 3b6f44b0065f692a170f9d5d75bd7ace [1,0,0,0,0,0|2,1,0]=4 142 B10R1.29 COCNc1cnoc1C 3ff55d935a9915c786e8aba29d2f8b19 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.29 CSCNc1ccsc1C 9fa53d4f27969fa38b58e7961a53a56f [1,0,0,0,0,0|2,1,0]=4 144 B10R1.29 CSCNc1cnoc1C ec33ae820e902c2a9b378577ee90bce2 [1,0,0,0,0,0|3,0,0]=4 145 B10R1.29 Cc1occc1CNCF debbb46e003ef38737ad013d4d2082c4 [1,0,0,0,0,0|3,0,0]=4 146 B10R1.29 Cc1occc1CNCO 4fc10a8ae65b3f0bb432accc32f35890 [1,0,0,0,0,0|3,0,0]=4 147 B10R1.29 Cc1occc1COCF c540d7b4f63007ff9017777dfd157adb [1,0,0,0,0,0|2,1,0]=4 148 B10R1.29 Cc1oncc1NCCF 9234bbfae6a715a040da1859fe7ec1e9 [1,0,0,0,0,0|3,0,0]=4 149 B10R1.29 Cc1oncc1NCCO ce07c41a61dc6e026a4d2fd8b4694547 [1,0,0,0,0,0|3,0,0]=4 150 B10R1.29 Cc1oncc1NCCS 698110539779eec7399d1d7c2953f811 [1,0,0,0,0,0|3,0,0]=4 151 B10R1.29 Cc1sccc1NCCBr fc52c130ed88866be4775db4af864018 [1,0,0,0,0,0|2,1,0]=4 152 B10R1.29 Cc1sccc1NCCF 7812a3b4ff1c0b6940d0df24124110ea [1,0,0,0,0,0|2,1,0]=4 153 B10R1.29 Cc1sccc1NCCI a8b77651892394fd120db7db54da458e [1,0,0,0,0,0|2,1,0]=4 154 B10R1.29 Cc1sccc1NCCO c0f2f4a2cfb28eb9d2f7052ce9280b59 [1,0,0,0,0,0|2,1,0]=4 155 B10R1.29 Cc1sccc1NCCS 98ce751c64e6c849319f91682ca82365 [1,0,0,0,0,0|2,1,0]=4 156 B12R1.45 CCCCNc1ccoc1C#N 284bf6cf2e54a166feade7983b13213d [0,1,0,0,0,0|2,0,1]=4 157 B12R1.45 CCCCNc1ccoc1C=O 6518f356549757c51bbb94bd0d68b142 [0,1,0,0,0,0|2,0,1]=4 158 B12R1.45 CCCCNc1ccsc1CC e7279808ae1c03b84f426620fdc73c2c [0,1,0,0,0,0|2,1,0]=4 159 B12R1.45 CCCCNc1ccsc1CO 339b49013244cbe0afa00bf6b51dced2 [0,1,0,0,0,0|2,1,0]=4 160 B12R1.45 CCCCNc1ccsc1SC 227c9c5bc6dd58127ac20e65a8279e3b [0,1,0,0,0,0|2,1,0]=4 161 B12R1.45 OCCCNc1ccoc1CO a0e28b973ac02efa8203e9aba7be4072 [0,1,0,0,0,0|3,0,0]=4 162 B12R1.45 OCc1occc1NCCCCl 3fe26883e0b3d529bebb82bc5ba1c971 [0,1,0,0,0,0|3,0,0]=4 163 B12R1.130 C=C(C)CNCc1ccoc1C 987e49606e0804d1c4e2dc5ce33d32b8 [0,1,0,0,0,0|2,0,1]=4 164 B12R1.130 C=C(C)COCc1ccoc1C 907739ae1af6903ca7a95cfc157d21e2 [0,1,0,0,0,0|1,1,1]=4 165 B12R1.130 Cc1occc1CNCC(C)C af71ba4b0b75bffb6291390bfb4b4610 [0,1,0,0,0,0|2,0,0]=3 166 B12R1.130 Cc1occc1CNCC(C)O a948a66c9c30da4c9dceeb03a421cbfc [0,1,0,0,0,0|2,0,0]=3 167 B12R1.130 Cc1occc1CNCC(F)F e3dc370d8c180477cd2d8eb3bd2a305e [0,1,0,0,0,0|3,0,0]=4 168 B12R1.130 Cc1occc1CNCN(C)C 78e82da0b93857a6b51e528d828f9f78 [0,1,0,0,0,0|3,0,0]=4 169 B12R1.130 Cc1occc1CNC[C@@H](C)O 46f8b383feec70c46aaff9e2f7e3ebfa [0,1,0,0,0,0|2,0,0]=3 170 B12R1.130 Cc1occc1CNC[C@H](C)O 1781683793b0a46f849772ae1b6060a6 [0,1,0,0,0,0|2,0,0]=3 171 B12R1.130 Cc1occc1COCC(C)C 1cedc13c79d1aef86033cb89be109cf3 [0,1,0,0,0,0|1,1,0]=3 172 B12R1.130 Cc1occc1COCC(F)F 7d03e2c44427a727b89f8974aa4d195f [0,1,0,0,0,0|2,1,0]=4 173 B12R1.130 Cc1occc1COCN(C)C 05d038615f259bd0878faf1193ae4b76 [0,1,0,0,0,0|2,1,0]=4 174 B12R1.130 Cc1ocnc1CNCC(C)C 5932005589cc159ace4db2bb2a121970 [0,1,0,0,0,0|3,0,0]=4 175 B12R1.130 Cc1ocnc1CNCC(C)O 89bbb256455c8aebfed251e40a56a67b [0,1,0,0,0,0|3,0,0]=4 176 B12R1.130 Cc1ocnc1CNC[C@@H](C)O 81a10b60f2f3aa39525221da850924de [0,1,0,0,0,0|3,0,0]=4 177 B12R1.130 Cc1ocnc1CNC[C@H](C)O 3e82afcd1dc01dd7230d257251aaa0ed [0,1,0,0,0,0|3,0,0]=4 178 B12R1.130 Cc1ocnc1COCC(C)C 22b708f99827a46eaa60588d5ae17adf [0,1,0,0,0,0|2,1,0]=4 179 B12R1.130 Cc1ocnc1COCC(C)F 0df2c4cdf9b53d77007d4a33d601fab3 [0,1,0,0,0,0|2,1,0]=4 180 B12R1.130 Cc1ocnc1COCC(C)S 4efa2cca6ad81f331e6bf7d12f124928 [0,1,0,0,0,0|2,1,0]=4 181 B12R1.130 Cc1ocnc1COC[C@@H](C)F 3654caa525105757d081f173cd7ad2e4 [0,1,0,0,0,0|2,1,0]=4 182 B12R1.130 Cc1ocnc1COC[C@H](C)F e9c5773fd04beccae0e935201d5641fc [0,1,0,0,0,0|2,1,0]=4 183 B12R1.130 Cc1oncc1CNCC(C)C 5514983798960a056ca0252175614c5b [0,1,0,0,0,0|3,0,0]=4 184 B12R1.130 Cc1oncc1CNCC(C)O 2b77717b77f8f5873b0c24a761100a6b [0,1,0,0,0,0|3,0,0]=4 185 B12R1.130 Cc1oncc1CNC[C@@H](C)O b626dc95dd4a87c124fb968460ddc8d4 [0,1,0,0,0,0|3,0,0]=4 186 B12R1.130 Cc1oncc1CNC[C@H](C)O 4b5f3682a7280fa10fb62589f506d0c4 [0,1,0,0,0,0|3,0,0]=4 187 B12R1.130 Cc1oncc1COCC(C)C 222a8a1d0cf842b4d7ffc899f497e932 [0,1,0,0,0,0|2,1,0]=4 188 B12R1.130 Cc1oncc1NCCC(C)C 467880606db9adf9a36a94a221a46537 [0,1,0,0,0,0|3,0,0]=4 189 B12R1.130 Cc1oncc1NCCC(C)O 52841db4963b65ebaf95b452837f29e1 [0,1,0,0,0,0|3,0,0]=4 190 B12R1.130 Cc1sccc1NCCC(C)C 30680ca337e38e1f35658bda18c95d53 [0,1,0,0,0,0|2,1,0]=4 191 B12R1.130 Cc1sccc1NCCC(C)O 7ccfd70ab80cad0020ba71024e94e536 [0,1,0,0,0,0|2,1,0]=4 192 B12R1.130 Cc1sccc1NCC[C@@H](C)O c94d920c1d1b2b1517fe9ea45509872d [0,1,0,0,0,0|2,1,0]=4 193 B12R1.130 Cc1sccc1NCC[C@H](C)O 14244b6b1c27278ed5e7b00e5f47e130 [0,1,0,0,0,0|2,1,0]=4 194 B12R1.318 CCCC(=O)Nc1ccsc1C bfb1edbe55b1a7d1229972d55a90c9a9 [0,1,0,0,0,0|2,1,0]=4 195 B12R1.318 CCCC(=O)Nc1cnoc1C 6ad942741fb6fa9d67d9b565c95cd333 [0,1,0,0,0,0|3,0,0]=4 196 B12R1.318 CCCC(C)Nc1ccsc1C 7fd51091459c4d5210b3684d7f1b2da0 [0,1,0,0,0,0|2,1,0]=4 197 B12R1.318 CCCC(C)Nc1cnoc1C 538f5a4eeaafd460d716cec324b03a33 [0,1,0,0,0,0|3,0,0]=4 198 B12R1.318 CCCN(C)Cc1ccoc1C c68e875cf6a6ed33b99ea6c0dcb51dae [0,1,0,0,0,0|2,0,0]=3 199 B12R1.318 COCN(C)Cc1ccoc1C 6c7e9d7c9d19cc4ff2e0a66b11387193 [0,1,0,0,0,0|3,0,0]=4 200 B12R1.318 CSCN(C)Cc1ccoc1C deca5ca3b22e869591b3bc8f6a4845ec [0,1,0,0,0,0|3,0,0]=4 201 B12R1.318 Cc1occc1CN(C)CCF 84c674ba44cd834c14852a8a0fe1f9a2 [0,1,0,0,0,0|3,0,0]=4 202 B12R1.318 Cc1occc1CN(C)CCO 1bf9297ef973d033765cd52ef60aceec [0,1,0,0,0,0|3,0,0]=4 203 B12R1.318 Cc1occc1CN(C)CCS 5f680741d5b764020355029cda3bf8fa [0,1,0,0,0,0|3,0,0]=4 204 B12R1.353 CCC(=O)NCc1ccoc1C 5db4cc0dbf09788b126a3667e59579ef [0,1,0,0,0,0|2,0,1]=4 205 B12R1.353 CCC(C)CNc1ccsc1C 3c92025c763bd3ea405a319dc6905590 [0,1,0,0,0,0|2,1,0]=4 206 B12R1.353 CCC(C)CNc1cnoc1C 71729abcf6a8a21bb6befa8e8e03b7b5 [0,1,0,0,0,0|3,0,0]=4 207 B12R1.353 CCC(C)NCc1ccoc1C 6a5841c4899dba9fca34ff1c28d02452 [0,1,0,0,0,0|2,0,0]=3 208 B12R1.353 CCC(C)NCc1cnoc1C 45001ed40efc1cbfb070c730a89865b5 [0,1,0,0,0,0|3,0,0]=4 209 B12R1.353 CCC(C)OCc1ccoc1C ad9a198a0639a7d013ef962de4601f93 [0,1,0,0,0,0|1,1,0]=3 210 B12R1.353 CCC(C)OCc1cnoc1C 73fec5ee4575ab8adecaccb61d660e78 [0,1,0,0,0,0|2,1,0]=4 211 B12R1.353 CCC(C)OCc1ncoc1C bfd7f5d6c13ab0acfa85afa961c49802 [0,1,0,0,0,0|2,1,0]=4 212 B12R1.353 CCC(O)CNc1cnoc1C 149862a5644114ada803c7a2e60857a0 [0,1,0,0,0,0|3,0,0]=4 213 B12R1.353 CC[C@@H](C)CNc1ccsc1C 8b587aecf67e7bbb6d66d1c941555395 [0,1,0,0,0,0|2,1,0]=4 214 B12R1.353 CC[C@@H](C)CNc1cnoc1C 2ace6fad9536c7417a6df6389e2d9188 [0,1,0,0,0,0|3,0,0]=4 215 B12R1.353 CC[C@@H](C)OCc1ncoc1C 6f0da5ec5f198c0354701103e78517ee [0,1,0,0,0,0|2,1,0]=4 216 B12R1.353 CC[C@H](C)CNc1ccsc1C bb1e4c42961b453142f07ed11c25efd0 [0,1,0,0,0,0|2,1,0]=4 217 B12R1.353 CC[C@H](C)CNc1cnoc1C 5b8a90233e98c6327666a9877ef754d0 [0,1,0,0,0,0|3,0,0]=4 218 B12R1.353 CC[C@H](C)OCc1ncoc1C 0fbee213839116bb56bb35f5cba96d22 [0,1,0,0,0,0|2,1,0]=4 219 B12R1.353 Cc1occc1CNC(C)CO 00721bbef49a3b7d873584a8732be122 [0,1,0,0,0,0|3,0,0]=4 220 B12R1.353 Cc1occc1CN[C@@H](C)CO 079d998fc636abfb6eebdeebdb4bb4d9 [0,1,0,0,0,0|3,0,0]=4 221 B12R1.353 Cc1occc1CN[C@H](C)CO 561dc6402c43f5bfc96bef913f5dd8f6 [0,1,0,0,0,0|3,0,0]=4 222 B12R1.372 C#CCCNCc1ccoc1C 5f04903b5c1d39ace8047fa15d3ec575 [0,1,0,0,0,0|2,0,1]=4 223 B12R1.372 C#CCCOCc1ccoc1C a93fdd6f0f4ca9f81dffd509bc72bde9 [0,1,0,0,0,0|1,1,1]=4 224 B12R1.372 C/C=C/CNCc1ccoc1C 7b4ba2dacc95f51e1af7910495fe2ff9 [0,1,0,0,0,0|2,0,1]=4 225 B12R1.372 C/C=C/COCc1ccoc1C cc16fe767d2aa7e933944ccfa367ce43 [0,1,0,0,0,0|1,1,1]=4 226 B12R1.372 C/C=C\CNCc1ccoc1C cdc6af1db4fdae8ef4bec4ac03eb927b [0,1,0,0,0,0|2,0,1]=4 227 B12R1.372 C/C=C\COCc1ccoc1C 90ffcf074a9258cab73a7df274031aa3 [0,1,0,0,0,0|1,1,1]=4 228 B12R1.372 C=CCCNCc1ccoc1C d6f209d502dd6771e36153d21e93535c [0,1,0,0,0,0|2,0,1]=4 229 B12R1.372 C=CCCOCc1ccoc1C fc7a3fa928fc2709d0e18ef8042a3a45 [0,1,0,0,0,0|1,1,1]=4 230 B12R1.372 CCCCCNc1ccsc1C 4ef7c6d61cb81ed140c71a5d21189f75 [0,1,0,0,0,0|2,1,0]=4 231 B12R1.372 CCCCCNc1cnoc1C 9db0b47756d200bee0fa39e29eadae92 [0,1,0,0,0,0|3,0,0]=4 232 B12R1.372 CCCCNCc1ccoc1C 0aaca2b7d591bc7ed7f1879f1eeaab8c [0,1,0,0,0,0|2,0,0]=3 233 B12R1.372 CCCCNCc1cnoc1C 9816249b831d40b5ad1d2c1a12199904 [0,1,0,0,0,0|3,0,0]=4 234 B12R1.372 CCCCNCc1ncoc1C f9da1b5ac3d7ab989cc60c088864aa33 [0,1,0,0,0,0|3,0,0]=4 235 B12R1.372 CCCCOCc1ccoc1C f10d80c1044dcc88e0cde7e9a16d8dad [0,1,0,0,0,0|1,1,0]=3 236 B12R1.372 CCCCOCc1cnoc1C 6cb5fa633fbf352fc3e8e33d3b69623f [0,1,0,0,0,0|2,1,0]=4 237 B12R1.372 CCCCOCc1ncoc1C 5589bb8ee9941dcb58c0ed972e8b6afe [0,1,0,0,0,0|2,1,0]=4 238 B12R1.372 CCOCCNc1ccsc1C 51f5d45ad34ff925cfcba039723043a6 [0,1,0,0,0,0|2,1,0]=4 239 B12R1.372 CCOCCNc1cnoc1C 13e5e223b801b5e0af0b52a215443cf9 [0,1,0,0,0,0|3,0,0]=4 240 B12R1.372 CCOCCNc1ncoc1C 4b3b1bb25f038bc3a807b9d31bda7c92 [0,1,0,0,0,0|3,0,0]=4 241 B12R1.372 CCOCNCc1ccoc1C 66083ee223750fdf7940223e8b8a09e3 [0,1,0,0,0,0|2,0,0]=3 242 B12R1.372 CCOCNCc1cnoc1C 9700ba4fa36842d223dd6636c935676b [0,1,0,0,0,0|3,0,0]=4 243 B12R1.372 CCOCNCc1ncoc1C 4a6bfe0f39234327c572b4c65d90bfe6 [0,1,0,0,0,0|3,0,0]=4 244 B12R1.372 CCOCOCc1ccoc1C a3a1ee232072e32e9e4ab27136843ce8 [0,1,0,0,0,0|1,1,0]=3 245 B12R1.372 CCSCCNc1ccsc1C 3be73b1d2a557fb14fcf4eb91bd543f2 [0,1,0,0,0,0|2,1,0]=4 246 B12R1.372 CCSCCNc1cnoc1C 1741ea5c7c03e3889588f1811a311e70 [0,1,0,0,0,0|3,0,0]=4 247 B12R1.372 COCCCNc1ccsc1C 7d57a3756953828f27955b2d0046b325 [0,1,0,0,0,0|2,1,0]=4 248 B12R1.372 COCCCNc1cnoc1C 9f25d0e25dab69ed34847f79ea4abd41 [0,1,0,0,0,0|3,0,0]=4 249 B12R1.372 COCCNCc1ccoc1C a9abaf9df98d8cdd9f8e034e71e387a2 [0,1,0,0,0,0|2,0,0]=3 250 B12R1.372 COCCNCc1cnoc1C 99e2ddf488144deef4da9356026eef7b [0,1,0,0,0,0|3,0,0]=4 251 B12R1.372 COCCNCc1ncoc1C 07de8dbdf442137e1b87f93a2b26cf96 [0,1,0,0,0,0|3,0,0]=4 252 B12R1.372 COCCOCc1ccoc1C f237919f80c499003e5cced4d7b1d5f4 [0,1,0,0,0,0|1,1,0]=3 253 B12R1.372 COCCOCc1cnoc1C 56afdc9aff8bc6be36a4568187085a82 [0,1,0,0,0,0|2,1,0]=4 254 B12R1.372 COCCOCc1ncoc1C 044bbd5a957e831fa3a7e8cb179b7c89 [0,1,0,0,0,0|2,1,0]=4 255 B12R1.372 CSCCCNc1ccsc1C 94dc4e16a8baa0878c4de354f26f6e71 [0,1,0,0,0,0|2,1,0]=4 256 B12R1.372 CSCCCNc1cnoc1C ee64c8bf6b99ddd26e16db25d255ff28 [0,1,0,0,0,0|3,0,0]=4 257 B12R1.372 CSCCNCc1ccoc1C 34423935a2f5d79b6c937b619203e835 [0,1,0,0,0,0|2,0,0]=3 258 B12R1.372 CSCCNCc1cnoc1C 57a59966a2d5594d9475c0685418fce5 [0,1,0,0,0,0|3,0,0]=4 259 B12R1.372 CSCCNCc1ncoc1C 0674f099199d935d5773028ca0def490 [0,1,0,0,0,0|3,0,0]=4 260 B12R1.372 CSCCOCc1ccoc1C 5eb787484e858f0709a738966f05a360 [0,1,0,0,0,0|1,1,0]=3 261 B12R1.372 CSCCOCc1cnoc1C b9b3759c18139926a55d69412288306c [0,1,0,0,0,0|2,1,0]=4 262 B12R1.372 CSCCOCc1ncoc1C 3f0d2e14d1df219278ba5b9e1ff0d89e [0,1,0,0,0,0|2,1,0]=4 263 B12R1.372 Cc1occc1CNCCC#N 4e81c0204787bd54927b35ddd90ca9f8 [0,1,0,0,0,0|2,0,1]=4 264 B12R1.372 Cc1occc1CNCCC=O 489ff0c9cf527cbe0ff652d760a33c09 [0,1,0,0,0,0|2,0,1]=4 265 B12R1.372 Cc1occc1CNCCCF ed187d683dbc3401165a583b9670a0cb [0,1,0,0,0,0|2,0,0]=3 266 B12R1.372 Cc1occc1CNCCCO 8da492daca70413a3f0c1283fa77a311 [0,1,0,0,0,0|2,0,0]=3 267 B12R1.372 Cc1occc1CNCCCS 22008103942c2dfb935bf4f4d903bf64 [0,1,0,0,0,0|2,0,0]=3 268 B12R1.372 Cc1occc1COCCC#N 47fcab58768a1b78b128e47a1e62d0a2 [0,1,0,0,0,0|1,1,1]=4 269 B12R1.372 Cc1occc1COCCC=O 2c5e9ec1098b6bd4e5c9e82779efa1db [0,1,0,0,0,0|1,1,1]=4 270 B12R1.372 Cc1occc1COCCCF 7754039ab54f1eec512e6ad488feb9b6 [0,1,0,0,0,0|1,1,0]=3 271 B12R1.372 Cc1occc1COCCCS fa947fdb2631765d338f077933604f9b [0,1,0,0,0,0|1,1,0]=3 272 B12R1.372 Cc1ocnc1CNCCCCl 9d556f62aaa3b874a3f8dbd71ff37950 [0,1,0,0,0,0|3,0,0]=4 273 B12R1.372 Cc1ocnc1CNCCCF b68feca76f21dd0e3b3eef6d600f4040 [0,1,0,0,0,0|3,0,0]=4 274 B12R1.372 Cc1ocnc1CNCCCO e58ad969cfc81c42d2531fa8d44471c7 [0,1,0,0,0,0|3,0,0]=4 275 B12R1.372 Cc1ocnc1CNCCCS dc7fa170f593db2326efb6bed6724451 [0,1,0,0,0,0|3,0,0]=4 276 B12R1.372 Cc1ocnc1COCCCF 544ed6cd891753922ac6e7ad055fe80b [0,1,0,0,0,0|2,1,0]=4 277 B12R1.372 Cc1ocnc1COCCCS 2468d061063a3b19cf14634abd844693 [0,1,0,0,0,0|2,1,0]=4 278 B12R1.372 Cc1oncc1CNCCCF 0c7c230495d4b972e8380cd08e96024f [0,1,0,0,0,0|3,0,0]=4 279 B12R1.372 Cc1oncc1CNCCCO a7d0061ece2d105b5cd2287cea71ad5f [0,1,0,0,0,0|3,0,0]=4 280 B12R1.372 Cc1oncc1CNCCCS 86197d14d108fbee63db28efd107d9af [0,1,0,0,0,0|3,0,0]=4 281 B12R1.372 Cc1oncc1COCCCF cb2ddbfdd75aa65dfd2628d48e6b1884 [0,1,0,0,0,0|2,1,0]=4 282 B12R1.372 Cc1oncc1COCCCS 42e524fa935ace08d5fbd2afef941760 [0,1,0,0,0,0|2,1,0]=4 283 B12R1.372 Cc1oncc1NCCCCCl 9c7cdb15b1652220c9064c5e81690fc1 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.372 Cc1oncc1NCCCCF 1cfb68b1d7625fa8b752418f29112aa1 [0,1,0,0,0,0|3,0,0]=4 285 B12R1.372 Cc1oncc1NCCCCO 42f301080b7ec381dd534ecda6696687 [0,1,0,0,0,0|3,0,0]=4 286 B12R1.372 Cc1sccc1NCCCCCl 1da6f1ed7acf2286de4e9d831ed6d20c [0,1,0,0,0,0|2,1,0]=4 287 B12R1.372 Cc1sccc1NCCCCF 95b9f7bdf4bc9df1c576043c556e71e8 [0,1,0,0,0,0|2,1,0]=4 288 B12R1.372 Cc1sccc1NCCCCO 5e35fd70a103e9af2a6d1ecf0c4ab34e [0,1,0,0,0,0|2,1,0]=4 289 B12R1.372 Cc1sccc1NCCCCS 067e795c843a168c02f52175093c493a [0,1,0,0,0,0|2,1,0]=4 290 B12R1.456 CCCCNc1nc(oc1C)C 7977919478baae9050d718f885d930eb [0,1,0,0,0,0|3,0,0]=4 291 B12R1.456 CCCNCc1cc(oc1C)C 1f080d90339e79c6aea19f56ddc0588d [0,1,0,0,0,0|2,0,0]=3 292 B12R1.456 CCCNCc1nc(oc1C)C 28c21600f41d8b9edd31c67709eed61a [0,1,0,0,0,0|3,0,0]=4 293 B12R1.456 CCCNCc1oc(=O)oc1C fd07e8daff5d761dba24842e2d532fc0 [0,1,0,0,0,0|3,0,0]=4 294 B12R1.456 CCCOCc1cc(oc1C)C 5e266076bcb19998d58510e252a5e299 [0,1,0,0,0,0|1,1,0]=3 295 B12R1.456 CCCOCc1nc(oc1C)Br d5d7c502818224e4ea48a9dc435ad054 [0,1,0,0,0,0|2,1,0]=4 296 B12R1.456 CCCOCc1nc(oc1C)C 35b823d3ab72ae6ee880a0bbdc4c9914 [0,1,0,0,0,0|2,1,0]=4 297 B12R1.456 CCCOCc1oc(=O)oc1C 954747c7ee52b580dcd476cd8e1d1ad0 [0,1,0,0,0,0|2,1,0]=4 298 B12R1.456 COCNCc1cc(oc1C)C 93a9f9c1cdb27b90edbef363c48a5cf2 [0,1,0,0,0,0|3,0,0]=4 299 B12R1.456 COCOCc1cc(oc1C)C 7cdd8efa808003c31b6dba3366d1e58a [0,1,0,0,0,0|2,1,0]=4 300 B12R1.456 CSCNCc1cc(oc1C)C 6991865680a01384a17d38996c021916 [0,1,0,0,0,0|3,0,0]=4 301 B12R1.456 CSCOCc1cc(oc1C)C 359c1b76427573daf3f9fa74d5df7486 [0,1,0,0,0,0|2,1,0]=4 302 B12R1.456 Cc1cc(c(o1)C)CNCCF 6af474caa9fba42613fcba99168900af [0,1,0,0,0,0|3,0,0]=4 303 B12R1.456 Cc1cc(c(o1)C)CNCCO 5a1539d757a8d3ac133d3fbcb71b96bf [0,1,0,0,0,0|3,0,0]=4 304 B12R1.456 Cc1cc(c(o1)C)CNCCS 44da4fbf83a47b81f11a78abbaf2a4be [0,1,0,0,0,0|3,0,0]=4 305 B12R1.456 Cc1cc(c(o1)C)COCCF 51ff648afe187d8f073679d7809c9879 [0,1,0,0,0,0|2,1,0]=4 306 B12R1.456 Cc1cc(c(o1)C)COCCS f0e15149e60ac7ec6eba8658a6d55343 [0,1,0,0,0,0|2,1,0]=4 307 B12R1.460 CCCCN(C)c1ccsc1C ef09df0fa3b0cf3fb93f2710095d1bee [0,1,0,0,0,0|2,1,0]=4 308 B12R1.460 CCCNC(=O)c1ccoc1Br 769b20484f446d9bf4931af5d4d317bf [0,1,0,0,0,0|3,0,0]=4 309 B12R1.460 CCCNC(=O)c1ccoc1C cf1bb657ce49ff79bda17cf0d9116812 [0,1,0,0,0,0|2,0,0]=3 310 B12R1.460 CCCNC(=O)c1ccoc1Cl 9fb0852e9750ecad82b08e77388531bb [0,1,0,0,0,0|3,0,0]=4 311 B12R1.460 CCCNC(=O)c1ccoc1I 600248d1b217784e57da349f5f73f6c8 [0,1,0,0,0,0|3,0,0]=4 312 B12R1.460 CCCNC(=O)c1ccsc1C f258c978450c56246c8c5790a7f11998 [0,1,0,0,0,0|2,1,0]=4 313 B12R1.460 CCCNC(=O)c1cnoc1C 1d57049053a5b44377668531f44979ee [0,1,0,0,0,0|3,0,0]=4 314 B12R1.460 CCCNC(=O)c1ncoc1C 9e1a6a139f6235ecea14a7c97e65ec80 [0,1,0,0,0,0|3,0,0]=4 315 B12R1.460 Cc1occc1C(=O)NCCBr a11bf9286e8da6dd898e01b22c08d15c [0,1,0,0,0,0|3,0,0]=4 316 B12R1.460 Cc1occc1C(=O)NCCF 9c7435a7452c4382f642088ebe8d621d [0,1,0,0,0,0|3,0,0]=4 317 B12R1.460 Cc1occc1C(=O)NCCI bf67083ce9f2d92939cd47a536d429a7 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.460 Cc1occc1C(=O)NCCO 2f0a6558aac476f80b770d9be736baec [0,1,0,0,0,0|3,0,0]=4 319 B12R1.460 Cc1occc1C(=O)NCCS 8a5c5f03d8af3a08f657afd9aa457177 [0,1,0,0,0,0|3,0,0]=4 320 B12R1.567 CCCCNc1c(noc1C)C 83f3b44820ede30d35dd426d3498ddb2 [0,1,0,0,0,0|3,0,0]=4 321 B12R1.567 CCCCOC1=C(OCC1=O)C da421e3701c2a0ff7de376d450e9b960 [0,1,0,0,0,0|1,1,1]=4 322 B12R1.567 CCCCOc1c(noc1C)C 9066623f5242384d9cac1ffd69f29749 [0,1,0,0,0,0|2,1,0]=4 323 B12R1.567 CCCNCc1c(noc1C)C 7b8c2e26b456c4b84eb56e5216fcac04 [0,1,0,0,0,0|3,0,0]=4 324 B12R1.567 CCCOCc1c(noc1C)Br bf5f89c7dda626669b520c400e1adf27 [0,1,0,0,0,0|2,1,0]=4 325 B12R1.567 CCCOCc1c(noc1C)C 53499ea647592cc9ae59b8d6e6022324 [0,1,0,0,0,0|2,1,0]=4 326 B12R2.211 Cc1sccc1NC2CC2C 96e6a1614cc686b8d63520a10496f485 [0,0,0,1,0,0|2,1,0]=4 327 B12R2.466 Cc1occc1COC2CC2 2dbf0f974ebc23c2e366973239779b43 [0,0,0,1,0,0|1,1,0]=3 328 B12R2.466 Cc1ocnc1COC2CC2 8361c275bf2f4de1360544cb37a71656 [0,0,0,1,0,0|2,1,0]=4 329 B12R2.466 Cc1oncc1COC2CC2 dce62f8fcd48989990133a2adaf7633f [0,0,0,1,0,0|2,1,0]=4 330 B12R2.466 Cc1oncc1NCC2CC2 a4ee0191fb06dba91d45444b19f96177 [0,0,0,1,0,0|3,0,0]=4 331 B12R2.466 Cc1sccc1NCC2CC2 8c5d53b49a429062e01cf620b03aa348 [0,0,0,1,0,0|2,1,0]=4 332 B12R2.1114 Cc1ocnc1CN2CCC2 eb97eaa8cb623acffd02559036f78244 [0,0,0,1,0,0|3,0,0]=4 333 B12R1.28 CCCCNc1cccc(c1)C f36b39ad3ead5e197d911ea9d057dd4e [0,0,0,0,0,1|3,0,0]=4 334 B12R1.28 CCCCNc1cccc(n1)C b50c160478b645e8709ed00a31cf2df2 [0,0,0,0,0,1|3,0,0]=4 335 B12R1.28 CCCCNc1ccnc(c1)C e6b03d134a6089ca15a5b9a55503d762 [0,0,0,0,0,1|3,0,0]=4 336 B12R1.28 CCCCNc1ccnc(n1)C f7a06b587a85665edf6f11e6f36013d2 [0,0,0,0,0,1|3,0,0]=4 337 B12R1.28 CCCCOc1cccc(c1)C de4e90dba26d310b97e7df87ced1e000 [0,0,0,0,0,1|2,1,0]=4 338 B12R1.28 CCCCOc1cccc(n1)C d9b6d18f8cc402e5aad7db256f0801f6 [0,0,0,0,0,1|2,1,0]=4 339 B12R1.28 CCCCOc1ccnc(c1)C 958584adfae3a5ad9d3921f49695ad0e [0,0,0,0,0,1|2,1,0]=4 340 B12R1.28 CCCCOc1ccnc(n1)C 15cac3b113ebafcd2ccc1dec19409ffb [0,0,0,0,0,1|2,1,0]=4 341 B12R1.28 CCCNCc1cccc(c1)C 0ea9b946138db81b53023dbdaca16203 [0,0,0,0,0,1|3,0,0]=4 342 B12R1.28 CCCNCc1cccc(n1)C eb159799c3e39812c6e0f5ecfc00929c [0,0,0,0,0,1|3,0,0]=4 343 B12R1.28 CCCNCc1ccnc(c1)C 44e3f8e97f0195b1553b942808256e2f [0,0,0,0,0,1|3,0,0]=4 344 B12R1.28 CCCNCc1ccnc(n1)C 6ceb8c766940d7220ce793fadca3d07b [0,0,0,0,0,1|3,0,0]=4 345 B12R1.28 CCCOCc1cccc(c1)C d8eb8d05914bbe210bfe6d56aae3fe46 [0,0,0,0,0,1|2,1,0]=4 346 B12R1.28 CCCOCc1cccc(n1)C 108e42919326b113159263e17f8ec3cb [0,0,0,0,0,1|2,1,0]=4 347 B12R1.28 CCCOCc1ccnc(c1)C 03df2ec691f193e1ca6cefb2cc28aec4 [0,0,0,0,0,1|2,1,0]=4 348 B12R1.28 CCCOCc1ccnc(n1)C 1f8f84d51edbdb097cc6195234b1cc6c [0,0,0,0,0,1|2,1,0]=4 349 B12R1.267 CCCCNc1ccccc1C cb964fe2d8cfd23c2726cd74a242470b [0,0,0,0,0,1|3,0,0]=4 350 B12R1.267 CCCCNc1cccnc1C fad811ff1fa797428fe957bb5e80f5b5 [0,0,0,0,0,1|3,0,0]=4 351 B12R1.267 CCCCNc1ccncc1C d67d07991761cc4a161bc3b26e7f4ef8 [0,0,0,0,0,1|3,0,0]=4 352 B12R1.267 CCCCNc1ccnnc1C c55b01ee160986307374574d4daa1088 [0,0,0,0,0,1|3,0,0]=4 353 B12R1.267 CCCCNc1cnccc1C d787f90e53c25369bc2f084e970b28cf [0,0,0,0,0,1|3,0,0]=4 354 B12R1.267 CCCCNc1cncnc1C 017fc671451585b648354d2c7abef698 [0,0,0,0,0,1|3,0,0]=4 355 B12R1.267 CCCCNc1ncccc1C 2e45a4067d865d7da64955a121039499 [0,0,0,0,0,1|3,0,0]=4 356 B12R1.267 CCCCNc1nccnc1C 90bc1b429aae368cae98fb58d90157ff [0,0,0,0,0,1|3,0,0]=4 357 B12R1.267 CCCCOc1ccccc1C 803afc2ce1e6d5fa1371cac971668549 [0,0,0,0,0,1|2,1,0]=4 358 B12R1.267 CCCCOc1cccnc1C 84e9fdf2bba58872ffe7a46a67662b35 [0,0,0,0,0,1|2,1,0]=4 359 B12R1.267 CCCCOc1cccoc1=O fbc49b8367347726350d6c0059a469cb [0,0,0,0,0,1|2,1,0]=4 360 B12R1.267 CCCCOc1ccncc1C a8a96a8ae5494e782a1db105dc9138fd [0,0,0,0,0,1|2,1,0]=4 361 B12R1.267 CCCCOc1cnccc1C 3b15574ad4f3c24340def9d6fb0c9767 [0,0,0,0,0,1|2,1,0]=4 362 B12R1.267 CCCCOc1cncnc1C f56822cb65a21eb5db63c0a384f05324 [0,0,0,0,0,1|2,1,0]=4 363 B12R1.267 CCCCOc1ncccc1C 9acd3db19edc794136930ecc9d37d4c9 [0,0,0,0,0,1|2,1,0]=4 364 B12R1.267 CCCCOc1nccnc1C 402b39c5e5f48238166c9210830a4ffa [0,0,0,0,0,1|2,1,0]=4 365 B12R1.267 CCCNCc1ccccc1C 050fe1959a544b7272683da7815962b7 [0,0,0,0,0,1|3,0,0]=4 366 B12R1.267 CCCNCc1cccnc1C e1b1b5a8410f06279070c8edcdf17240 [0,0,0,0,0,1|3,0,0]=4 367 B12R1.267 CCCNCc1ccncc1C 2ed7bb25324af023967144bd7385c902 [0,0,0,0,0,1|3,0,0]=4 368 B12R1.267 CCCNCc1cnccc1C 9bead837e92e04248f1f4a17f6bc75bc [0,0,0,0,0,1|3,0,0]=4 369 B12R1.267 CCCNCc1ncccc1C d2df36c8f920a1d0503e8cfb0b483277 [0,0,0,0,0,1|3,0,0]=4 370 B12R1.267 CCCNCc1nccnc1C 2329748998eb0628f0fe982f13629fb6 [0,0,0,0,0,1|3,0,0]=4 371 B12R1.267 CCCOCc1ccccc1C 69819a6d99087ea23f1233c6ad1452d2 [0,0,0,0,0,1|2,1,0]=4 372 B12R1.267 CCCOCc1cccnc1C 80f08444768dce951386843ce88fb151 [0,0,0,0,0,1|2,1,0]=4 373 B12R1.267 CCCOCc1ccncc1C 7735e31f03b9348d7e7ebc447c03a04d [0,0,0,0,0,1|2,1,0]=4 374 B12R1.267 CCCOCc1ccnnc1C a47ac6ca4ea5355ce53d923db72664f2 [0,0,0,0,0,1|2,1,0]=4 375 B12R1.267 CCCOCc1cnccc1C c5527632473ce43017a4a07048be0b6b [0,0,0,0,0,1|2,1,0]=4 376 B12R1.267 CCCOCc1ncccc1C 7c546d71a2c0070eaea514043b7c3a08 [0,0,0,0,0,1|2,1,0]=4 377 B12R1.267 CCCOCc1nccnc1C 4f5af91c665324e63db9a5c85cb38147 [0,0,0,0,0,1|2,1,0]=4 378 B9R0.45 C/C=C/C=C/COCCC 8f1e48b4facc41411447438079f84a28 [1,0,1,0,0,0|1,1,0]=4 379 B9R0.45 CC=CC=CCOCCC 56450f7f936a8924869fea1d2e9622e7 [1,0,1,0,0,0|1,1,0]=4 380 B9R1.12 BrCCNc1ccoc1 a2231b54df1a9ad952a7199505b4249b [2,0,0,0,0,0|2,0,0]=4 381 B9R1.12 CCCNc1ccoc1 cc4f6f51569c182aca4da58e5f019c78 [2,0,0,0,0,0|1,0,0]=3 382 B9R1.12 CCCNc1ccon1 67d2486210e5c6b1db57939f48d96b10 [2,0,0,0,0,0|2,0,0]=4 383 B9R1.12 CCCNc1ccsc1 a70237f11ed81d43b5ff787e5b6c83f9 [2,0,0,0,0,0|1,1,0]=4 384 B9R1.12 CCCNc1cnoc1 7187c9b6458116c29751d2ac51a34544 [2,0,0,0,0,0|2,0,0]=4 385 B9R1.12 CCCNc1cocn1 ba2d440733fea026f6967dab40049325 [2,0,0,0,0,0|2,0,0]=4 386 B9R1.12 CCCOc1ccsc1 09284982954b71ce4e3ef57411744ecc [2,0,0,0,0,0|0,2,0]=4 387 B9R1.12 CCCOc1cnoc1 7ef6e28be5c71f134588464c20303dfc [2,0,0,0,0,0|1,1,0]=4 388 B9R1.12 CCNCc1ccoc1 790b339bd93664fda272fb5f895d2be9 [2,0,0,0,0,0|2,0,0]=4 389 B9R1.12 FCCNc1ccoc1 c1ef02526436d56670fbc827dff10294 [2,0,0,0,0,0|2,0,0]=4 390 B9R1.12 ICCNc1ccoc1 d3fd15a20520072c5b9980450c3c59c1 [2,0,0,0,0,0|2,0,0]=4 391 B9R1.12 OCCNc1ccoc1 57b3dbe9a8463690570ac98cb9dbd904 [2,0,0,0,0,0|2,0,0]=4 392 B9R1.12 SCCNc1ccoc1 005f080777d11987a0a12d398378313f [2,0,0,0,0,0|2,0,0]=4 393 B9R1.33 CCNc1ccsc1C 77679f4a4608797405be9c01b56f6c78 [2,0,0,0,0,0|1,1,0]=4 394 B9R1.33 CCNc1cnoc1C d9c8edeb0d1248f73261689ae7d88e51 [2,0,0,0,0,0|2,0,0]=4 395 B11R1.4 CCCCCNc1ccoc1 873754c10feb0cec44bbaccf311bec49 [1,1,0,0,0,0|2,0,0]=4 396 B11R1.4 CCCCNCc1ccoc1 ab8253f518ded2d472c649b3f9cb4c45 [1,1,0,0,0,0|2,0,0]=4 397 B11R1.4 CCCCOCc1ccoc1 1cadfa682bb5a9af12fa0ba0bf74414e [1,1,0,0,0,0|1,1,0]=4 398 B11R1.4 CCCOCCc1ccoc1 bc991c92cafa29c358102c9d241d422b [1,1,0,0,0,0|1,1,0]=4 399 B11R1.4 CCOCCNc1ccoc1 ceb28da3f53f1a7b716fae0923cbcbba [1,1,0,0,0,0|2,0,0]=4 400 B11R1.4 CCSCCNc1ccoc1 8228fb92ed8b83be507a70e2c2053f07 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.4 COCCCNc1ccoc1 7da15c00e1bcececad0a7fd6f14428fe [1,1,0,0,0,0|2,0,0]=4 402 B11R1.4 COCCNCc1ccoc1 2897bb321a698f16a6d87bd3a04096e7 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.4 COCCOCc1ccoc1 8aa5b618d954632c161b50baf6b29d3e [1,1,0,0,0,0|1,1,0]=4 404 B11R1.4 CSCCCNc1ccoc1 2fedea1604e6d299476007ddb7de1b1e [1,1,0,0,0,0|2,0,0]=4 405 B11R1.4 CSCCNCc1ccoc1 59d8d440416ef1a9141a5bd2a2a0e524 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.4 CSCCOCc1ccoc1 cd55e314581ad3093df73b5d4f73731c [1,1,0,0,0,0|1,1,0]=4 407 B11R1.4 ClCCCCNc1ccoc1 771cbc91e9831047a3b4b5849879de18 [1,1,0,0,0,0|2,0,0]=4 408 B11R1.4 FCCCNCc1ccoc1 31040cbd62b6f16134c1f6f037b48edd [1,1,0,0,0,0|2,0,0]=4 409 B11R1.4 FCCCOCc1ccoc1 5a0d690f493bdb49f3af3b903502941a [1,1,0,0,0,0|1,1,0]=4 410 B11R1.4 OCCCCNc1ccoc1 b3b4900a73e189905b02829a78e386d1 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.4 OCCCNCc1ccoc1 cb6d6c10c8d1e9fbb486a611728fd9ee [1,1,0,0,0,0|2,0,0]=4 412 B11R1.4 SCCCCNc1ccoc1 494470c53d8ee9c5709ac4ca04ab3233 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.4 SCCCNCc1ccoc1 c4e2dea12f827e7f17147b83e6fa0c1d [1,1,0,0,0,0|2,0,0]=4 414 B11R1.4 SCCCOCc1ccoc1 6fa7c6662ec9123ef0150c1436bf84e6 [1,1,0,0,0,0|1,1,0]=4 415 B11R1.25 CCC(C)CNc1ccoc1 b996204742a27f41a0bc070ef3e80806 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.25 CCC(C)NCc1ccoc1 8c02b655539c9007d5e8f97ef5952ea6 [1,1,0,0,0,0|2,0,0]=4 417 B11R1.25 CCC(O)CNc1ccoc1 af3de1eebca676b63539dc0f61addb24 [1,1,0,0,0,0|2,0,0]=4 418 B11R1.25 CC[C@@H](O)CNc1ccoc1 adb57c64716ed05698c95128eb081729 [1,1,0,0,0,0|2,0,0]=4 419 B11R1.25 CC[C@H](C)CNc1ccoc1 04df10668397f8172e021865054bc0ae [1,1,0,0,0,0|2,0,0]=4 420 B11R1.27 CCCOCc1coc(c1)Br 3d4050a756fcb8346ff7f38eca57b798 [1,1,0,0,0,0|1,1,0]=4 421 B11R1.29 CCCNC(=O)c1ccoc1 b710ca9b77d5dd5c6625c458d5e02fff [1,1,0,0,0,0|2,0,0]=4 422 B11R1.29 CCCNC(C)c1ccoc1 ef27b7e57df58245be3f3d8d20e03887 [1,1,0,0,0,0|2,0,0]=4 423 B11R1.29 CCCN[C@@H](C)c1ccoc1 b71226b1dd3058ada600f00f02af999d [1,1,0,0,0,0|2,0,0]=4 424 B11R1.29 CCCOC(C)c1ccoc1 cd17fc6327b8a7dbf5c2dabbfe8c9b51 [1,1,0,0,0,0|1,1,0]=4 425 B11R1.30 CCCN(C)Cc1ccoc1 8977ce9718cfaad00a8f445e9e6ba097 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.172 CC(C)CCNc1ccoc1 7ebe9b14796b4c217c38dc26f6fec162 [1,1,0,0,0,0|2,0,0]=4 427 B11R1.172 CC(C)CNCc1ccoc1 abdce0e0b6e3e9e183851a8f16b7972b [1,1,0,0,0,0|2,0,0]=4 428 B11R1.172 CC(C)COCc1ccoc1 f9f3dacca4368645a18802fe7b1f131d [1,1,0,0,0,0|1,1,0]=4 429 B11R1.172 CC(O)CCNc1ccoc1 0d5aace06c195fae7236613b1f15760c [1,1,0,0,0,0|2,0,0]=4 430 B11R1.172 CC(O)CNCc1ccoc1 c05e4a8d2cf400a602ecf2a2d20445f6 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.172 C[C@@H](O)CCNc1ccoc1 f528c33cfde9ed2040e1fc72eaabddad [1,1,0,0,0,0|2,0,0]=4 432 B11R1.172 C[C@H](O)CCNc1ccoc1 a8dc0afe0ca1e4ba9281aaecb84be944 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.172 C[C@H](O)CNCc1ccoc1 0067a311d9970e551754a6d67d461fe2 [1,1,0,0,0,0|2,0,0]=4 434 B11R1.18 CCCNc1ccoc1C=O 8564ee0f606b121f43acfb4d5d51b6b6 [1,1,0,0,0,0|1,0,1]=4 435 B11R1.18 CCCNc1ccsc1CO 070da06b32b09baa0566aa685bb97b6e [1,1,0,0,0,0|1,1,0]=4 436 B11R1.18 CCCNc1ccsc1SC 001c51c2e24edfefbc40d25252a6a9ea [1,1,0,0,0,0|1,1,0]=4 437 B11R1.90 Cc1occc1CNC(C)C 17abcd4fdf9255353b63518ff11bab95 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.90 Cc1occc1COC(C)C f7f6019c6f0e9e0ddc81d3677321bdaf [1,1,0,0,0,0|1,1,0]=4 439 B11R1.90 Cc1oncc1NCC(C)C 34813a768b78a3ab8c9b78913319a609 [1,1,0,0,0,0|2,0,0]=4 440 B11R1.90 Cc1oncc1NCC(C)O d1e564e51e58102584b124e0b20f8a75 [1,1,0,0,0,0|2,0,0]=4 441 B11R1.90 Cc1oncc1NC[C@H](C)O bf53c2c27b1d742677f932ade32906ae [1,1,0,0,0,0|2,0,0]=4 442 B11R1.90 Cc1sccc1NCC(C)C 485d075c687477ab97f2007d1c5e282b [1,1,0,0,0,0|1,1,0]=4 443 B11R1.90 Cc1sccc1NCC(C)O 8fc8d2a49842c583c78c02db29ba6f62 [1,1,0,0,0,0|1,1,0]=4 444 B11R1.90 Cc1sccc1NC[C@H](C)O ecb5525c1fe997b79263e45d4e5f4173 [1,1,0,0,0,0|1,1,0]=4 445 B11R1.228 CCC(C)Nc1ccsc1C 1d7fa03ca5da0ef3edb7300d6183a09f [1,1,0,0,0,0|1,1,0]=4 446 B11R1.228 CCC(C)Nc1cnoc1C 2d6e7aced454a7bbdcfc375515db1b19 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.228 CCN(C)Cc1ccoc1C cb43f8e6d099313ab37a95a506dfbf31 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.230 CCCNc1nc(oc1C)C 74fde0412a7013e5b90ad3817c1531bd [1,1,0,0,0,0|2,0,0]=4 449 B11R1.230 CCNCc1cc(oc1C)C dd96d82e483c84cbec4e3a508af787c6 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.230 CCOCc1cc(oc1C)C dcdc223e41fb44ebc0039150711e399c [1,1,0,0,0,0|1,1,0]=4 451 B11R1.465 CCCNc1c(noc1C)C cdb9fb1e43fbf30f9ed0a1d73449ed8c [1,1,0,0,0,0|2,0,0]=4 452 B11R1.465 CCCOC1=C(OCC1=O)C 331405f9365f304f12472c39d9bd19e6 [1,1,0,0,0,0|0,1,1]=4 453 B11R1.465 CCCOc1c(noc1C)C 6551add8ae165b352b5150e30a2b310c [1,1,0,0,0,0|1,1,0]=4 454 B13R1.6 CCOCCSc1cccc(c1)C 4590ce05061f4be1cc0da47e33c2863f [0,1,0,0,0,1|2,0,0]=4 455 B13R1.55 CCCCNc1cc(oc(=O)c1)C dd8ff9671bbfdf43017d85fcf158ec34 [0,1,0,0,0,1|2,0,0]=4 456 B13R1.55 CCCCOc1cc(oc(=O)c1)C 2ea7048d9f84bf54275c5fede1c18735 [0,1,0,0,0,1|1,1,0]=4 457 B13R1.8919 CCCCOc1c(occc1=O)C 9bfdcfbc12e34f8266d2c0e5b0956fa2 [0,1,0,0,0,1|1,1,0]=4 458 B13R1.8919 CCCCOc1c(occc1=S)C d72c003cdfcc1c4d7e37e8f6df261556 [0,1,0,0,0,1|1,1,0]=4 459 B13R1.137 CCCCCNc1ccoc1CO 263a4b1db9aef4d7acf00aa98e8548c3 [0,2,0,0,0,0|2,0,0]=4 460 B13R1.137 OCCCCNc1ccoc1CO e43f2ecb8f5114de35cc52d76925df2d [0,2,0,0,0,0|2,0,0]=4 461 B13R1.137 OCc1occc1NCCCCCl bc19876f24a8d5bf45da1a45cf587be9 [0,2,0,0,0,0|2,0,0]=4 462 B13R1.137 OCc1occc1NCCCCS efe193d6fc7058b6f767890d3c1156ce [0,2,0,0,0,0|2,0,0]=4 463 B13R1.670 CCCCNc1ccoc1C(=O)C 27a8b6c1e03f8849560c0eef18226f1e [0,2,0,0,0,0|2,0,0]=4 464 B13R1.670 CCCCNc1ccoc1C(C)O 888df8676640c3b7bca8744731201d8b [0,2,0,0,0,0|2,0,0]=4 465 B13R1.168 Cc1occc1C(=O)NCC(C)C c9d9481690b33e0ffb6b641afa279e57 [0,2,0,0,0,0|2,0,0]=4 466 B13R1.168 Cc1occc1C(=O)NCC(C)O 3d3146b9c3d8b756e88008baf4f4d656 [0,2,0,0,0,0|2,0,0]=4 467 B13R1.168 Cc1occc1C(=O)NC[C@@H](C)O 616498d7ff8b8821caa2b3f983d06b67 [0,2,0,0,0,0|2,0,0]=4 468 B13R1.168 Cc1occc1C(=O)NC[C@H](C)O 00c4ae6f9334d08e9c3c8b782157f171 [0,2,0,0,0,0|2,0,0]=4 469 B13R1.169 Cc1occc1CNC(C)C(C)C 221026ae146ef61c4cf0de9db4b890b4 [0,2,0,0,0,0|2,0,0]=4 470 B13R1.169 Cc1occc1COC(C)C(C)C 52ea0b49dd4a4cbe10ad69b66a023014 [0,2,0,0,0,0|1,1,0]=4 471 B13R1.195 Cc1occc1CNCC(C)(C)C 2104a8257a427cf295501233460a6dc7 [0,2,0,0,0,0|2,0,0]=4 472 B13R1.195 Cc1occc1CNCC(C)(C)F fae47b7059ad587a45baa87f15cef67a [0,2,0,0,0,0|2,0,0]=4 473 B13R1.195 Cc1occc1CNCC(C)(C)O a90db89efc3b0c261a29eb0113a3d2c7 [0,2,0,0,0,0|2,0,0]=4 474 B13R1.195 Cc1occc1CNCC(C)(F)F 3cacdba9a8ff652f8869c48942232ddc [0,2,0,0,0,0|2,0,0]=4 475 B13R1.195 Cc1occc1COCC(C)(C)C a2b12a1c4462e3fe16c54ad5d47354d5 [0,2,0,0,0,0|1,1,0]=4 476 B13R1.195 Cc1occc1COCC(C)(C)F b5b77ef72e33e7f3cb0d40fc0f36a2d4 [0,2,0,0,0,0|1,1,0]=4 477 B13R1.195 Cc1occc1COCC(C)(C)O 6ae75b7a8d40d985204a94e7defd3b05 [0,2,0,0,0,0|1,1,0]=4 478 B13R1.195 Cc1occc1COCC(C)(F)F 1d1c7193d0c23017cba081834f7e4349 [0,2,0,0,0,0|1,1,0]=4 479 B13R1.282 Cc1occc1CN(C)CC(C)C bff44193e844c835705973ff4ab2eb41 [0,2,0,0,0,0|2,0,0]=4 480 B13R1.282 Cc1occc1CN(C)CC(C)O 3708b69c2b86417987509748eb420227 [0,2,0,0,0,0|2,0,0]=4 481 B13R1.282 Cc1occc1CN(C)C[C@@H](C)O 86fc96ea99407eacbc8c668dd759dfea [0,2,0,0,0,0|2,0,0]=4 482 B13R1.282 Cc1occc1CN(C)C[C@H](C)O 2f83068fbccb81b15b7615a0c9233a95 [0,2,0,0,0,0|2,0,0]=4 483 B13R1.599 C=C(CC)CNCc1ccoc1C f88ed47fbdd3dfd63a10e3fb1b714048 [0,2,0,0,0,0|2,0,0]=4 484 B13R1.599 C=C(CC)COCc1ccoc1C d5242a307786e3ca6fb2e0e63a77a890 [0,2,0,0,0,0|1,1,0]=4 485 B13R1.599 CCC(=O)CNCc1ccoc1C e07fcf7395158ff1439b07bc90403f59 [0,2,0,0,0,0|2,0,0]=4 486 B13R1.599 CCC(=O)COCc1ccoc1C 69effc301832a3542d245324e05094ba [0,2,0,0,0,0|1,1,0]=4 487 B13R1.599 CCC(C)CNCc1ccoc1C 901defaa961190392cd49d71c2b01aec [0,2,0,0,0,0|2,0,0]=4 488 B13R1.599 CCC(C)COCc1ccoc1C bd2f43929a98cb7bac04c9f7d22aa88d [0,2,0,0,0,0|1,1,0]=4 489 B13R1.599 CCC(O)CNCc1ccoc1C a1e371dd184210f640fcd40a375c796c [0,2,0,0,0,0|2,0,0]=4 490 B13R1.599 CC[C@@H](C)CNCc1ccoc1C 4d7101ef99161f9395f4b19a990389e4 [0,2,0,0,0,0|2,0,0]=4 491 B13R1.599 CC[C@@H](C)COCc1ccoc1C 943b3ca2d65b6147e30423704307e692 [0,2,0,0,0,0|1,1,0]=4 492 B13R1.599 CC[C@H](C)CNCc1ccoc1C b05d381782fe6dbbd0554fa0f84e0af4 [0,2,0,0,0,0|2,0,0]=4 493 B13R1.599 CC[C@H](C)COCc1ccoc1C 3957417a1856e9bb61973cf7c9090d7f [0,2,0,0,0,0|1,1,0]=4 494 B13R1.599 COC(C)CNCc1ccoc1C 4e107f539266d3e35bd34bfd56134f7b [0,2,0,0,0,0|2,0,0]=4 495 B13R1.599 COC(C)COCc1ccoc1C 6eeb66f82202ce8eb286e9caeed5fe10 [0,2,0,0,0,0|1,1,0]=4 496 B13R1.599 CO[C@@H](C)CNCc1ccoc1C 9629b6b04bfa930132a5a460b83f91e1 [0,2,0,0,0,0|2,0,0]=4 497 B13R1.599 CO[C@@H](C)COCc1ccoc1C 1a12f52855b566d2160e97d74b2b90be [0,2,0,0,0,0|1,1,0]=4 498 B13R1.599 CO[C@H](C)CNCc1ccoc1C 2fde9f150ae6d384a8dca4b1afbccdaa [0,2,0,0,0,0|2,0,0]=4 499 B13R1.599 CO[C@H](C)COCc1ccoc1C 286e447b9d22df8d6f812985573a4ece [0,2,0,0,0,0|1,1,0]=4 500 B13R1.599 Cc1occc1CNCC(C)C#N f98559e4bca6bb717b4081c0052b9aa3 [0,2,0,0,0,0|2,0,0]=4 501 B13R1.599 Cc1occc1CNCC(C)CO 8f482b48b7df56d46147ae83ceb6000d [0,2,0,0,0,0|2,0,0]=4 502 B13R1.599 Cc1occc1CNCC(O)CF 64de9802d187d586d1c271642cc46f0a [0,2,0,0,0,0|2,0,0]=4 503 B13R1.599 Cc1occc1CNCC(O)CO 3edfa0d4b0f031098a000b4125fb1ae3 [0,2,0,0,0,0|2,0,0]=4 504 B13R1.599 Cc1occc1CNC[C@@H](C)CO 96cd552cbbaac0ab2e8d5d5818183194 [0,2,0,0,0,0|2,0,0]=4 505 B13R1.599 Cc1occc1CNC[C@@H](O)CO 83e5eba8b8193dc3c13d7da677178713 [0,2,0,0,0,0|2,0,0]=4 506 B13R1.599 Cc1occc1CNC[C@H](C)CO 10b405c37eedcfcf8295067cac6cf997 [0,2,0,0,0,0|2,0,0]=4 507 B13R1.599 Cc1occc1CNC[C@H](O)CO 1d7e224d78bc049f3821910b0d4eb5ac [0,2,0,0,0,0|2,0,0]=4 508 B13R1.599 Cc1occc1COCC(C)C#N 2f4d19e36b4e850bdc46537b825201c7 [0,2,0,0,0,0|1,1,0]=4 509 B13R1.599 Cc1occc1COCC(O)CO b33124e0d583cadb8ed82c4273025ff6 [0,2,0,0,0,0|1,1,0]=4 510 B13R1.599 Cc1occc1COC[C@@H](O)CO cb2de0c226f4493616c173d0d2461d61 [0,2,0,0,0,0|1,1,0]=4 511 B13R1.599 Cc1occc1COC[C@H](O)CO 2314b959021ae72ad0ef563541022f34 [0,2,0,0,0,0|1,1,0]=4 512 B13R1.3485 Cc1cc(c(o1)C)CNCC(C)C 06dd8aee3a3a75d70119258363336569 [0,2,0,0,0,0|2,0,0]=4 513 B13R1.3485 Cc1cc(c(o1)C)CNCC(C)O 5803db89c517871ba37618fa19a026be [0,2,0,0,0,0|2,0,0]=4 514 B13R1.3485 Cc1cc(c(o1)C)CNC[C@@H](C)O aebafde6a2a78218ce8078a93ab75212 [0,2,0,0,0,0|2,0,0]=4 515 B13R1.3485 Cc1cc(c(o1)C)CNC[C@H](C)O e818832f603e6ea9efaa6c737c7b324d [0,2,0,0,0,0|2,0,0]=4 516 B13R1.3485 Cc1cc(c(o1)C)COCC(C)C 68b061add33b33329104c03afdc20d54 [0,2,0,0,0,0|1,1,0]=4 517 B13R1.686 CCCCN(C)Cc1ccoc1C b42c51be0ad63f9a37947752b7730636 [0,2,0,0,0,0|2,0,0]=4 518 B13R1.686 CCOCN(C)Cc1ccoc1C bfae4c20bde77d7a7a2448c5425d6159 [0,2,0,0,0,0|2,0,0]=4 519 B13R1.686 COCCN(C)Cc1ccoc1C 14a2501a08c295c3c91a12b9a5dbfb81 [0,2,0,0,0,0|2,0,0]=4 520 B13R1.686 CSCCN(C)Cc1ccoc1C 0bb6a30b3e2146f6a5a965916ee42e7b [0,2,0,0,0,0|2,0,0]=4 521 B13R1.686 Cc1occc1CN(C)CCCF 4f2491d184e07494bca5025f9f29ab91 [0,2,0,0,0,0|2,0,0]=4 522 B13R1.686 Cc1occc1CN(C)CCCO 47e1e54cde6542cf52344fbb17710447 [0,2,0,0,0,0|2,0,0]=4 523 B13R1.686 Cc1occc1CN(C)CCCS 7dda8d8a94635484a674e6be6ff7bd4b [0,2,0,0,0,0|2,0,0]=4 524 B13R1.704 CCC(C)N(C)Cc1ccoc1C e5b63ae5f462e4a8561cc1386078cdbb [0,2,0,0,0,0|2,0,0]=4 525 B13R1.2909 CCCN(C)C(=O)c1ccoc1C dbf212a4da3c50405e6002e410252ba8 [0,2,0,0,0,0|2,0,0]=4 526 B13R1.316 CCC(C=O)NCc1ccoc1C 7c1f4dc5632cea945badfd75ff7608e3 [0,2,0,0,0,0|2,0,0]=4 527 B13R1.316 CCC(C=O)OCc1ccoc1C 3b5dd31c0e75044deb1d3278d8dabba1 [0,2,0,0,0,0|1,1,0]=4 528 B13R1.316 CCC(CC)NCc1ccoc1C b38c352722846c29e60a540ea5d542e9 [0,2,0,0,0,0|2,0,0]=4 529 B13R1.316 CCC(CC)OCc1ccoc1C 4b1c373e0e77a08e2edf3cfe6580caf6 [0,2,0,0,0,0|1,1,0]=4 530 B13R1.316 CCC(CO)NCc1ccoc1C 4773054eb33909d0fe444f697d80b7cd [0,2,0,0,0,0|2,0,0]=4 531 B13R1.439 CCC(C)NC(=O)c1ccoc1C 96e7f3a746e765de454211a1eb0dbb1d [0,2,0,0,0,0|2,0,0]=4 532 B13R1.439 CC[C@@H](C)NC(=O)c1ccoc1C 55b901a1cb2a4ca451c1c48a932414b4 [0,2,0,0,0,0|2,0,0]=4 533 B13R1.439 CC[C@H](C)NC(=O)c1ccoc1C 3b13125b044165d942f240eb7dd35649 [0,2,0,0,0,0|2,0,0]=4 534 B13R1.444 CCCC(=O)NCc1ccoc1C 33096d93b66fb20b12ba9e27cb8d3d8f [0,2,0,0,0,0|2,0,0]=4 535 B13R1.444 CCCC(C)NCc1ccoc1C b064f019478dd5b27d0855acf2f813f3 [0,2,0,0,0,0|2,0,0]=4 536 B13R1.444 CCCC(C)OCc1ccoc1C a59baa336198d15c9355f70e89208cb6 [0,2,0,0,0,0|1,1,0]=4 537 B13R1.444 COCC(C)NCc1ccoc1C 22d809b7e53928559852d60d3906e5f0 [0,2,0,0,0,0|2,0,0]=4 538 B13R1.444 COCC(C)OCc1ccoc1C ee9ec58145fad3fbca46fd52a4ee0113 [0,2,0,0,0,0|1,1,0]=4 539 B13R1.444 Cc1occc1CNC(C)CCO 4c7dfd18b4c4dbc78186f1774b75b624 [0,2,0,0,0,0|2,0,0]=4 540 B13R1.596 CCC(C)NCc1cc(oc1C)C fba09fc43e56a0ed0620253a526b44fa [0,2,0,0,0,0|2,0,0]=4 541 B13R1.596 CCC(C)OCc1cc(oc1C)C 8c6be08157a8ceb5dddd56b9fad63ba1 [0,2,0,0,0,0|1,1,0]=4 542 B13R1.167 C=C(C)CCNCc1ccoc1C 5f323f553d7a459d10f9cb90f8fc0d17 [0,2,0,0,0,0|2,0,0]=4 543 B13R1.167 C=C(C)CCOCc1ccoc1C 5b9c413d2a06b39fa98751c1e95b5c9a [0,2,0,0,0,0|1,1,0]=4 544 B13R1.167 CC(=O)CCNCc1ccoc1C 800d200792c678ff0ac46f81f7830296 [0,2,0,0,0,0|2,0,0]=4 545 B13R1.167 CC(=O)CCOCc1ccoc1C 9c265aca9d0acc711a6513ce631ad0d4 [0,2,0,0,0,0|1,1,0]=4 546 B13R1.167 Cc1occc1CNCCC(C)C 5b11477a2750c814563e0cfd28b580b6 [0,2,0,0,0,0|2,0,0]=4 547 B13R1.167 Cc1occc1CNCCC(C)O 952e8b168193b36013e03ad4a46e3719 [0,2,0,0,0,0|2,0,0]=4 548 B13R1.167 Cc1occc1CNCCN(C)C d814d8ee8336a01bb2ad8fa284521049 [0,2,0,0,0,0|2,0,0]=4 549 B13R1.167 Cc1occc1CNCCS(=O)C f578c06fc99fe8e9e9f75b214e111eda [0,2,0,0,0,0|2,0,0]=4 550 B13R1.167 Cc1occc1CNCOC(C)C 89dc858871100208c58c08ca51379941 [0,2,0,0,0,0|2,0,0]=4 551 B13R1.167 Cc1occc1COCCC(C)C 8a1b583ae0841088c435b9d03b5f7113 [0,2,0,0,0,0|1,1,0]=4 552 B13R1.167 Cc1occc1COCCN(C)C 00b2f2aaec4506a9d880da7bfcb7d7a7 [0,2,0,0,0,0|1,1,0]=4 553 B13R1.167 Cc1occc1COCCS(=O)C 7eac474fa014bc7116fb77d494bc6d56 [0,2,0,0,0,0|1,1,0]=4 554 B13R1.167 Cc1occc1COCOC(C)C c312039bc6c1adac2994114a6d157977 [0,2,0,0,0,0|1,1,0]=4 555 B13R1.190 CCCCNCc1cc(oc1C)C 16bad6af924474795ae500742ab8232d [0,2,0,0,0,0|2,0,0]=4 556 B13R1.190 CCCCOCc1cc(oc1C)C a6559da3cd141bb1790b97afe3753c90 [0,2,0,0,0,0|1,1,0]=4 557 B13R1.190 CCOCNCc1cc(oc1C)C 1d1059f25687d89df1cd617ab4077e23 [0,2,0,0,0,0|2,0,0]=4 558 B13R1.190 COCCNCc1cc(oc1C)C 8379b263c2d62d4a3a1814405eff39cd [0,2,0,0,0,0|2,0,0]=4 559 B13R1.190 COCCOCc1cc(oc1C)C c3645f70176fcbaf75c7ccc93444f007 [0,2,0,0,0,0|1,1,0]=4 560 B13R1.190 CSCCNCc1cc(oc1C)C 08452e9a5c5bee32e5bf7bdb0f147a54 [0,2,0,0,0,0|2,0,0]=4 561 B13R1.190 CSCCOCc1cc(oc1C)C cceff28aa6f3d21ee0b944ab93fedda5 [0,2,0,0,0,0|1,1,0]=4 562 B13R1.190 Cc1cc(c(o1)C)CNCCCF 954d399be70908750774f58613e576b9 [0,2,0,0,0,0|2,0,0]=4 563 B13R1.190 Cc1cc(c(o1)C)CNCCCO be751406c73827350e0ff9e9646e8f04 [0,2,0,0,0,0|2,0,0]=4 564 B13R1.190 Cc1cc(c(o1)C)CNCCCS 6b2d79bac2912a24bc456e4e021ed915 [0,2,0,0,0,0|2,0,0]=4 565 B13R1.190 Cc1cc(c(o1)C)COCCCF 2f7eb8b73f53328f0b1f64b120b50e89 [0,2,0,0,0,0|1,1,0]=4 566 B13R1.190 Cc1cc(c(o1)C)COCCCS 96f9273136cf55972d3253fdbde15db1 [0,2,0,0,0,0|1,1,0]=4 567 B13R1.654 C#CCCCNCc1ccoc1C 4d879f0b8607a501e4c81a664fa4cc84 [0,2,0,0,0,0|2,0,0]=4 568 B13R1.654 C#CCCCOCc1ccoc1C 5a77a690753640e1106f33c38a08f2b4 [0,2,0,0,0,0|1,1,0]=4 569 B13R1.654 C=CCCCNCc1ccoc1C baf02cfda443d0112a70f0e943e8c46a [0,2,0,0,0,0|2,0,0]=4 570 B13R1.654 C=CCCCOCc1ccoc1C 4fe2c8fe763e7d22ea9df286d0099ef2 [0,2,0,0,0,0|1,1,0]=4 571 B13R1.654 CC/C=C/CNCc1ccoc1C 2313eaf780fc59d4a178ba905c4e9a1a [0,2,0,0,0,0|2,0,0]=4 572 B13R1.654 CC/C=C/COCc1ccoc1C 4bc9c71a0191573b9e0bbba2d14e5501 [0,2,0,0,0,0|1,1,0]=4 573 B13R1.654 CCCCCNCc1ccoc1C 187dbd70c6b0a1a843e367ffbfc9aeed [0,2,0,0,0,0|2,0,0]=4 574 B13R1.654 CCCCCOCc1ccoc1C 920da468843532f1989a8e2e93a391f8 [0,2,0,0,0,0|1,1,0]=4 575 B13R1.654 CCOCCNCc1ccoc1C f7b0960a362269245e06e20e60636082 [0,2,0,0,0,0|2,0,0]=4 576 B13R1.654 CCOCCOCc1ccoc1C caadedc2da1865d447f96daabf9feaba [0,2,0,0,0,0|1,1,0]=4 577 B13R1.654 CCSCCNCc1ccoc1C 09dfa4c1001f7516c1920137f0e20829 [0,2,0,0,0,0|2,0,0]=4 578 B13R1.654 CCSCCOCc1ccoc1C c6d4ab5d021733c157bbcdfb3eea477e [0,2,0,0,0,0|1,1,0]=4 579 B13R1.654 COCCCNCc1ccoc1C d1b6a51d87fc8f29f855371d5256a713 [0,2,0,0,0,0|2,0,0]=4 580 B13R1.654 COCCCOCc1ccoc1C e677ae23a2a3baf870a55ba1c3792cd6 [0,2,0,0,0,0|1,1,0]=4 581 B13R1.654 CSCCCNCc1ccoc1C 9aeec8ff11e0b6886e2782063d1501a2 [0,2,0,0,0,0|2,0,0]=4 582 B13R1.654 CSCCCOCc1ccoc1C d2c63a5aaa28b0dd4291812f6701431e [0,2,0,0,0,0|1,1,0]=4 583 B13R1.654 Cc1occc1CNCCCC#N ddffda05f07de2ef32361f900fb79ffd [0,2,0,0,0,0|2,0,0]=4 584 B13R1.654 Cc1occc1CNCCCC=O 86ab771fb0ce6c7f01808228d841759d [0,2,0,0,0,0|2,0,0]=4 585 B13R1.654 Cc1occc1CNCCCCF 3fc852fa7bec44113e7cd309cfe76da9 [0,2,0,0,0,0|2,0,0]=4 586 B13R1.654 Cc1occc1CNCCCCO f7a12630cf0bffa67089b4ab7b816c28 [0,2,0,0,0,0|2,0,0]=4 587 B13R1.654 Cc1occc1COCCCC#N f5f4d2af134d11e723ab498ac40b6bbf [0,2,0,0,0,0|1,1,0]=4 588 B13R1.654 Cc1occc1COCCCC=O 6eb4117a9291862fc209c8eba96a3579 [0,2,0,0,0,0|1,1,0]=4 589 B13R1.654 Cc1occc1COCCCCF fab6168bad5c7dfd004292838d40692e [0,2,0,0,0,0|1,1,0]=4 590 B13R1.725 CCCCNC(=O)c1ccoc1C a6d7153f29b4c5da75ee29655234781d [0,2,0,0,0,0|2,0,0]=4 591 B13R1.725 COCCNC(=O)c1ccoc1C 1195f325c3f0abee41da952d0fb642eb [0,2,0,0,0,0|2,0,0]=4 592 B13R1.725 CSCCNC(=O)c1ccoc1C ebd067c750bdf83affb8e9aa50238ec2 [0,2,0,0,0,0|2,0,0]=4 593 B13R1.725 Cc1occc1C(=O)NCCCCl 28a3442b565b57fc52e5264a3e4b853b [0,2,0,0,0,0|2,0,0]=4 594 B13R1.725 Cc1occc1C(=O)NCCCO 76ca37741a830634159e6befa2222330 [0,2,0,0,0,0|2,0,0]=4 595 B13R1.680 CCCNC(=O)c1cc(oc1C)Br 711998d2fe235fd213a369f66f641d6f [0,2,0,0,0,0|2,0,0]=4 596 B13R1.680 CCCNC(=O)c1cc(oc1C)C 10d95ed75705258dcf40ba6ab0d7f994 [0,2,0,0,0,0|2,0,0]=4 597 B13R1.2515 CCCNC(=O)c1c(coc1C)C 1cab9324eda56bb3a6a2da0b4e5d9168 [0,2,0,0,0,0|2,0,0]=4 598 B11R2.5 CC1CC1Nc2ccoc2 f306e4fc391a67fbda2e38594357206d [1,0,0,1,0,0|2,0,0]=4 599 B11R2.385 c1cc(co1)COC2CC2 35d9e97d12fac95a3d58a489c841e98a [1,0,0,1,0,0|1,1,0]=4 600 B11R2.385 c1cc(co1)NCC2CC2 1e87185fea84c46c84fa920c9940d803 [1,0,0,1,0,0|2,0,0]=4 601 B13R2.449 CCCN1CCc2occc2C1 0d5201335338c823c6a7dc4c17824e08 [0,1,0,1,0,0|2,0,0]=4 602 B13R2.3140 Cc1occc1CNCC2CC2 06b6e91fa8421ffe77df1d1a8dac0ee7 [0,1,0,1,0,0|2,0,0]=4 603 B13R2.3140 Cc1occc1COCC2CC2 a18aa2de511be098ae808d419a789551 [0,1,0,1,0,0|1,1,0]=4 604 B13R2.3139 Cc1occc1CN(C)C2CC2 3e0962aaffcbd8075f4d8a8d8d14b3d0 [0,1,0,1,0,0|2,0,0]=4 605 B13R2.3152 Cc1occc1CNC2CCC2 7866084d74c9a7a62bcaee904e14b117 [0,1,0,1,0,0|2,0,0]=4 606 B13R2.3152 Cc1occc1COC2CCC2 b5a3ae5f195a6fc46241fba46febc4e7 [0,1,0,1,0,0|1,1,0]=4 607 B13R2.3152 Cc1occc1COC2COC2 a185a452987070a485ad2a074b5ea778 [0,1,0,1,0,0|1,1,0]=4 608 B13R2.3004 Cc1cc(c(o1)C)CNC2CC2 3bd492e31e2f9c963eccb6592c63a083 [0,1,0,1,0,0|2,0,0]=4 609 B13R2.3004 Cc1cc(c(o1)C)COC2CC2 ecd3d1cb9b0c71eced6d436b014ede0e [0,1,0,1,0,0|1,1,0]=4 610 B13R2.3151 Cc1occc1C(=O)NC2CC2 0065ad23449e3c8ee6ada1ae9683da2e [0,1,0,1,0,0|2,0,0]=4 611 B13R2.10561 Cc1occc1C(=O)N2CCC2 bb36cb21982ad1bc7a451194230116f5 [0,1,0,1,0,0|2,0,0]=4