0 B11R1.91 C=C(Br)CNc1ccccc1 93ec6105ca168468e9c8838717ff6b1e [0,0,0,0,0,0|2,0,2]=4 1 B11R1.91 C=C(C)CNc1ccccc1 9ff030153dc2dcaf07d1da3f9e6a073f [0,0,0,0,0,0|2,0,1]=3 2 B11R1.91 C=C(C)CNc1ccccn1 296f6d3c9e71203263ef4c60889651d0 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.91 C=C(C)CNc1cccnc1 8810dec0d1b93ae6f2f50fc532118fa0 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.91 C=C(C)CNc1ccncc1 7fd564b3611fb48098820a623411bd04 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.91 C=C(C)COc1ccccn1 53d55f6223fd317f454a145f4adf39b2 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.91 C=C(C)COc1cccnc1 3cac933caa917577843fc86e5c520fd6 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.91 C=C(C)COc1ccncc1 5c56bc0d616e9eba4b34abaa7d463cec [0,0,0,0,0,0|3,0,1]=4 8 B11R1.91 C=C(Cl)CNc1ccccc1 e3c53739f614fbc554b5ed591e111126 [0,0,0,0,0,0|2,0,2]=4 9 B11R1.91 C=C(F)CNc1ccccc1 aea10c9376159512fe2427e907c2a329 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [0,0,0,0,0,0|1,0,2]=3 11 B11R1.91 CC(=O)CNc1ccccn1 9ef5867d6e28a360f3e560522ae4c545 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.91 CC(=O)CNc1cccnc1 35a6037a85b015cc869f557087769b5d [0,0,0,0,0,0|2,0,2]=4 13 B11R1.91 CC(=O)CNc1ccncc1 e7e1df2bfec9194a79bb5918ba94764c [0,0,0,0,0,0|2,0,2]=4 14 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,0,0,0,0,0|1,0,2]=3 15 B11R1.91 CC(=O)NCc1ccccn1 4a5e0ad0f6fb64ba7eb4726872bef1d0 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.91 CC(=O)NCc1cccnc1 7b71a51c058bd0c2c3114d8b61c7e1f0 [0,0,0,0,0,0|2,0,2]=4 17 B11R1.91 CC(=O)NCc1ccncc1 9156811b92bf0707f7382e576ceea554 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.91 CC(C)CNc1ccccn1 7b009ca04377ecc13f70ec3cf4ebfeda [0,0,0,0,0,0|3,0,0]=3 20 B11R1.91 CC(C)CNc1cccnc1 872c17275baf8dfc3e3fcfc1c6e8b0aa [0,0,0,0,0,0|3,0,0]=3 21 B11R1.91 CC(C)CNc1cccnn1 6e0a186ee92f69845b1d1e2faa4b9d99 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.91 CC(C)CNc1ccncc1 25b00c7dc1cdd402497940b3c77292de [0,0,0,0,0,0|3,0,0]=3 23 B11R1.91 CC(C)CNc1ccncn1 f3aaf01b8fb4390cec4d8d0c307de117 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.91 CC(C)CNc1ccnnc1 a8df0e4f94a9188832304de39fa0752f [0,0,0,0,0,0|4,0,0]=4 25 B11R1.91 CC(C)CNc1cnccn1 95ddfe6d68910c614f0cbdfaa85d0133 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.91 CC(C)CNc1cncnc1 cb16d6f63363d23c43e0f4ee19155631 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.91 CC(C)CNc1ncccn1 fb6ae2e310931ddbda6cf67796620c38 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.91 CC(C)COc1ccccn1 7b0823f232ca75667ab72b773cf2055c [0,0,0,0,0,0|3,0,0]=3 29 B11R1.91 CC(C)COc1cccnc1 639764ab0bac28311f80a0c1092bb51e [0,0,0,0,0,0|3,0,0]=3 30 B11R1.91 CC(C)COc1ccncc1 f219312091f37b23472c98e305cf03a6 [0,0,0,0,0,0|3,0,0]=3 31 B11R1.91 CC(C)COc1ccnnc1 505d9a49f2cac632fe0c68cb941cb98c [0,0,0,0,0,0|4,0,0]=4 32 B11R1.91 CC(C)COc1cnccn1 fca5516fc8fc749e126db826ec1364f8 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.91 CC(C)COc1cncnc1 b99958e2d254a4ae75237cf3e69e1130 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.91 CC(C)COc1ncccn1 1f457fce7df81ae19e8aadca0db78537 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,0,0,0,0,0|2,0,0]=2 36 B11R1.91 CC(C)NCc1ccccn1 856545f5d02de0038284fed0716bf52b [0,0,0,0,0,0|3,0,0]=3 37 B11R1.91 CC(C)NCc1cccnc1 f83c1668bc1a0795e6062eecd9dab4fd [0,0,0,0,0,0|3,0,0]=3 38 B11R1.91 CC(C)NCc1cccnn1 cccaf60f16873524c6ada28e623ee50e [0,0,0,0,0,0|4,0,0]=4 39 B11R1.91 CC(C)NCc1ccncc1 6f1dfa66543bb67ac78a3a333bf46a66 [0,0,0,0,0,0|3,0,0]=3 40 B11R1.91 CC(C)NCc1ccncn1 36ee71268b7fc037f6d2456244279a98 [0,0,0,0,0,0|4,0,0]=4 41 B11R1.91 CC(C)NCc1ccnnc1 98a9968a20acdc964ac10c028e00eec7 [0,0,0,0,0,0|4,0,0]=4 42 B11R1.91 CC(C)NCc1cnccn1 320d7f2d7b3c9da90f951a37d43af864 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.91 CC(C)NCc1ncccn1 248c6dc0e3f7cb9e6cb68053e65f796a [0,0,0,0,0,0|4,0,0]=4 44 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,0,0,0,0,0|2,0,0]=2 45 B11R1.91 CC(C)OCc1ccccn1 0763eb944dcd10bf40a6049a3281f0fa [0,0,0,0,0,0|3,0,0]=3 46 B11R1.91 CC(C)OCc1cccnc1 15bee2bbdfea4851383d51503cc56958 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.91 CC(C)OCc1cccnn1 9e75df7bf42bec5daa46f121cb3b2fee [0,0,0,0,0,0|4,0,0]=4 48 B11R1.91 CC(C)OCc1ccncc1 6b799cfffcfa8445d7523666b8d1a250 [0,0,0,0,0,0|3,0,0]=3 49 B11R1.91 CC(C)OCc1ccncn1 8ca6a7835eff3f310e3286485f2bc8a3 [0,0,0,0,0,0|4,0,0]=4 50 B11R1.91 CC(C)OCc1ccnnc1 9f4405a184896ebf514498f5e77701bf [0,0,0,0,0,0|4,0,0]=4 51 B11R1.91 CC(C)OCc1cnccn1 e68303144f36400499d51e9b07ed6d5f [0,0,0,0,0,0|4,0,0]=4 52 B11R1.91 CC(C)OCc1cncnc1 0b9844eb4d847bf9172813d1bb5440e6 [0,0,0,0,0,0|4,0,0]=4 53 B11R1.91 CC(C)OCc1ncccn1 38d74e076887ffaed244a2918ea05836 [0,0,0,0,0,0|4,0,0]=4 54 B11R1.91 CC(O)CCN1CC=CCC1 dfe64ddccbdab298af4f980824c483b2 [0,0,0,0,0,0|1,0,3]=4 55 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,0,0,0,0,0|1,0,0]=1 56 B11R1.91 CC(O)CNc1ccccn1 0b02a9fc805d3fdc80aa58b252d76fac [0,0,0,0,0,0|2,0,0]=2 57 B11R1.91 CC(O)CNc1cccnc1 be948b4ea22210c06fa11f5ff0c44d9b [0,0,0,0,0,0|2,0,0]=2 58 B11R1.91 CC(O)CNc1cccnn1 e8550c43b60b9bd9029917d25ea6398c [0,0,0,0,0,0|3,0,0]=3 59 B11R1.91 CC(O)CNc1ccncc1 58a36af31ee3d9178a47f4e2f681d20e [0,0,0,0,0,0|2,0,0]=2 60 B11R1.91 CC(O)CNc1ccncn1 87e78bbdc595709f51d9a8bdf7f2897c [0,0,0,0,0,0|3,0,0]=3 61 B11R1.91 CC(O)CNc1ccnnc1 ab88da5307d11b10e2373643d8ebb95d [0,0,0,0,0,0|3,0,0]=3 62 B11R1.91 CC(O)CNc1cnccn1 f991222b12e39f41fc4f22d1360207a1 [0,0,0,0,0,0|3,0,0]=3 63 B11R1.91 CC(O)CNc1cncnc1 9fc5976bef6d9ef64c8d846f37ba79d4 [0,0,0,0,0,0|3,0,0]=3 64 B11R1.91 CC(O)CNc1cnncn1 e9d744d012cb875341a25fa1c5edb17d [0,0,0,0,0,0|4,0,0]=4 65 B11R1.91 CC(O)CNc1ncccn1 b6f7059776643b68745371242f2eebca [0,0,0,0,0,0|3,0,0]=3 66 B11R1.91 CC(O)CNc1nccnn1 079966ed897e1488fdb5a48945dead87 [0,0,0,0,0,0|4,0,0]=4 67 B11R1.91 CC(O)CNc1ncncn1 8378777ea0b6c602b3848430a6c1368f [0,0,0,0,0,0|4,0,0]=4 68 B11R1.91 CN(C)CNc1ccccc1 6ea2b21a530eb73fceed274bf1825a42 [0,0,0,0,0,0|3,0,0]=3 69 B11R1.91 CN(C)CNc1ccccn1 7dd3487cd8d87b9dce82d3b1e66d4dfe [0,0,0,0,0,0|4,0,0]=4 70 B11R1.91 CN(C)CNc1cccnc1 06dc729fa11ea9023ada541fc670b33d [0,0,0,0,0,0|4,0,0]=4 71 B11R1.91 CN(C)CNc1ccncc1 06f2faf99e2f9062dfe4af47bfbbee1d [0,0,0,0,0,0|4,0,0]=4 72 B11R1.91 CN(C)COc1ccccn1 0d00edbce2a52e0b3d43150d9124361f [0,0,0,0,0,0|4,0,0]=4 73 B11R1.91 CN(C)COc1cccnc1 ba3cfa03500b005052d6345515b92103 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.91 CN(C)COc1ccncc1 24dcd02da3008257944139a724552f1d [0,0,0,0,0,0|4,0,0]=4 75 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,0,0,0,0,0|1,0,0]=1 76 B11R1.91 C[C@@H](O)CNc1ccccn1 2f50c5c35f8b03d00f3a417683f2e1c8 [0,0,0,0,0,0|2,0,0]=2 77 B11R1.91 C[C@@H](O)CNc1cccnc1 0269da8e8da5f2bc75323d1a7b31953c [0,0,0,0,0,0|2,0,0]=2 78 B11R1.91 C[C@@H](O)CNc1cccnn1 6d7b3599ec55158b05cb5aa4687b61f0 [0,0,0,0,0,0|3,0,0]=3 79 B11R1.91 C[C@@H](O)CNc1ccncc1 a759ad58b644a21887782ccec01db51a [0,0,0,0,0,0|2,0,0]=2 80 B11R1.91 C[C@@H](O)CNc1ccncn1 b017b3dcb881e43eb2f919cb0bf0d312 [0,0,0,0,0,0|3,0,0]=3 81 B11R1.91 C[C@@H](O)CNc1ccnnc1 fc7aeafa26d135bbab6fad8fb9254eca [0,0,0,0,0,0|3,0,0]=3 82 B11R1.91 C[C@@H](O)CNc1cnccn1 eefedac70fb9e61b84978ca5f31e1024 [0,0,0,0,0,0|3,0,0]=3 83 B11R1.91 C[C@@H](O)CNc1cnncn1 ec8f16affeeb15fca88b483b81b727bd [0,0,0,0,0,0|4,0,0]=4 84 B11R1.91 C[C@@H](O)CNc1ncccn1 ec34d1470851807c1662c266c1187822 [0,0,0,0,0,0|3,0,0]=3 85 B11R1.91 C[C@@H](O)CNc1nccnn1 97fdbd1b5c4939a91b3631c209d843d4 [0,0,0,0,0,0|4,0,0]=4 86 B11R1.91 C[C@@H](O)CNc1ncncn1 4a9bcbd957cdb1adcc86639f07423516 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,0,0,0,0,0|1,0,0]=1 88 B11R1.91 C[C@H](O)CNc1ccccn1 b5e1e178b39afd2578578a870577034a [0,0,0,0,0,0|2,0,0]=2 89 B11R1.91 C[C@H](O)CNc1cccnc1 13f963f21a32ff7cb405ad7d76f40567 [0,0,0,0,0,0|2,0,0]=2 90 B11R1.91 C[C@H](O)CNc1cccnn1 d1cbd42116d6dcb71e4b9c0be7e6b4b4 [0,0,0,0,0,0|3,0,0]=3 91 B11R1.91 C[C@H](O)CNc1ccncc1 40e1cfcf68d3fb31f8ea23f4fe31cf2f [0,0,0,0,0,0|2,0,0]=2 92 B11R1.91 C[C@H](O)CNc1ccncn1 d98c0c85670dd7a9571673306a8a7bbe [0,0,0,0,0,0|3,0,0]=3 93 B11R1.91 C[C@H](O)CNc1ccnnc1 121e8797e50363cde88e3aa495b3c0e6 [0,0,0,0,0,0|3,0,0]=3 94 B11R1.91 C[C@H](O)CNc1cnccn1 8436b233d47376aa6994f036c7608979 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.91 C[C@H](O)CNc1cncnc1 892e1398c21057eaaa2e672d8bd1d026 [0,0,0,0,0,0|3,0,0]=3 96 B11R1.91 C[C@H](O)CNc1cnncn1 70a6f470a69e2478a941d74a578a283f [0,0,0,0,0,0|4,0,0]=4 97 B11R1.91 C[C@H](O)CNc1ncccn1 b8c9593e9f50f526bf52c6b1059528a2 [0,0,0,0,0,0|3,0,0]=3 98 B11R1.91 C[C@H](O)CNc1nccnn1 4aeacf9a97ea5933405c1b517f46e8ff [0,0,0,0,0,0|4,0,0]=4 99 B11R1.91 C[C@H](O)CNc1ncncn1 dfe662c9d366e87300e75de3cfa1ce4f [0,0,0,0,0,0|4,0,0]=4 100 B11R1.91 FC(F)CNc1ccccc1 84c83ea792636e350c2a00840c340dda [0,0,0,0,0,0|3,0,0]=3 101 B11R1.91 FC(F)CNc1ccccn1 3e6bbc18fb170dbd99c0771b3f20bde4 [0,0,0,0,0,0|4,0,0]=4 102 B11R1.91 FC(F)CNc1cccnc1 a910c213573add99ea980c8d5d2e609d [0,0,0,0,0,0|4,0,0]=4 103 B11R1.91 FC(F)CNc1ccncc1 852d9eca092b668f9041ed00a1aecc1b [0,0,0,0,0,0|4,0,0]=4 104 B11R1.91 FC(F)COc1ccccn1 5e0a1a0fa35c804046b8ebf535a7456b [0,0,0,0,0,0|4,0,0]=4 105 B11R1.91 FC(F)COc1cccnc1 16e8b5d84e4d3ff38c6e69c3e22cb9c1 [0,0,0,0,0,0|4,0,0]=4 106 B11R1.91 FC(F)COc1ccncc1 dbba5604807b4396b0d70022291913bd [0,0,0,0,0,0|4,0,0]=4 107 B11R1.91 NC(=O)CNc1ccccc1 cb8f4e233e85228cf5430aee72130ae8 [0,0,0,0,0,0|2,0,2]=4 108 B11R1.91 O=C(O)CNc1ccccc1 aa02152e084051d6acb84b2b7ca3be40 [0,0,0,0,0,0|2,0,1]=3 109 B11R1.91 O=C(O)CNc1ccccn1 83bad72d96578f6ee29657bf854abc17 [0,0,0,0,0,0|3,0,1]=4 110 B11R1.91 O=C(O)CNc1cccnc1 4378235c0fca8603764c85f64c571ed0 [0,0,0,0,0,0|3,0,1]=4 111 B11R1.91 O=C(O)CNc1ccncc1 d2ec8efae842007114d587a1ec71d62f [0,0,0,0,0,0|3,0,1]=4 112 B11R1.91 O=C(O)COc1ccccn1 d10c5c7e1100e6f68973343e5e477bed [0,0,0,0,0,0|3,0,1]=4 113 B11R1.91 O=C(O)COc1cccnc1 109e5f2cec28855b082ac5e8dd76ca14 [0,0,0,0,0,0|3,0,1]=4 114 B11R1.91 O=C(O)COc1ccncc1 b0acb3702ddf8b44733ab3e3ff47483a [0,0,0,0,0,0|3,0,1]=4 115 B11R1.91 O=[N+]([O-])CNc1ccccc1 ee2373fe0eba3d741763c77ec19667e3 [0,0,0,0,0,0|3,0,1]=4 116 B10R1.17 BrCCNc1ccccc1 08c39138e90dcc3ad4c25fdba0569b67 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.17 BrCCNc1ccccn1 3e3884def368abe14a8394ce1a1093e4 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.17 BrCCNc1cccnc1 2d13be8c88ebb7269676c6abc03a383d [1,0,0,0,0,0|3,0,0]=4 119 B10R1.17 BrCCNc1ccncc1 aa3f433af4f4f2183977f3124b404d50 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.17 C#CCNc1ccccc1 61f0baab40ac49dd5c7bdcf3c0e69fb4 [1,0,0,0,0,0|1,0,2]=4 121 B10R1.17 C=CCNc1ccccc1 47db636c74d7e6cdd4488df2cb146b26 [1,0,0,0,0,0|1,0,2]=4 122 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [1,0,0,0,0,0|1,0,0]=2 123 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [1,0,0,0,0,0|2,0,0]=3 124 B10R1.17 CCCNc1cccnc1 54f0ece250e78709faf1eb2fd4dc869b [1,0,0,0,0,0|2,0,0]=3 125 B10R1.17 CCCNc1cccnn1 563334c6dadea743653cde03719d759b [1,0,0,0,0,0|3,0,0]=4 126 B10R1.17 CCCNc1ccncc1 d6095b2a5c05617a6cec49b81fb053c5 [1,0,0,0,0,0|2,0,0]=3 127 B10R1.17 CCCNc1ccncn1 b9fcfeaf51b4e3f06d605d771d307526 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.17 CCCNc1ccnnc1 2caee9d9c90b98666cbfecfa06fa8cff [1,0,0,0,0,0|3,0,0]=4 129 B10R1.17 CCCNc1cnccn1 21846cbecedbe2640cf1187c9cb12883 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.17 CCCNc1cncnc1 2bb7fb2ced184242938c7fda4c6e1a37 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.17 CCCNc1ncccn1 75419027ddb25105c51dd1506820ccba [1,0,0,0,0,0|3,0,0]=4 132 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [1,0,0,0,0,0|2,0,0]=3 133 B10R1.17 CCCOc1cccnc1 a97f517fc793a805aaab3ac7468bbd26 [1,0,0,0,0,0|2,0,0]=3 134 B10R1.17 CCCOc1ccncc1 f349ca52270425380eacc7a2a158cca4 [1,0,0,0,0,0|2,0,0]=3 135 B10R1.17 CCCOc1ccnnc1 3c9c3d60b434f5a1bdb1673f40955496 [1,0,0,0,0,0|3,0,0]=4 136 B10R1.17 CCCOc1cnccn1 63621ef82dd8a608febe84451551c55a [1,0,0,0,0,0|3,0,0]=4 137 B10R1.17 CCCOc1cncnc1 3e9abc9b1ba148ce4f151dd0bc3facae [1,0,0,0,0,0|3,0,0]=4 138 B10R1.17 CCCOc1ncccn1 5c5a6b9b9ac104a48d6c4b0d32992f0c [1,0,0,0,0,0|3,0,0]=4 139 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [1,0,0,0,0,0|1,0,0]=2 140 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [1,0,0,0,0,0|2,0,0]=3 141 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [1,0,0,0,0,0|2,0,0]=3 142 B10R1.17 CCNCc1cccnn1 d81bd9bf1bc516576c473bbc4cf064a6 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.17 CCNCc1ccncc1 2e26d8de78e71e06bcd28df387653244 [1,0,0,0,0,0|2,0,0]=3 144 B10R1.17 CCNCc1ccncn1 ae6a093ba5aef71c0ed8d67651e0dd26 [1,0,0,0,0,0|3,0,0]=4 145 B10R1.17 CCNCc1ccnnc1 dc0861acfe2535501016a881a15b8655 [1,0,0,0,0,0|3,0,0]=4 146 B10R1.17 CCNCc1cnccn1 e42a4917d2a6a9dffed5bdafd4c5a5d6 [1,0,0,0,0,0|3,0,0]=4 147 B10R1.17 CCNCc1cncnc1 f9703e58bb488c49affd31e2d844b19f [1,0,0,0,0,0|3,0,0]=4 148 B10R1.17 CCNCc1ncccn1 7e64da8f6dedc74d9803d8b0ac5afe0e [1,0,0,0,0,0|3,0,0]=4 149 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [1,0,0,0,0,0|1,0,0]=2 150 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [1,0,0,0,0,0|2,0,0]=3 151 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [1,0,0,0,0,0|2,0,0]=3 152 B10R1.17 CCOCc1cccnn1 a18ecdaafc84bd92138525fb2f4ad399 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.17 CCOCc1ccncc1 1d1afe04b02325a5cf955e686c22ba10 [1,0,0,0,0,0|2,0,0]=3 154 B10R1.17 CCOCc1ccncn1 d55d0b80fa8d405bad8866668c0f9fa7 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.17 CCOCc1ccnnc1 eb3f0189714571d275860574016314ed [1,0,0,0,0,0|3,0,0]=4 156 B10R1.17 CCOCc1cnccn1 7fb271123056acc990d03d3767398eec [1,0,0,0,0,0|3,0,0]=4 157 B10R1.17 CCOCc1cncnc1 c69748ab8bdd1b31da65e1fc4248cd6d [1,0,0,0,0,0|3,0,0]=4 158 B10R1.17 CCOCc1ncccn1 ba95357c7224be2db8f523f6aa6f9bb0 [1,0,0,0,0,0|3,0,0]=4 159 B10R1.17 COCNc1ccccc1 6c62c6b48b6ce69fe29d4b52e03d5674 [1,0,0,0,0,0|2,0,0]=3 160 B10R1.17 COCNc1ccccn1 a7abef3468bc69aa80ea510854a664da [1,0,0,0,0,0|3,0,0]=4 161 B10R1.17 COCNc1cccnc1 06eb298a8599044156c09f99ea626504 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.17 COCNc1ccncc1 cff9bc6476b5f7fb176472d400021849 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.17 COCOc1ccccn1 20cd252a71a5a01c3e93af63053a4326 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.17 COCOc1cccnc1 d9b37fb8d6b9f459b8606485db596791 [1,0,0,0,0,0|3,0,0]=4 165 B10R1.17 COCOc1ccncc1 18fbb570a0961cb423d27776329da350 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.17 CSCNc1ccccc1 7a27a5c68b132b0ae36908396631930e [1,0,0,0,0,0|2,0,0]=3 167 B10R1.17 CSCNc1ccccn1 cc0ec9b3c5cc0b5eddbb2cfb429d6e35 [1,0,0,0,0,0|3,0,0]=4 168 B10R1.17 CSCNc1cccnc1 e9d3d08db46089fcfbd01833b3252a03 [1,0,0,0,0,0|3,0,0]=4 169 B10R1.17 CSCNc1ccncc1 b2728812347dbf5a187f75cde2f2f0f7 [1,0,0,0,0,0|3,0,0]=4 170 B10R1.17 CSCOc1ccccn1 af78560ad465f4d707ca132fa83d0e3a [1,0,0,0,0,0|3,0,0]=4 171 B10R1.17 CSCOc1cccnc1 ba5df6f707d429b8683f03b4c7f7b4a6 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.17 CSCOc1ccncc1 4513be07dbfed35afed2a35144dfb259 [1,0,0,0,0,0|3,0,0]=4 173 B10R1.17 FCCNc1ccccc1 f275d2eb426a2818882d3c7dcacca572 [1,0,0,0,0,0|2,0,0]=3 174 B10R1.17 FCCNc1ccccn1 6ab197fb6cbd8dea7ad6d85c80356b58 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.17 FCCNc1cccnc1 948881de1f8cebdb00d3305a89cccf21 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.17 FCCNc1ccncc1 261e26a80d82936049687c2cbf67d868 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.17 FCCOc1ccccn1 06b65dfb48082d4779fc37c34dadb476 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.17 FCCOc1cccnc1 7a88b89adbe5c70a007fa3204bf675ab [1,0,0,0,0,0|3,0,0]=4 179 B10R1.17 FCCOc1ccncc1 7674fd5219d4fad9f3b2390ff6ade4b7 [1,0,0,0,0,0|3,0,0]=4 180 B10R1.17 FCNCc1ccccc1 0dcd541b35f2d813e3bd4529f13aa61b [1,0,0,0,0,0|2,0,0]=3 181 B10R1.17 FCNCc1ccccn1 14327276004818c05fc55a3ce987673c [1,0,0,0,0,0|3,0,0]=4 182 B10R1.17 FCNCc1cccnc1 303a68c3e72902076a5285aac654492a [1,0,0,0,0,0|3,0,0]=4 183 B10R1.17 FCNCc1ccncc1 f86a74e0d1d92929ce958fb624476f4c [1,0,0,0,0,0|3,0,0]=4 184 B10R1.17 FCOCc1ccccc1 602c85a0828834d1798ab6d91c5aa92b [1,0,0,0,0,0|2,0,0]=3 185 B10R1.17 FCOCc1ccccn1 52de5aacdb8cde16edb0cbea31183c40 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.17 FCOCc1cccnc1 d58467b55ec7fcb175961d4ef6210edb [1,0,0,0,0,0|3,0,0]=4 187 B10R1.17 FCOCc1ccncc1 90104d817a6745d762aa8ebc5bd6efa2 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.17 ICCNc1ccccc1 2e8d29f41a7952c3a309dd8ce57744b3 [1,0,0,0,0,0|2,0,0]=3 189 B10R1.17 ICCNc1cccnc1 bd2873fb4e8705ac6b2391510b61aca0 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.17 N#CCNc1ccccc1 fb8b42e8ff84ada914e54c1d3d6bf55b [1,0,0,0,0,0|2,0,1]=4 191 B10R1.17 N#CNCc1ccccc1 a34d70ab939a88101ebb668f17250d10 [1,0,0,0,0,0|2,0,1]=4 192 B10R1.17 O=CCNc1ccccc1 c4995b86d7297371e551e9130c388474 [1,0,0,0,0,0|1,0,2]=4 193 B10R1.17 O=CNCc1ccccc1 8c79f42269c527e7ed1741ce8019791f [1,0,0,0,0,0|1,0,2]=4 194 B10R1.17 OCCNc1ccccc1 39a30f826fab6ed2b66a9ec4a9dddbdb [1,0,0,0,0,0|1,0,0]=2 195 B10R1.17 OCCNc1ccccn1 14d1f9671b0391e7cf5b318b74673aa8 [1,0,0,0,0,0|2,0,0]=3 196 B10R1.17 OCCNc1cccnc1 528072d5adbbf320415662e70c05db36 [1,0,0,0,0,0|2,0,0]=3 197 B10R1.17 OCCNc1cccnn1 904669d1e67b66fbedf39e30d8f01302 [1,0,0,0,0,0|3,0,0]=4 198 B10R1.17 OCCNc1ccncc1 2d153fc0224e0960cc8e262d108ccf9f [1,0,0,0,0,0|2,0,0]=3 199 B10R1.17 OCCNc1ccncn1 16630884411af81ebaafd51b9ece01ce [1,0,0,0,0,0|3,0,0]=4 200 B10R1.17 OCCNc1ccnnc1 6c844b991ad1b9c7f6f76a597c7a9487 [1,0,0,0,0,0|3,0,0]=4 201 B10R1.17 OCCNc1cnccn1 b8c8b329bec75a99372dd1b5fe38a887 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.17 OCCNc1cncnc1 41f2b3166167c4b3726a258fdaf09eb3 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.17 OCCNc1ncccn1 f239abfea1ae338c0c6b2d47a465751c [1,0,0,0,0,0|3,0,0]=4 204 B10R1.17 OCNCc1ccccc1 c4aaeb48f32c090af3c65531a6e27cd4 [1,0,0,0,0,0|1,0,0]=2 205 B10R1.17 OCNCc1ccccn1 9488b9a65408dc593594baac432012ff [1,0,0,0,0,0|2,0,0]=3 206 B10R1.17 OCNCc1cccnc1 86bd6343ace558a3752eaa3d1a554844 [1,0,0,0,0,0|2,0,0]=3 207 B10R1.17 OCNCc1cccnn1 ab22a6b6bf709ff19959feb80ebef395 [1,0,0,0,0,0|3,0,0]=4 208 B10R1.17 OCNCc1ccncc1 31d693e5cbaa1006fa13d8924b3493eb [1,0,0,0,0,0|2,0,0]=3 209 B10R1.17 OCNCc1ccncn1 e1601b835614d257d03e1a317c6e849b [1,0,0,0,0,0|3,0,0]=4 210 B10R1.17 OCNCc1ccnnc1 b085a3150d717e399252729324dde4be [1,0,0,0,0,0|3,0,0]=4 211 B10R1.17 OCNCc1cnccn1 2e97e3c7cc39869beec41193ed233122 [1,0,0,0,0,0|3,0,0]=4 212 B10R1.17 OCNCc1cncnc1 c9fd3f017cac60092425968f0623c6bf [1,0,0,0,0,0|3,0,0]=4 213 B10R1.17 OCNCc1ncccn1 c2a1de97786ff8120b7277138f237b3a [1,0,0,0,0,0|3,0,0]=4 214 B10R1.17 SCCNc1ccccc1 9bbad99372906cf90d9dd5df1e41681f [1,0,0,0,0,0|1,1,0]=3 215 B10R1.17 SCCNc1ccccn1 de2447df01f4514b4267a28db291424f [1,0,0,0,0,0|2,1,0]=4 216 B10R1.17 SCCNc1cccnc1 d7661b93dffeb3e5de5eb3930ee71345 [1,0,0,0,0,0|2,1,0]=4 217 B10R1.17 SCCNc1ccncc1 577353449c24c89c4540584279fd2c55 [1,0,0,0,0,0|2,1,0]=4 218 B10R1.17 SCCOc1ccccn1 80884e7103538d273738856f1f9d4222 [1,0,0,0,0,0|2,1,0]=4 219 B10R1.17 SCCOc1cccnc1 84b759d60311f3e5695c1f1ffc5005e0 [1,0,0,0,0,0|2,1,0]=4 220 B10R1.17 SCCOc1ccncc1 bcb2c22e459aa7ecd2660e818a75429e [1,0,0,0,0,0|2,1,0]=4 221 B12R1.21 C=C(C)CNc1ccc(cc1)Br 8dc7c710ab065447c48123f5bcedf0d7 [0,1,0,0,0,0|2,0,1]=4 222 B12R1.21 C=C(C)CNc1ccc(cc1)C b9648f75e96e288122c1f1f52f17747f [0,1,0,0,0,0|2,0,1]=4 223 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 220d67265de58d61a8991b9e2785ee2d [0,1,0,0,0,0|2,0,1]=4 224 B12R1.21 C=C(C)CNc1ccc(cc1)F 9baed94ab3d9e5ced3ce874d6c51416e [0,1,0,0,0,0|2,0,1]=4 225 B12R1.21 C=C(C)CNc1ccc(cc1)I 06dfc038b0a9a5ffed5b770675a3f2a7 [0,1,0,0,0,0|2,0,1]=4 226 B12R1.21 C=C(C)CNc1ccc(cc1)S 921d107d183b9a1bdcbc25be7b23a76d [0,1,0,0,0,0|2,0,1]=4 227 B12R1.21 C=C(C)COc1ccc(cc1)Br a11895d937d3f2d9f08464f39279ebc3 [0,1,0,0,0,0|2,0,1]=4 228 B12R1.21 C=C(C)COc1ccc(cc1)C 4b1d2a823038eb68fdc1b48cdf3bab5c [0,1,0,0,0,0|2,0,1]=4 229 B12R1.21 C=C(C)COc1ccc(cc1)Cl ea127c52905a815dded5f13c6ffd1cfb [0,1,0,0,0,0|2,0,1]=4 230 B12R1.21 C=C(C)COc1ccc(cc1)F 676a93816a9a29e23b5ed4b6963c19fe [0,1,0,0,0,0|2,0,1]=4 231 B12R1.21 C=C(C)COc1ccc(cc1)I 5901a75df5ef921835413fe721bc19b6 [0,1,0,0,0,0|2,0,1]=4 232 B12R1.21 C=C(C)COc1ccc(cc1)S e1438e91dbf00b53d040faf3c1a65953 [0,1,0,0,0,0|2,0,1]=4 233 B12R1.21 CC(=O)CNc1ccc(cc1)C c6df41938fb73851720b8d504c48231e [0,1,0,0,0,0|1,0,2]=4 234 B12R1.21 CC(=O)CNc1ccc(cc1)F 9780023b225d3200ffd10d583c37ffdb [0,1,0,0,0,0|1,0,2]=4 235 B12R1.21 CC(=O)CNc1ccc(cc1)S 423de7376f76e98fc0bb1a5337720e0a [0,1,0,0,0,0|1,0,2]=4 236 B12R1.21 CC(=O)NCc1ccc(cc1)Br d2cc47a2d2f5d0454a6ab6aa9be01b2e [0,1,0,0,0,0|1,0,2]=4 237 B12R1.21 CC(=O)NCc1ccc(cc1)C 6d1c8fe2cbf40141f0ff7216820c0ba5 [0,1,0,0,0,0|1,0,2]=4 238 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 932ef7783d78c6800f8298437d4b88f9 [0,1,0,0,0,0|1,0,2]=4 239 B12R1.21 CC(=O)NCc1ccc(cc1)F c15fb7f7daa1d8d13002cf39462c9e3a [0,1,0,0,0,0|1,0,2]=4 240 B12R1.21 CC(=O)NCc1ccc(cc1)I 638cbc421d0f9cd22ecaa35e0d864cbc [0,1,0,0,0,0|1,0,2]=4 241 B12R1.21 CC(=O)NCc1ccc(cc1)O 3eb259396d79ab6b5f53bb6ff52007c0 [0,1,0,0,0,0|1,0,2]=4 242 B12R1.21 CC(C)CNc1ccc(=O)[nH]c1 3970684279a6ee0105700d3d18cb6e83 [0,1,0,0,0,0|3,0,0]=4 243 B12R1.21 CC(C)CNc1ccc(cc1)Br aafc6d7f6bffefff521c174b2e36cf47 [0,1,0,0,0,0|2,0,0]=3 244 B12R1.21 CC(C)CNc1ccc(cc1)Cl b590bea18aa2be2fe9530b5825b6b83d [0,1,0,0,0,0|2,0,0]=3 245 B12R1.21 CC(C)CNc1ccc(cc1)F f869f8ebca9e23d7a314cca58e04355a [0,1,0,0,0,0|2,0,0]=3 246 B12R1.21 CC(C)CNc1ccc(cc1)I f5ed240cfb530eb638c88433537d6bc6 [0,1,0,0,0,0|2,0,0]=3 247 B12R1.21 CC(C)CNc1ccc(cc1)S 5aebae70a565a4395c9f06d404e49e19 [0,1,0,0,0,0|2,0,0]=3 248 B12R1.21 CC(C)CNc1ccc(cn1)Br bde6ddc1f63f60284fa6607640a728d9 [0,1,0,0,0,0|3,0,0]=4 249 B12R1.21 CC(C)CNc1ccc(cn1)Cl 0ae5375a5e4c82cbd22b2ab085684d82 [0,1,0,0,0,0|3,0,0]=4 250 B12R1.21 CC(C)CNc1ccc(cn1)F 8b43a1cc0e501ca0d0605ad14f0df209 [0,1,0,0,0,0|3,0,0]=4 251 B12R1.21 CC(C)CNc1ccc(cn1)I 23fefd3376fbc7b4befdabe310bb0dda [0,1,0,0,0,0|3,0,0]=4 252 B12R1.21 CC(C)CNc1ccc(nc1)Br f97d236c26c6d2f7293dba68c7c4b075 [0,1,0,0,0,0|3,0,0]=4 253 B12R1.21 CC(C)CNc1ccc(nc1)Cl 35dd1dae0c5db16264d559782cfce889 [0,1,0,0,0,0|3,0,0]=4 254 B12R1.21 CC(C)CNc1ccc(nc1)F 47051ae2555eee9d12ed92095481c029 [0,1,0,0,0,0|3,0,0]=4 255 B12R1.21 CC(C)CNc1ccc(nc1)I 7597ad1c53bebc44f0a198afe4e3c158 [0,1,0,0,0,0|3,0,0]=4 256 B12R1.21 CC(C)COc1ccc(cc1)Br 688e322571e772c33ef9f7f1b70011c4 [0,1,0,0,0,0|2,0,0]=3 257 B12R1.21 CC(C)COc1ccc(cc1)Cl f021a9169c3057630072da40a25929d0 [0,1,0,0,0,0|2,0,0]=3 258 B12R1.21 CC(C)COc1ccc(cc1)F 041d5d9f7bc26d03338ae74cc974acbe [0,1,0,0,0,0|2,0,0]=3 259 B12R1.21 CC(C)COc1ccc(cc1)I c8700cb8e6ceb84be023f81a6b63abe0 [0,1,0,0,0,0|2,0,0]=3 260 B12R1.21 CC(C)COc1ccc(cc1)S 93dc663c86ffdc9dd467a4fa1c50d8c7 [0,1,0,0,0,0|2,0,0]=3 261 B12R1.21 CC(C)COc1ccc(cn1)Cl 7644f0b62ceae011d9bc3001c519b209 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.21 CC(C)COc1ccc(cn1)F d8047addd92359ec92c2a0f4a9db82e5 [0,1,0,0,0,0|3,0,0]=4 263 B12R1.21 CC(C)COc1ccc(cn1)I 13cb687e6b43dbc8c66a5b339f34fae3 [0,1,0,0,0,0|3,0,0]=4 264 B12R1.21 CC(C)COc1ccc(nc1)Br 6cab0d3607c8822f4e69470f0506e296 [0,1,0,0,0,0|3,0,0]=4 265 B12R1.21 CC(C)COc1ccc(nc1)Cl 10704f4ae7612096859276a99ef4643b [0,1,0,0,0,0|3,0,0]=4 266 B12R1.21 CC(C)COc1ccc(nc1)F fe25916c3c5d8a0c73f1742e4890c4b4 [0,1,0,0,0,0|3,0,0]=4 267 B12R1.21 CC(C)COc1ccc(nc1)I f8c7ca358dc5afbf7199c955088be042 [0,1,0,0,0,0|3,0,0]=4 268 B12R1.21 CC(C)NCc1ccc(=O)[nH]c1 f5fff734176dc5499671c9909abad5b3 [0,1,0,0,0,0|3,0,0]=4 269 B12R1.21 CC(C)NCc1ccc(cc1)Br 37c09d76c90c7ae49ec6a65ce3a6a041 [0,1,0,0,0,0|2,0,0]=3 270 B12R1.21 CC(C)NCc1ccc(cc1)Cl 19728114897127fa755988490a2025d5 [0,1,0,0,0,0|2,0,0]=3 271 B12R1.21 CC(C)NCc1ccc(cc1)F 76a0754a7751d3d66ff80ab158c9f2b0 [0,1,0,0,0,0|2,0,0]=3 272 B12R1.21 CC(C)NCc1ccc(cc1)I 49ceb1852914812d45311ac4b38b1f31 [0,1,0,0,0,0|2,0,0]=3 273 B12R1.21 CC(C)NCc1ccc(cn1)Cl c4f69fa6d84754b6825b9b1c6de7fed8 [0,1,0,0,0,0|3,0,0]=4 274 B12R1.21 CC(C)NCc1ccc(cn1)F c4865c3c8142a2d416d4be6ac231c6e4 [0,1,0,0,0,0|3,0,0]=4 275 B12R1.21 CC(C)NCc1ccc(nc1)Br 66c358003a2aeaecd114c0fca0aabd06 [0,1,0,0,0,0|3,0,0]=4 276 B12R1.21 CC(C)NCc1ccc(nc1)Cl b141e36d256d8ba46ce47c529972ed91 [0,1,0,0,0,0|3,0,0]=4 277 B12R1.21 CC(C)NCc1ccc(nc1)F c68d5f2c5bc0cadc3f885e96b8ce170e [0,1,0,0,0,0|3,0,0]=4 278 B12R1.21 CC(C)OCc1cc[n+](cc1)[O-] ad48718861e57a0359d9b9f53b66d92f [0,1,0,0,0,0|3,0,0]=4 279 B12R1.21 CC(C)OCc1ccc(cc1)Br bb4176ce0b9ad4d7fb8568832a43e29a [0,1,0,0,0,0|2,0,0]=3 280 B12R1.21 CC(C)OCc1ccc(cc1)Cl abfc8ca1cd1171daf8ae63ae6bec02b0 [0,1,0,0,0,0|2,0,0]=3 281 B12R1.21 CC(C)OCc1ccc(cc1)F ac9a18f3d487a18e76f77222965a393f [0,1,0,0,0,0|2,0,0]=3 282 B12R1.21 CC(C)OCc1ccc(cc1)I a45cec946311a49c5890d06f9a04aef0 [0,1,0,0,0,0|2,0,0]=3 283 B12R1.21 CC(C)OCc1ccc(cc1)S 8bebaeb2cc5402024d06e9416cbf6988 [0,1,0,0,0,0|2,0,0]=3 284 B12R1.21 CC(C)OCc1ccc(cn1)Cl e6b6d6a6b704e48f9bad6d91e44552d4 [0,1,0,0,0,0|3,0,0]=4 285 B12R1.21 CC(C)OCc1ccc(cn1)F cb42a6ce37282edad9aea9a5be279e31 [0,1,0,0,0,0|3,0,0]=4 286 B12R1.21 CC(C)OCc1ccc(cn1)I d91e2bc09c51ae21ccaab7c4ab76b331 [0,1,0,0,0,0|3,0,0]=4 287 B12R1.21 CC(C)OCc1ccc(nc1)Br af871ec452ce610ac0391d6007c2df16 [0,1,0,0,0,0|3,0,0]=4 288 B12R1.21 CC(C)OCc1ccc(nc1)Cl 410f08f8c81d19a105b5a2a9721c4558 [0,1,0,0,0,0|3,0,0]=4 289 B12R1.21 CC(C)OCc1ccc(nc1)F ba373ea2643bfa56519dd6f4851e18e6 [0,1,0,0,0,0|3,0,0]=4 290 B12R1.21 CC(O)CNc1ccc(=O)[nH]c1 fe0ef9f5074b82f8f95ef30bad6eaaec [0,1,0,0,0,0|2,0,0]=3 291 B12R1.21 CC(O)CNc1ccc(cc1)Br 6cc2dd3906a998fe7a5d4e2a8d208d21 [0,1,0,0,0,0|1,0,0]=2 292 B12R1.21 CC(O)CNc1ccc(cc1)Cl 30612ac8d45eff6171f59f16b2492f67 [0,1,0,0,0,0|1,0,0]=2 293 B12R1.21 CC(O)CNc1ccc(cc1)F 44764ce23148993885c02e8cea63902c [0,1,0,0,0,0|1,0,0]=2 294 B12R1.21 CC(O)CNc1ccc(cc1)I 8fb5974b6715edad9e8863320d6bae04 [0,1,0,0,0,0|1,0,0]=2 295 B12R1.21 CC(O)CNc1ccc(cc1)S 6ef936aebb7976c5c92d176540ed67f0 [0,1,0,0,0,0|1,0,0]=2 296 B12R1.21 CC(O)CNc1ccc(cn1)Br 3bb705e8b8882ecbcb75e3aafb5cb397 [0,1,0,0,0,0|2,0,0]=3 297 B12R1.21 CC(O)CNc1ccc(cn1)Cl a0461b6c7f6ad9724e717a03872b2b92 [0,1,0,0,0,0|2,0,0]=3 298 B12R1.21 CC(O)CNc1ccc(cn1)F 709e9c446a73da6a4e03b61a673f02f3 [0,1,0,0,0,0|2,0,0]=3 299 B12R1.21 CC(O)CNc1ccc(cn1)I f0d6e74c59cf163dd0d30a8e9491e2e6 [0,1,0,0,0,0|2,0,0]=3 300 B12R1.21 CC(O)CNc1ccc(nc1)Br a542c1d9e7cf0e130887ca34de5abc7f [0,1,0,0,0,0|2,0,0]=3 301 B12R1.21 CC(O)CNc1ccc(nc1)Cl 2a1cbdbd92bca6158a94cb2d7caacea7 [0,1,0,0,0,0|2,0,0]=3 302 B12R1.21 CC(O)CNc1ccc(nc1)F dab207a7d149400a047fe59c6dd352b8 [0,1,0,0,0,0|2,0,0]=3 303 B12R1.21 CC(O)CNc1ccc(nc1)I ed5e8982e5c801e62f5181b175b31078 [0,1,0,0,0,0|2,0,0]=3 304 B12R1.21 CC(O)CNc1ccc(nn1)Br 586f2fe0961d8185422997160e94b9f6 [0,1,0,0,0,0|3,0,0]=4 305 B12R1.21 CC(O)CNc1ccc(nn1)Cl edabaeddbd0fb712f6c063614ab5b671 [0,1,0,0,0,0|3,0,0]=4 306 B12R1.21 CC(O)CNc1ccc(nn1)F 88dab1a5ad7268069190af9fd1a1ca1a [0,1,0,0,0,0|3,0,0]=4 307 B12R1.21 CC(O)CNc1ccc(nn1)I f77600c9a3df2886c46799568bcaeb2a [0,1,0,0,0,0|3,0,0]=4 308 B12R1.21 CC(O)CNc1cnc(=O)[nH]c1 d3b2ef21be0f330a52a5008a12c6bd45 [0,1,0,0,0,0|3,0,0]=4 309 B12R1.21 CC(O)CNc1cnc(cn1)Br 51025a49aafe58a598530ae7d929f721 [0,1,0,0,0,0|3,0,0]=4 310 B12R1.21 CC(O)CNc1cnc(cn1)Cl 2abdfa449c14107463c52a053b1f5793 [0,1,0,0,0,0|3,0,0]=4 311 B12R1.21 CC(O)CNc1cnc(cn1)I cfa39ae31309ddd5fab610ca39761e5b [0,1,0,0,0,0|3,0,0]=4 312 B12R1.21 CC(O)CNc1cnc(nc1)Br 2a9ede44affcccd4f98e723eb2edaced [0,1,0,0,0,0|3,0,0]=4 313 B12R1.21 CC(O)CNc1cnc(nc1)Cl 0fb87fed0b212934033308ca3f286a78 [0,1,0,0,0,0|3,0,0]=4 314 B12R1.21 CC(O)CNc1cnc(nc1)I eb1839395d0c3c2096ac834d3aa08400 [0,1,0,0,0,0|3,0,0]=4 315 B12R1.21 CC(O)CNc1ncc(cn1)Br 45381c68b3b9dcfaa637d02141c5483c [0,1,0,0,0,0|3,0,0]=4 316 B12R1.21 CC(O)CNc1ncc(cn1)Cl 0574726ad4b8ecfe8b9304b8c76c11ba [0,1,0,0,0,0|3,0,0]=4 317 B12R1.21 CC(O)CNc1ncc(cn1)F afff94111ea2397293333db015a1af80 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.21 CC(O)CNc1ncc(cn1)I e77f8e326f7a33cd6904df7c65f6b9b2 [0,1,0,0,0,0|3,0,0]=4 319 B12R1.21 CN(C)CNc1ccc(cc1)Br d70bd3e201d4e3984a2cbe371116b356 [0,1,0,0,0,0|3,0,0]=4 320 B12R1.21 CN(C)CNc1ccc(cc1)Cl 84d82794d22fd2615e84d614fa4d76e4 [0,1,0,0,0,0|3,0,0]=4 321 B12R1.21 CN(C)CNc1ccc(cc1)F c53489144a229a82a42fe108426a5611 [0,1,0,0,0,0|3,0,0]=4 322 B12R1.21 CN(C)CNc1ccc(cc1)I 9ce69571ab45326b30512a54a577d9b1 [0,1,0,0,0,0|3,0,0]=4 323 B12R1.21 CN(C)CNc1ccc(cc1)S 5aa5c6e46c584a58cd79277c7decaaf0 [0,1,0,0,0,0|3,0,0]=4 324 B12R1.21 CN(C)COc1ccc(cc1)Br 1ae60d05f401b4677bf02579aec9f4e3 [0,1,0,0,0,0|3,0,0]=4 325 B12R1.21 CN(C)COc1ccc(cc1)Cl 31a0679c78f3b12cc66bbe20f49b9a4e [0,1,0,0,0,0|3,0,0]=4 326 B12R1.21 CN(C)COc1ccc(cc1)F 47f9c488aaff7ce417b7673dfdc64bd4 [0,1,0,0,0,0|3,0,0]=4 327 B12R1.21 CN(C)COc1ccc(cc1)I 2c421eec61bc06e369712388216897f9 [0,1,0,0,0,0|3,0,0]=4 328 B12R1.21 CN(C)COc1ccc(cc1)S 90858c38fd8e55792e84d69d8884b1c6 [0,1,0,0,0,0|3,0,0]=4 329 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 2ad4df23c69dfa44e26a216951079c17 [0,1,0,0,0,0|1,0,0]=2 330 B12R1.21 C[C@@H](O)CNc1ccc(cc1)F d13032a00d782f9fd58bde9b7b7e5b40 [0,1,0,0,0,0|1,0,0]=2 331 B12R1.21 C[C@@H](O)CNc1ccc(cc1)I fcafc0398c9f6631b1e264180519d9a5 [0,1,0,0,0,0|1,0,0]=2 332 B12R1.21 C[C@@H](O)CNc1ccc(cc1)S c5036038618daf9d110f2837b38cc7f0 [0,1,0,0,0,0|1,0,0]=2 333 B12R1.21 C[C@@H](O)CNc1ccc(cn1)I 4372f82851e4ac2d780523c3cb2e9aaf [0,1,0,0,0,0|2,0,0]=3 334 B12R1.21 C[C@@H](O)CNc1ccc(nc1)Cl 0b072a983c28bdb115b4e0bd834036bd [0,1,0,0,0,0|2,0,0]=3 335 B12R1.21 C[C@@H](O)CNc1ccc(nc1)F b382e47334999ee55f54bd8309b42c71 [0,1,0,0,0,0|2,0,0]=3 336 B12R1.21 C[C@@H](O)CNc1ccc(nn1)Br ba31c84ceed4cf6fceeb521bdb3f8e03 [0,1,0,0,0,0|3,0,0]=4 337 B12R1.21 C[C@@H](O)CNc1ccc(nn1)F 745008f42c8807e75983fedffc366bd7 [0,1,0,0,0,0|3,0,0]=4 338 B12R1.21 C[C@@H](O)CNc1ccc(nn1)I 525d816b6f5ec382eea5d1032b0bf906 [0,1,0,0,0,0|3,0,0]=4 339 B12R1.21 C[C@@H](O)CNc1cnc(nc1)Cl b3b26e216cab9ed4e8987cdb9d970b8e [0,1,0,0,0,0|3,0,0]=4 340 B12R1.21 C[C@@H](O)CNc1ncc(cn1)F 7db25f7a82abfa82005b79050deff146 [0,1,0,0,0,0|3,0,0]=4 341 B12R1.21 C[C@@H](O)CNc1ncc(cn1)I 5873000aff9cd25f339fe6f28ccd09c5 [0,1,0,0,0,0|3,0,0]=4 342 B12R1.21 C[C@H](O)CNc1ccc(=O)[nH]c1 3af6b84894ad5bd91e3770aa97cb289c [0,1,0,0,0,0|2,0,0]=3 343 B12R1.21 C[C@H](O)CNc1ccc(cc1)Br dfc814dc76baf36262caaec8d25f4215 [0,1,0,0,0,0|1,0,0]=2 344 B12R1.21 C[C@H](O)CNc1ccc(cc1)Cl 8fb7f0b55d9fe9f1cdafd45ef42c2de4 [0,1,0,0,0,0|1,0,0]=2 345 B12R1.21 C[C@H](O)CNc1ccc(cc1)F 4385cb997d0b526c90619c1645b8b1ad [0,1,0,0,0,0|1,0,0]=2 346 B12R1.21 C[C@H](O)CNc1ccc(cc1)I 7222c72737ac92de3960850b939145d2 [0,1,0,0,0,0|1,0,0]=2 347 B12R1.21 C[C@H](O)CNc1ccc(cc1)S 638aabe1512824e4dc38e2389b85f596 [0,1,0,0,0,0|1,0,0]=2 348 B12R1.21 C[C@H](O)CNc1ccc(cn1)Br 1a24c54c176cbcb49489e48c1efa3a9b [0,1,0,0,0,0|2,0,0]=3 349 B12R1.21 C[C@H](O)CNc1ccc(cn1)Cl d098040213df0bdb930eb14d21e66802 [0,1,0,0,0,0|2,0,0]=3 350 B12R1.21 C[C@H](O)CNc1ccc(cn1)F e81983c3e4747cd69b645e7ae3c93b33 [0,1,0,0,0,0|2,0,0]=3 351 B12R1.21 C[C@H](O)CNc1ccc(cn1)I 767c705e53bfc23b58214ff37510f109 [0,1,0,0,0,0|2,0,0]=3 352 B12R1.21 C[C@H](O)CNc1ccc(nc1)Br 9c48efee9c9cff6d5a96217167e77ce3 [0,1,0,0,0,0|2,0,0]=3 353 B12R1.21 C[C@H](O)CNc1ccc(nc1)Cl e4468ea427969982ddeeb854ca54009a [0,1,0,0,0,0|2,0,0]=3 354 B12R1.21 C[C@H](O)CNc1ccc(nc1)F a8cb8979fd8f15707d9df65901983e8d [0,1,0,0,0,0|2,0,0]=3 355 B12R1.21 C[C@H](O)CNc1ccc(nc1)I d890ed11396f2cae41a408b951219b57 [0,1,0,0,0,0|2,0,0]=3 356 B12R1.21 C[C@H](O)CNc1ccc(nn1)Br b3c8a78413d52d41f729656da28364ca [0,1,0,0,0,0|3,0,0]=4 357 B12R1.21 C[C@H](O)CNc1ccc(nn1)Cl 91f1a141d7161749c729eb312e06f7c5 [0,1,0,0,0,0|3,0,0]=4 358 B12R1.21 C[C@H](O)CNc1ccc(nn1)F 0b055e081d93599a27805dd351d4d8cc [0,1,0,0,0,0|3,0,0]=4 359 B12R1.21 C[C@H](O)CNc1ccc(nn1)I c8d7fb2dd5211b68660e13415dee2ad5 [0,1,0,0,0,0|3,0,0]=4 360 B12R1.21 C[C@H](O)CNc1cnc(=O)[nH]c1 1678fbb97d45a12c7b16de36186f0ab2 [0,1,0,0,0,0|3,0,0]=4 361 B12R1.21 C[C@H](O)CNc1cnc(cn1)Br 4662bea4670ab2397559aadc8dddb0ff [0,1,0,0,0,0|3,0,0]=4 362 B12R1.21 C[C@H](O)CNc1cnc(cn1)Cl 1a915ee9a47c0dcbcfcbc9f6ece66da2 [0,1,0,0,0,0|3,0,0]=4 363 B12R1.21 C[C@H](O)CNc1cnc(cn1)I c9e4835e94db2f5a60f06cabb8d0f951 [0,1,0,0,0,0|3,0,0]=4 364 B12R1.21 C[C@H](O)CNc1cnc(nc1)Br df538a4d64271ef3f42260d6d907f743 [0,1,0,0,0,0|3,0,0]=4 365 B12R1.21 C[C@H](O)CNc1cnc(nc1)Cl 9f15ee61a730e4c5194de5c11856f32c [0,1,0,0,0,0|3,0,0]=4 366 B12R1.21 C[C@H](O)CNc1cnc(nc1)I 8e8bb445fc94170f9c8f5c32abcb7089 [0,1,0,0,0,0|3,0,0]=4 367 B12R1.21 C[C@H](O)CNc1ncc(cn1)Br 770bbcc89558b243261079f47a4ae065 [0,1,0,0,0,0|3,0,0]=4 368 B12R1.21 C[C@H](O)CNc1ncc(cn1)Cl 57ef48a03aaa23bece1937adffe5f117 [0,1,0,0,0,0|3,0,0]=4 369 B12R1.21 C[C@H](O)CNc1ncc(cn1)F 24d4d5789e724c0504f3f9efb058d69c [0,1,0,0,0,0|3,0,0]=4 370 B12R1.21 C[C@H](O)CNc1ncc(cn1)I e6368770d11ad2028e2a0e76e947dc5e [0,1,0,0,0,0|3,0,0]=4 371 B12R1.21 Cc1ccc(cc1)CNC(C)C 9f3293af5f5347150ac2434f1c0f5ea3 [0,1,0,0,0,0|2,0,0]=3 372 B12R1.21 Cc1ccc(cc1)COC(C)C 7eda3a9e7a3c4601d0edf3097f1c1fb1 [0,1,0,0,0,0|2,0,0]=3 373 B12R1.21 Cc1ccc(cc1)NCC(=O)O 74e964dee6b2c45f80d52be884637f2a [0,1,0,0,0,0|2,0,1]=4 374 B12R1.21 Cc1ccc(cc1)NCC(C)C d33fe3d6c1e672a348e9fedb377a9185 [0,1,0,0,0,0|2,0,0]=3 375 B12R1.21 Cc1ccc(cc1)NCC(C)O 8379462492ffae9a9aea5a1dcd1f96eb [0,1,0,0,0,0|1,0,0]=2 376 B12R1.21 Cc1ccc(cc1)NCC(F)F 8dbaec332eb7c95f0a28f44a63b384cf [0,1,0,0,0,0|3,0,0]=4 377 B12R1.21 Cc1ccc(cc1)NCN(C)C f410d4238a7fc65021317765c852db2f [0,1,0,0,0,0|3,0,0]=4 378 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O a5239ddc3731748474623fb5c2811c3d [0,1,0,0,0,0|1,0,0]=2 379 B12R1.21 Cc1ccc(cc1)NC[C@H](C)O 07456d37e9494f0c908a5c4ac8161df3 [0,1,0,0,0,0|1,0,0]=2 380 B12R1.21 Cc1ccc(cc1)OCC(=O)O b391ad11299a568c97edf041fe65000c [0,1,0,0,0,0|2,0,1]=4 381 B12R1.21 Cc1ccc(cc1)OCC(C)C c1aa096b3782800b4571efa5c0f498bc [0,1,0,0,0,0|2,0,0]=3 382 B12R1.21 Cc1ccc(cc1)OCC(F)F 64bd7b21ecd6aa2ebbade786a513dbf6 [0,1,0,0,0,0|3,0,0]=4 383 B12R1.21 Cc1ccc(cc1)OCN(C)C 8df4da1e8ff5f1a2a333a699e01425b0 [0,1,0,0,0,0|3,0,0]=4 384 B12R1.21 Cc1ccc(cn1)CNC(C)C dcca654450af647880d19bcbcad782d0 [0,1,0,0,0,0|3,0,0]=4 385 B12R1.21 Cc1ccc(cn1)COC(C)C c818a7f0551a9b355b44729de8a8ae60 [0,1,0,0,0,0|3,0,0]=4 386 B12R1.21 Cc1ccc(cn1)NCC(C)C 4aba7b7e95dd3d9152b31c769536eac4 [0,1,0,0,0,0|3,0,0]=4 387 B12R1.21 Cc1ccc(cn1)NCC(C)O f2810c201523a66605acea892064dd67 [0,1,0,0,0,0|2,0,0]=3 388 B12R1.21 Cc1ccc(cn1)NC[C@H](C)O ece7c29ab5bb61a6fc85f34a024e2877 [0,1,0,0,0,0|2,0,0]=3 389 B12R1.21 Cc1ccc(cn1)OCC(C)C 69c2bcf05b8548d6cd0c9b6f80a2281a [0,1,0,0,0,0|3,0,0]=4 390 B12R1.21 Cc1ccc(nc1)CNC(C)C 1873ba9dced7d99c6e146a54f65349ff [0,1,0,0,0,0|3,0,0]=4 391 B12R1.21 Cc1ccc(nc1)COC(C)C 268c71dd25830b86e2dc9d4896798456 [0,1,0,0,0,0|3,0,0]=4 392 B12R1.21 Cc1ccc(nc1)NCC(C)C b0a45bd99f228701345f0b0569d4055c [0,1,0,0,0,0|3,0,0]=4 393 B12R1.21 Cc1ccc(nc1)NCC(C)O 55cf6d0ffbcf3e2dad324ab76d9d53e3 [0,1,0,0,0,0|2,0,0]=3 394 B12R1.21 Cc1ccc(nc1)NC[C@@H](C)O 20c469c17324998b728338dc116c2199 [0,1,0,0,0,0|2,0,0]=3 395 B12R1.21 Cc1ccc(nc1)NC[C@H](C)O 6cacad85bc513bc56640526407b45f29 [0,1,0,0,0,0|2,0,0]=3 396 B12R1.21 Cc1ccc(nc1)OCC(C)C 3690188a26d66aaddf7d44e6d0ccd16a [0,1,0,0,0,0|3,0,0]=4 397 B12R1.21 Cc1ccc(nn1)NCC(C)O 8edbf5597162a7b21ef866c17baca375 [0,1,0,0,0,0|3,0,0]=4 398 B12R1.21 Cc1ccc(nn1)NC[C@@H](C)O b52a906c547c3d90ae483e437ee26c46 [0,1,0,0,0,0|3,0,0]=4 399 B12R1.21 Cc1ccc(nn1)NC[C@H](C)O ab1ef6848ae542f9e5fb1d1de8fc1e3c [0,1,0,0,0,0|3,0,0]=4 400 B12R1.21 Cc1cnc(cn1)NCC(C)O 8618f6965d727cdcfe628a18be90efe0 [0,1,0,0,0,0|3,0,0]=4 401 B12R1.21 Cc1cnc(cn1)NC[C@H](C)O dbd6a6042d91e71d77707bdf7b65b5dd [0,1,0,0,0,0|3,0,0]=4 402 B12R1.21 Cc1cnc(nc1)NCC(C)O ae5027171aae2f9922dab9439e418235 [0,1,0,0,0,0|3,0,0]=4 403 B12R1.21 Cc1cnc(nc1)NC[C@H](C)O 48479903fd092a7c9cf7bf7f03fe2424 [0,1,0,0,0,0|3,0,0]=4 404 B12R1.21 Cc1ncc(cn1)NCC(C)O c0fd457c51f7903c3c0e1abcbb73a5ba [0,1,0,0,0,0|3,0,0]=4 405 B12R1.21 Cc1ncc(cn1)NC[C@H](C)O 50a3b9bfc4dbb33cf094bdb62dbba3c7 [0,1,0,0,0,0|3,0,0]=4 406 B12R1.21 FC(F)CNc1ccc(cc1)Br 0f4038464005f37649633330f51e0e41 [0,1,0,0,0,0|3,0,0]=4 407 B12R1.21 FC(F)CNc1ccc(cc1)Cl 1d970371d8de6593ae223a422fa08cfc [0,1,0,0,0,0|3,0,0]=4 408 B12R1.21 FC(F)CNc1ccc(cc1)I 35b593c561089596470c7b137fe37aee [0,1,0,0,0,0|3,0,0]=4 409 B12R1.21 FC(F)CNc1ccc(cc1)S 0f9e8754e4b2588d5105e1b86dd09025 [0,1,0,0,0,0|3,0,0]=4 410 B12R1.21 FC(F)COc1ccc(cc1)Br d5a1939523c4ca2a483b248611e0f62a [0,1,0,0,0,0|3,0,0]=4 411 B12R1.21 FC(F)COc1ccc(cc1)Cl a5860fd83d8cce6628f31ae6c4bebf4c [0,1,0,0,0,0|3,0,0]=4 412 B12R1.21 FC(F)COc1ccc(cc1)I e45f78d4049ab40db2f7a29a69780ef7 [0,1,0,0,0,0|3,0,0]=4 413 B12R1.21 FC(F)COc1ccc(cc1)S 098a379994ab4ea0b7edbda81bdd75fd [0,1,0,0,0,0|3,0,0]=4 414 B12R1.21 Fc1ccc(cc1)NCC(F)F 08747e994c4d5dbb11e848da42b9e70e [0,1,0,0,0,0|3,0,0]=4 415 B12R1.21 Fc1ccc(cc1)OCC(F)F acab3603fec94a494e629634c12e3115 [0,1,0,0,0,0|3,0,0]=4 416 B12R1.21 O=C(O)CNc1ccc(cc1)Br 7da0d863f5bb29f83e0c10f1f7c0547e [0,1,0,0,0,0|2,0,1]=4 417 B12R1.21 O=C(O)CNc1ccc(cc1)Cl ecfcb6d7f6b9c05aeb6ab6499e94dfa4 [0,1,0,0,0,0|2,0,1]=4 418 B12R1.21 O=C(O)CNc1ccc(cc1)F 4e89215ad65c56d949cab153f0ac84e0 [0,1,0,0,0,0|2,0,1]=4 419 B12R1.21 O=C(O)CNc1ccc(cc1)I 2ba461660eb79ccc00a06823117a48dd [0,1,0,0,0,0|2,0,1]=4 420 B12R1.21 O=C(O)CNc1ccc(cc1)S f20c646ff83492b8833296086758cc6a [0,1,0,0,0,0|2,0,1]=4 421 B12R1.21 O=C(O)COc1ccc(cc1)Br b2e258860e40223ee9da79dbd882e7d5 [0,1,0,0,0,0|2,0,1]=4 422 B12R1.21 O=C(O)COc1ccc(cc1)Cl 28aa8b483311aaf8605303390d0ded6a [0,1,0,0,0,0|2,0,1]=4 423 B12R1.21 O=C(O)COc1ccc(cc1)F a0f040c73294c1633c8e3593094e773e [0,1,0,0,0,0|2,0,1]=4 424 B12R1.21 O=C(O)COc1ccc(cc1)I d32cb6deb654e7f5efc087ff2ed69aa0 [0,1,0,0,0,0|2,0,1]=4 425 B12R1.21 O=C(O)COc1ccc(cc1)S 8835852d462b385559e65d146a31e233 [0,1,0,0,0,0|2,0,1]=4 426 B12R1.27 BrCC(Br)CNc1ccccc1 e7e12b5e4c30a5d2720e1014017ec37c [0,1,0,0,0,0|2,0,0]=3 427 B12R1.27 BrCC(Br)CNc1ccccn1 f6cf2089bf10aa602d3cdacac7c9d312 [0,1,0,0,0,0|3,0,0]=4 428 B12R1.27 BrCC(Br)CNc1cccnc1 2c59232d0724c99794ed52d831828438 [0,1,0,0,0,0|3,0,0]=4 429 B12R1.27 BrCC(Br)CNc1ccncc1 b86162968a69522e7cfe73a7ee0dc87a [0,1,0,0,0,0|3,0,0]=4 430 B12R1.27 C#CC(C)NCc1ccccc1 0c823c8410acc72523ada4697880703b [0,1,0,0,0,0|2,0,0]=3 431 B12R1.27 C#CC(C)NCc1ccccn1 ad6b1fb21ba096ea477c4ba3a68283ca [0,1,0,0,0,0|3,0,0]=4 432 B12R1.27 C#CC(C)NCc1cccnc1 23b4a60f70f0a6facc411dde8b81b065 [0,1,0,0,0,0|3,0,0]=4 433 B12R1.27 C#CC(C)NCc1ccncc1 20cbaacc45168c0cad327880493b7f3b [0,1,0,0,0,0|3,0,0]=4 434 B12R1.27 C#CC(C)OCc1ccccc1 f6359202a87cde289007d81369eaa165 [0,1,0,0,0,0|2,0,0]=3 435 B12R1.27 C#CC(C)OCc1ccccn1 903ee5413328087e012403be2a6f9a74 [0,1,0,0,0,0|3,0,0]=4 436 B12R1.27 C#CC(C)OCc1cccnc1 27bc712e2a2f5b54ccb587c26321c64b [0,1,0,0,0,0|3,0,0]=4 437 B12R1.27 C#C[C@@H](C)NCc1ccccc1 51fd06b5dc99f337c53516eb04becf75 [0,1,0,0,0,0|2,0,0]=3 438 B12R1.27 C#C[C@@H](C)NCc1ccccn1 4d1c127dd42610df5076aa2ebacb008d [0,1,0,0,0,0|3,0,0]=4 439 B12R1.27 C#C[C@@H](C)NCc1cccnc1 fd4a88a1da68e3b7aab4cf836a2705d2 [0,1,0,0,0,0|3,0,0]=4 440 B12R1.27 C#C[C@@H](C)OCc1ccccc1 5a1f683c3ddc74682e7065902596ab4b [0,1,0,0,0,0|2,0,0]=3 441 B12R1.27 C#C[C@@H](C)OCc1ccccn1 04d0f33658cd73c944a5f8ac187b6720 [0,1,0,0,0,0|3,0,0]=4 442 B12R1.27 C#C[C@@H](C)OCc1cccnc1 31f57c38c83a01a7e153c545431ffed8 [0,1,0,0,0,0|3,0,0]=4 443 B12R1.27 C#C[C@H](C)NCc1ccccc1 5c0b47a0f6d5613da204666041aaf216 [0,1,0,0,0,0|2,0,0]=3 444 B12R1.27 C#C[C@H](C)NCc1ccccn1 decfdb3d020b9f8f1748be500b3d3e94 [0,1,0,0,0,0|3,0,0]=4 445 B12R1.27 C#C[C@H](C)NCc1cccnc1 b7f630fa157fcfc92e6054ac0ba18e1f [0,1,0,0,0,0|3,0,0]=4 446 B12R1.27 C#C[C@H](C)OCc1ccccc1 760d62af860bc17bf4194987b15f5245 [0,1,0,0,0,0|2,0,0]=3 447 B12R1.27 C#C[C@H](C)OCc1ccccn1 194393544ea69e88ea521cbd4a133ce5 [0,1,0,0,0,0|3,0,0]=4 448 B12R1.27 C#C[C@H](C)OCc1cccnc1 0a831b0ff4f14fb1e4243b0eac6fb036 [0,1,0,0,0,0|3,0,0]=4 449 B12R1.27 C=C(CC)CNc1ccccc1 109c052abdb53f9ddab28ed347d98fd8 [0,1,0,0,0,0|2,0,1]=4 450 B12R1.27 C=C(CNc1ccccc1)OC bb949f54d2f54d3e6e888faf57686f4e [0,1,0,0,0,0|1,0,2]=4 451 B12R1.27 C=C(CO)CNc1ccccc1 6dd075951d15cc232b8e7770860ee4cb [0,1,0,0,0,0|1,0,2]=4 452 B12R1.27 C=CC(C)NCc1ccccc1 a2d84df39e96bf4d63bb9a0f31cf21bd [0,1,0,0,0,0|2,0,0]=3 453 B12R1.27 C=CC(C)NCc1ccccn1 c2585ccce6fd2359aaa73835bf2cf65d [0,1,0,0,0,0|3,0,0]=4 454 B12R1.27 C=CC(C)NCc1cccnc1 7cec8fd02050ec361d8281c4552c4fe2 [0,1,0,0,0,0|3,0,0]=4 455 B12R1.27 C=CC(C)NCc1ccncc1 fd7a18089a5ba7430cb92b6d8f32ee57 [0,1,0,0,0,0|3,0,0]=4 456 B12R1.27 C=CC(C)OCc1ccccc1 5eba3aa739773a1c08ab0c58859512d1 [0,1,0,0,0,0|2,0,0]=3 457 B12R1.27 C=CC(C)OCc1ccccn1 bbdfd69ebb8ab53913fa15d4b2825809 [0,1,0,0,0,0|3,0,0]=4 458 B12R1.27 C=CC(C)OCc1cccnc1 0e2ae91440488b0d8d3e25a4e88da374 [0,1,0,0,0,0|3,0,0]=4 459 B12R1.27 C=CC(C)OCc1ccncc1 e24f5025453a289dfa949961b31f46dd [0,1,0,0,0,0|3,0,0]=4 460 B12R1.27 C=CC(O)CNc1ccccc1 e6108fb7cfe75301d4d656a5d5d31162 [0,1,0,0,0,0|1,0,1]=3 461 B12R1.27 C=CC(O)CNc1ccccn1 38bb823f312b98d5691f547d82dd5a59 [0,1,0,0,0,0|2,0,1]=4 462 B12R1.27 C=CC(O)CNc1cccnc1 c9f671afde3f30ddf69ac90ee2fa441b [0,1,0,0,0,0|2,0,1]=4 463 B12R1.27 C=CC(O)CNc1ccncc1 7abcc84a7a158f14616407473c229011 [0,1,0,0,0,0|2,0,1]=4 464 B12R1.27 C=C[C@H](C)OCc1ccccc1 723c5fd60a5c4ba97fa272fb1c420579 [0,1,0,0,0,0|2,0,0]=3 465 B12R1.27 C=C[C@H](C)OCc1ccccn1 9eb6fc20ae0d5afdfad18379d27f9f8b [0,1,0,0,0,0|3,0,0]=4 466 B12R1.27 C=C[C@H](C)OCc1cccnc1 06e7b3e5ebf7969bdca7cd59c31810f0 [0,1,0,0,0,0|3,0,0]=4 467 B12R1.27 CC(C#N)CNc1ccccc1 bca83eb9ab77da1cbd259e8c3d4283ee [0,1,0,0,0,0|2,0,0]=3 468 B12R1.27 CC(C#N)CNc1ccccn1 0fc32d740ad406a6dc426ede3076b193 [0,1,0,0,0,0|3,0,0]=4 469 B12R1.27 CC(C#N)CNc1cccnc1 036abd006575b41a44c75a3611809cf9 [0,1,0,0,0,0|3,0,0]=4 470 B12R1.27 CC(C#N)CNc1ccncc1 d39fdb52e11d3c711f1562e497819de3 [0,1,0,0,0,0|3,0,0]=4 471 B12R1.27 CC(C#N)COc1ccccn1 ba403bd0c82629b664b7888c6e2df195 [0,1,0,0,0,0|3,0,0]=4 472 B12R1.27 CC(C#N)COc1cccnc1 552960b934c9d47c3d5b0d1587169ff1 [0,1,0,0,0,0|3,0,0]=4 473 B12R1.27 CC(C#N)COc1ccncc1 08db35268e406432bec146c7e3af2c1e [0,1,0,0,0,0|3,0,0]=4 474 B12R1.27 CC(C#N)NCc1ccccc1 a297cbe65f4070e0226da02d61e71151 [0,1,0,0,0,0|2,0,0]=3 475 B12R1.27 CC(C#N)NCc1ccccn1 c49f40e61428cbf5316185f700db1db6 [0,1,0,0,0,0|3,0,0]=4 476 B12R1.27 CC(C#N)NCc1cccnc1 16d2d1def443ebc45b6ba0670a49cf7b [0,1,0,0,0,0|3,0,0]=4 477 B12R1.27 CC(C=O)NCc1ccccc1 52acbe8f861a146c2fae15c546c154ce [0,1,0,0,0,0|1,0,1]=3 478 B12R1.27 CC(C=O)NCc1ccccn1 0951a0ee01d1b16bb17c0f8e58213b1e [0,1,0,0,0,0|2,0,1]=4 479 B12R1.27 CC(C=O)NCc1cccnc1 355f37186fa2df6a1fe0c1b99c16c994 [0,1,0,0,0,0|2,0,1]=4 480 B12R1.27 CC(C=O)NCc1ccncc1 265f47f3a9987f7cd704262036405d38 [0,1,0,0,0,0|2,0,1]=4 481 B12R1.27 CC(C=O)OCc1ccccc1 dab13d83530825bb9c7bbbb7bc6908d9 [0,1,0,0,0,0|1,0,1]=3 482 B12R1.27 CC(C=O)OCc1ccccn1 1cd8eadb46df6e59cb4a04a39c1e77c7 [0,1,0,0,0,0|2,0,1]=4 483 B12R1.27 CC(C=O)OCc1cccnc1 51ede6b99e44af095a1dfaa30f3ea80e [0,1,0,0,0,0|2,0,1]=4 484 B12R1.27 CC(C=O)OCc1ccncc1 82db9291823d6d4efb135b517d9dc049 [0,1,0,0,0,0|2,0,1]=4 485 B12R1.27 CC(CF)OCc1ccccc1 c18da580e3dabe7992624a35c25d53e8 [0,1,0,0,0,0|2,0,0]=3 486 B12R1.27 CC(CF)OCc1ccccn1 0d7b7c864206636c9235d181d09d6b15 [0,1,0,0,0,0|3,0,0]=4 487 B12R1.27 CC(CF)OCc1cccnc1 dcd165da872903498dbd39f6392c4596 [0,1,0,0,0,0|3,0,0]=4 488 B12R1.27 CC(CO)CNc1ccccc1 f07a32871260f72c2fb2363a7f611104 [0,1,0,0,0,0|1,0,0]=2 489 B12R1.27 CC(CO)CNc1ccccn1 9228158f05cdce3bcf2332746a0d5a23 [0,1,0,0,0,0|2,0,0]=3 490 B12R1.27 CC(CO)CNc1cccnc1 801122522d7c4cbfe437832579f981bf [0,1,0,0,0,0|2,0,0]=3 491 B12R1.27 CC(CO)CNc1cccnn1 98d1904fab5d41362a075c11e1efa1aa [0,1,0,0,0,0|3,0,0]=4 492 B12R1.27 CC(CO)CNc1ccncc1 40e833cdc1404a8681b4db576acfe323 [0,1,0,0,0,0|2,0,0]=3 493 B12R1.27 CC(CO)CNc1ccncn1 b45c3d5b1659b474c15fccd6fbedf12a [0,1,0,0,0,0|3,0,0]=4 494 B12R1.27 CC(CO)CNc1ccnnc1 78eb7b62c61d117d7bf1280befe623f5 [0,1,0,0,0,0|3,0,0]=4 495 B12R1.27 CC(CO)CNc1cnccn1 4467f0cfd9c9dbc876a653a533aa52f9 [0,1,0,0,0,0|3,0,0]=4 496 B12R1.27 CC(CO)CNc1cncnc1 c1db632a973f58d02699cb672a9bc766 [0,1,0,0,0,0|3,0,0]=4 497 B12R1.27 CC(CO)CNc1ncccn1 201c3fb44aebb48ac9014ffccfbfbea5 [0,1,0,0,0,0|3,0,0]=4 498 B12R1.27 CC(CO)NCc1ccccc1 8f2e7b2c99e7f1ec8ee06bbaf841b37c [0,1,0,0,0,0|1,0,0]=2 499 B12R1.27 CC(CO)NCc1ccccn1 dc606027ab1cf21842521e3cd6aab041 [0,1,0,0,0,0|2,0,0]=3 500 B12R1.27 CC(CO)NCc1cccnc1 80adcdefa26a29e6989696dff2f189ce [0,1,0,0,0,0|2,0,0]=3 501 B12R1.27 CC(CO)NCc1cccnn1 c0ae66a6706b4b09ae7fbfdd61df0b00 [0,1,0,0,0,0|3,0,0]=4 502 B12R1.27 CC(CO)NCc1ccncc1 9672e7a66b4b38bfe57c10026c0328a2 [0,1,0,0,0,0|2,0,0]=3 503 B12R1.27 CC(CO)NCc1ccncn1 eeb32be9623ececc3cd1b1108d4a73d9 [0,1,0,0,0,0|3,0,0]=4 504 B12R1.27 CC(CO)NCc1ccnnc1 b000a1f808d028c5c52000e71e5aa2bc [0,1,0,0,0,0|3,0,0]=4 505 B12R1.27 CC(CO)NCc1cnccn1 c4d9086c3d359aa0fead8d59b651d860 [0,1,0,0,0,0|3,0,0]=4 506 B12R1.27 CC(CO)NCc1cncnc1 4baf132c2cabed4f1213cc5f82034422 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.27 CC(CO)NCc1ncccn1 837e97a48ad085370e6b0d812fd567c5 [0,1,0,0,0,0|3,0,0]=4 508 B12R1.27 CC(CS)OCc1ccccc1 bf9173a456888d57225f0e1203a32c5e [0,1,0,0,0,0|1,1,0]=3 509 B12R1.27 CC(CS)OCc1ccccn1 d5c25dfa8bcef5c73ff7d0ae8229ced9 [0,1,0,0,0,0|2,1,0]=4 510 B12R1.27 CC(CS)OCc1cccnc1 c6dbc5eba4423fac160580b226332d7c [0,1,0,0,0,0|2,1,0]=4 511 B12R1.27 CCC(=O)CNc1ccccc1 8a00a9b87cff2992f22bb204b9e2670f [0,1,0,0,0,0|1,0,2]=4 512 B12R1.27 CCC(=O)NCc1ccccc1 cd109163e80059e2763660343f9dbe36 [0,1,0,0,0,0|1,0,2]=4 513 B12R1.27 CCC(C)CNc1ccccc1 fb8ee4288bf8853fd57c8a217184507f [0,1,0,0,0,0|2,0,0]=3 514 B12R1.27 CCC(C)CNc1ccccn1 6f2b4521dfa3e14ebf77bc9e288b8c6c [0,1,0,0,0,0|3,0,0]=4 515 B12R1.27 CCC(C)CNc1cccnc1 799d2535ec95c75adc3efc07c94a55e6 [0,1,0,0,0,0|3,0,0]=4 516 B12R1.27 CCC(C)CNc1ccncc1 1d114bdb53eb8bc5873d9cc0853c5acf [0,1,0,0,0,0|3,0,0]=4 517 B12R1.27 CCC(C)COc1ccccn1 068a7be24dc7922a67d6964a1394c7d6 [0,1,0,0,0,0|3,0,0]=4 518 B12R1.27 CCC(C)COc1cccnc1 0c32f61d8566e65294b7d65adcb5b70b [0,1,0,0,0,0|3,0,0]=4 519 B12R1.27 CCC(C)COc1ccncc1 60b90e0040b7a2f08da03a263d76f7dc [0,1,0,0,0,0|3,0,0]=4 520 B12R1.27 CCC(C)NCc1ccccc1 ab8df84230779f2ea3e6a09700944eac [0,1,0,0,0,0|2,0,0]=3 521 B12R1.27 CCC(C)NCc1ccccn1 600531c2c0367b3cbfd9810ef9c18666 [0,1,0,0,0,0|3,0,0]=4 522 B12R1.27 CCC(C)NCc1cccnc1 03aa38772555301826d5e6a7450f6276 [0,1,0,0,0,0|3,0,0]=4 523 B12R1.27 CCC(C)NCc1ccncc1 8f2ef9d0f5df7ed3c4b3d292b12e10fb [0,1,0,0,0,0|3,0,0]=4 524 B12R1.27 CCC(C)OCc1ccccc1 ecd56e0e8d83f20f8ba3d53f4367b277 [0,1,0,0,0,0|2,0,0]=3 525 B12R1.27 CCC(C)OCc1ccccn1 cdbc114ff1e98274e0c76d4efba7fd19 [0,1,0,0,0,0|3,0,0]=4 526 B12R1.27 CCC(C)OCc1cccnc1 48e9afbe8701af90763c0a4646314a57 [0,1,0,0,0,0|3,0,0]=4 527 B12R1.27 CCC(C)OCc1ccncc1 a48ab0f470a95fc03f35a49430e127c9 [0,1,0,0,0,0|3,0,0]=4 528 B12R1.27 CCC(O)CNc1ccccc1 3a32ac0a6b49d877750df15cf382268b [0,1,0,0,0,0|1,0,0]=2 529 B12R1.27 CCC(O)CNc1ccccn1 6864d6686de3983b3129898abd14e11f [0,1,0,0,0,0|2,0,0]=3 530 B12R1.27 CCC(O)CNc1cccnc1 5ec705eaa989393421bbf1121531428c [0,1,0,0,0,0|2,0,0]=3 531 B12R1.27 CCC(O)CNc1cccnn1 ac8c3cdae8804672bacb52140e53905b [0,1,0,0,0,0|3,0,0]=4 532 B12R1.27 CCC(O)CNc1ccncc1 0b60e4dad8ea5561a0d2716be536ff21 [0,1,0,0,0,0|2,0,0]=3 533 B12R1.27 CCC(O)CNc1ccncn1 ca102469dcbe8fe4e133ae077b53bc80 [0,1,0,0,0,0|3,0,0]=4 534 B12R1.27 CCC(O)CNc1ccnnc1 fe0e786ee5d88fafe3b7ed52c4168ced [0,1,0,0,0,0|3,0,0]=4 535 B12R1.27 CCC(O)CNc1cnccn1 6334d1439105446d009be2bfcd484584 [0,1,0,0,0,0|3,0,0]=4 536 B12R1.27 CCC(O)CNc1cncnc1 4bd5a3ed92eaf9c981e18e753f2261c5 [0,1,0,0,0,0|3,0,0]=4 537 B12R1.27 CCC(O)CNc1ncccn1 fcd9c82d249780013a859f025e7e3182 [0,1,0,0,0,0|3,0,0]=4 538 B12R1.27 CCN(C)CCc1ccccc1 7c4ca4f684c66e96c63c7f2e129ac623 [0,1,0,0,0,0|2,0,0]=3 539 B12R1.27 CCN(C)CCc1ccccn1 2fc992e6b94f2894c06f88d1be2c6eae [0,1,0,0,0,0|3,0,0]=4 540 B12R1.27 CCN(C)CCc1cccnc1 8f102e3d75ada77333a942e239825207 [0,1,0,0,0,0|3,0,0]=4 541 B12R1.27 CCN(C)CCc1ccncc1 b74613155a01263f6023f3efd6abab19 [0,1,0,0,0,0|3,0,0]=4 542 B12R1.27 CC[C@@H](C)CNc1ccccc1 7adb7de69cc286747885efdd5e0d3ab0 [0,1,0,0,0,0|2,0,0]=3 543 B12R1.27 CC[C@@H](C)CNc1ccccn1 b147644fe4c42e26e6b4ca990988fc8c [0,1,0,0,0,0|3,0,0]=4 544 B12R1.27 CC[C@@H](C)CNc1cccnc1 1eb105ddecf8c3249110848ecff4eaa7 [0,1,0,0,0,0|3,0,0]=4 545 B12R1.27 CC[C@@H](C)CNc1ccncc1 ea454cc837b589ad6fa29f9da9abac60 [0,1,0,0,0,0|3,0,0]=4 546 B12R1.27 CC[C@@H](C)COc1ccccn1 874982a66f916edcb8896717a7802590 [0,1,0,0,0,0|3,0,0]=4 547 B12R1.27 CC[C@@H](C)COc1cccnc1 58227191aae01f35afcd7cf132697857 [0,1,0,0,0,0|3,0,0]=4 548 B12R1.27 CC[C@@H](C)COc1ccncc1 d0894bc1ae7cda042c896f44faa1550c [0,1,0,0,0,0|3,0,0]=4 549 B12R1.27 CC[C@@H](C)NCc1ccccc1 1448d746eef22413d3964f8047936159 [0,1,0,0,0,0|2,0,0]=3 550 B12R1.27 CC[C@@H](C)NCc1ccccn1 abcbefa3b0b43406c128be8257adf8b2 [0,1,0,0,0,0|3,0,0]=4 551 B12R1.27 CC[C@@H](C)NCc1cccnc1 b119e02beb918b7f43cb64ab2c69b801 [0,1,0,0,0,0|3,0,0]=4 552 B12R1.27 CC[C@@H](C)OCc1ccccc1 0a5e215baf34a258dd8987ff4d2156b3 [0,1,0,0,0,0|2,0,0]=3 553 B12R1.27 CC[C@@H](C)OCc1ccccn1 01fb0c2d8a73e699c5cca2351e7c51da [0,1,0,0,0,0|3,0,0]=4 554 B12R1.27 CC[C@@H](C)OCc1cccnc1 2a740981d9be19ca809d229b469f45a2 [0,1,0,0,0,0|3,0,0]=4 555 B12R1.27 CC[C@@H](O)CNc1ccccc1 765034dc37ea09fed7d7c3321191febe [0,1,0,0,0,0|1,0,0]=2 556 B12R1.27 CC[C@@H](O)CNc1cccnc1 804d6049e9a11075b053115d69a8a4fd [0,1,0,0,0,0|2,0,0]=3 557 B12R1.27 CC[C@@H](O)CNc1ccncc1 d1898f70a0d74eecc26d475907d4eaff [0,1,0,0,0,0|2,0,0]=3 558 B12R1.27 CC[C@@H](O)CNc1ccncn1 649018c5a6a5f17284abaad2f68f2eae [0,1,0,0,0,0|3,0,0]=4 559 B12R1.27 CC[C@H](C)CNc1ccccc1 1ad1285ada078333483cb7913624769f [0,1,0,0,0,0|2,0,0]=3 560 B12R1.27 CC[C@H](C)CNc1ccccn1 75c9b55178b9e6cbffbfe52153637e1b [0,1,0,0,0,0|3,0,0]=4 561 B12R1.27 CC[C@H](C)CNc1cccnc1 2e0a2075fe988129d1dcbf5d21b158ec [0,1,0,0,0,0|3,0,0]=4 562 B12R1.27 CC[C@H](C)CNc1ccncc1 1476b49c3603a7542420a49c2bf3dc59 [0,1,0,0,0,0|3,0,0]=4 563 B12R1.27 CC[C@H](C)COc1ccccn1 f5b749782758cf24dab04e1718b2b720 [0,1,0,0,0,0|3,0,0]=4 564 B12R1.27 CC[C@H](C)COc1cccnc1 07e42e29a9d594c30776c88035bd838e [0,1,0,0,0,0|3,0,0]=4 565 B12R1.27 CC[C@H](C)COc1ccncc1 91877b6a13f619eb114c1ca0ccf0b7a7 [0,1,0,0,0,0|3,0,0]=4 566 B12R1.27 CC[C@H](C)NCc1ccccc1 1d652b15c79b972376b40d93f2c0c28b [0,1,0,0,0,0|2,0,0]=3 567 B12R1.27 CC[C@H](C)NCc1ccccn1 db87df854d63d8a538c09dd589fcce72 [0,1,0,0,0,0|3,0,0]=4 568 B12R1.27 CC[C@H](C)NCc1cccnc1 fa7be05a72600688ba61bb2a45c0e2c1 [0,1,0,0,0,0|3,0,0]=4 569 B12R1.27 CC[C@H](C)OCc1ccccc1 b8de8bd5177d460679bde97bee24bb31 [0,1,0,0,0,0|2,0,0]=3 570 B12R1.27 CC[C@H](C)OCc1ccccn1 095ff59c775b3964aafbd1681dc69b03 [0,1,0,0,0,0|3,0,0]=4 571 B12R1.27 CC[C@H](C)OCc1cccnc1 dc7942b08bf13064943cbe342b7c887c [0,1,0,0,0,0|3,0,0]=4 572 B12R1.27 CN(C=O)CCc1ccccc1 9fb02e1cb373d4704048d9ef6c04ee21 [0,1,0,0,0,0|1,0,1]=3 573 B12R1.27 CN(C=O)CCc1ccccn1 16a2ece4ff1bacf526fae60eca9f8ffa [0,1,0,0,0,0|2,0,1]=4 574 B12R1.27 CN(C=O)CCc1cccnc1 ccdb98ff89857da134ddd0f017e9db4f [0,1,0,0,0,0|2,0,1]=4 575 B12R1.27 CN(C=O)CCc1ccncc1 f145a26c0f8191f8592a6b75153f43a0 [0,1,0,0,0,0|2,0,1]=4 576 B12R1.27 CN(CF)CCc1ccccc1 af958a660e6bf737d02c2dfab1bc467d [0,1,0,0,0,0|2,0,0]=3 577 B12R1.27 CN(CF)CCc1ccccn1 e47249cec0a9e47647623cac83a45a8e [0,1,0,0,0,0|3,0,0]=4 578 B12R1.27 CN(CF)CCc1cccnc1 e55726a3c32e233d630a4f29602b811f [0,1,0,0,0,0|3,0,0]=4 579 B12R1.27 CN(CF)CCc1ccncc1 6e2d36b26079cda0d2af1bea77a09d35 [0,1,0,0,0,0|3,0,0]=4 580 B12R1.27 CN(CO)CCc1ccccc1 c9a67cdf713e4c874ec2d63ed5e8590a [0,1,0,0,0,0|1,0,0]=2 581 B12R1.27 CN(CO)CCc1ccccn1 aa0d4ac6d05fc927494412ee9fe9c7cc [0,1,0,0,0,0|2,0,0]=3 582 B12R1.27 CN(CO)CCc1cccnc1 b13669a1ddf1ac46ef1460e055843b9e [0,1,0,0,0,0|2,0,0]=3 583 B12R1.27 CN(CO)CCc1ccncc1 d571b134ccefa2efaeb2d36d2248e45c [0,1,0,0,0,0|2,0,0]=3 584 B12R1.27 CNC(=O)CNc1ccccc1 9c8781c492a9bef282f2e4766dfd7321 [0,1,0,0,0,0|1,0,2]=4 585 B12R1.27 COC(=O)CNc1ccccc1 4732dba1106eb1ebf4644524cb0d5858 [0,1,0,0,0,0|1,0,2]=4 586 B12R1.27 COC(C)CNc1ccccc1 8b7aea6540e0014f2969161722152c0a [0,1,0,0,0,0|1,0,0]=2 587 B12R1.27 COC(C)CNc1ccccn1 aa1fffc4826b028b66ca3b6131bb2129 [0,1,0,0,0,0|2,0,0]=3 588 B12R1.27 COC(C)CNc1cccnc1 22ea1776f5c64fa404e2b1d10875769b [0,1,0,0,0,0|2,0,0]=3 589 B12R1.27 COC(C)CNc1cccnn1 57b8f2e31a89437037bb968036b0a7ad [0,1,0,0,0,0|3,0,0]=4 590 B12R1.27 COC(C)CNc1ccncc1 8583756de850d35d798b9d18e790369d [0,1,0,0,0,0|2,0,0]=3 591 B12R1.27 COC(C)CNc1ccncn1 9a338fed3fdbe41865e288d21845d7b6 [0,1,0,0,0,0|3,0,0]=4 592 B12R1.27 COC(C)CNc1ccnnc1 1ef6344f5f57a524b522bc16ce4f3f7a [0,1,0,0,0,0|3,0,0]=4 593 B12R1.27 COC(C)CNc1cnccn1 4934fe98e881c8caac1de5e17b4dc92d [0,1,0,0,0,0|3,0,0]=4 594 B12R1.27 COC(C)CNc1cncnc1 76d1148a167534b4fcc70bd965040319 [0,1,0,0,0,0|3,0,0]=4 595 B12R1.27 COC(C)CNc1ncccn1 8570879f1ddd8a7a1e5f6c89edecdeea [0,1,0,0,0,0|3,0,0]=4 596 B12R1.27 COC(C)COc1ccccn1 f8dc8bfeccf22df73c7ed2e356fc48da [0,1,0,0,0,0|2,0,0]=3 597 B12R1.27 COC(C)COc1cccnc1 9293f71aa0063e3b71a6c85117d16856 [0,1,0,0,0,0|2,0,0]=3 598 B12R1.27 COC(C)COc1ccncc1 5fbc7e5892edbad02dcb9a66b68a62df [0,1,0,0,0,0|2,0,0]=3 599 B12R1.27 COC(C)COc1ccnnc1 c736b03fcccbeacc05d0d73575cc4d1b [0,1,0,0,0,0|3,0,0]=4 600 B12R1.27 COC(C)COc1cnccn1 168521879b84e34b8c393d32fd7d174c [0,1,0,0,0,0|3,0,0]=4 601 B12R1.27 COC(C)COc1cncnc1 018a2a8d74b79afe6852ad6a79d6a6d6 [0,1,0,0,0,0|3,0,0]=4 602 B12R1.27 COC(C)COc1ncccn1 0fcc0297343c993aabe4b47abb5acb0d [0,1,0,0,0,0|3,0,0]=4 603 B12R1.27 CO[C@@H](C)CNc1ccccc1 1db51b6397d595cc5bd1ef07b3dce178 [0,1,0,0,0,0|1,0,0]=2 604 B12R1.27 CO[C@@H](C)CNc1ccccn1 3f6f24d683b32bf983db741333c2969d [0,1,0,0,0,0|2,0,0]=3 605 B12R1.27 CO[C@@H](C)CNc1cccnc1 ed45e74a30d0fad7831c896f4455a3e9 [0,1,0,0,0,0|2,0,0]=3 606 B12R1.27 CO[C@@H](C)CNc1cccnn1 a7aab28edd21d3a5ef3d70cba3e8d7f9 [0,1,0,0,0,0|3,0,0]=4 607 B12R1.27 CO[C@@H](C)CNc1ccncc1 321a70901c24d6141307a3fd83345c5f [0,1,0,0,0,0|2,0,0]=3 608 B12R1.27 CO[C@@H](C)CNc1ccncn1 917b47bd5f497576d3e7486855c6ee57 [0,1,0,0,0,0|3,0,0]=4 609 B12R1.27 CO[C@@H](C)CNc1ccnnc1 bd91b33e1ab00e0320ecd558add50c2b [0,1,0,0,0,0|3,0,0]=4 610 B12R1.27 CO[C@@H](C)CNc1cnccn1 53ae0935256e105b3eb7c609b854c909 [0,1,0,0,0,0|3,0,0]=4 611 B12R1.27 CO[C@@H](C)CNc1cncnc1 ae65d70c0954de37db4895592764b4d0 [0,1,0,0,0,0|3,0,0]=4 612 B12R1.27 CO[C@@H](C)CNc1ncccn1 0812a69d040d25016f59a08e6acb2161 [0,1,0,0,0,0|3,0,0]=4 613 B12R1.27 CO[C@@H](C)COc1ccccn1 74e5eb55678aa99f2f01dd02e58c0f99 [0,1,0,0,0,0|2,0,0]=3 614 B12R1.27 CO[C@@H](C)COc1cccnc1 4625df0874e428ea62a16a84848b31c3 [0,1,0,0,0,0|2,0,0]=3 615 B12R1.27 CO[C@@H](C)COc1ccncc1 a06e60f07f6a57574e8cbc8ff90265e7 [0,1,0,0,0,0|2,0,0]=3 616 B12R1.27 CO[C@@H](C)COc1ccnnc1 6c807b2fe478ce11e5850217979ae864 [0,1,0,0,0,0|3,0,0]=4 617 B12R1.27 CO[C@@H](C)COc1cnccn1 b74633bf8dc1ffc4614cbf0963cc0979 [0,1,0,0,0,0|3,0,0]=4 618 B12R1.27 CO[C@@H](C)COc1cncnc1 b7287c1396ba7fd311664ce2851613b9 [0,1,0,0,0,0|3,0,0]=4 619 B12R1.27 CO[C@@H](C)COc1ncccn1 d43b5c2f21fcbe512af85251c28b8a25 [0,1,0,0,0,0|3,0,0]=4 620 B12R1.27 CO[C@H](C)CNc1ccccc1 b7b86a2dea3233b080c54d71a8f46990 [0,1,0,0,0,0|1,0,0]=2 621 B12R1.27 CO[C@H](C)CNc1ccccn1 04ec0231ca9bc4cf1eff96f841c37724 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.27 CO[C@H](C)CNc1cccnc1 3d28dbb191d334198e2e90ddce2fa1a4 [0,1,0,0,0,0|2,0,0]=3 623 B12R1.27 CO[C@H](C)CNc1cccnn1 308d9b61ca0613da225819a6631aa0ff [0,1,0,0,0,0|3,0,0]=4 624 B12R1.27 CO[C@H](C)CNc1ccncc1 bd2ba612a637b68c883a6591cf32e881 [0,1,0,0,0,0|2,0,0]=3 625 B12R1.27 CO[C@H](C)CNc1ccncn1 7bf1aa7877bed7ec80381d13b25beaa6 [0,1,0,0,0,0|3,0,0]=4 626 B12R1.27 CO[C@H](C)CNc1ccnnc1 0b1e03d7a3c7cf42a00b9ce336a3dc0b [0,1,0,0,0,0|3,0,0]=4 627 B12R1.27 CO[C@H](C)CNc1cnccn1 b719a317b586b472c3ca3ba92317ee19 [0,1,0,0,0,0|3,0,0]=4 628 B12R1.27 CO[C@H](C)CNc1cncnc1 57edc74303f1d79aedad731207c3d117 [0,1,0,0,0,0|3,0,0]=4 629 B12R1.27 CO[C@H](C)CNc1ncccn1 b988e20ae9c69cfad8a575078571ad98 [0,1,0,0,0,0|3,0,0]=4 630 B12R1.27 CO[C@H](C)COc1ccccn1 48788836bfd03aade6f0bd2c51b60c5c [0,1,0,0,0,0|2,0,0]=3 631 B12R1.27 CO[C@H](C)COc1cccnc1 a0e969ee0f3c10fe22a63e3d03e64109 [0,1,0,0,0,0|2,0,0]=3 632 B12R1.27 CO[C@H](C)COc1ccncc1 8e99d9b0419ebb5515c91639e755a31d [0,1,0,0,0,0|2,0,0]=3 633 B12R1.27 CO[C@H](C)COc1ccnnc1 f945c9bbfb6b3f9636756fc0824691de [0,1,0,0,0,0|3,0,0]=4 634 B12R1.27 CO[C@H](C)COc1cnccn1 f10e17992a6825010ede7d0e515d88a7 [0,1,0,0,0,0|3,0,0]=4 635 B12R1.27 CO[C@H](C)COc1cncnc1 2e85b0fd0e5e5e9f49a37e10ec2a6b1b [0,1,0,0,0,0|3,0,0]=4 636 B12R1.27 CO[C@H](C)COc1ncccn1 f5255e9db0e1162de21d873188fcd514 [0,1,0,0,0,0|3,0,0]=4 637 B12R1.27 C[C@@H](CO)CNc1ccccc1 8acaf8396f10bf3948fe3b52f4656e75 [0,1,0,0,0,0|1,0,0]=2 638 B12R1.27 C[C@@H](CO)CNc1ccccn1 af016b84d95f1080f07ef6f02d15824a [0,1,0,0,0,0|2,0,0]=3 639 B12R1.27 C[C@@H](CO)CNc1cccnc1 6052f0c67d4cdd3f80ceffbd11480331 [0,1,0,0,0,0|2,0,0]=3 640 B12R1.27 C[C@@H](CO)CNc1cccnn1 0b6a2fb6d9427f1ca932a4a2c6e94db3 [0,1,0,0,0,0|3,0,0]=4 641 B12R1.27 C[C@@H](CO)CNc1ccncc1 f14674535a69f3232455d568e370ba78 [0,1,0,0,0,0|2,0,0]=3 642 B12R1.27 C[C@@H](CO)CNc1ccncn1 d45f622473b51bdfa511c740fe038021 [0,1,0,0,0,0|3,0,0]=4 643 B12R1.27 C[C@@H](CO)CNc1ccnnc1 a6db6be48967f658cf422398cf0ac2af [0,1,0,0,0,0|3,0,0]=4 644 B12R1.27 C[C@@H](CO)CNc1cnccn1 b34ebd6399cbc236ef2ab5ac79900198 [0,1,0,0,0,0|3,0,0]=4 645 B12R1.27 C[C@@H](CO)CNc1cncnc1 f7b57f8d63359c7bfa45b0eb0355141f [0,1,0,0,0,0|3,0,0]=4 646 B12R1.27 C[C@@H](CO)CNc1ncccn1 af018eff6911c0d83a5da864e125d204 [0,1,0,0,0,0|3,0,0]=4 647 B12R1.27 C[C@@H](CO)NCc1ccccc1 a52866c987a35d6e1a5b62fda8afddea [0,1,0,0,0,0|1,0,0]=2 648 B12R1.27 C[C@@H](CO)NCc1ccccn1 24b346e5ac8cec24f6566fe18f21e557 [0,1,0,0,0,0|2,0,0]=3 649 B12R1.27 C[C@@H](CO)NCc1cccnc1 c05978b6b00adbcee4f88cca44b079ed [0,1,0,0,0,0|2,0,0]=3 650 B12R1.27 C[C@@H](CO)NCc1cccnn1 05a1dc5c207ae3eee6144f6e1c657205 [0,1,0,0,0,0|3,0,0]=4 651 B12R1.27 C[C@@H](CO)NCc1ccncc1 5b07b762d221cbddc1d819cacc34979c [0,1,0,0,0,0|2,0,0]=3 652 B12R1.27 C[C@@H](CO)NCc1ccncn1 f6ff3ba88bfe69e87216c2a7058d07f8 [0,1,0,0,0,0|3,0,0]=4 653 B12R1.27 C[C@@H](CO)NCc1ccnnc1 602b58db0892c99d23481e8ecf4bc7eb [0,1,0,0,0,0|3,0,0]=4 654 B12R1.27 C[C@@H](CO)NCc1cnccn1 848c1433beb181bd59c54d3b96b16fa8 [0,1,0,0,0,0|3,0,0]=4 655 B12R1.27 C[C@@H](CO)NCc1cncnc1 7062307e6488c38c00784838f500b75b [0,1,0,0,0,0|3,0,0]=4 656 B12R1.27 C[C@@H](CO)NCc1ncccn1 18b98af25da2c21ca4e52167d59e15d7 [0,1,0,0,0,0|3,0,0]=4 657 B12R1.27 C[C@H](C=O)NCc1ccccc1 645b627cd889138b5240bcb1ce686b72 [0,1,0,0,0,0|1,0,1]=3 658 B12R1.27 C[C@H](C=O)NCc1ccccn1 03bdbd8da67049c2d2c33d47db20e2fa [0,1,0,0,0,0|2,0,1]=4 659 B12R1.27 C[C@H](C=O)NCc1cccnc1 47cfbb35f7e7c7b0499ef97765177bd2 [0,1,0,0,0,0|2,0,1]=4 660 B12R1.27 C[C@H](C=O)NCc1ccncc1 ccea8fe7d65d626f79faa41d0215f7ff [0,1,0,0,0,0|2,0,1]=4 661 B12R1.27 C[C@H](C=O)OCc1ccccc1 d71860644cbe1541da13b3966902f7f7 [0,1,0,0,0,0|1,0,1]=3 662 B12R1.27 C[C@H](C=O)OCc1ccccn1 77e036a149c9b895f58a4f79f65d470f [0,1,0,0,0,0|2,0,1]=4 663 B12R1.27 C[C@H](C=O)OCc1cccnc1 56d6eb81a4dd63eb667314ef58479328 [0,1,0,0,0,0|2,0,1]=4 664 B12R1.27 C[C@H](C=O)OCc1ccncc1 4516527db7ccfbd7ba68d2eb1b2efd9c [0,1,0,0,0,0|2,0,1]=4 665 B12R1.27 C[C@H](CO)CNc1ccccc1 de01f7c1f1d3b008ec664fad35110bba [0,1,0,0,0,0|1,0,0]=2 666 B12R1.27 C[C@H](CO)CNc1ccccn1 e822e956d48a344afeb617359365dcfb [0,1,0,0,0,0|2,0,0]=3 667 B12R1.27 C[C@H](CO)CNc1cccnc1 27ef93a68bfc032deefa13733949bda2 [0,1,0,0,0,0|2,0,0]=3 668 B12R1.27 C[C@H](CO)CNc1cccnn1 560938529d62da9a8aac673de498ec01 [0,1,0,0,0,0|3,0,0]=4 669 B12R1.27 C[C@H](CO)CNc1ccncc1 4fd9d26d176ae9102178ddd2e18bcf70 [0,1,0,0,0,0|2,0,0]=3 670 B12R1.27 C[C@H](CO)CNc1ccncn1 bda1eef39f4a95e453c3bac3205df33f [0,1,0,0,0,0|3,0,0]=4 671 B12R1.27 C[C@H](CO)CNc1ccnnc1 8de1988db6879a452006eab050105901 [0,1,0,0,0,0|3,0,0]=4 672 B12R1.27 C[C@H](CO)CNc1cnccn1 de693ece84470b212343000297ad249f [0,1,0,0,0,0|3,0,0]=4 673 B12R1.27 C[C@H](CO)CNc1cncnc1 f499f8ec27d7f7988221cad8c244b04a [0,1,0,0,0,0|3,0,0]=4 674 B12R1.27 C[C@H](CO)CNc1ncccn1 916d39941d1066a7157031db8367b91b [0,1,0,0,0,0|3,0,0]=4 675 B12R1.27 C[C@H](CO)NCc1ccccc1 6eed9f4ff81e8b8226b9282b8f3ad13f [0,1,0,0,0,0|1,0,0]=2 676 B12R1.27 C[C@H](CO)NCc1ccccn1 f876cbcb18ab33a44cd48067a6e0c620 [0,1,0,0,0,0|2,0,0]=3 677 B12R1.27 C[C@H](CO)NCc1cccnc1 21544267eb570ab70ec823c251a550b0 [0,1,0,0,0,0|2,0,0]=3 678 B12R1.27 C[C@H](CO)NCc1cccnn1 1a2bd735b97b66ca6ea47e333ae5c2c6 [0,1,0,0,0,0|3,0,0]=4 679 B12R1.27 C[C@H](CO)NCc1ccncc1 7dbeacc2c2607a95fa1f0ce20b03a078 [0,1,0,0,0,0|2,0,0]=3 680 B12R1.27 C[C@H](CO)NCc1ccncn1 c32e0f5fede4f5050d0aa02b72ffe485 [0,1,0,0,0,0|3,0,0]=4 681 B12R1.27 C[C@H](CO)NCc1ccnnc1 74241780e18870a69ac7c87826b5a58a [0,1,0,0,0,0|3,0,0]=4 682 B12R1.27 C[C@H](CO)NCc1cnccn1 aa92059eda1f440fdfb5e1dbb18875a2 [0,1,0,0,0,0|3,0,0]=4 683 B12R1.27 C[C@H](CO)NCc1cncnc1 8e45c1650fb11b8b52cada27361a54d9 [0,1,0,0,0,0|3,0,0]=4 684 B12R1.27 C[C@H](CO)NCc1ncccn1 0f954e7651a99fa27d25d1118270587f [0,1,0,0,0,0|3,0,0]=4 685 B12R1.27 C[C@H](CS)OCc1ccccc1 76a62ad706fe4942b152f21141bdace8 [0,1,0,0,0,0|1,1,0]=3 686 B12R1.27 C[C@H](CS)OCc1ccccn1 bfa2f3c46950c58e36e3009f57740457 [0,1,0,0,0,0|2,1,0]=4 687 B12R1.27 C[C@H](CS)OCc1cccnc1 ac5d95777938b777033779188a5a5b0a [0,1,0,0,0,0|2,1,0]=4 688 B12R1.27 O=C(CF)NCc1ccccc1 44d0634b73cc2a3134198abb702adc32 [0,1,0,0,0,0|1,0,2]=4 689 B12R1.27 O=C(CNc1ccccc1)NO b700dc391e059a1fe9e2fea74fdf720f [0,1,0,0,0,0|2,0,1]=4 690 B12R1.27 O=C(CO)CNc1ccccc1 1cf374c57dfb525ce3f48cecf3edf550 [0,1,0,0,0,0|1,0,2]=4 691 B12R1.27 O=C(CO)NCc1ccccc1 f4f787a5214848c6970058ebdb73c876 [0,1,0,0,0,0|1,0,2]=4 692 B12R1.27 O=C(CS)NCc1ccccc1 f91da9c658c39a4f0c257ce61b60a1a7 [0,1,0,0,0,0|1,0,2]=4 693 B12R1.27 OC(CF)CNc1ccccc1 e518893c8dbaaac7e0289d266d42fc20 [0,1,0,0,0,0|1,0,0]=2 694 B12R1.27 OC(CF)CNc1ccccn1 1b489c84af593acbd12dd849bb8613a4 [0,1,0,0,0,0|2,0,0]=3 695 B12R1.27 OC(CF)CNc1cccnc1 d4c1cc0570898fb9377efaef5e2305e5 [0,1,0,0,0,0|2,0,0]=3 696 B12R1.27 OC(CF)CNc1cccnn1 29f1003d9f08ef42ebf9fbe7bc31121a [0,1,0,0,0,0|3,0,0]=4 697 B12R1.27 OC(CF)CNc1ccncc1 234aee4af07f2b3b212146219e07228f [0,1,0,0,0,0|2,0,0]=3 698 B12R1.27 OC(CF)CNc1ccncn1 0bcfbf6e12b3f59f0790d80fc41339c1 [0,1,0,0,0,0|3,0,0]=4 699 B12R1.27 OC(CF)CNc1ccnnc1 fa10282c8783ec42b25f89ded8112a84 [0,1,0,0,0,0|3,0,0]=4 700 B12R1.27 OC(CF)CNc1cnccn1 ee6cb5aa7b22cf43e37825f709173987 [0,1,0,0,0,0|3,0,0]=4 701 B12R1.27 OC(CF)CNc1cncnc1 4c7efbb3f256465736ae79d2f2a05dcc [0,1,0,0,0,0|3,0,0]=4 702 B12R1.27 OC(CF)CNc1ncccn1 dd089ad3929e2fe47b5067487d7f2a6d [0,1,0,0,0,0|3,0,0]=4 703 B12R1.27 OCC(F)CNc1ccccc1 12f6637854cd5607d7beeb33d98c9d66 [0,1,0,0,0,0|2,0,0]=3 704 B12R1.27 OCC(F)CNc1ccccn1 636742c95dad33ab1c71801ff2f3a9f9 [0,1,0,0,0,0|3,0,0]=4 705 B12R1.27 OCC(F)CNc1cccnc1 15292281630b121a7c03a4f02b41c1f1 [0,1,0,0,0,0|3,0,0]=4 706 B12R1.27 OCC(F)CNc1ccncc1 57082d81e0870faa97be4e7901ad63fe [0,1,0,0,0,0|3,0,0]=4 707 B12R1.27 OCC(O)CNc1ccccc1 2c98ea52c81c0230088b12196d6eb24a [0,1,0,0,0,0|1,0,0]=2 708 B12R1.27 OCC(O)CNc1ccccn1 01ee7f693227d7b41743528a5289097e [0,1,0,0,0,0|2,0,0]=3 709 B12R1.27 OCC(O)CNc1cccnc1 1b47ebf45ca013920823a1b9e2030f55 [0,1,0,0,0,0|2,0,0]=3 710 B12R1.27 OCC(O)CNc1cccnn1 c37660606513696fffd56ba0becf4339 [0,1,0,0,0,0|3,0,0]=4 711 B12R1.27 OCC(O)CNc1ccncc1 1a36e5f608fa544c06535c254ccc872e [0,1,0,0,0,0|2,0,0]=3 712 B12R1.27 OCC(O)CNc1ccncn1 6c3d967743ad1842f53cd0a78440874e [0,1,0,0,0,0|3,0,0]=4 713 B12R1.27 OCC(O)CNc1ccnnc1 32360f9a05f168d3d26cfbec11317622 [0,1,0,0,0,0|3,0,0]=4 714 B12R1.27 OCC(O)CNc1cnccn1 38f4f717546be1a1edb1cb90ca085d60 [0,1,0,0,0,0|3,0,0]=4 715 B12R1.27 OCC(O)CNc1cncnc1 8dad7ccc42d9ab0ac0019baeaf4da201 [0,1,0,0,0,0|3,0,0]=4 716 B12R1.27 OCC(O)CNc1ncccn1 c8c3ea7763b8905b18ba231ae62c2d9a [0,1,0,0,0,0|3,0,0]=4 717 B12R1.27 OCC(O)COc1ccccn1 de982e49db9e5905cbf502b472dbf63c [0,1,0,0,0,0|2,0,0]=3 718 B12R1.27 OCC(O)COc1cccnc1 16ebbab500126aa2ce0f1a83627b97a0 [0,1,0,0,0,0|2,0,0]=3 719 B12R1.27 OCC(O)COc1ccncc1 c33db2e763b2b133bf4e8cf0f33b9837 [0,1,0,0,0,0|2,0,0]=3 720 B12R1.27 OCC(O)COc1ccnnc1 cf0397c1ca36c85913dbb6935af38a04 [0,1,0,0,0,0|3,0,0]=4 721 B12R1.27 OCC(O)COc1cnccn1 11df0c63b0f6b4d8bd464a325e4a7069 [0,1,0,0,0,0|3,0,0]=4 722 B12R1.27 OCC(O)COc1cncnc1 bf36ce90ecbc962c27719fe389906c71 [0,1,0,0,0,0|3,0,0]=4 723 B12R1.27 OCC(O)COc1ncccn1 286403b4fdbdd90521acb85f3a67a40b [0,1,0,0,0,0|3,0,0]=4 724 B12R1.27 OC[C@@H](F)CNc1ccccc1 df0a72159854bbc7d14ee531e659ec9c [0,1,0,0,0,0|2,0,0]=3 725 B12R1.27 OC[C@@H](F)CNc1ccccn1 1584848d336c5e6a789273d622755063 [0,1,0,0,0,0|3,0,0]=4 726 B12R1.27 OC[C@@H](F)CNc1cccnc1 27174b986a871a35ff2a2528d99fe670 [0,1,0,0,0,0|3,0,0]=4 727 B12R1.27 OC[C@@H](F)CNc1ccncc1 404fdfcd1b5e1015d1e7047c1dce70c8 [0,1,0,0,0,0|3,0,0]=4 728 B12R1.27 OC[C@@H](O)CNc1ccccc1 d5ed593b781b051c17ac5c0f665c9b28 [0,1,0,0,0,0|1,0,0]=2 729 B12R1.27 OC[C@@H](O)CNc1ccccn1 2519c7c1d8c00423d8e7e0d2e871ff57 [0,1,0,0,0,0|2,0,0]=3 730 B12R1.27 OC[C@@H](O)CNc1cccnc1 8c575336f8c6d4fe624442e780d70b20 [0,1,0,0,0,0|2,0,0]=3 731 B12R1.27 OC[C@@H](O)CNc1cccnn1 58a3e678159e6534b8b3409e8c95293a [0,1,0,0,0,0|3,0,0]=4 732 B12R1.27 OC[C@@H](O)CNc1ccncc1 0661095638a99c4a845de3cb9b65b46b [0,1,0,0,0,0|2,0,0]=3 733 B12R1.27 OC[C@@H](O)CNc1ccncn1 10efd3c226492fc8b4b0e6a19a39c9ac [0,1,0,0,0,0|3,0,0]=4 734 B12R1.27 OC[C@@H](O)CNc1ccnnc1 acb1c01bc9eb17a8a3fcbee3135f100f [0,1,0,0,0,0|3,0,0]=4 735 B12R1.27 OC[C@@H](O)CNc1cnccn1 7407429709e17e3ed0b8a23970e73740 [0,1,0,0,0,0|3,0,0]=4 736 B12R1.27 OC[C@@H](O)CNc1cncnc1 194f45f86576854268b66d8b98ccefef [0,1,0,0,0,0|3,0,0]=4 737 B12R1.27 OC[C@@H](O)CNc1ncccn1 67a9d28146b1982de145b045ea5f4c68 [0,1,0,0,0,0|3,0,0]=4 738 B12R1.27 OC[C@@H](O)COc1ccccn1 5d7275d622eef8cbe7d078a5f35c4912 [0,1,0,0,0,0|2,0,0]=3 739 B12R1.27 OC[C@@H](O)COc1cccnc1 67d57f427db75d1af6a0440a66710d9f [0,1,0,0,0,0|2,0,0]=3 740 B12R1.27 OC[C@@H](O)COc1ccncc1 30d909e2d35e87bd7663ec863341db7c [0,1,0,0,0,0|2,0,0]=3 741 B12R1.27 OC[C@@H](O)COc1ccnnc1 765093cc1e790d6c8ddeca68a451daca [0,1,0,0,0,0|3,0,0]=4 742 B12R1.27 OC[C@@H](O)COc1cnccn1 0eed07766913688fb589489d701afc2f [0,1,0,0,0,0|3,0,0]=4 743 B12R1.27 OC[C@@H](O)COc1cncnc1 202f6dbc78ec2ff0e3b381ae227e6fe3 [0,1,0,0,0,0|3,0,0]=4 744 B12R1.27 OC[C@@H](O)COc1ncccn1 fb606f8980318ebc969c6d4c4b853e7d [0,1,0,0,0,0|3,0,0]=4 745 B12R1.27 OC[C@H](F)CNc1ccccc1 9734eac13b001b84d3ee28ab012b0276 [0,1,0,0,0,0|2,0,0]=3 746 B12R1.27 OC[C@H](F)CNc1ccccn1 9c1fd0a321ca27bdcba2b167501dd415 [0,1,0,0,0,0|3,0,0]=4 747 B12R1.27 OC[C@H](F)CNc1cccnc1 4b4d10ed0c8ade13b1cf2e37b68a476b [0,1,0,0,0,0|3,0,0]=4 748 B12R1.27 OC[C@H](F)CNc1ccncc1 72be82e16ff155294b9146aea6bc917f [0,1,0,0,0,0|3,0,0]=4 749 B12R1.27 OC[C@H](O)CNc1ccccc1 4df6835ea35fcadc1546d95d2a23469d [0,1,0,0,0,0|1,0,0]=2 750 B12R1.27 OC[C@H](O)CNc1ccccn1 e668a53640e03ea6cd35db659b23303b [0,1,0,0,0,0|2,0,0]=3 751 B12R1.27 OC[C@H](O)CNc1cccnc1 f403b2d413b3dfc5460a701b3f32906f [0,1,0,0,0,0|2,0,0]=3 752 B12R1.27 OC[C@H](O)CNc1cccnn1 087448f1183ed7f43bb3b961de8ba49d [0,1,0,0,0,0|3,0,0]=4 753 B12R1.27 OC[C@H](O)CNc1ccncc1 563e5b58751d3dcea31b001699743353 [0,1,0,0,0,0|2,0,0]=3 754 B12R1.27 OC[C@H](O)CNc1ccncn1 70c5dc777387b42dc9ea51088d2653ff [0,1,0,0,0,0|3,0,0]=4 755 B12R1.27 OC[C@H](O)CNc1ccnnc1 0d2b84acb37073cd849272b6d1955d3f [0,1,0,0,0,0|3,0,0]=4 756 B12R1.27 OC[C@H](O)CNc1cnccn1 ee79647d0d893b6c2e8e16a89ef61985 [0,1,0,0,0,0|3,0,0]=4 757 B12R1.27 OC[C@H](O)CNc1cncnc1 e539fd22c8ae62559eaa8fbad559d609 [0,1,0,0,0,0|3,0,0]=4 758 B12R1.27 OC[C@H](O)CNc1ncccn1 ababa3637c22251016991c8e9b423ba2 [0,1,0,0,0,0|3,0,0]=4 759 B12R1.27 OC[C@H](O)COc1ccccn1 045d37c66440cc9315b76b72a2532fa4 [0,1,0,0,0,0|2,0,0]=3 760 B12R1.27 OC[C@H](O)COc1cccnc1 2642a621d8fa510d1c90c0e4fdb0b054 [0,1,0,0,0,0|2,0,0]=3 761 B12R1.27 OC[C@H](O)COc1ccncc1 7a8d5ee1399af5e53a3e66738822d7f4 [0,1,0,0,0,0|2,0,0]=3 762 B12R1.27 OC[C@H](O)COc1ccnnc1 666300e94135e6a4b7f5ad0aa796298e [0,1,0,0,0,0|3,0,0]=4 763 B12R1.27 OC[C@H](O)COc1cnccn1 f148bf1e896930240548bc4612b4a608 [0,1,0,0,0,0|3,0,0]=4 764 B12R1.27 OC[C@H](O)COc1cncnc1 ce721f5fd4bf850299ea6d479f05c805 [0,1,0,0,0,0|3,0,0]=4 765 B12R1.27 OC[C@H](O)COc1ncccn1 ec1e58c945dcba45a17837c41f7c3b4c [0,1,0,0,0,0|3,0,0]=4 766 B12R1.43 CC(=O)C(C)Nc1ccccc1 a5a89e613210df479342158a0b1bf72b [0,1,0,0,0,0|1,0,2]=4 767 B12R1.43 CC(=O)N(C)Cc1ccccc1 b985bf2c7484ae6a34647301b4683566 [0,1,0,0,0,0|1,0,2]=4 768 B12R1.43 CC(C)C(C)Nc1ccccc1 48093fab6ce2f9bea5eaf7557d6a555a [0,1,0,0,0,0|2,0,0]=3 769 B12R1.43 CC(C)C(C)Nc1ccccn1 56417f300787c21b824e0c0aa0c41aee [0,1,0,0,0,0|3,0,0]=4 770 B12R1.43 CC(C)C(C)Nc1cccnc1 d9c105ac720d93c173804a1a7215f55a [0,1,0,0,0,0|3,0,0]=4 771 B12R1.43 CC(C)C(C)Nc1ccncc1 f569432198f25ecd4f5fab536aa2585a [0,1,0,0,0,0|3,0,0]=4 772 B12R1.43 CC(C)C(C)Oc1ccccn1 0d1f1b8bafc8f4ae0cafc9a3a285e8fd [0,1,0,0,0,0|3,0,0]=4 773 B12R1.43 CC(C)C(C)Oc1cccnc1 7dd98d846884613a0fa0dacf726d609e [0,1,0,0,0,0|3,0,0]=4 774 B12R1.43 CC(C)C(C)Oc1ccncc1 e9f09d2447e1596ae903cb10648aeae2 [0,1,0,0,0,0|3,0,0]=4 775 B12R1.43 CC(C)N(C)Cc1ccccc1 d5edd43e495581ab07d4c878cf7efc6a [0,1,0,0,0,0|2,0,0]=3 776 B12R1.43 CC(C)N(C)Cc1ccccn1 1f5d3f68b51d0d1177f99817ac8f4046 [0,1,0,0,0,0|3,0,0]=4 777 B12R1.43 CC(C)N(C)Cc1cccnc1 1e873a4fbb2a3d762374aea8e87346b5 [0,1,0,0,0,0|3,0,0]=4 778 B12R1.43 CC(C)N(C)Cc1ccncc1 46734e331886f41f4f5306fbbfbe60e0 [0,1,0,0,0,0|3,0,0]=4 779 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 638de983f09ad8573a19e829866f679b [0,1,0,0,0,0|2,0,0]=3 780 B12R1.43 CC(C)[C@@H](C)Nc1cccnc1 8cc5cb560100920359a30d0b936931d0 [0,1,0,0,0,0|3,0,0]=4 781 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 37a4cc2968d8598e2dd44bb0f3ee65d4 [0,1,0,0,0,0|2,0,0]=3 782 B12R1.43 CC(C)[C@H](C)Nc1cccnc1 a0486500948362bfb0f4d9c857b8c881 [0,1,0,0,0,0|3,0,0]=4 783 B12R1.43 CC(O)C(=O)Nc1ccccn1 f1d6303cd0d3b7df7383a33060640cf2 [0,1,0,0,0,0|2,0,1]=4 784 B12R1.43 CC(O)C(=O)Nc1cccnc1 a6d8461b9d4871e9e14a4c125c563fab [0,1,0,0,0,0|2,0,1]=4 785 B12R1.43 CC(O)C(=O)Nc1ccncc1 5f38f891f7bf86acd8ff4507d609ca19 [0,1,0,0,0,0|2,0,1]=4 786 B12R1.43 CC(O)C(C)Nc1ccccc1 807016486516eda629177f9c4eb1e753 [0,1,0,0,0,0|1,0,0]=2 787 B12R1.43 CC(O)C(C)Nc1cccnc1 16f61952065d032141860c15b03f12c0 [0,1,0,0,0,0|2,0,0]=3 788 B12R1.43 C[C@@H](Nc1ccccc1)C(F)F 0725725b1a04a0d41d2316c9b2ed73b0 [0,1,0,0,0,0|3,0,0]=4 789 B12R1.43 C[C@@H](O)C(=O)Nc1ccccn1 20404072193521e4c24d9cd80d7ff514 [0,1,0,0,0,0|2,0,1]=4 790 B12R1.43 C[C@@H](O)C(=O)Nc1cccnc1 1f46b38a6f9fc93718ab3b927f346130 [0,1,0,0,0,0|2,0,1]=4 791 B12R1.43 C[C@@H](O)C(=O)Nc1ccncc1 196aea65f4f06495d0e80a2672b6d60d [0,1,0,0,0,0|2,0,1]=4 792 B12R1.43 C[C@H](Nc1ccccc1)C(F)F 14231ae717c62ec767200c948d4825fd [0,1,0,0,0,0|3,0,0]=4 793 B12R1.43 C[C@H](O)C(=O)Nc1ccccn1 10afc9763efda53effac1a6da94c3576 [0,1,0,0,0,0|2,0,1]=4 794 B12R1.43 C[C@H](O)C(=O)Nc1cccnc1 ec61428d6808a30af6e5a1bbccc688ed [0,1,0,0,0,0|2,0,1]=4 795 B12R1.43 C[C@H](O)C(=O)Nc1ccncc1 d03198d60543ea33e6296ae8259bf97a [0,1,0,0,0,0|2,0,1]=4 796 B12R1.43 O=C(O)C(F)Nc1ccccc1 c5ce312e32f06c5c8ff8fb1426824373 [0,1,0,0,0,0|2,0,1]=4 797 B12R1.43 O=C(O)[C@H](F)Nc1ccccc1 a79b4fb1f0a48c194a6531a29520d20f [0,1,0,0,0,0|2,0,1]=4 798 B12R1.107 C=C(C)CN(C)c1ccccc1 892f6b3ce1ea7a9b6cd32d9e819b4a96 [0,1,0,0,0,0|2,0,1]=4 799 B12R1.107 CC(=O)NC(C)c1ccccc1 5ac270090224b04d6e18bd0f40247bab [0,1,0,0,0,0|1,0,2]=4 800 B12R1.107 CC(=O)N[C@@H](C)c1ccccc1 83a412c49d00ac7737895652e0438906 [0,1,0,0,0,0|1,0,2]=4 801 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 6af9f7af8ede42291806b12f353a29c9 [0,1,0,0,0,0|1,0,2]=4 802 B12R1.107 CC(C)CN(C)c1ccccc1 95fef0ba310b862ee7742e989aa00371 [0,1,0,0,0,0|2,0,0]=3 803 B12R1.107 CC(C)CN(C)c1ccccn1 8902d7360de5bdf38f8ffbb3d266f9d8 [0,1,0,0,0,0|3,0,0]=4 804 B12R1.107 CC(C)CN(C)c1cccnc1 a80b388d9409df9822a700b6b9414c72 [0,1,0,0,0,0|3,0,0]=4 805 B12R1.107 CC(C)CN(C)c1ccncc1 190e4353355d3998c1470756e6537d1f [0,1,0,0,0,0|3,0,0]=4 806 B12R1.107 CC(C)NC(C)c1ccccn1 7a8a49744ff2dc697705e105a4d29b31 [0,1,0,0,0,0|3,0,0]=4 807 B12R1.107 CC(C)NC(C)c1cccnc1 f83045cb9bb475cbbd0d72c753be3dbb [0,1,0,0,0,0|3,0,0]=4 808 B12R1.107 CC(C)NC(C)c1ccncc1 4565af1a01c9e3a5c5433e3411958097 [0,1,0,0,0,0|3,0,0]=4 809 B12R1.107 CC(C)N[C@@H](C)c1ccccn1 5a8182a5c2834a1b8d14a1d525ca73eb [0,1,0,0,0,0|3,0,0]=4 810 B12R1.107 CC(C)N[C@@H](C)c1cccnc1 bba252309d650ecc30069f3dddd1b105 [0,1,0,0,0,0|3,0,0]=4 811 B12R1.107 CC(C)N[C@@H](C)c1ccncc1 775d0cb56d3dd6bc4738e2685aee9f6a [0,1,0,0,0,0|3,0,0]=4 812 B12R1.107 CC(C)N[C@H](C)c1ccccn1 8a594a7c5da3e31c163d1068dcac9471 [0,1,0,0,0,0|3,0,0]=4 813 B12R1.107 CC(C)N[C@H](C)c1cccnc1 ce94c3a37523dd9db9b3b4f768ea9506 [0,1,0,0,0,0|3,0,0]=4 814 B12R1.107 CC(C)N[C@H](C)c1ccncc1 a8f7ac5675fa91c5d895f344e2b2bc66 [0,1,0,0,0,0|3,0,0]=4 815 B12R1.107 CC(C)OC(C)c1ccccc1 c88937e1bba3e11ca71331a692d3263d [0,1,0,0,0,0|2,0,0]=3 816 B12R1.107 CC(C)OC(C)c1ccccn1 e36bdb169f8c2820d6238217cf2c0c9b [0,1,0,0,0,0|3,0,0]=4 817 B12R1.107 CC(C)OC(C)c1cccnc1 a720356d264ae2e2bd94268a34af0246 [0,1,0,0,0,0|3,0,0]=4 818 B12R1.107 CC(C)OC(C)c1ccncc1 dff8cce62d02c112ddba22a89b06b30b [0,1,0,0,0,0|3,0,0]=4 819 B12R1.107 CC(C)O[C@@H](C)c1ccccc1 cd312c9ad337f3d7e7cf959a697dd297 [0,1,0,0,0,0|2,0,0]=3 820 B12R1.107 CC(C)O[C@@H](C)c1ccccn1 6a258a3944fb55be34cbeaa329643f08 [0,1,0,0,0,0|3,0,0]=4 821 B12R1.107 CC(C)O[C@@H](C)c1cccnc1 e078965ffd7282aede11459af9dd81de [0,1,0,0,0,0|3,0,0]=4 822 B12R1.107 CC(C)O[C@@H](C)c1ccncc1 a72003c25fd185808d9c1b428a24fd38 [0,1,0,0,0,0|3,0,0]=4 823 B12R1.107 CC(C)O[C@H](C)c1ccccc1 b2ce62b73f9b987a3fea9afe8162e394 [0,1,0,0,0,0|2,0,0]=3 824 B12R1.107 CC(C)O[C@H](C)c1ccccn1 328ee8bf306075f10d7c4472fab39f5c [0,1,0,0,0,0|3,0,0]=4 825 B12R1.107 CC(C)O[C@H](C)c1cccnc1 8b46fac7478602a39d5771164fd44ea8 [0,1,0,0,0,0|3,0,0]=4 826 B12R1.107 CC(C)O[C@H](C)c1ccncc1 0ca354191167bd77b68c3f542b91cfff [0,1,0,0,0,0|3,0,0]=4 827 B12R1.107 CC(O)CN(C)c1ccccc1 f96f86be852a8f681918c1e7f925b14c [0,1,0,0,0,0|1,0,0]=2 828 B12R1.107 CC(O)CN(C)c1cccnc1 d715257cc205a3ad1ba2a7c44829d24d [0,1,0,0,0,0|2,0,0]=3 829 B12R1.107 CC(O)CN(C)c1cccnn1 1c322cd267a516fbadcd110637f977e6 [0,1,0,0,0,0|3,0,0]=4 830 B12R1.107 CC(O)CN(C)c1ccncc1 e695f10b7dfeea1b5f1e680bb57e7ff7 [0,1,0,0,0,0|2,0,0]=3 831 B12R1.107 CC(O)CN(C)c1ccncn1 856fb79055e7dfde8054faed0dc226a3 [0,1,0,0,0,0|3,0,0]=4 832 B12R1.107 CC(O)CN(C)c1ccnnc1 f44b90e814259fc1e28b3523e5113fa9 [0,1,0,0,0,0|3,0,0]=4 833 B12R1.107 CC(O)CN(C)c1cnccn1 0c5963eca3b43b7dbe63fc25f7d89dfb [0,1,0,0,0,0|3,0,0]=4 834 B12R1.107 CC(O)CN(C)c1ncccn1 932fe967f2ac95a07966ae3381083442 [0,1,0,0,0,0|3,0,0]=4 835 B12R1.107 CN(CC(=O)O)c1ccccc1 858f8808a1d727235e14bdbf7ff6ac3d [0,1,0,0,0,0|2,0,1]=4 836 B12R1.107 CN(CC(F)F)c1ccccc1 05f004b3b4c4b69f1581d75ed67c7356 [0,1,0,0,0,0|3,0,0]=4 837 B12R1.107 C[C@H](O)CN(C)c1ccccc1 623c379093f4d5c87dbfc7a6a5452bce [0,1,0,0,0,0|1,0,0]=2 838 B12R1.107 C[C@H](O)CN(C)c1cccnc1 7e2d3b3bc5bbd8f2620cee39b367bf51 [0,1,0,0,0,0|2,0,0]=3 839 B12R1.107 C[C@H](O)CN(C)c1cccnn1 30d1677c9624272e2ac32f5aadc53724 [0,1,0,0,0,0|3,0,0]=4 840 B12R1.107 C[C@H](O)CN(C)c1ccncc1 cdb081538e85a8b740b305a52424207c [0,1,0,0,0,0|2,0,0]=3 841 B12R1.107 C[C@H](O)CN(C)c1ccncn1 367e5c4b202bca095bf1fec483c70387 [0,1,0,0,0,0|3,0,0]=4 842 B12R1.107 C[C@H](O)CN(C)c1ccnnc1 2d2aa89216503e25b21f18f322770b32 [0,1,0,0,0,0|3,0,0]=4 843 B12R1.107 C[C@H](O)CN(C)c1cnccn1 e7140e82e0ba3da361ffbb30c9119f91 [0,1,0,0,0,0|3,0,0]=4 844 B12R1.107 C[C@H](O)CN(C)c1ncccn1 7f650c85a1af20974b789ac773bff4cc [0,1,0,0,0,0|3,0,0]=4 845 B12R1.125 C=C(C)CNc1ccccc1C 0775997f92f40e132d20ea5fe7bd037c [0,1,0,0,0,0|2,0,1]=4 846 B12R1.125 C=C(C)CNc1ccccc1Cl a75535e95522e1719e06cc6979b758b3 [0,1,0,0,0,0|2,0,1]=4 847 B12R1.125 C=C(C)CNc1ccccc1F 9b7c12d4b75b7be7a150f8ba427b5f42 [0,1,0,0,0,0|2,0,1]=4 848 B12R1.125 C=C(C)CNc1ccccc1I f6467f3a4a3ed6a797fa030b9ae4ec92 [0,1,0,0,0,0|2,0,1]=4 849 B12R1.125 C=C(C)CNc1ccccc1S 9590615441677828468f9996a31408ce [0,1,0,0,0,0|2,0,1]=4 850 B12R1.125 C=C(C)COc1ccccc1C 50941d3358717591e5c55d30412cbebf [0,1,0,0,0,0|2,0,1]=4 851 B12R1.125 C=C(C)COc1ccccc1Cl c433224d4376530c43d1e8a4447f9529 [0,1,0,0,0,0|2,0,1]=4 852 B12R1.125 C=C(C)COc1ccccc1F 20b0d2b9bf3e175b0ffacf7761f1d330 [0,1,0,0,0,0|2,0,1]=4 853 B12R1.125 C=C(C)COc1ccccc1I f8be04256775a295a8c22cdfbdfac3ce [0,1,0,0,0,0|2,0,1]=4 854 B12R1.125 CC(=O)CNc1ccccc1C 6c131824b73be3bd14e6342145d37cb4 [0,1,0,0,0,0|1,0,2]=4 855 B12R1.125 CC(=O)CNc1ccccc1F 9434eaabf0739c357d09cdea72164c56 [0,1,0,0,0,0|1,0,2]=4 856 B12R1.125 CC(=O)NCc1ccccc1Br c47d1b381faeb3750f6d77f8a6825780 [0,1,0,0,0,0|1,0,2]=4 857 B12R1.125 CC(=O)NCc1ccccc1C 878373bfe1c9994e38f6b300a4c7508f [0,1,0,0,0,0|1,0,2]=4 858 B12R1.125 CC(=O)NCc1ccccc1Cl b19ee0daad189de3f536de6cee918157 [0,1,0,0,0,0|1,0,2]=4 859 B12R1.125 CC(=O)NCc1ccccc1F 7cb30f4a5a9e7b6ebe7ffa0ec755e5d6 [0,1,0,0,0,0|1,0,2]=4 860 B12R1.125 CC(=O)NCc1ccccc1I 3fdc9f6ca170895ba3e43a993004cbe3 [0,1,0,0,0,0|1,0,2]=4 861 B12R1.125 CC(=O)NCc1ccccc1O 0586c5299a3d61253924ffc29f47c091 [0,1,0,0,0,0|1,0,2]=4 862 B12R1.125 CC(C)CNc1c[nH]ccc1=O 3b03ea0bb77f8e7d321e8ba0c96772d1 [0,1,0,0,0,0|3,0,0]=4 863 B12R1.125 CC(C)CNc1ccc[nH]c1=S 8e3a62399c7f1ac89cf2c2b861315f33 [0,1,0,0,0,0|3,0,0]=4 864 B12R1.125 CC(C)CNc1cccc[n+]1[O-] 689b30fb24174281715b1e2295d6fd1b [0,1,0,0,0,0|3,0,0]=4 865 B12R1.125 CC(C)CNc1ccccc1Br 97dcb5c3c65ce65124839fce143060ed [0,1,0,0,0,0|2,0,0]=3 866 B12R1.125 CC(C)CNc1ccccc1Cl 75d6f72f33e1b81eaa5975119e7851a7 [0,1,0,0,0,0|2,0,0]=3 867 B12R1.125 CC(C)CNc1ccccc1F 1f6d990d4611c55e81ba435b4de3227f [0,1,0,0,0,0|2,0,0]=3 868 B12R1.125 CC(C)CNc1ccccc1I 8137d11aab68af4ff87c3b0c458aeadf [0,1,0,0,0,0|2,0,0]=3 869 B12R1.125 CC(C)CNc1ccccc1S abeaa0222adaeba5cb90e228335806a0 [0,1,0,0,0,0|2,0,0]=3 870 B12R1.125 CC(C)CNc1cccnc1Br e4e35cf9a45e8464362812984f0dcb29 [0,1,0,0,0,0|3,0,0]=4 871 B12R1.125 CC(C)CNc1cccnc1Cl e27f120938cdfad22a9d53ca2ece2161 [0,1,0,0,0,0|3,0,0]=4 872 B12R1.125 CC(C)CNc1cccnc1F 96b3802c2db207930b95c94df62440dc [0,1,0,0,0,0|3,0,0]=4 873 B12R1.125 CC(C)CNc1cccnc1I 48231421f771901ae224cd2d83518b5a [0,1,0,0,0,0|3,0,0]=4 874 B12R1.125 CC(C)CNc1ccncc1Br c2ed8fd4459e567e6fc82d9899d25f80 [0,1,0,0,0,0|3,0,0]=4 875 B12R1.125 CC(C)CNc1ccncc1Cl 1a3dd903c6829977355f03ea4926eb4b [0,1,0,0,0,0|3,0,0]=4 876 B12R1.125 CC(C)CNc1ccncc1F 5747fbc5541ea5634e0d79e127688ce0 [0,1,0,0,0,0|3,0,0]=4 877 B12R1.125 CC(C)CNc1ccncc1I 1554741b1b824ec64a61799e1f57cd4a [0,1,0,0,0,0|3,0,0]=4 878 B12R1.125 CC(C)CNc1cnccc1Br a1750953a126ec3c55ead7f1bbd124cb [0,1,0,0,0,0|3,0,0]=4 879 B12R1.125 CC(C)CNc1cnccc1Cl ea676dc248bf0bb68510cef98a5c2721 [0,1,0,0,0,0|3,0,0]=4 880 B12R1.125 CC(C)CNc1cnccc1F bd64b3b317a29392a4044c03bdb541d5 [0,1,0,0,0,0|3,0,0]=4 881 B12R1.125 CC(C)CNc1cnccc1I 05e43f5b8e6667c6fbf8f845bd4fb066 [0,1,0,0,0,0|3,0,0]=4 882 B12R1.125 CC(C)CNc1cnccc1S 24918fb93412c853be460e7bc090cec7 [0,1,0,0,0,0|3,0,0]=4 883 B12R1.125 CC(C)CNc1ncccc1Br fae7f676714f4f0b4d9a3346ec38d262 [0,1,0,0,0,0|3,0,0]=4 884 B12R1.125 CC(C)CNc1ncccc1Cl 6854bd1dac0bcfd1589f4cde44ac0686 [0,1,0,0,0,0|3,0,0]=4 885 B12R1.125 CC(C)CNc1ncccc1F c9b843ec39757011d12a4f0d9d477f19 [0,1,0,0,0,0|3,0,0]=4 886 B12R1.125 CC(C)CNc1ncccc1I a8a8c3c3e1f4d6c6293dd19e4366ca81 [0,1,0,0,0,0|3,0,0]=4 887 B12R1.125 CC(C)COc1ccc[nH]c1=S 7cf31679b8b84a26df7d913fb8de737f [0,1,0,0,0,0|3,0,0]=4 888 B12R1.125 CC(C)COc1cccc[n+]1[O-] 90f4e1bdff35950ddac633fbe78456a9 [0,1,0,0,0,0|3,0,0]=4 889 B12R1.125 CC(C)COc1ccccc1Br 15e4cd0efed59b74bb1886c65548b9ce [0,1,0,0,0,0|2,0,0]=3 890 B12R1.125 CC(C)COc1ccccc1Cl ec2a4d693a1f337c73c825dab32a22e8 [0,1,0,0,0,0|2,0,0]=3 891 B12R1.125 CC(C)COc1ccccc1F 3d250d7b85e326d2d954c337a0f1907d [0,1,0,0,0,0|2,0,0]=3 892 B12R1.125 CC(C)COc1ccccc1I 179013c2eef1a81cfd9d0470359a57c5 [0,1,0,0,0,0|2,0,0]=3 893 B12R1.125 CC(C)COc1ccccc1S 3c07cbd446137458a8a811b24d5966d2 [0,1,0,0,0,0|2,0,0]=3 894 B12R1.125 CC(C)COc1cccnc1Br 0278dcd8e75402c6e226bd0d671b7cf3 [0,1,0,0,0,0|3,0,0]=4 895 B12R1.125 CC(C)COc1cccnc1Cl 41fd6af4f5d26b414a821e4b03b3d8fa [0,1,0,0,0,0|3,0,0]=4 896 B12R1.125 CC(C)COc1cccnc1F fd7af796a2b1344ab209b53adf573de3 [0,1,0,0,0,0|3,0,0]=4 897 B12R1.125 CC(C)COc1cccnc1I 8818acbf89666f4ebe1942f8299c4bc1 [0,1,0,0,0,0|3,0,0]=4 898 B12R1.125 CC(C)COc1cccoc1=O 45df10a23fce7e58eaab8fa4ac81b508 [0,1,0,0,0,0|3,0,0]=4 899 B12R1.125 CC(C)COc1ccncc1Br 76b5f88eb65a5cfb6ae6b530d5f76337 [0,1,0,0,0,0|3,0,0]=4 900 B12R1.125 CC(C)COc1ccncc1Cl f28708ed6a61c93329f92a369d11035a [0,1,0,0,0,0|3,0,0]=4 901 B12R1.125 CC(C)COc1ccncc1F 6c709eb8750c3a8924247fa6b8a79fc8 [0,1,0,0,0,0|3,0,0]=4 902 B12R1.125 CC(C)COc1cnccc1Br baa265ac6db9382ad621fb0e3d2e4286 [0,1,0,0,0,0|3,0,0]=4 903 B12R1.125 CC(C)COc1cnccc1Cl f1a754cc7617bfcd453fe7e24b90cd5e [0,1,0,0,0,0|3,0,0]=4 904 B12R1.125 CC(C)COc1cnccc1F d2888be0656caedf957d8f1373572b95 [0,1,0,0,0,0|3,0,0]=4 905 B12R1.125 CC(C)COc1cnccc1I 446f87702702d377df3b308dd5125063 [0,1,0,0,0,0|3,0,0]=4 906 B12R1.125 CC(C)COc1coccc1=O 614bed8cd5a90cce22ec40c4fdcd726a [0,1,0,0,0,0|3,0,0]=4 907 B12R1.125 CC(C)COc1ncccc1Br 3f386d7d47b34b2ac46f0a2ae6e73e95 [0,1,0,0,0,0|3,0,0]=4 908 B12R1.125 CC(C)COc1ncccc1Cl 6de14ae7428ddbeb75053110c130c498 [0,1,0,0,0,0|3,0,0]=4 909 B12R1.125 CC(C)COc1ncccc1F a9cb4a7eade6381f71dc5eb3e7f6b4ad [0,1,0,0,0,0|3,0,0]=4 910 B12R1.125 CC(C)COn1ccccc1=N e29cdf3d114d78764214cf0d7bd88c1b [0,1,0,0,0,0|3,0,0]=4 911 B12R1.125 CC(C)COn1ccccc1=O 520cbc87b96c5de6e4f7512692f10f1c [0,1,0,0,0,0|3,0,0]=4 912 B12R1.125 CC(C)COn1ccccc1=S 6836594d7ae7c3a48edd8c4299ac9353 [0,1,0,0,0,0|3,0,0]=4 913 B12R1.125 CC(C)NCc1cccc[n+]1[O-] 75c78e72999a2a9c82d82071968cfcf8 [0,1,0,0,0,0|3,0,0]=4 914 B12R1.125 CC(C)NCc1ccccc1Cl 9b9897219917fd3530700a473a4db4bc [0,1,0,0,0,0|2,0,0]=3 915 B12R1.125 CC(C)NCc1ccccc1F 22106e2f6b32da238c4d16ecaebf9107 [0,1,0,0,0,0|2,0,0]=3 916 B12R1.125 CC(C)NCc1ccccc1I 3b248e8d40a66b793c94674298302a5d [0,1,0,0,0,0|2,0,0]=3 917 B12R1.125 CC(C)NCc1cccnc1Br 22459f2ca835d8f7937b98fb2a9c12c5 [0,1,0,0,0,0|3,0,0]=4 918 B12R1.125 CC(C)NCc1cccnc1Cl 1a6e41b1638b07ef5214929c520cab92 [0,1,0,0,0,0|3,0,0]=4 919 B12R1.125 CC(C)NCc1cccnc1F 25593b5896d79eeec200973b3dd6952c [0,1,0,0,0,0|3,0,0]=4 920 B12R1.125 CC(C)NCc1ccncc1Br d81e7ee16e73504478b6791c384b9ec3 [0,1,0,0,0,0|3,0,0]=4 921 B12R1.125 CC(C)NCc1ccncc1Cl 251b95b9f8185cc37c498345c403ee2f [0,1,0,0,0,0|3,0,0]=4 922 B12R1.125 CC(C)NCc1ccncc1F 3fd62883cc180b7243d81db6adc63828 [0,1,0,0,0,0|3,0,0]=4 923 B12R1.125 CC(C)NCc1ncccc1Br ba070c387cfb926f8a021c30b52f1b8f [0,1,0,0,0,0|3,0,0]=4 924 B12R1.125 CC(C)NCc1ncccc1Cl 1546787973be24b721a8bc7496cac392 [0,1,0,0,0,0|3,0,0]=4 925 B12R1.125 CC(C)NCc1ncccc1F aa0069dced2d7cc22965885f3f7a9397 [0,1,0,0,0,0|3,0,0]=4 926 B12R1.125 CC(C)OCc1ccc[nH]c1=O e297c1be086c22b1e84c5a8b3babb68d [0,1,0,0,0,0|3,0,0]=4 927 B12R1.125 CC(C)OCc1ccccc1Cl f1d0578f20039107ab7831c744270352 [0,1,0,0,0,0|2,0,0]=3 928 B12R1.125 CC(C)OCc1ccccc1F 88ffe0c3ffb1a7712dee49c51d8757cb [0,1,0,0,0,0|2,0,0]=3 929 B12R1.125 CC(C)OCc1ccccc1I 091e4f6992ab541edd05dc5206b2152a [0,1,0,0,0,0|2,0,0]=3 930 B12R1.125 CC(C)OCc1cccnc1Br 054a1fa90d466c66e80e2f94ee0cc8ad [0,1,0,0,0,0|3,0,0]=4 931 B12R1.125 CC(C)OCc1cccnc1Cl 9341dccfc0e34600d7a9f7d86868c180 [0,1,0,0,0,0|3,0,0]=4 932 B12R1.125 CC(C)OCc1cccnc1F 43198bce1943ba438eca35cf747bbab3 [0,1,0,0,0,0|3,0,0]=4 933 B12R1.125 CC(C)OCc1ccncc1Cl b2bd70abc2680c5faca01e36afe3c508 [0,1,0,0,0,0|3,0,0]=4 934 B12R1.125 CC(C)OCc1ccncc1F e0f664bd9f24e773b8099a6425861e38 [0,1,0,0,0,0|3,0,0]=4 935 B12R1.125 CC(C)OCc1ccncc1I a9ac24f885be578976859e0b73ccf536 [0,1,0,0,0,0|3,0,0]=4 936 B12R1.125 CC(C)OCc1cnccc1Br 3e276621683da2bb94d01c109be41823 [0,1,0,0,0,0|3,0,0]=4 937 B12R1.125 CC(C)OCc1cnccc1Cl eb99f0c34344c7f47466de55040bd0d4 [0,1,0,0,0,0|3,0,0]=4 938 B12R1.125 CC(C)OCc1cnccc1F 68c200210a3748d543a35abac99f931b [0,1,0,0,0,0|3,0,0]=4 939 B12R1.125 CC(C)OCc1ncccc1Br 4614c9d7b350005a40859c2bd40e6e3d [0,1,0,0,0,0|3,0,0]=4 940 B12R1.125 CC(C)OCc1ncccc1Cl 4451d4ad31d9d68f63a26b0996be1d97 [0,1,0,0,0,0|3,0,0]=4 941 B12R1.125 CC(C)OCc1ncccc1F a6ff5296d7d94bb454d989a3d95e21c4 [0,1,0,0,0,0|3,0,0]=4 942 B12R1.125 CC(O)CNc1c[nH]ccc1=O 3d53fb936c3f25e29733d7792976e8ad [0,1,0,0,0,0|2,0,0]=3 943 B12R1.125 CC(O)CNc1c[nH]cnc1=O 11156e59abf00c4555fa24b195c69a63 [0,1,0,0,0,0|3,0,0]=4 944 B12R1.125 CC(O)CNc1ccc[nH]c1=S b34bbcf0ab8a0d7c87dba4f3ad419b1b [0,1,0,0,0,0|2,0,0]=3 945 B12R1.125 CC(O)CNc1cccc[n+]1[O-] 58ef4e5c02549723bc3393d8daa55594 [0,1,0,0,0,0|2,0,0]=3 946 B12R1.125 CC(O)CNc1ccccc1Br 4a8178895a974705dd8c5d47896d821f [0,1,0,0,0,0|1,0,0]=2 947 B12R1.125 CC(O)CNc1ccccc1Cl 18a1aeb377915ff3d7752e638825109f [0,1,0,0,0,0|1,0,0]=2 948 B12R1.125 CC(O)CNc1ccccc1F 2118f4d689b50b2f5bf4fe77b0346bb5 [0,1,0,0,0,0|1,0,0]=2 949 B12R1.125 CC(O)CNc1ccccc1I 4ba68e475ff4710ffb78d3e623e4dd83 [0,1,0,0,0,0|1,0,0]=2 950 B12R1.125 CC(O)CNc1ccccc1S c9cd17787d858b75a205fbdc344be6ff [0,1,0,0,0,0|1,0,0]=2 951 B12R1.125 CC(O)CNc1cccnc1Br f249a4b8744d03a02e24b0b13450af63 [0,1,0,0,0,0|2,0,0]=3 952 B12R1.125 CC(O)CNc1cccnc1Cl 95b371b3e779eaabee26b45d4e140a5e [0,1,0,0,0,0|2,0,0]=3 953 B12R1.125 CC(O)CNc1cccnc1F e14799916c7fb7239e2d571cef33ba0a [0,1,0,0,0,0|2,0,0]=3 954 B12R1.125 CC(O)CNc1cccnc1I a1f63668ebab19c97abdffaea4e72eb2 [0,1,0,0,0,0|2,0,0]=3 955 B12R1.125 CC(O)CNc1ccn[nH]c1=O a11c57a7ff5d59789d46712048c3f2ba [0,1,0,0,0,0|3,0,0]=4 956 B12R1.125 CC(O)CNc1ccn[nH]c1=S bbfff3dd43e4bafe164bc097b9952487 [0,1,0,0,0,0|3,0,0]=4 957 B12R1.125 CC(O)CNc1ccncc1Br 49e627a4311350710b14646544dad8e6 [0,1,0,0,0,0|2,0,0]=3 958 B12R1.125 CC(O)CNc1ccncc1Cl 389013cf861be617897026b577813ca5 [0,1,0,0,0,0|2,0,0]=3 959 B12R1.125 CC(O)CNc1ccncc1F 355936ef1844d0a8c62ea95b5737bc01 [0,1,0,0,0,0|2,0,0]=3 960 B12R1.125 CC(O)CNc1ccncc1I c8887a8087c124ee48ec112b4551594b [0,1,0,0,0,0|2,0,0]=3 961 B12R1.125 CC(O)CNc1ccnnc1Br d4a9af1bdd3358be87acf09717f499c5 [0,1,0,0,0,0|3,0,0]=4 962 B12R1.125 CC(O)CNc1ccnnc1Cl ca779b49832389d00df67edb9ea0d0b9 [0,1,0,0,0,0|3,0,0]=4 963 B12R1.125 CC(O)CNc1cnccc1Br eaf65a54847da2d7542db29233cc1f77 [0,1,0,0,0,0|2,0,0]=3 964 B12R1.125 CC(O)CNc1cnccc1Cl 9a0a7220cc2978dd9e3bc2e3be28b091 [0,1,0,0,0,0|2,0,0]=3 965 B12R1.125 CC(O)CNc1cnccc1F ea8f2671d1611ccf384a8e9cbfdfd0a7 [0,1,0,0,0,0|2,0,0]=3 966 B12R1.125 CC(O)CNc1cnccc1I 02315c0170c733e27427e65855199904 [0,1,0,0,0,0|2,0,0]=3 967 B12R1.125 CC(O)CNc1cnccc1S 95f61ff7061c672b64fb2292d23abb71 [0,1,0,0,0,0|2,0,0]=3 968 B12R1.125 CC(O)CNc1cncnc1Br d67a2adc72cca1cb636156167dc3e80a [0,1,0,0,0,0|3,0,0]=4 969 B12R1.125 CC(O)CNc1cncnc1Cl 9099cb05d28b2c8a65dd09153ce861bf [0,1,0,0,0,0|3,0,0]=4 970 B12R1.125 CC(O)CNc1cncnc1I fa4ba537930f64b91e6f29e725a8445c [0,1,0,0,0,0|3,0,0]=4 971 B12R1.125 CC(O)CNc1cnncc1Br 6203140f081c23f1e78e6a2978ee87e4 [0,1,0,0,0,0|3,0,0]=4 972 B12R1.125 CC(O)CNc1cnncc1Cl e43b9c5d2c71083435b478a63103b6ea [0,1,0,0,0,0|3,0,0]=4 973 B12R1.125 CC(O)CNc1ncccc1Br 07bd0212188f6402081d3601f8be3e37 [0,1,0,0,0,0|2,0,0]=3 974 B12R1.125 CC(O)CNc1ncccc1Cl fb81df189928bf6a6f8705b7c6310d7f [0,1,0,0,0,0|2,0,0]=3 975 B12R1.125 CC(O)CNc1ncccc1F 5c44bed55227ca225f290d0a98f09154 [0,1,0,0,0,0|2,0,0]=3 976 B12R1.125 CC(O)CNc1ncccc1I b32669ead1f744a88a5ba4686f32e11f [0,1,0,0,0,0|2,0,0]=3 977 B12R1.125 CC(O)CNc1nccnc1Br cc4d4b08fae26fb04cdddfd3aca5f05a [0,1,0,0,0,0|3,0,0]=4 978 B12R1.125 CC(O)CNc1nccnc1Cl 6834193a32564dc37ba03b5264bcaa81 [0,1,0,0,0,0|3,0,0]=4 979 B12R1.125 CC(O)CNc1nccnc1I 59f1472df2ab39c7f7ac33aea6f92d3d [0,1,0,0,0,0|3,0,0]=4 980 B12R1.125 CC(O)CNc1ncncc1Br 8688ff4334942155e6617bc49678216c [0,1,0,0,0,0|3,0,0]=4 981 B12R1.125 CC(O)CNc1ncncc1Cl c4a8759560c83246518d9dc27481a8f3 [0,1,0,0,0,0|3,0,0]=4 982 B12R1.125 CC(O)CNc1ncncc1F a4417d2546eacdd3f1a20bf81c15911a [0,1,0,0,0,0|3,0,0]=4 983 B12R1.125 CC(O)CNc1ncncc1I 6aca8c3f0ffac486542d82f2a98a5b58 [0,1,0,0,0,0|3,0,0]=4 984 B12R1.125 CN(C)CNc1ccccc1I 9db091b00fc74cd0330b59002f1d7c8a [0,1,0,0,0,0|3,0,0]=4 985 B12R1.125 CN(C)COc1ccccc1Cl 97615d5e6a9b6d2759b55d0ad129882e [0,1,0,0,0,0|3,0,0]=4 986 B12R1.125 CN(C)COc1ccccc1F d924d84b19d4fe40db67235213a44035 [0,1,0,0,0,0|3,0,0]=4 987 B12R1.125 CN(C)COc1ccccc1I 6002f90dd33e7c9d3ab5ef7fc55225a1 [0,1,0,0,0,0|3,0,0]=4 988 B12R1.125 C[C@@H](O)CNc1c[nH]ccc1=O 5f79fe3799d2a83c4e3e87433d3e3608 [0,1,0,0,0,0|2,0,0]=3 989 B12R1.125 C[C@@H](O)CNc1c[nH]ccc1=S cf033160e241c97b4ca3ce2c552c85c1 [0,1,0,0,0,0|2,0,0]=3 990 B12R1.125 C[C@@H](O)CNc1c[nH]cnc1=O 8b97f74169fd66bc9d6b677558e2ee4c [0,1,0,0,0,0|3,0,0]=4 991 B12R1.125 C[C@@H](O)CNc1cccc[n+]1[O-] 687afa08a076e2b07454026ec39dcbac [0,1,0,0,0,0|2,0,0]=3 992 B12R1.125 C[C@@H](O)CNc1ccccc1I 9fbcb093ddb932bd7f24eaa426a08c17 [0,1,0,0,0,0|1,0,0]=2 993 B12R1.125 C[C@@H](O)CNc1ccn[nH]c1=O 353a68a78dab7f3b59ef7589f9026071 [0,1,0,0,0,0|3,0,0]=4 994 B12R1.125 C[C@@H](O)CNc1ccn[nH]c1=S ca66bf8b48106ca7bf364dc67faa563f [0,1,0,0,0,0|3,0,0]=4 995 B12R1.125 C[C@@H](O)CNc1ccncc1Br 36efb5895b04a2243adf88897ef5fba8 [0,1,0,0,0,0|2,0,0]=3 996 B12R1.125 C[C@@H](O)CNc1ccncc1Cl 8cdd9ee7984fb60d95117ee4e5feaf7b [0,1,0,0,0,0|2,0,0]=3 997 B12R1.125 C[C@@H](O)CNc1ccncc1F 6d3ab2346604d093f7ea13674488e780 [0,1,0,0,0,0|2,0,0]=3 998 B12R1.125 C[C@@H](O)CNc1ccncc1I 9588db304d2759452d21d2091301c54d [0,1,0,0,0,0|2,0,0]=3 999 B12R1.125 C[C@@H](O)CNc1ccnnc1Br ebb3cdec3a381fa8790e9ee157ef13d6 [0,1,0,0,0,0|3,0,0]=4 1000 B12R1.125 C[C@@H](O)CNc1ccnnc1Cl de33984caeed8e0d90868093b0d21d41 [0,1,0,0,0,0|3,0,0]=4 1001 B12R1.125 C[C@@H](O)CNc1cnccc1F 95434ac9320d84db3a7117cef5c52be1 [0,1,0,0,0,0|2,0,0]=3 1002 B12R1.125 C[C@@H](O)CNc1cnccc1I 3547ce108436077763fca1e4125b8421 [0,1,0,0,0,0|2,0,0]=3 1003 B12R1.125 C[C@@H](O)CNc1cnncc1Cl 8f640bc1acf143879c240225c3c5f6b1 [0,1,0,0,0,0|3,0,0]=4 1004 B12R1.125 C[C@@H](O)CNc1ncccc1F 8d1fce3ad304cd5add0f920bc2011ffa [0,1,0,0,0,0|2,0,0]=3 1005 B12R1.125 C[C@@H](O)CNc1ncccc1I 8f85ec08735117db5aa326be3c8b449f [0,1,0,0,0,0|2,0,0]=3 1006 B12R1.125 C[C@@H](O)CNc1nccnc1Br 53bc0939e796139317b30a0557107641 [0,1,0,0,0,0|3,0,0]=4 1007 B12R1.125 C[C@@H](O)CNc1nccnc1Cl 84fa54c54da9940b46748dde2bf5da88 [0,1,0,0,0,0|3,0,0]=4 1008 B12R1.125 C[C@@H](O)CNc1nccnc1I d9ba8c3e809b4805db25e99080cd4f46 [0,1,0,0,0,0|3,0,0]=4 1009 B12R1.125 C[C@@H](O)CNc1ncncc1Br 2fd6a5fbce337ee4e586442e7bc72b23 [0,1,0,0,0,0|3,0,0]=4 1010 B12R1.125 C[C@H](O)CNc1c[nH]ccc1=O 02a4079d850e6605d93586a6281b70dc [0,1,0,0,0,0|2,0,0]=3 1011 B12R1.125 C[C@H](O)CNc1c[nH]cnc1=O 76cc9baac22dd7b18a7ff1310a1be2cd [0,1,0,0,0,0|3,0,0]=4 1012 B12R1.125 C[C@H](O)CNc1ccc[nH]c1=S c677e475db5a045cf918a4f3dc237770 [0,1,0,0,0,0|2,0,0]=3 1013 B12R1.125 C[C@H](O)CNc1cccc[n+]1[O-] 3ca150da2baee929ab0eb5c41a876172 [0,1,0,0,0,0|2,0,0]=3 1014 B12R1.125 C[C@H](O)CNc1ccccc1Br c817d086f8954ccab620e5f4c72375d6 [0,1,0,0,0,0|1,0,0]=2 1015 B12R1.125 C[C@H](O)CNc1ccccc1Cl 764c54c7fa40fe5604a3aadd5e4b8400 [0,1,0,0,0,0|1,0,0]=2 1016 B12R1.125 C[C@H](O)CNc1ccccc1F 215b77315898b180d735c74dedf26562 [0,1,0,0,0,0|1,0,0]=2 1017 B12R1.125 C[C@H](O)CNc1ccccc1I a750a87f3e2f024043f4659d08af95be [0,1,0,0,0,0|1,0,0]=2 1018 B12R1.125 C[C@H](O)CNc1ccccc1S a2817a071e3134750611d07f0df977a7 [0,1,0,0,0,0|1,0,0]=2 1019 B12R1.125 C[C@H](O)CNc1cccnc1Br cb05ae2c8a7f395c5db1d1cb21241540 [0,1,0,0,0,0|2,0,0]=3 1020 B12R1.125 C[C@H](O)CNc1cccnc1Cl 6a54c1f1bd42de78c04c03ed899e30c5 [0,1,0,0,0,0|2,0,0]=3 1021 B12R1.125 C[C@H](O)CNc1cccnc1F 68e2310190b98f6e1ca376ac9038c5e6 [0,1,0,0,0,0|2,0,0]=3 1022 B12R1.125 C[C@H](O)CNc1cccnc1I c657793bf2063866d445ec116027f6ed [0,1,0,0,0,0|2,0,0]=3 1023 B12R1.125 C[C@H](O)CNc1ccn[nH]c1=O fec496ebd424281fa3a69b1c2d07b99b [0,1,0,0,0,0|3,0,0]=4 1024 B12R1.125 C[C@H](O)CNc1ccn[nH]c1=S c5b6b6c66cc8c5c530697c7bc1527eb5 [0,1,0,0,0,0|3,0,0]=4 1025 B12R1.125 C[C@H](O)CNc1ccncc1Br 92af10e064c44362771587d2b7ff6107 [0,1,0,0,0,0|2,0,0]=3 1026 B12R1.125 C[C@H](O)CNc1ccncc1Cl 9b089a2d85441f7d34ac33f385ca6751 [0,1,0,0,0,0|2,0,0]=3 1027 B12R1.125 C[C@H](O)CNc1ccncc1F 9765e9d1b5079beeb740b155725bbef9 [0,1,0,0,0,0|2,0,0]=3 1028 B12R1.125 C[C@H](O)CNc1ccncc1I f60f177f40280a6978365e392ba22e1f [0,1,0,0,0,0|2,0,0]=3 1029 B12R1.125 C[C@H](O)CNc1ccnnc1Br d2f2322b4c56cde568452f4ed8dd436a [0,1,0,0,0,0|3,0,0]=4 1030 B12R1.125 C[C@H](O)CNc1ccnnc1Cl cbeefe0c8e34a9a117a49f6c6aa6e664 [0,1,0,0,0,0|3,0,0]=4 1031 B12R1.125 C[C@H](O)CNc1cnccc1Br 1eee97065adebfcb7a8c4bf3f26df9b7 [0,1,0,0,0,0|2,0,0]=3 1032 B12R1.125 C[C@H](O)CNc1cnccc1Cl 66271cbefbaa5806a0c717c16dbd3a8a [0,1,0,0,0,0|2,0,0]=3 1033 B12R1.125 C[C@H](O)CNc1cnccc1F d336cae90794b05f39090268142b7564 [0,1,0,0,0,0|2,0,0]=3 1034 B12R1.125 C[C@H](O)CNc1cnccc1I 6504d61491ad824c9446f77b28b01dbf [0,1,0,0,0,0|2,0,0]=3 1035 B12R1.125 C[C@H](O)CNc1cnccc1S 02cce5a2da2ad67652071d500e1604b3 [0,1,0,0,0,0|2,0,0]=3 1036 B12R1.125 C[C@H](O)CNc1cncnc1Br 79f2298f54ab7ee82309dd62e4af118d [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.125 C[C@H](O)CNc1cncnc1Cl 94a61cb0abee7a3d16eaa7ebe72ea491 [0,1,0,0,0,0|3,0,0]=4 1038 B12R1.125 C[C@H](O)CNc1cncnc1I 625eb078929cd3cdfbd05f7fa78d7514 [0,1,0,0,0,0|3,0,0]=4 1039 B12R1.125 C[C@H](O)CNc1cnncc1Br dca6e78bbc44724a10d0eef458a3297b [0,1,0,0,0,0|3,0,0]=4 1040 B12R1.125 C[C@H](O)CNc1cnncc1Cl 4b97ff6f1d56ec39e537181979a1a5ee [0,1,0,0,0,0|3,0,0]=4 1041 B12R1.125 C[C@H](O)CNc1ncccc1Br 0cd2e15e8d36860b3e21dab3e9fca808 [0,1,0,0,0,0|2,0,0]=3 1042 B12R1.125 C[C@H](O)CNc1ncccc1Cl d053537d578a96648da276ead9a8082b [0,1,0,0,0,0|2,0,0]=3 1043 B12R1.125 C[C@H](O)CNc1ncccc1F 9167006b81bfb33786aa0bc27dcdeb3d [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.125 C[C@H](O)CNc1ncccc1I ddf72d40dbf0953fdd2ccbeedb79e867 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.125 C[C@H](O)CNc1nccnc1Br 2b2272ced237b2785135ce64b8f6f5f1 [0,1,0,0,0,0|3,0,0]=4 1046 B12R1.125 C[C@H](O)CNc1nccnc1Cl e2402ce8d2abb48f3c4ce46737c4dcb6 [0,1,0,0,0,0|3,0,0]=4 1047 B12R1.125 C[C@H](O)CNc1nccnc1I 3ab4f844d13dc351cbe56eb74040719a [0,1,0,0,0,0|3,0,0]=4 1048 B12R1.125 C[C@H](O)CNc1ncncc1Br 0272c8e1ea4a569345c45381f145f189 [0,1,0,0,0,0|3,0,0]=4 1049 B12R1.125 C[C@H](O)CNc1ncncc1Cl 2f8bf4bf5aec8dc2216df65fb4b8ef00 [0,1,0,0,0,0|3,0,0]=4 1050 B12R1.125 C[C@H](O)CNc1ncncc1F c0072eca7885b6054adffa3de4307858 [0,1,0,0,0,0|3,0,0]=4 1051 B12R1.125 C[C@H](O)CNc1ncncc1I ddc915dc5d4607dcd9aa0d3c50ebcb54 [0,1,0,0,0,0|3,0,0]=4 1052 B12R1.125 Cc1ccccc1CNC(C)C 2dd08d80be2d3e51d4d72fed96629045 [0,1,0,0,0,0|2,0,0]=3 1053 B12R1.125 Cc1ccccc1NCC(C)C 1586ab8e64ea906befcc8bbfad124462 [0,1,0,0,0,0|2,0,0]=3 1054 B12R1.125 Cc1ccccc1NCC(C)O 31ba569e9dedf1c2e9bd352e34766cab [0,1,0,0,0,0|1,0,0]=2 1055 B12R1.125 Cc1ccccc1NC[C@H](C)O f7931a4967f5c286879c882148e8589e [0,1,0,0,0,0|1,0,0]=2 1056 B12R1.125 Cc1ccccc1OCC(=O)O 790f516e7054b2979edc9dce7ff0f82c [0,1,0,0,0,0|2,0,1]=4 1057 B12R1.125 Cc1ccccc1OCC(C)C 364254b27b947c9392bf52594b3dc819 [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.125 Cc1ccccc1OCC(F)F ea55285ab166959395d050fdb79a3796 [0,1,0,0,0,0|3,0,0]=4 1059 B12R1.125 Cc1ccccc1OCN(C)C 352a0cc9d2eab6580b092e8e3f27bcfa [0,1,0,0,0,0|3,0,0]=4 1060 B12R1.125 Cc1cccnc1CNC(C)C 5c608f0fb577a4839d6566b1f8cde4a7 [0,1,0,0,0,0|3,0,0]=4 1061 B12R1.125 Cc1cccnc1COC(C)C d0c708a01280fb6f5078e1dd21e398c6 [0,1,0,0,0,0|3,0,0]=4 1062 B12R1.125 Cc1cccnc1NCC(C)C 282c02e5a453782598cad364ccee854e [0,1,0,0,0,0|3,0,0]=4 1063 B12R1.125 Cc1cccnc1NCC(C)O 35dc987bd3bce708549aef0f92ed4026 [0,1,0,0,0,0|2,0,0]=3 1064 B12R1.125 Cc1cccnc1NC[C@@H](C)O e4ef53946909e77e87e6f77348db81d0 [0,1,0,0,0,0|2,0,0]=3 1065 B12R1.125 Cc1cccnc1NC[C@H](C)O abae2ad82f4f1fc30603b3fd48fc0e6e [0,1,0,0,0,0|2,0,0]=3 1066 B12R1.125 Cc1cccnc1OCC(C)C 573ebe28edc295f62b8c3f4cb7f93024 [0,1,0,0,0,0|3,0,0]=4 1067 B12R1.125 Cc1ccncc1NCC(C)C 0a5762a41cc112098a2ea13f68f3fa1b [0,1,0,0,0,0|3,0,0]=4 1068 B12R1.125 Cc1ccncc1NCC(C)O 2f15eac49afabd0d03f0d0d2b1fae88b [0,1,0,0,0,0|2,0,0]=3 1069 B12R1.125 Cc1ccncc1NC[C@H](C)O d11181ba52bc4967fbb62fb9f25aaaec [0,1,0,0,0,0|2,0,0]=3 1070 B12R1.125 Cc1ccncc1OCC(C)C ac9c54ecd0093716288cc6cafb2156d2 [0,1,0,0,0,0|3,0,0]=4 1071 B12R1.125 Cc1ccnnc1NCC(C)O 94eef95e3cdfc01d10444dd7a9a11f6c [0,1,0,0,0,0|3,0,0]=4 1072 B12R1.125 Cc1ccnnc1NC[C@@H](C)O 581d76d91d7628bccd66c456ef25661f [0,1,0,0,0,0|3,0,0]=4 1073 B12R1.125 Cc1ccnnc1NC[C@H](C)O b232633cd438aa76d2ba534ac0c96e8e [0,1,0,0,0,0|3,0,0]=4 1074 B12R1.125 Cc1cnccc1CNC(C)C fd3c13616b7aae9904ff75b6dc257c3e [0,1,0,0,0,0|3,0,0]=4 1075 B12R1.125 Cc1cnccc1COC(C)C ff9355dbcebbc16b1ea6e10e3b3965f7 [0,1,0,0,0,0|3,0,0]=4 1076 B12R1.125 Cc1cnccc1NCC(C)C cd6d78737d148d2d51c403a22f81251b [0,1,0,0,0,0|3,0,0]=4 1077 B12R1.125 Cc1cnccc1NCC(C)O 8da7f2c22d500f598f370ef794c365dc [0,1,0,0,0,0|2,0,0]=3 1078 B12R1.125 Cc1cnccc1NC[C@@H](C)O 5e3e987cd021a1ce977cc61d2f69692c [0,1,0,0,0,0|2,0,0]=3 1079 B12R1.125 Cc1cnccc1NC[C@H](C)O 513d5e641422e9b49e2fdc54ce6f8720 [0,1,0,0,0,0|2,0,0]=3 1080 B12R1.125 Cc1cnccc1OCC(C)C c3a7d65c45f030d0d75c0ef6588ca42d [0,1,0,0,0,0|3,0,0]=4 1081 B12R1.125 Cc1cncnc1NCC(C)O 4d765ec78b022f6e9b85ca348665ca3d [0,1,0,0,0,0|3,0,0]=4 1082 B12R1.125 Cc1cncnc1NC[C@H](C)O a3739be52799ee6701d7b6dfe65e473f [0,1,0,0,0,0|3,0,0]=4 1083 B12R1.125 Cc1ncccc1CNC(C)C 9e75f3824b522bcdb845f9a2f15ad81b [0,1,0,0,0,0|3,0,0]=4 1084 B12R1.125 Cc1ncccc1COC(C)C a9da00623a47634eafd7b8cce50e0671 [0,1,0,0,0,0|3,0,0]=4 1085 B12R1.125 Cc1ncccc1NCC(C)C c7474db981f6e5e3e75f25e8d6317671 [0,1,0,0,0,0|3,0,0]=4 1086 B12R1.125 Cc1ncccc1NCC(C)O f0d41d8d2f35341a2155c14f483de914 [0,1,0,0,0,0|2,0,0]=3 1087 B12R1.125 Cc1ncccc1NC[C@H](C)O cf45cd1f3e8e64b21a2d69dce94d1b86 [0,1,0,0,0,0|2,0,0]=3 1088 B12R1.125 Cc1ncccc1OCC(C)C c4d92e6663fbe07004fa45eda68d9c29 [0,1,0,0,0,0|3,0,0]=4 1089 B12R1.125 Cc1nccnc1NCC(C)O c6fe08610e3144e5261435fd521f805d [0,1,0,0,0,0|3,0,0]=4 1090 B12R1.125 Cc1nccnc1NC[C@@H](C)O 787d4bf46d569ab2aca96e5d43300a12 [0,1,0,0,0,0|3,0,0]=4 1091 B12R1.125 Cc1nccnc1NC[C@H](C)O ef24cce204f0dffa88e8432611e18df9 [0,1,0,0,0,0|3,0,0]=4 1092 B12R1.125 Cc1ncncc1NCC(C)O 0c8bc0046f2aaf77bf00c5f48beeabbf [0,1,0,0,0,0|3,0,0]=4 1093 B12R1.125 Cc1ncncc1NC[C@H](C)O cdcda8311cdbc07b64b3949abb222a23 [0,1,0,0,0,0|3,0,0]=4 1094 B12R1.125 Cc1nnccc1NCC(C)O d15d931071b93245d7c82be394156251 [0,1,0,0,0,0|3,0,0]=4 1095 B12R1.125 Cc1nnccc1NC[C@@H](C)O 8b1a381c78f24f0752d69c1cd1eaffd8 [0,1,0,0,0,0|3,0,0]=4 1096 B12R1.125 Cc1nnccc1NC[C@H](C)O 217f26dcbb84da8155db255c8a2b1654 [0,1,0,0,0,0|3,0,0]=4 1097 B12R1.125 FC(F)CNc1ccccc1I 50b761e3721f8f4f8e26c50a5ea667b8 [0,1,0,0,0,0|3,0,0]=4 1098 B12R1.125 FC(F)COc1ccccc1Cl 382b274a03ab3699ef1ac83879764de2 [0,1,0,0,0,0|3,0,0]=4 1099 B12R1.125 FC(F)COc1ccccc1I 330b24980f29faa485ab99fddf0adfc2 [0,1,0,0,0,0|3,0,0]=4 1100 B12R1.125 FC(F)COc1ccccc1S a341dca9181a49ab9bfd20dd2026b5c6 [0,1,0,0,0,0|3,0,0]=4 1101 B12R1.125 Fc1ccccc1OCC(F)F 8b6fdf6f7cf770e1b925f8f7cba9a778 [0,1,0,0,0,0|3,0,0]=4 1102 B12R1.125 O=C(O)CNc1ccccc1Cl 72ceb1a4580a5539766aacebb9f5208d [0,1,0,0,0,0|2,0,1]=4 1103 B12R1.125 O=C(O)CNc1ccccc1F d5281a80776d04d3f57a32b19190a866 [0,1,0,0,0,0|2,0,1]=4 1104 B12R1.125 O=C(O)CNc1ccccc1I cf8eefbc4134617c6d29c73960171e74 [0,1,0,0,0,0|2,0,1]=4 1105 B12R1.125 O=C(O)COc1ccccc1Cl 9d360724e65d0a9db0c9ea2961f67e23 [0,1,0,0,0,0|2,0,1]=4 1106 B12R1.125 O=C(O)COc1ccccc1F c16281f1eb871a500227c73f62ec1311 [0,1,0,0,0,0|2,0,1]=4 1107 B12R1.125 O=C(O)COc1ccccc1I 4eb3edec4284410b4281af3af43661de [0,1,0,0,0,0|2,0,1]=4 1108 B12R1.226 C=C(C)CNc1cccc(c1)Br de1e76ede883aee85cbcf5339a7f8f25 [0,1,0,0,0,0|2,0,1]=4 1109 B12R1.226 C=C(C)CNc1cccc(c1)C 0f8e64f7c75a7af21f7e45d5d7851656 [0,1,0,0,0,0|2,0,1]=4 1110 B12R1.226 C=C(C)CNc1cccc(c1)Cl 34927e69a4522517159f6f62ef580aec [0,1,0,0,0,0|2,0,1]=4 1111 B12R1.226 C=C(C)CNc1cccc(c1)F e57cadd3f881c2b4adb44901fb57d5ad [0,1,0,0,0,0|2,0,1]=4 1112 B12R1.226 C=C(C)CNc1cccc(c1)I 26a6f07a6c1f09cf7f9c9ba1e22512f8 [0,1,0,0,0,0|2,0,1]=4 1113 B12R1.226 C=C(C)CNc1cccc(c1)S a2bb3bbb8593e8517ca2355f15a3da0d [0,1,0,0,0,0|2,0,1]=4 1114 B12R1.226 C=C(C)COc1cccc(c1)Br 270e0e9cec9d46a473b1bc9a8dcff70c [0,1,0,0,0,0|2,0,1]=4 1115 B12R1.226 C=C(C)COc1cccc(c1)C 9b7f8a285f7e1ff408aa84ad50ead534 [0,1,0,0,0,0|2,0,1]=4 1116 B12R1.226 C=C(C)COc1cccc(c1)Cl 4a4b3322147858a73bc9162445708e27 [0,1,0,0,0,0|2,0,1]=4 1117 B12R1.226 C=C(C)COc1cccc(c1)F 8939a2d27aa59e5b53fcf26c7a2c6fcb [0,1,0,0,0,0|2,0,1]=4 1118 B12R1.226 C=C(C)COc1cccc(c1)I c7035a9fe74ceb65e4fb7171f5f2ff65 [0,1,0,0,0,0|2,0,1]=4 1119 B12R1.226 C=C(C)COc1cccc(c1)S e177be72ee62f401e97990216337270e [0,1,0,0,0,0|2,0,1]=4 1120 B12R1.226 CC(=O)CNc1cccc(c1)C 33e32618ff2915ad648437dd5dce6cbd [0,1,0,0,0,0|1,0,2]=4 1121 B12R1.226 CC(=O)CNc1cccc(c1)F 1b1aeadc0fd3e934a52dcdc2c9f88ad3 [0,1,0,0,0,0|1,0,2]=4 1122 B12R1.226 CC(=O)CNc1cccc(c1)O 58381ec1392288e974af170ef04a232f [0,1,0,0,0,0|1,0,2]=4 1123 B12R1.226 CC(=O)CNc1cccc(c1)S d6d61e3f91394fcd573c1e423d8034bd [0,1,0,0,0,0|1,0,2]=4 1124 B12R1.226 CC(=O)NCc1cccc(c1)Br de12b91af74adce6491e684ee046a109 [0,1,0,0,0,0|1,0,2]=4 1125 B12R1.226 CC(=O)NCc1cccc(c1)C 2a897b53ee5ae4ee12831959238615eb [0,1,0,0,0,0|1,0,2]=4 1126 B12R1.226 CC(=O)NCc1cccc(c1)Cl 41ca11020cbae0363ca80ce2470c3eaa [0,1,0,0,0,0|1,0,2]=4 1127 B12R1.226 CC(=O)NCc1cccc(c1)F 01d6391ca1042cdbb55ba2e4912ec579 [0,1,0,0,0,0|1,0,2]=4 1128 B12R1.226 CC(=O)NCc1cccc(c1)I 5fa08dbe9ba4e88c69d843155ffafe98 [0,1,0,0,0,0|1,0,2]=4 1129 B12R1.226 CC(=O)NCc1cccc(c1)O c305a8cebe934755e5a41fc4c98fdcfd [0,1,0,0,0,0|1,0,2]=4 1130 B12R1.226 CC(C)CNc1cc(ccn1)Br 92e025e0f5a2b5ee3ca5c62e3c3e1dcc [0,1,0,0,0,0|3,0,0]=4 1131 B12R1.226 CC(C)CNc1cc(ccn1)Cl d2d6d3ca355190ba86f24e0a8858fa79 [0,1,0,0,0,0|3,0,0]=4 1132 B12R1.226 CC(C)CNc1cc(ccn1)F fefa2d67f700e4e010a470257d2f7319 [0,1,0,0,0,0|3,0,0]=4 1133 B12R1.226 CC(C)CNc1cc(ccn1)I 8615c250cd177f5b70fa7122f7be7ad9 [0,1,0,0,0,0|3,0,0]=4 1134 B12R1.226 CC(C)CNc1cc[nH]c(=S)c1 6fa2bce60248fa1a55a78ba1b0e6f048 [0,1,0,0,0,0|3,0,0]=4 1135 B12R1.226 CC(C)CNc1cccc(c1)Br 47f96ede91384a2957a9f738bcf7cbb7 [0,1,0,0,0,0|2,0,0]=3 1136 B12R1.226 CC(C)CNc1cccc(c1)Cl b77efea477419bad137ef23a5b33cfdb [0,1,0,0,0,0|2,0,0]=3 1137 B12R1.226 CC(C)CNc1cccc(c1)F 4fe892f19d398f74f696f31fe8fec9d4 [0,1,0,0,0,0|2,0,0]=3 1138 B12R1.226 CC(C)CNc1cccc(c1)I a713b158e8d2e866fe5954e27f6736a8 [0,1,0,0,0,0|2,0,0]=3 1139 B12R1.226 CC(C)CNc1cccc(c1)S d8df0c59c2a95482a973f3e4b2ca8288 [0,1,0,0,0,0|2,0,0]=3 1140 B12R1.226 CC(C)CNc1cccc(n1)Br 7cbe956768fbcb50152ecf7d1bbee778 [0,1,0,0,0,0|3,0,0]=4 1141 B12R1.226 CC(C)CNc1cccc(n1)Cl 275fe9b94c6e556eab72865e8ebbfc62 [0,1,0,0,0,0|3,0,0]=4 1142 B12R1.226 CC(C)CNc1cccc(n1)F 642e3c48e9102d05aba90e53da3173d7 [0,1,0,0,0,0|3,0,0]=4 1143 B12R1.226 CC(C)CNc1cccc(n1)I fa3c8c557f38affcb6d5ab100906efef [0,1,0,0,0,0|3,0,0]=4 1144 B12R1.226 CC(C)CNc1ccnc(c1)Br b7f6e7319a4a3a503754e67c3ba677af [0,1,0,0,0,0|3,0,0]=4 1145 B12R1.226 CC(C)CNc1ccnc(c1)Cl 38b36b62c659df80d9a95e292196ebce [0,1,0,0,0,0|3,0,0]=4 1146 B12R1.226 CC(C)CNc1ccnc(c1)F 1bd28f05743f77b2f662056e62d42111 [0,1,0,0,0,0|3,0,0]=4 1147 B12R1.226 CC(C)CNc1ccnc(c1)I 56c42639de0d700bc834f828eafaa370 [0,1,0,0,0,0|3,0,0]=4 1148 B12R1.226 CC(C)CNc1cncc(c1)Br e1d37862732b58ed0d46ad2b442fe3ba [0,1,0,0,0,0|3,0,0]=4 1149 B12R1.226 CC(C)CNc1cncc(c1)Cl a05988a39f568b9d29f394a1d8d672cd [0,1,0,0,0,0|3,0,0]=4 1150 B12R1.226 CC(C)CNc1cncc(c1)F de5f8ad0fa30543c8eba1d330606506b [0,1,0,0,0,0|3,0,0]=4 1151 B12R1.226 CC(C)CNc1cncc(c1)I 794da77beffd2e94bc5b6bbef9ad3be2 [0,1,0,0,0,0|3,0,0]=4 1152 B12R1.226 CC(C)COc1cc(ccn1)Br f34d9e1ee8531a4e480a1dab2ae0a766 [0,1,0,0,0,0|3,0,0]=4 1153 B12R1.226 CC(C)COc1cc(ccn1)Cl 876f25ea2e7c43d383155eac009ff9ac [0,1,0,0,0,0|3,0,0]=4 1154 B12R1.226 CC(C)COc1cc(ccn1)F f833658a0f7dc9066d84a60638d4b26c [0,1,0,0,0,0|3,0,0]=4 1155 B12R1.226 CC(C)COc1ccc[n+](c1)[O-] 7bd89c5d1cf67818819101f40977c4c5 [0,1,0,0,0,0|3,0,0]=4 1156 B12R1.226 CC(C)COc1cccc(=O)[nH]1 ad01ea304d19906638e478d39a2e0124 [0,1,0,0,0,0|3,0,0]=4 1157 B12R1.226 CC(C)COc1cccc(c1)Br 78b9893bdd66fbb7fd676a9f9d9a6b5c [0,1,0,0,0,0|2,0,0]=3 1158 B12R1.226 CC(C)COc1cccc(c1)Cl 17fc81f1248afd3345d318121f9a6be5 [0,1,0,0,0,0|2,0,0]=3 1159 B12R1.226 CC(C)COc1cccc(c1)F 952f6b6f6d9d7e5903334a6085f9ca2b [0,1,0,0,0,0|2,0,0]=3 1160 B12R1.226 CC(C)COc1cccc(c1)I 825de32ad6ba816c4a9b0b15d9f5b09d [0,1,0,0,0,0|2,0,0]=3 1161 B12R1.226 CC(C)COc1cccc(c1)S 1e2cf6d2ce302e2dbeb13d96800a69ca [0,1,0,0,0,0|2,0,0]=3 1162 B12R1.226 CC(C)COc1cccc(n1)Br b034d8c99d6faa3c6865be3de5d1442b [0,1,0,0,0,0|3,0,0]=4 1163 B12R1.226 CC(C)COc1cccc(n1)F 62d939db865eee29d08bcd45e7a528d8 [0,1,0,0,0,0|3,0,0]=4 1164 B12R1.226 CC(C)COc1ccnc(c1)Br ee849173a5a5c4349d085cdc486c9b3d [0,1,0,0,0,0|3,0,0]=4 1165 B12R1.226 CC(C)COc1ccnc(c1)Cl 679d6a5727deb8c64975da6c5556c5ff [0,1,0,0,0,0|3,0,0]=4 1166 B12R1.226 CC(C)COc1ccnc(c1)F 4a5d6ec80c2f156124d7c2b22754a005 [0,1,0,0,0,0|3,0,0]=4 1167 B12R1.226 CC(C)COc1cncc(c1)Br 4dedea8b7dbd937fa79e1f0cc22c2bb9 [0,1,0,0,0,0|3,0,0]=4 1168 B12R1.226 CC(C)COc1cncc(c1)Cl 59840de6f9ae77e1a87386e35ac7e867 [0,1,0,0,0,0|3,0,0]=4 1169 B12R1.226 CC(C)COc1cncc(c1)F 639ce80f70067fb9c55b302b07f69de6 [0,1,0,0,0,0|3,0,0]=4 1170 B12R1.226 CC(C)COc1cncc(c1)I f4bb8d8afe699062abc94a3155f1deaa [0,1,0,0,0,0|3,0,0]=4 1171 B12R1.226 CC(C)NCc1cc(ccn1)Br 8e80878aa33f629cad82435a04ceb908 [0,1,0,0,0,0|3,0,0]=4 1172 B12R1.226 CC(C)NCc1cc(ccn1)Cl 32e06332ef624538e73eda4739130df1 [0,1,0,0,0,0|3,0,0]=4 1173 B12R1.226 CC(C)NCc1cc[nH]c(=O)c1 a9d3b7042d066144e705a5aefd7af7a3 [0,1,0,0,0,0|3,0,0]=4 1174 B12R1.226 CC(C)NCc1ccc[n+](c1)[O-] 9ce22988e76f5dc081315f40c755b50e [0,1,0,0,0,0|3,0,0]=4 1175 B12R1.226 CC(C)NCc1cccc(c1)Br 1c3c944c566959e7eef7efc9a8c8251c [0,1,0,0,0,0|2,0,0]=3 1176 B12R1.226 CC(C)NCc1cccc(c1)Cl 9dbc94fad7d16f41b15b3aebc8ca545b [0,1,0,0,0,0|2,0,0]=3 1177 B12R1.226 CC(C)NCc1cccc(c1)F 3787b7b4f5a6fda7587bfa332950191c [0,1,0,0,0,0|2,0,0]=3 1178 B12R1.226 CC(C)NCc1cccc(c1)I d4cf7394a008619606fd5e038404d76e [0,1,0,0,0,0|2,0,0]=3 1179 B12R1.226 CC(C)NCc1cccc(n1)Br 92981f813a24d8d775368435b84eaa2a [0,1,0,0,0,0|3,0,0]=4 1180 B12R1.226 CC(C)NCc1cccc(n1)Cl aa1ee281695a9ad7738f13543541b870 [0,1,0,0,0,0|3,0,0]=4 1181 B12R1.226 CC(C)NCc1cccc(n1)F d5092e57e9a868be90528ab937b42467 [0,1,0,0,0,0|3,0,0]=4 1182 B12R1.226 CC(C)NCc1ccnc(c1)Br 4e955cd75cbd32217324fe06a5f62d16 [0,1,0,0,0,0|3,0,0]=4 1183 B12R1.226 CC(C)NCc1ccnc(c1)Cl c3a0e82e1c5d8e071306a6e2c2031c2a [0,1,0,0,0,0|3,0,0]=4 1184 B12R1.226 CC(C)NCc1ccnc(c1)F 855389c627a9d2d3a26eb81ea5120d6e [0,1,0,0,0,0|3,0,0]=4 1185 B12R1.226 CC(C)NCc1cncc(c1)Cl 1beac4c811c386bd882c5994a0320252 [0,1,0,0,0,0|3,0,0]=4 1186 B12R1.226 CC(C)NCc1cncc(c1)F e2080bbe71ccb9f6d9cbbca121cbe88f [0,1,0,0,0,0|3,0,0]=4 1187 B12R1.226 CC(C)OCc1cc(ccn1)Br 9932eefd1b7919be677ec4d9584bc46e [0,1,0,0,0,0|3,0,0]=4 1188 B12R1.226 CC(C)OCc1cc(ccn1)Cl 6dc5ed2046731d52a661701cd5d846d3 [0,1,0,0,0,0|3,0,0]=4 1189 B12R1.226 CC(C)OCc1cc(ccn1)F f1226fa30365aecf5c0399c4c40863a8 [0,1,0,0,0,0|3,0,0]=4 1190 B12R1.226 CC(C)OCc1cc(ccn1)I e74abf2de8912acb35da5a89ba1deed6 [0,1,0,0,0,0|3,0,0]=4 1191 B12R1.226 CC(C)OCc1cc[nH]c(=O)c1 85d906cbf41d5a15f8bc6c1395069ebe [0,1,0,0,0,0|3,0,0]=4 1192 B12R1.226 CC(C)OCc1ccc[n+](c1)[O-] d38acb4354d307073691091144cd615b [0,1,0,0,0,0|3,0,0]=4 1193 B12R1.226 CC(C)OCc1cccc(c1)Br 879562350b15275860c09e604131f21c [0,1,0,0,0,0|2,0,0]=3 1194 B12R1.226 CC(C)OCc1cccc(c1)Cl c3629f30972b60636a5bcff8690532c9 [0,1,0,0,0,0|2,0,0]=3 1195 B12R1.226 CC(C)OCc1cccc(c1)F 9a739aed0fdfe4226f0a5132088c54a0 [0,1,0,0,0,0|2,0,0]=3 1196 B12R1.226 CC(C)OCc1cccc(c1)I bf4c5f71e0f6d55a1580b32357b1183d [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.226 CC(C)OCc1cccc(n1)Br 35fa467c36dfbeeeb465ccad65fa5030 [0,1,0,0,0,0|3,0,0]=4 1198 B12R1.226 CC(C)OCc1cccc(n1)Cl 9428a85a94900d1b57fec614b8d404d0 [0,1,0,0,0,0|3,0,0]=4 1199 B12R1.226 CC(C)OCc1cccc(n1)F 97b1015e3c5a2a7f62c00be27b547db2 [0,1,0,0,0,0|3,0,0]=4 1200 B12R1.226 CC(C)OCc1cccc(n1)I bb69f335dbd7852f08b40a535b49fbee [0,1,0,0,0,0|3,0,0]=4 1201 B12R1.226 CC(C)OCc1ccnc(c1)Br a129fd8f23288caa4054dfc29ac5eb88 [0,1,0,0,0,0|3,0,0]=4 1202 B12R1.226 CC(C)OCc1ccnc(c1)Cl 1cde8935647c5b7477594cd8497eb539 [0,1,0,0,0,0|3,0,0]=4 1203 B12R1.226 CC(C)OCc1ccnc(c1)F 6b057a32826a40ca519dab472d51b7eb [0,1,0,0,0,0|3,0,0]=4 1204 B12R1.226 CC(C)OCc1cncc(c1)Br ae9940374847da64ff378c9e72639058 [0,1,0,0,0,0|3,0,0]=4 1205 B12R1.226 CC(C)OCc1cncc(c1)Cl a8d8ad9bc31d1803aaf9b8722356b9ab [0,1,0,0,0,0|3,0,0]=4 1206 B12R1.226 CC(C)OCc1cncc(c1)F 9f506b2078438f04c43df9245dc018b1 [0,1,0,0,0,0|3,0,0]=4 1207 B12R1.226 CC(C)OCc1cncc(c1)I 4b26f759d15ef95a86ae863dc2ee2fb0 [0,1,0,0,0,0|3,0,0]=4 1208 B12R1.226 CC(O)CNc1cc(ccn1)Br 4eb75113648cbcdd9f085f4cb97ba67f [0,1,0,0,0,0|2,0,0]=3 1209 B12R1.226 CC(O)CNc1cc(ccn1)Cl 2f5be7214cdb8b3e284b1eb1ed5ee7f5 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.226 CC(O)CNc1cc(ccn1)F 21f5483da5ae45e7d097182623f22a69 [0,1,0,0,0,0|2,0,0]=3 1211 B12R1.226 CC(O)CNc1cc(ccn1)I e88beb584feee4f1bf0fa29e79faf809 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.226 CC(O)CNc1cc(cnn1)Br 888f26521393825b95116a696d653f84 [0,1,0,0,0,0|3,0,0]=4 1213 B12R1.226 CC(O)CNc1cc(cnn1)Cl 0e9319fab4d929dbf651d2cdc938f329 [0,1,0,0,0,0|3,0,0]=4 1214 B12R1.226 CC(O)CNc1cc(ncn1)Br bdda0e368d176ad04e1d699866232a60 [0,1,0,0,0,0|3,0,0]=4 1215 B12R1.226 CC(O)CNc1cc(ncn1)Cl 1f6e54092fd3f693c15c07bcc3f1ffd1 [0,1,0,0,0,0|3,0,0]=4 1216 B12R1.226 CC(O)CNc1cc(ncn1)F a71c21948f87260a41be9843836398d5 [0,1,0,0,0,0|3,0,0]=4 1217 B12R1.226 CC(O)CNc1cc(ncn1)I 132cbc72684e796186114e477bf0620f [0,1,0,0,0,0|3,0,0]=4 1218 B12R1.226 CC(O)CNc1cc[nH]c(=O)n1 1440b7a33a2adb7cead598a97b48cbf4 [0,1,0,0,0,0|3,0,0]=4 1219 B12R1.226 CC(O)CNc1cc[nH]c(=S)c1 675d40e4efe7cad1b51fee02575cee92 [0,1,0,0,0,0|2,0,0]=3 1220 B12R1.226 CC(O)CNc1cccc(c1)Br 1313cc150d07e3249eb16f742927aba5 [0,1,0,0,0,0|1,0,0]=2 1221 B12R1.226 CC(O)CNc1cccc(c1)Cl b0b36293e53ebea3215e5b365b1c91a1 [0,1,0,0,0,0|1,0,0]=2 1222 B12R1.226 CC(O)CNc1cccc(c1)F 7b51f8f85220316ed6f71fbb6c6e04a1 [0,1,0,0,0,0|1,0,0]=2 1223 B12R1.226 CC(O)CNc1cccc(c1)I e3b39e215b46b137d14817575c01ba24 [0,1,0,0,0,0|1,0,0]=2 1224 B12R1.226 CC(O)CNc1cccc(c1)S 78e49f113d0630c078debe2e470f3646 [0,1,0,0,0,0|1,0,0]=2 1225 B12R1.226 CC(O)CNc1cccc(n1)Br 600a21101ec147af960b049dc357cb45 [0,1,0,0,0,0|2,0,0]=3 1226 B12R1.226 CC(O)CNc1cccc(n1)Cl 6249d33464a0922906315c0826fdb5fa [0,1,0,0,0,0|2,0,0]=3 1227 B12R1.226 CC(O)CNc1cccc(n1)F 1d15f0d9b31cdbefc2079c301be686b8 [0,1,0,0,0,0|2,0,0]=3 1228 B12R1.226 CC(O)CNc1cccc(n1)I 7cc58b0d323c56e7f4787fe1a4fc323f [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.226 CC(O)CNc1ccnc(c1)Br dfd126cba0eb1d2e070d8a03732e582a [0,1,0,0,0,0|2,0,0]=3 1230 B12R1.226 CC(O)CNc1ccnc(c1)Cl b44bac36c5e0c498f5a79e32ffd90ca8 [0,1,0,0,0,0|2,0,0]=3 1231 B12R1.226 CC(O)CNc1ccnc(c1)F 32fd0709675178143ebd3e328bc6c4f0 [0,1,0,0,0,0|2,0,0]=3 1232 B12R1.226 CC(O)CNc1ccnc(c1)I 67eb1e4018e55de61bae6b4a9eaff9b7 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.226 CC(O)CNc1ccnc(n1)Br b1d9d5fc2900cf81df8a87fc805a8b03 [0,1,0,0,0,0|3,0,0]=4 1234 B12R1.226 CC(O)CNc1ccnc(n1)Cl 62b3b2336dad305112f42d526bacff94 [0,1,0,0,0,0|3,0,0]=4 1235 B12R1.226 CC(O)CNc1ccnc(n1)F 9795421cded406df3b46cb00670bc275 [0,1,0,0,0,0|3,0,0]=4 1236 B12R1.226 CC(O)CNc1ccnc(n1)S 5b7205285a92d6c3d392f2f73e23d24e [0,1,0,0,0,0|3,0,0]=4 1237 B12R1.226 CC(O)CNc1cn[nH]c(=O)c1 dc036fbeb4787da84278288aee236deb [0,1,0,0,0,0|3,0,0]=4 1238 B12R1.226 CC(O)CNc1cncc(c1)Br fc8eb3052bf1ddf413f1b8865c1db6e3 [0,1,0,0,0,0|2,0,0]=3 1239 B12R1.226 CC(O)CNc1cncc(c1)Cl 4a8053a285dce96c427cf3e32cf583b6 [0,1,0,0,0,0|2,0,0]=3 1240 B12R1.226 CC(O)CNc1cncc(c1)F cb6b848bcd5792e0288b2cef34b25331 [0,1,0,0,0,0|2,0,0]=3 1241 B12R1.226 CC(O)CNc1cncc(c1)I a60ccf3153cdfd1a71cfabf6e4af740c [0,1,0,0,0,0|2,0,0]=3 1242 B12R1.226 CC(O)CNc1cncc(n1)Br 33f1a478d8cc5ce347621abfd2874687 [0,1,0,0,0,0|3,0,0]=4 1243 B12R1.226 CC(O)CNc1cncc(n1)Cl 8cab8eccaa3e550304b77b1cb5af6a07 [0,1,0,0,0,0|3,0,0]=4 1244 B12R1.226 CC(O)CNc1cncc(n1)F 47d55a68f70eb49a4c542cd72f36a420 [0,1,0,0,0,0|3,0,0]=4 1245 B12R1.226 CC(O)CNc1cnnc(c1)Cl 5b994ced50021bfd5fb0958e74d483f9 [0,1,0,0,0,0|3,0,0]=4 1246 B12R1.226 CC(O)CNc1cnnc(c1)F 1f0b46055c69425c40d12a443bdc9bb1 [0,1,0,0,0,0|3,0,0]=4 1247 B12R1.226 CC(O)CNc1nccc(=O)[nH]1 21513092a3ad5fcc74a8c4892edca595 [0,1,0,0,0,0|3,0,0]=4 1248 B12R1.226 CC(O)CNc1nccc(n1)Br 09a7b2c73576d28648408c3644c0ccce [0,1,0,0,0,0|3,0,0]=4 1249 B12R1.226 CC(O)CNc1nccc(n1)Cl c7ea86216e25467ed2bbbd41e6dafd32 [0,1,0,0,0,0|3,0,0]=4 1250 B12R1.226 CC(O)CNc1nccc(n1)F ff3fc83d0f40ad1207e13b30ce7f50bf [0,1,0,0,0,0|3,0,0]=4 1251 B12R1.226 CC(O)CNc1nccc(n1)I 3479f9c91cdd0978ac5b8031c7ea8532 [0,1,0,0,0,0|3,0,0]=4 1252 B12R1.226 CC(O)CNc1nccc(n1)S a84c318f5d3a04cf95532469a4a12771 [0,1,0,0,0,0|3,0,0]=4 1253 B12R1.226 CN(C)CNc1cccc(c1)Br a9db52ec4d18e43fd5f8052a16d9b2f5 [0,1,0,0,0,0|3,0,0]=4 1254 B12R1.226 CN(C)CNc1cccc(c1)Cl b91ebc3860602b7d435fbc25bba120c0 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.226 CN(C)CNc1cccc(c1)F fabc161cc8935ed63e4bf8f7340eeb1b [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.226 CN(C)CNc1cccc(c1)I 73b573d1bee26bd55249f0d50a8760e1 [0,1,0,0,0,0|3,0,0]=4 1257 B12R1.226 CN(C)CNc1cccc(c1)S 8b408beb2995a69d831e59e74ceea8c7 [0,1,0,0,0,0|3,0,0]=4 1258 B12R1.226 CN(C)COc1cccc(c1)Br 58f441b0ca3290c7f2d4537ec22a4d7a [0,1,0,0,0,0|3,0,0]=4 1259 B12R1.226 CN(C)COc1cccc(c1)Cl a81bc88b54f5005184b834642d9d3f86 [0,1,0,0,0,0|3,0,0]=4 1260 B12R1.226 CN(C)COc1cccc(c1)F 58b8398ab333a20e468588e9a1f2ba62 [0,1,0,0,0,0|3,0,0]=4 1261 B12R1.226 CN(C)COc1cccc(c1)I d82dc4d136e4cc08f2e0c8e654992b65 [0,1,0,0,0,0|3,0,0]=4 1262 B12R1.226 CN(C)COc1cccc(c1)S bcd4099b9a40b45e56f4b34dede1ec79 [0,1,0,0,0,0|3,0,0]=4 1263 B12R1.226 C[C@@H](O)CNc1cc(ccn1)Br fcf580093fbbd52f043e03905b045f63 [0,1,0,0,0,0|2,0,0]=3 1264 B12R1.226 C[C@@H](O)CNc1cc(ccn1)F 7c627a34d8002e71d16001b63a9cbf8d [0,1,0,0,0,0|2,0,0]=3 1265 B12R1.226 C[C@@H](O)CNc1cc(ccn1)I f7b4921822a28b03f652dcfb546b0d56 [0,1,0,0,0,0|2,0,0]=3 1266 B12R1.226 C[C@@H](O)CNc1cc(cnn1)Br a8d5808180712bb8015528e2f65aee73 [0,1,0,0,0,0|3,0,0]=4 1267 B12R1.226 C[C@@H](O)CNc1cc(ncn1)Br bc17912079b69edd1202f4f14c2a1717 [0,1,0,0,0,0|3,0,0]=4 1268 B12R1.226 C[C@@H](O)CNc1cc(ncn1)Cl a54b728ee300da3129634995f1c5fe2c [0,1,0,0,0,0|3,0,0]=4 1269 B12R1.226 C[C@@H](O)CNc1cc(ncn1)F 73bd91f8ac89fddc895b7004db4fa4a9 [0,1,0,0,0,0|3,0,0]=4 1270 B12R1.226 C[C@@H](O)CNc1cc(ncn1)I ba185986f11c97793978c7c43e80b49d [0,1,0,0,0,0|3,0,0]=4 1271 B12R1.226 C[C@@H](O)CNc1cc[nH]c(=O)n1 821d105066072cce4ee7fdf2c1871353 [0,1,0,0,0,0|3,0,0]=4 1272 B12R1.226 C[C@@H](O)CNc1cc[nH]c(=S)c1 166c739d44b867455eff0bcc231dc4e5 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.226 C[C@@H](O)CNc1cccc(c1)Br 7f47c7e325073bbe1ddb7b38bff8b932 [0,1,0,0,0,0|1,0,0]=2 1274 B12R1.226 C[C@@H](O)CNc1cccc(c1)Cl 8246dcd52dcd9ed0dbef7338a7f127b3 [0,1,0,0,0,0|1,0,0]=2 1275 B12R1.226 C[C@@H](O)CNc1cccc(c1)F e736be531156c2b7166ca634fb8a70ce [0,1,0,0,0,0|1,0,0]=2 1276 B12R1.226 C[C@@H](O)CNc1cccc(c1)I 4db71a0fd089913b0233a85b00396803 [0,1,0,0,0,0|1,0,0]=2 1277 B12R1.226 C[C@@H](O)CNc1ccnc(c1)Br 89856843cbe45518810f43c5a9c13e4b [0,1,0,0,0,0|2,0,0]=3 1278 B12R1.226 C[C@@H](O)CNc1ccnc(c1)Cl 8e87aed991c96e126489801232854c34 [0,1,0,0,0,0|2,0,0]=3 1279 B12R1.226 C[C@@H](O)CNc1ccnc(c1)F 70ff665587c887d1afa5505f70b20c92 [0,1,0,0,0,0|2,0,0]=3 1280 B12R1.226 C[C@@H](O)CNc1ccnc(c1)I eacb0e15ace996ea8fe319421d09d312 [0,1,0,0,0,0|2,0,0]=3 1281 B12R1.226 C[C@@H](O)CNc1ccnc(n1)Br f992e34b2db4b891f8a71daa9e779e95 [0,1,0,0,0,0|3,0,0]=4 1282 B12R1.226 C[C@@H](O)CNc1ccnc(n1)Cl e2bd0d7b12d0801b5c79f8aae2e96cf4 [0,1,0,0,0,0|3,0,0]=4 1283 B12R1.226 C[C@@H](O)CNc1ccnc(n1)F 78882f218232a3cae5707fbae5a0e309 [0,1,0,0,0,0|3,0,0]=4 1284 B12R1.226 C[C@@H](O)CNc1cn[nH]c(=O)c1 f1e9db9731d9abce6708f56a79118d98 [0,1,0,0,0,0|3,0,0]=4 1285 B12R1.226 C[C@@H](O)CNc1cncc(c1)Cl 9c2d006a345a336b57e335fe828be629 [0,1,0,0,0,0|2,0,0]=3 1286 B12R1.226 C[C@@H](O)CNc1cncc(c1)F 3b97406ad533c2c660aa09de33e1cbfa [0,1,0,0,0,0|2,0,0]=3 1287 B12R1.226 C[C@@H](O)CNc1cncc(c1)I 6ee4ec67faef77ee55359e9b44f7ed3d [0,1,0,0,0,0|2,0,0]=3 1288 B12R1.226 C[C@@H](O)CNc1cnnc(c1)Cl 7d0d78e979642ef7808e5eb98c98ba7c [0,1,0,0,0,0|3,0,0]=4 1289 B12R1.226 C[C@@H](O)CNc1nccc(=O)[nH]1 92ca9c651120329a81ee0704e43579b3 [0,1,0,0,0,0|3,0,0]=4 1290 B12R1.226 C[C@@H](O)CNc1nccc(n1)Br 92aa515f21878022c87a18469eaae846 [0,1,0,0,0,0|3,0,0]=4 1291 B12R1.226 C[C@@H](O)CNc1nccc(n1)F 3d00121cb1ca9c24fcfad5d4ccc83214 [0,1,0,0,0,0|3,0,0]=4 1292 B12R1.226 C[C@H](O)CNc1cc(ccn1)Br d536e481fe4c90fc963dc23b065e9b43 [0,1,0,0,0,0|2,0,0]=3 1293 B12R1.226 C[C@H](O)CNc1cc(ccn1)Cl 0909db7c52624d39930d8f407ae9ee98 [0,1,0,0,0,0|2,0,0]=3 1294 B12R1.226 C[C@H](O)CNc1cc(ccn1)F a0ed839dbcb0777e4867b4fd0827e01f [0,1,0,0,0,0|2,0,0]=3 1295 B12R1.226 C[C@H](O)CNc1cc(ccn1)I bd8f803a572755a40ed5e2557333ed9a [0,1,0,0,0,0|2,0,0]=3 1296 B12R1.226 C[C@H](O)CNc1cc(cnn1)Br 848d96a1dfb974b900cecfc96ea87be5 [0,1,0,0,0,0|3,0,0]=4 1297 B12R1.226 C[C@H](O)CNc1cc(cnn1)Cl 30a5143cb5621ada39e53c34dc8d9d67 [0,1,0,0,0,0|3,0,0]=4 1298 B12R1.226 C[C@H](O)CNc1cc(ncn1)Br 1adea30bb73162080864d4b52b547ae3 [0,1,0,0,0,0|3,0,0]=4 1299 B12R1.226 C[C@H](O)CNc1cc(ncn1)Cl 042c20d1548b9ffc98fd9d45a39d9fc0 [0,1,0,0,0,0|3,0,0]=4 1300 B12R1.226 C[C@H](O)CNc1cc(ncn1)F 7f3155beda5eff4e11dcb2f794110dae [0,1,0,0,0,0|3,0,0]=4 1301 B12R1.226 C[C@H](O)CNc1cc(ncn1)I 2333c4a65335cc36b5d1ff83c346f9cd [0,1,0,0,0,0|3,0,0]=4 1302 B12R1.226 C[C@H](O)CNc1cc[nH]c(=O)n1 0d965656fe81280b8bfd158366282eca [0,1,0,0,0,0|3,0,0]=4 1303 B12R1.226 C[C@H](O)CNc1cc[nH]c(=S)c1 e0c9c561956b4f8f54b14facdaaab781 [0,1,0,0,0,0|2,0,0]=3 1304 B12R1.226 C[C@H](O)CNc1cccc(c1)Br a49c8030ae048c6affea28034df1531a [0,1,0,0,0,0|1,0,0]=2 1305 B12R1.226 C[C@H](O)CNc1cccc(c1)Cl 2370f8fa6414cdc9dd596258b1f50ab7 [0,1,0,0,0,0|1,0,0]=2 1306 B12R1.226 C[C@H](O)CNc1cccc(c1)F 81dcc6ac1cc4da1e70d103a206dd18af [0,1,0,0,0,0|1,0,0]=2 1307 B12R1.226 C[C@H](O)CNc1cccc(c1)I f90f80969bfd6ec1423e67f3dd3ecafa [0,1,0,0,0,0|1,0,0]=2 1308 B12R1.226 C[C@H](O)CNc1cccc(c1)S 0421b4bf0fcc630d12159982ed02f691 [0,1,0,0,0,0|1,0,0]=2 1309 B12R1.226 C[C@H](O)CNc1cccc(n1)Br ea4df55d31e5320ffa1278f605e2a2f2 [0,1,0,0,0,0|2,0,0]=3 1310 B12R1.226 C[C@H](O)CNc1cccc(n1)Cl 8745136b6a3f41e6e727975a1b08a5e1 [0,1,0,0,0,0|2,0,0]=3 1311 B12R1.226 C[C@H](O)CNc1cccc(n1)F 05bd3522c8043b7e1283f8782a1976cc [0,1,0,0,0,0|2,0,0]=3 1312 B12R1.226 C[C@H](O)CNc1cccc(n1)I 8127a06ebfe0b430aa70b036cb2f20ce [0,1,0,0,0,0|2,0,0]=3 1313 B12R1.226 C[C@H](O)CNc1ccnc(c1)Br eaf2f0f30c28d3d50b4ae34a86fa945b [0,1,0,0,0,0|2,0,0]=3 1314 B12R1.226 C[C@H](O)CNc1ccnc(c1)Cl 099ad97284595dd0b37ea8b0859c3418 [0,1,0,0,0,0|2,0,0]=3 1315 B12R1.226 C[C@H](O)CNc1ccnc(c1)F 79efc6c69fe2cdfb7a782d68e764551f [0,1,0,0,0,0|2,0,0]=3 1316 B12R1.226 C[C@H](O)CNc1ccnc(c1)I 23a347fd05b294388e97d2fdeb63c013 [0,1,0,0,0,0|2,0,0]=3 1317 B12R1.226 C[C@H](O)CNc1ccnc(n1)Br b13960a4f0b8fed7e3f1c290867cc31f [0,1,0,0,0,0|3,0,0]=4 1318 B12R1.226 C[C@H](O)CNc1ccnc(n1)Cl 08dfde2f7837e0b7bf9d5f227434abb2 [0,1,0,0,0,0|3,0,0]=4 1319 B12R1.226 C[C@H](O)CNc1ccnc(n1)F 69f00fb57ef07292a545efe9c4cc85cd [0,1,0,0,0,0|3,0,0]=4 1320 B12R1.226 C[C@H](O)CNc1ccnc(n1)S 38b8c427af08b791cb1572f54ee4af57 [0,1,0,0,0,0|3,0,0]=4 1321 B12R1.226 C[C@H](O)CNc1cn[nH]c(=O)c1 a8f326cd21bfc0bb0d23141a12064c1f [0,1,0,0,0,0|3,0,0]=4 1322 B12R1.226 C[C@H](O)CNc1cncc(c1)Br 695ae5760ac9c2c44e85378edfdae2ba [0,1,0,0,0,0|2,0,0]=3 1323 B12R1.226 C[C@H](O)CNc1cncc(c1)Cl 76e576e540f9c330176b3eb0b27ae183 [0,1,0,0,0,0|2,0,0]=3 1324 B12R1.226 C[C@H](O)CNc1cncc(c1)F 380df7038475fed73e414ddfc49473f4 [0,1,0,0,0,0|2,0,0]=3 1325 B12R1.226 C[C@H](O)CNc1cncc(c1)I 9097c77693e818acf3b1d0abefbd3802 [0,1,0,0,0,0|2,0,0]=3 1326 B12R1.226 C[C@H](O)CNc1cncc(n1)Br 451fc0834473310156486ed98936b921 [0,1,0,0,0,0|3,0,0]=4 1327 B12R1.226 C[C@H](O)CNc1cncc(n1)Cl a712814fae992b30c8e05cace850ffab [0,1,0,0,0,0|3,0,0]=4 1328 B12R1.226 C[C@H](O)CNc1cncc(n1)F 2ab95e41d5f8560d00da915943925824 [0,1,0,0,0,0|3,0,0]=4 1329 B12R1.226 C[C@H](O)CNc1cnnc(c1)Cl 499ccadceae1e51df3178d44d33090db [0,1,0,0,0,0|3,0,0]=4 1330 B12R1.226 C[C@H](O)CNc1cnnc(c1)F 21c7e930ba0fff532d3f0e45c0845a2d [0,1,0,0,0,0|3,0,0]=4 1331 B12R1.226 C[C@H](O)CNc1nccc(=O)[nH]1 5c040f301524e94cfb6233167fb3b91b [0,1,0,0,0,0|3,0,0]=4 1332 B12R1.226 C[C@H](O)CNc1nccc(n1)Br 53b7ee4305c6d01f4028d6bf7b896534 [0,1,0,0,0,0|3,0,0]=4 1333 B12R1.226 C[C@H](O)CNc1nccc(n1)Cl 661f4280a0431d51fa35496500f5b90f [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.226 C[C@H](O)CNc1nccc(n1)F 125243d0a9f91cca9ab1dd6bd57a37d1 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.226 C[C@H](O)CNc1nccc(n1)I 63529a2b8b06f65626b0f3d882987286 [0,1,0,0,0,0|3,0,0]=4 1336 B12R1.226 C[C@H](O)CNc1nccc(n1)S 6fc30bf959881c48a6509e58cd3f976d [0,1,0,0,0,0|3,0,0]=4 1337 B12R1.226 Cc1cc(ccn1)CNC(C)C 85e45bfc3c207c3638bd5e2c8259642e [0,1,0,0,0,0|3,0,0]=4 1338 B12R1.226 Cc1cc(ccn1)COC(C)C 01df0a32ec3b2c2a15bb77b36a0acd44 [0,1,0,0,0,0|3,0,0]=4 1339 B12R1.226 Cc1cc(ccn1)NCC(C)C 3fdba0792b03b1655ba47f333666e4eb [0,1,0,0,0,0|3,0,0]=4 1340 B12R1.226 Cc1cc(ccn1)NCC(C)O 2a2144a7c838a20ceb594a2ca539ddfe [0,1,0,0,0,0|2,0,0]=3 1341 B12R1.226 Cc1cc(ccn1)NC[C@@H](C)O 3b9a6c7a62350d8700326020ad0ef7e4 [0,1,0,0,0,0|2,0,0]=3 1342 B12R1.226 Cc1cc(ccn1)NC[C@H](C)O 7e7b9809785d6a953208ca1e8d34f1d4 [0,1,0,0,0,0|2,0,0]=3 1343 B12R1.226 Cc1cc(ccn1)OCC(C)C b5eb16a2ea6a09b6bd3df3b0ea4e9788 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.226 Cc1cc(ncn1)NCC(C)O 8497a29766b89fc57ce688cd42497101 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.226 Cc1cc(ncn1)NC[C@@H](C)O 74c8b943752a9b18e4c2081cdf8b7a9e [0,1,0,0,0,0|3,0,0]=4 1346 B12R1.226 Cc1cc(ncn1)NC[C@H](C)O af75c9ce220d219b574267b94fd90282 [0,1,0,0,0,0|3,0,0]=4 1347 B12R1.226 Cc1cccc(c1)CNC(C)C 409614b24510f7aec784aa24e2d29ef2 [0,1,0,0,0,0|2,0,0]=3 1348 B12R1.226 Cc1cccc(c1)COC(C)C ac14bed03bb08492372420f353b99c52 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.226 Cc1cccc(c1)NCC(=O)O 70649742ccf1605dab9ff92fff0b0048 [0,1,0,0,0,0|2,0,1]=4 1350 B12R1.226 Cc1cccc(c1)NCC(C)C 4d0c9075dc953be03bb974637f4ee812 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.226 Cc1cccc(c1)NCC(C)O 6ec20ee81cd6564f027fad7c9046635a [0,1,0,0,0,0|1,0,0]=2 1352 B12R1.226 Cc1cccc(c1)NCC(F)F 81d0e59adb7d407ab4b688185206bf1c [0,1,0,0,0,0|3,0,0]=4 1353 B12R1.226 Cc1cccc(c1)NCN(C)C f60eeb0a22d178d4adde33f0517fefb6 [0,1,0,0,0,0|3,0,0]=4 1354 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O b7ae52517241209d5ba2933489a9a337 [0,1,0,0,0,0|1,0,0]=2 1355 B12R1.226 Cc1cccc(c1)NC[C@H](C)O 1a909dc0c3197c842cec2d227814451e [0,1,0,0,0,0|1,0,0]=2 1356 B12R1.226 Cc1cccc(c1)OCC(=O)O 786604a4d9b6b5a28358b6494e3779c8 [0,1,0,0,0,0|2,0,1]=4 1357 B12R1.226 Cc1cccc(c1)OCC(C)C a573d64150ab49ed03c4bef1c7ab030b [0,1,0,0,0,0|2,0,0]=3 1358 B12R1.226 Cc1cccc(c1)OCC(F)F 66a6ee211418aa2b98b10f48a814c6c2 [0,1,0,0,0,0|3,0,0]=4 1359 B12R1.226 Cc1cccc(c1)OCN(C)C c8f371c842f7e29ba772757895b8b2d4 [0,1,0,0,0,0|3,0,0]=4 1360 B12R1.226 Cc1cccc(n1)CNC(C)C 193c586811e8cd7a5541b12d9c26503c [0,1,0,0,0,0|3,0,0]=4 1361 B12R1.226 Cc1cccc(n1)COC(C)C a8c2bc277290339bbc2222ef578b71a7 [0,1,0,0,0,0|3,0,0]=4 1362 B12R1.226 Cc1cccc(n1)NCC(C)C 690c1bd26f6de02ab0577df7d32212ca [0,1,0,0,0,0|3,0,0]=4 1363 B12R1.226 Cc1cccc(n1)NCC(C)O ab7a789a6298d797de7936cb64d58021 [0,1,0,0,0,0|2,0,0]=3 1364 B12R1.226 Cc1cccc(n1)NC[C@H](C)O 53ec20956490ee5f75534d2e8b2a9312 [0,1,0,0,0,0|2,0,0]=3 1365 B12R1.226 Cc1cccc(n1)OCC(C)C af20de35cd01146532ced994d2c6db13 [0,1,0,0,0,0|3,0,0]=4 1366 B12R1.226 Cc1ccnc(c1)CNC(C)C 99e05fe61e0126c3de92bf40ba9c20cd [0,1,0,0,0,0|3,0,0]=4 1367 B12R1.226 Cc1ccnc(c1)COC(C)C 9cf6c87bb1aeb8968300667a319e43b5 [0,1,0,0,0,0|3,0,0]=4 1368 B12R1.226 Cc1ccnc(c1)NCC(C)C 30516c36b70bbf57d4d6b22c37df495e [0,1,0,0,0,0|3,0,0]=4 1369 B12R1.226 Cc1ccnc(c1)NCC(C)O 8a949be7710933378e8e032c40724451 [0,1,0,0,0,0|2,0,0]=3 1370 B12R1.226 Cc1ccnc(c1)NC[C@@H](C)O 6f8908c07b9e740bad3fded4ee895786 [0,1,0,0,0,0|2,0,0]=3 1371 B12R1.226 Cc1ccnc(c1)NC[C@H](C)O c15c721a5b484d333e68b6cb07a3c97f [0,1,0,0,0,0|2,0,0]=3 1372 B12R1.226 Cc1ccnc(c1)OCC(C)C 321f3a5a160bdb50bed95c845440f7c6 [0,1,0,0,0,0|3,0,0]=4 1373 B12R1.226 Cc1ccnc(n1)NCC(C)O 85784da4666b11af57c307a488db48c7 [0,1,0,0,0,0|3,0,0]=4 1374 B12R1.226 Cc1ccnc(n1)NC[C@@H](C)O d4df92075580b9ba9c58a7ee39ddf9bc [0,1,0,0,0,0|3,0,0]=4 1375 B12R1.226 Cc1ccnc(n1)NC[C@H](C)O 8742172e1eed24b29a4627191dc9f56e [0,1,0,0,0,0|3,0,0]=4 1376 B12R1.226 Cc1cncc(c1)COC(C)C e26c34959a591f33a0f083cd95d6cc72 [0,1,0,0,0,0|3,0,0]=4 1377 B12R1.226 Cc1cncc(c1)NCC(C)C b2696ec0572661c2397dd77e1bb90c39 [0,1,0,0,0,0|3,0,0]=4 1378 B12R1.226 Cc1cncc(c1)NCC(C)O b294a425e1b2496a5059b3d30e4ae850 [0,1,0,0,0,0|2,0,0]=3 1379 B12R1.226 Cc1cncc(c1)NC[C@@H](C)O 826a5a2883e032112179a32ef6422c41 [0,1,0,0,0,0|2,0,0]=3 1380 B12R1.226 Cc1cncc(c1)NC[C@H](C)O 4d98f7f58f71e7537b2412a834bb3b7c [0,1,0,0,0,0|2,0,0]=3 1381 B12R1.226 Cc1cncc(c1)OCC(C)C 6bdf0e37100da7cddffb0edcd615d3ff [0,1,0,0,0,0|3,0,0]=4 1382 B12R1.226 Cc1cncc(n1)NCC(C)O cd24f6840b8446c24787af5d1aaecade [0,1,0,0,0,0|3,0,0]=4 1383 B12R1.226 Cc1cncc(n1)NC[C@H](C)O 14132f2e8cd1418960960db1ab71ff3f [0,1,0,0,0,0|3,0,0]=4 1384 B12R1.226 Cc1cnnc(c1)NCC(C)O 11d1ab13f2d12113f91cacfb046c6082 [0,1,0,0,0,0|3,0,0]=4 1385 B12R1.226 Cc1cnnc(c1)NC[C@H](C)O b9ad09a01d53c99345768ca1f4990b3b [0,1,0,0,0,0|3,0,0]=4 1386 B12R1.226 Cc1nccc(n1)NCC(C)O 38cc9c3ea32e79ec48dcbd18a9d39e6f [0,1,0,0,0,0|3,0,0]=4 1387 B12R1.226 Cc1nccc(n1)NC[C@@H](C)O fdd675f9e510be77d717c72ea72f0f53 [0,1,0,0,0,0|3,0,0]=4 1388 B12R1.226 Cc1nccc(n1)NC[C@H](C)O 4a15a8dd613e514a21e579bd5b6a4e73 [0,1,0,0,0,0|3,0,0]=4 1389 B12R1.226 FC(F)CNc1cccc(c1)Br d877c23a1d6ba60ff8904263c1a819b6 [0,1,0,0,0,0|3,0,0]=4 1390 B12R1.226 FC(F)CNc1cccc(c1)Cl d98b436985610892d442e099120f728b [0,1,0,0,0,0|3,0,0]=4 1391 B12R1.226 FC(F)CNc1cccc(c1)I 59025a6ef57d092585c3717a1ddf478a [0,1,0,0,0,0|3,0,0]=4 1392 B12R1.226 FC(F)CNc1cccc(c1)S 8e4a7dbc1d4053b292b9267a06c0d9ae [0,1,0,0,0,0|3,0,0]=4 1393 B12R1.226 FC(F)COc1cccc(c1)Br 69a3d8505535c71714505d7f0a635e9f [0,1,0,0,0,0|3,0,0]=4 1394 B12R1.226 FC(F)COc1cccc(c1)Cl bffa38f16f538d728edcbef1d06807f3 [0,1,0,0,0,0|3,0,0]=4 1395 B12R1.226 FC(F)COc1cccc(c1)I 32fe9c2e854075b8dd4e9027b6eb14ae [0,1,0,0,0,0|3,0,0]=4 1396 B12R1.226 FC(F)COc1cccc(c1)S 5da16e673d95b37aa3279b95aabf3254 [0,1,0,0,0,0|3,0,0]=4 1397 B12R1.226 Fc1cccc(c1)NCC(F)F ee44dc9504499f6317ca45940546246d [0,1,0,0,0,0|3,0,0]=4 1398 B12R1.226 Fc1cccc(c1)OCC(F)F 7ad3e8299688bad64f8263fad8bc51f5 [0,1,0,0,0,0|3,0,0]=4 1399 B12R1.226 O=C(O)CNc1cccc(c1)Br 9278e11a40bd0c998d6708a7d8d19cec [0,1,0,0,0,0|2,0,1]=4 1400 B12R1.226 O=C(O)CNc1cccc(c1)Cl 8c61f8028006442c9d2649d1f957fd7d [0,1,0,0,0,0|2,0,1]=4 1401 B12R1.226 O=C(O)CNc1cccc(c1)F b6b54d04a07f3216d0a04238f5fba3c1 [0,1,0,0,0,0|2,0,1]=4 1402 B12R1.226 O=C(O)CNc1cccc(c1)I 3367bac10174c84517b534b631544e4f [0,1,0,0,0,0|2,0,1]=4 1403 B12R1.226 O=C(O)CNc1cccc(c1)S fc8191f1550f855ffd0b67405c376481 [0,1,0,0,0,0|2,0,1]=4 1404 B12R1.226 O=C(O)COc1cccc(c1)Br e18aee2a75703ec32ea93890efc3e7f5 [0,1,0,0,0,0|2,0,1]=4 1405 B12R1.226 O=C(O)COc1cccc(c1)Cl 4a28b0a0b2d269e23d85b0a61be6911d [0,1,0,0,0,0|2,0,1]=4 1406 B12R1.226 O=C(O)COc1cccc(c1)F cb013db402aed90397054cf12c2b0390 [0,1,0,0,0,0|2,0,1]=4 1407 B12R1.226 O=C(O)COc1cccc(c1)I 804ac6165bd2b28fc1b6fc8e01f174fa [0,1,0,0,0,0|2,0,1]=4 1408 B12R1.226 O=C(O)COc1cccc(c1)S bd8deb7f8bafa7f0f3024aeb5dcbddd5 [0,1,0,0,0,0|2,0,1]=4 1409 B12R1.891 CC(C)(C)CNc1ccccc1 866f0c000f012585c56b315997251133 [0,1,0,0,0,0|2,0,0]=3 1410 B12R1.891 CC(C)(C)CNc1ccccn1 825c8dcede6c8cbf2339b0b7c7d45e1b [0,1,0,0,0,0|3,0,0]=4 1411 B12R1.891 CC(C)(C)CNc1cccnc1 908c5da89c2bdb3f315cf4e834504505 [0,1,0,0,0,0|3,0,0]=4 1412 B12R1.891 CC(C)(C)CNc1ccncc1 c7826f86c82660c7ba287f44da463481 [0,1,0,0,0,0|3,0,0]=4 1413 B12R1.891 CC(C)(C)COc1ccccn1 421375595ba5ea063d0532b9ff9e5f28 [0,1,0,0,0,0|3,0,0]=4 1414 B12R1.891 CC(C)(C)COc1cccnc1 2989d2b8310518a29f31f2404a03d6a4 [0,1,0,0,0,0|3,0,0]=4 1415 B12R1.891 CC(C)(C)COc1ccncc1 5e962ee509d4432d5bb927399ceaf559 [0,1,0,0,0,0|3,0,0]=4 1416 B12R1.891 CC(C)(C)NCc1ccccc1 7201c1c22c9fa04427965e3124c0e1d6 [0,1,0,0,0,0|2,0,0]=3 1417 B12R1.891 CC(C)(C)NCc1ccccn1 0f37804617340fc0b75b0242b29a7097 [0,1,0,0,0,0|3,0,0]=4 1418 B12R1.891 CC(C)(C)NCc1cccnc1 e3606661dec28ebc372974ee9287b956 [0,1,0,0,0,0|3,0,0]=4 1419 B12R1.891 CC(C)(F)CNc1ccccc1 b0242d6e7e1a9c8e30a280dd6d0dab3d [0,1,0,0,0,0|2,0,0]=3 1420 B12R1.891 CC(C)(F)CNc1ccccn1 fe8adf03c8a78edde4b29e3da49427a0 [0,1,0,0,0,0|3,0,0]=4 1421 B12R1.891 CC(C)(F)CNc1cccnc1 84d6970d460bb9620346fcd71e6d6cff [0,1,0,0,0,0|3,0,0]=4 1422 B12R1.891 CC(C)(F)CNc1ccncc1 f43d2174ce529b3faed4f33e7967e657 [0,1,0,0,0,0|3,0,0]=4 1423 B12R1.891 CC(C)(F)COc1ccccn1 d504348a9adfc7199e45e6e9e59837a8 [0,1,0,0,0,0|3,0,0]=4 1424 B12R1.891 CC(C)(F)COc1cccnc1 850aad1ca43014e96566b0a1863b780e [0,1,0,0,0,0|3,0,0]=4 1425 B12R1.891 CC(C)(F)COc1ccncc1 7a538294d43fe85e5079e51e34b00043 [0,1,0,0,0,0|3,0,0]=4 1426 B12R1.891 CC(C)(O)CNc1ccccc1 f100447f9f947bdcf8b3cb6f09283ae4 [0,1,0,0,0,0|1,0,0]=2 1427 B12R1.891 CC(C)(O)CNc1ccccn1 cf6912f661b3c01ae5b5537abe66db21 [0,1,0,0,0,0|2,0,0]=3 1428 B12R1.891 CC(C)(O)CNc1cccnc1 71ecef7e440c1fa3a1e1bd94fd82e500 [0,1,0,0,0,0|2,0,0]=3 1429 B12R1.891 CC(C)(O)CNc1cccnn1 7c8c2786f98a35d7b59489f754fe08a7 [0,1,0,0,0,0|3,0,0]=4 1430 B12R1.891 CC(C)(O)CNc1ccncc1 1bed3845b568ed539a76759be48529f6 [0,1,0,0,0,0|2,0,0]=3 1431 B12R1.891 CC(C)(O)CNc1ccncn1 5894abb58b5a59abec771d82d3ee119d [0,1,0,0,0,0|3,0,0]=4 1432 B12R1.891 CC(C)(O)CNc1ccnnc1 c673cd24cf2155bc33ecc2cfb1c64002 [0,1,0,0,0,0|3,0,0]=4 1433 B12R1.891 CC(C)(O)CNc1cnccn1 5f6fad78c4f9acccca78e396e21f481c [0,1,0,0,0,0|3,0,0]=4 1434 B12R1.891 CC(C)(O)CNc1cncnc1 6105284bcf8941061efe79403378a974 [0,1,0,0,0,0|3,0,0]=4 1435 B12R1.891 CC(C)(O)CNc1ncccn1 b06a01a58904da3df936ce403c75b256 [0,1,0,0,0,0|3,0,0]=4 1436 B12R1.891 CC(C)(O)COc1ccccn1 fa2c8c78bdb754150fd86ac274e44221 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.891 CC(C)(O)COc1cccnc1 a9de8f0e83ed901e6844ff45d51f92a8 [0,1,0,0,0,0|2,0,0]=3 1438 B12R1.891 CC(C)(O)COc1ccncc1 c2673769e1a688b3690e43a7ffdece7f [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.891 CC(C)(O)COc1ccnnc1 0629f6eef12880d2a18a2ec4473c1bb7 [0,1,0,0,0,0|3,0,0]=4 1440 B12R1.891 CC(C)(O)COc1cnccn1 6a16fcde8baf31ebc1dc609c106714f0 [0,1,0,0,0,0|3,0,0]=4 1441 B12R1.891 CC(C)(O)COc1cncnc1 412cfc0b8e7990190e94339b73870f77 [0,1,0,0,0,0|3,0,0]=4 1442 B12R1.891 CC(C)(O)COc1ncccn1 d572e850ed4470d4cae6412ce4bf2e1c [0,1,0,0,0,0|3,0,0]=4 1443 B12R1.891 CC(F)(F)CNc1ccccc1 082b0f20fce6d46920eb2d5531e00578 [0,1,0,0,0,0|2,0,0]=3 1444 B12R1.891 CC(F)(F)CNc1ccccn1 75b3d4f73b12b1b55e58e25c1ab8c77e [0,1,0,0,0,0|3,0,0]=4 1445 B12R1.891 CC(F)(F)CNc1cccnc1 f5d103f74c34330848ce191a2459d5f0 [0,1,0,0,0,0|3,0,0]=4 1446 B12R1.891 CC(F)(F)CNc1ccncc1 ead51d252387f646b601600e8ec6f1eb [0,1,0,0,0,0|3,0,0]=4 1447 B12R1.891 CC(F)(F)COc1ccccn1 fae94620e4df48fe84d8e40fd8069ebf [0,1,0,0,0,0|3,0,0]=4 1448 B12R1.891 CC(F)(F)COc1cccnc1 f30e2cb5ef51ad469935b8d6f12eba8a [0,1,0,0,0,0|3,0,0]=4 1449 B12R1.891 CC(F)(F)COc1ccncc1 cf14736d1ba8a120d17b19c664d2c6d3 [0,1,0,0,0,0|3,0,0]=4 1450 B12R1.891 CS(=O)(=O)CNc1ccccc1 b140962be5bd942e91165cc653df790b [0,1,0,0,0,0|2,0,1]=4 1451 B12R1.891 FC(F)(F)CNc1ccccc1 f45959f2448e685ddbe28f96778505f8 [0,1,0,0,0,0|3,0,0]=4 1452 B12R1.891 O=S(=O)(O)CNc1ccccc1 6677b656bffd58623a47a06fa430ba01 [0,1,0,0,0,0|3,0,0]=4 1453 B10R0.4 C=C/C=C/CCNCC(C)O 6f5777434eaec8485d022c26883a6127 [0,0,1,0,0,0|1,0,2]=4 1454 B10R0.4 C=C/C=C/CCNC[C@@H](C)O 01d6a2cf66d4ae70023382f872a80395 [0,0,1,0,0,0|1,0,2]=4 1455 B10R0.4 C=C/C=C/CCNC[C@H](C)O 8ee38f098af8f95b7ec5d0e9b083f7c3 [0,0,1,0,0,0|1,0,2]=4 1456 B10R0.78 C=C/C=C/C(=O)NCC(C)C a3844a0ec5abaf6eda8ca48c5fdbfdb4 [0,0,1,0,0,0|3,0,0]=4 1457 B10R0.78 C=C/C=C/C(=O)NCC(C)O bbfdb9c065d31cd9d2d615cb81a494da [0,0,1,0,0,0|2,0,0]=3 1458 B10R0.78 C=C/C=C/C(=O)NC[C@@H](C)O 438e256d415f262435d70cba80271310 [0,0,1,0,0,0|2,0,0]=3 1459 B10R0.78 C=C/C=C/C(=O)NC[C@H](C)O 06b8be728d252d132bd72b2b526349ca [0,0,1,0,0,0|2,0,0]=3 1460 B10R0.78 C=C/C=C\C(=O)NCC(C)C 1dd9352c50ac5e6f8f3809df03aeda40 [0,0,1,0,0,0|3,0,0]=4 1461 B10R0.78 C=C/C=C\C(=O)NCC(C)O 466d6cbc66a97699c5dfad7306d5da0e [0,0,1,0,0,0|2,0,0]=3 1462 B10R0.78 C=C/C=C\C(=O)NC[C@@H](C)O cda76130ff67e68446c72dc8c0506ce3 [0,0,1,0,0,0|2,0,0]=3 1463 B10R0.78 C=C/C=C\C(=O)NC[C@H](C)O 2b570d30f671d5be22e6bdfb7ad14282 [0,0,1,0,0,0|2,0,0]=3 1464 B10R0.78 C=CC=CC(=O)NCC(C)C 9ee529ef15651cf2b8b82a031e37bc05 [0,0,1,0,0,0|3,0,0]=4 1465 B10R0.78 C=CC=CC(=O)NCC(C)O 555260ab24ab95e54b82dcfd8581b226 [0,0,1,0,0,0|2,0,0]=3 1466 B10R0.78 C=CC=CC(=O)NC[C@@H](C)O 78810557d579033d0001ff46f1ae9555 [0,0,1,0,0,0|2,0,0]=3 1467 B10R0.78 C=CC=CC(=O)NC[C@H](C)O c8c447e557dc2540a3504288c1090056 [0,0,1,0,0,0|2,0,0]=3 1468 B12R2.11 CC1CC1Nc2ccccc2 6c2b1ed9451679c2c2b0f3748602bd6d [0,0,0,1,0,0|2,0,0]=3 1469 B12R2.11 CC1CC1Nc2cccnc2 e0f55178f08b4b2b54d9d876d97d2290 [0,0,0,1,0,0|3,0,0]=4 1470 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccc2 25c07123a823d9ea2969aff7da72cef4 [0,0,0,1,0,0|2,0,0]=3 1471 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccn2 fc41faec2161d9bc088f35169f0fc9e1 [0,0,0,1,0,0|3,0,0]=4 1472 B12R2.11 F[C@@H]1C[C@@H]1Nc2cccnc2 9a55f17e12e7bd55a0d9204d46e602d2 [0,0,0,1,0,0|3,0,0]=4 1473 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccncc2 e875be7aa53cc8868d0dc6f2280dccb1 [0,0,0,1,0,0|3,0,0]=4 1474 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccc2 b0efbced164dabbe532e6255951097b4 [0,0,0,1,0,0|2,0,0]=3 1475 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccn2 fc17ffe1e9ad6aa28e2159d2a121a181 [0,0,0,1,0,0|3,0,0]=4 1476 B12R2.11 F[C@@H]1C[C@H]1Nc2cccnc2 0d6be40ecda6b776d8730416c6199b26 [0,0,0,1,0,0|3,0,0]=4 1477 B12R2.11 F[C@@H]1C[C@H]1Nc2ccncc2 9a1a1d0be717c0e6f1c430f271f30434 [0,0,0,1,0,0|3,0,0]=4 1478 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccc2 e610ffc6a467ed241d6c7f91606b201b [0,0,0,1,0,0|2,0,0]=3 1479 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccn2 59b89bc513bfcbe6b29399fe485506d9 [0,0,0,1,0,0|3,0,0]=4 1480 B12R2.11 F[C@H]1C[C@@H]1Nc2cccnc2 8475542138490fb913b76b598d12ad5e [0,0,0,1,0,0|3,0,0]=4 1481 B12R2.11 F[C@H]1C[C@@H]1Nc2ccncc2 f538efd1a15bc37e881d8b371d907da9 [0,0,0,1,0,0|3,0,0]=4 1482 B12R2.2057 c1cc(ccn1)COC2CC2 da3247f4bbaea1ae4c65fbee8045d76d [0,0,0,1,0,0|3,0,0]=4 1483 B12R2.2057 c1cc(ccn1)NCC2CC2 849918da92a0c0498a218bfd0f4ee058 [0,0,0,1,0,0|3,0,0]=4 1484 B12R2.2057 c1cc(ccn1)OCC2CC2 c00853e2b14f5a610ec89d61eadf6a66 [0,0,0,1,0,0|3,0,0]=4 1485 B12R2.2057 c1ccc(cc1)CNC2CC2 0722218fcfefdcb8b8f0e8dc60326858 [0,0,0,1,0,0|2,0,0]=3 1486 B12R2.2057 c1ccc(cc1)COC2CC2 4f6efb1abdd284b3ec5fbe724b10a332 [0,0,0,1,0,0|2,0,0]=3 1487 B12R2.2057 c1ccc(cc1)NCC2CC2 14003b7d6af1ed476ecb017534f042ad [0,0,0,1,0,0|2,0,0]=3 1488 B12R2.2057 c1ccc(nc1)CNC2CC2 072625a4614190be9cbf10388fa5861b [0,0,0,1,0,0|3,0,0]=4 1489 B12R2.2057 c1ccc(nc1)COC2CC2 abde439d2a0ddaaa61aa7afca3b1da4d [0,0,0,1,0,0|3,0,0]=4 1490 B12R2.2057 c1ccc(nc1)NCC2CC2 a4bb220accadbaa000279249a4daf5cf [0,0,0,1,0,0|3,0,0]=4 1491 B12R2.2057 c1ccc(nc1)OCC2CC2 05ede210d3ae4cc4a2c3f7154d855ada [0,0,0,1,0,0|3,0,0]=4 1492 B12R2.2057 c1cncc(c1)CNC2CC2 de74061854556603c3b7f6c7b31bcca1 [0,0,0,1,0,0|3,0,0]=4 1493 B12R2.2057 c1cncc(c1)COC2CC2 4f1f4bbe9c5cccaf786a2469b1a1b939 [0,0,0,1,0,0|3,0,0]=4 1494 B12R2.2057 c1cncc(c1)NCC2CC2 116af6c2af65d4c96c0cfbf27938bace [0,0,0,1,0,0|3,0,0]=4 1495 B12R2.2057 c1cncc(c1)OCC2CC2 6e3515b4fef3884dcd9b31bc8938b0e1 [0,0,0,1,0,0|3,0,0]=4 1496 B10R1.18 CC(C)Nc1ccccc1 678b2595d663b993cd638fb4df86366a [0,0,0,0,1,0|2,0,0]=3 1497 B10R1.18 CC(C)Nc1ccccn1 8f41ba2831fdc97ef841b17526dcf604 [0,0,0,0,1,0|3,0,0]=4 1498 B10R1.18 CC(C)Nc1cccnc1 b32b013363863cea153240b96e97c19f [0,0,0,0,1,0|3,0,0]=4 1499 B10R1.18 CC(C)Nc1ccncc1 ed919cf6533ea85c87fe5a974cf5c4b4 [0,0,0,0,1,0|3,0,0]=4 1500 B10R1.18 CC(C)Oc1ccccn1 0855bdc27823287e98107cda25a8e4de [0,0,0,0,1,0|3,0,0]=4 1501 B10R1.18 CC(C)Oc1cccnc1 2d5fbf8b6573bcaaa6ad1437daf348fa [0,0,0,0,1,0|3,0,0]=4 1502 B10R1.18 CC(C)Oc1ccncc1 fcbd1de824cfd0b7040632344868de57 [0,0,0,0,1,0|3,0,0]=4 1503 B10R1.66 CC(C)CNc1cccs1 67dcb3c9cca955e96d2162e1f77ad9d3 [0,0,0,0,1,0|3,0,0]=4 1504 B10R1.66 CC(C)CNc1ccoc1 92d7f688a6d1f51c3400fe3a15833da1 [0,0,0,0,1,0|3,0,0]=4 1505 B10R1.66 CC(C)CNc1ccsc1 7cc22761b2fabc54b5196a591e8fc4c9 [0,0,0,0,1,0|3,0,0]=4 1506 B10R1.66 CC(C)COc1ccco1 9a23c54afcd88900faea26a95d44c122 [0,0,0,0,1,0|3,0,0]=4 1507 B10R1.66 CC(C)COc1cccs1 c3a2875732f90e39bc97fc0388c7ee98 [0,0,0,0,1,0|3,0,0]=4 1508 B10R1.66 CC(C)COc1ccsc1 374674527614a256faaff2fdb87d8e4a [0,0,0,0,1,0|3,0,0]=4 1509 B10R1.66 CC(C)NCc1cc[nH]c1 cf294f8cbcc8fb18d9d4535f2cee2d84 [0,0,0,0,1,0|3,0,0]=4 1510 B10R1.66 CC(C)NCc1ccc[nH]1 c8f8c41b508c6a9e408dd2699920d8e8 [0,0,0,0,1,0|3,0,0]=4 1511 B10R1.66 CC(C)NCc1ccco1 e2693f4935da627db7fd450f0265afc1 [0,0,0,0,1,0|3,0,0]=4 1512 B10R1.66 CC(C)NCc1cccs1 542111b118739a23c6a7d49f5267f947 [0,0,0,0,1,0|3,0,0]=4 1513 B10R1.66 CC(C)NCc1ccoc1 9c3bf90c5e383bd61420059098037cce [0,0,0,0,1,0|3,0,0]=4 1514 B10R1.66 CC(C)NCc1ccsc1 2b46aa805fc411dd211b8b601290d377 [0,0,0,0,1,0|3,0,0]=4 1515 B10R1.66 CC(C)OCc1cc[nH]c1 a9c2c1df43af3abc4356f95c5822d5bb [0,0,0,0,1,0|3,0,0]=4 1516 B10R1.66 CC(C)OCc1ccc[nH]1 4dddb07a03dc24f89786ddb418b6d01e [0,0,0,0,1,0|3,0,0]=4 1517 B10R1.66 CC(C)OCc1ccco1 e50c3d4d785de91a25589c3a50142414 [0,0,0,0,1,0|3,0,0]=4 1518 B10R1.66 CC(C)OCc1cccs1 3e503778417dd68d76dc700a03f16b0b [0,0,0,0,1,0|3,0,0]=4 1519 B10R1.66 CC(C)OCc1ccsc1 08ab63ccd9d7e1df75755ae18202bc9e [0,0,0,0,1,0|3,0,0]=4 1520 B10R1.66 CC(O)CCN1CC=CC1 0680373d40399833ded96b9cb4078576 [0,0,0,0,1,0|1,0,2]=4 1521 B10R1.66 CC(O)CNc1cc[nH]n1 653d6b33a71baec5f27f6a356c6e83ef [0,0,0,0,1,0|3,0,0]=4 1522 B10R1.66 CC(O)CNc1cccs1 60380a00e499cd7119533a566202f141 [0,0,0,0,1,0|2,0,0]=3 1523 B10R1.66 CC(O)CNc1ccno1 fc2cce262388ca7c62de70655fa7a177 [0,0,0,0,1,0|3,0,0]=4 1524 B10R1.66 CC(O)CNc1ccns1 2e3a4fe0c5f370c37dbe9fdb2b500b6b [0,0,0,0,1,0|3,0,0]=4 1525 B10R1.66 CC(O)CNc1ccoc1 6769b47f7a32452deeeae8f17954196d [0,0,0,0,1,0|2,0,0]=3 1526 B10R1.66 CC(O)CNc1ccon1 fb90ef6465516ef4256048fee10e0bb3 [0,0,0,0,1,0|3,0,0]=4 1527 B10R1.66 CC(O)CNc1ccsc1 db72e8a684aaa0a0a16c796e8ccb2de6 [0,0,0,0,1,0|2,0,0]=3 1528 B10R1.66 CC(O)CNc1cn[nH]c1 7a74f403f33334b5d58c55e06358c0a5 [0,0,0,0,1,0|3,0,0]=4 1529 B10R1.66 CC(O)CNc1cncs1 527df7bc8c01cd78e946898e99807fb8 [0,0,0,0,1,0|3,0,0]=4 1530 B10R1.66 CC(O)CNc1cnoc1 1167d41cc36e799b229359ee9ec1a100 [0,0,0,0,1,0|3,0,0]=4 1531 B10R1.66 CC(O)CNc1cnsc1 5dcb4d8b9ba314e7ccf41696c818d419 [0,0,0,0,1,0|3,0,0]=4 1532 B10R1.66 CC(O)CNc1cocn1 04eb8269d84a26043e6a4811a28eb1ff [0,0,0,0,1,0|3,0,0]=4 1533 B10R1.66 CC(O)CNc1cscn1 2df5e61fe02e5bba147de85cb26f9ae1 [0,0,0,0,1,0|3,0,0]=4 1534 B10R1.66 CC(O)CNc1ncc[nH]1 2fd7eae1aa9773de07657c16a6dda0d4 [0,0,0,0,1,0|3,0,0]=4 1535 B10R1.66 CC(O)CNc1ncco1 af71533ef2de2cec8c8cad0a710fca7a [0,0,0,0,1,0|3,0,0]=4 1536 B10R1.66 CC(O)CNc1nccs1 00b56e817f0000f48a9dbb7b78e2a2b9 [0,0,0,0,1,0|3,0,0]=4 1537 B10R1.66 C[C@@H](O)CNc1cc[nH]n1 4962241ad3bde547d03c8cd703ee5cb0 [0,0,0,0,1,0|3,0,0]=4 1538 B10R1.66 C[C@@H](O)CNc1ccno1 f3d1a2517810a4c57fee3d52d5b1f63a [0,0,0,0,1,0|3,0,0]=4 1539 B10R1.66 C[C@@H](O)CNc1ccns1 ec62a2b5da1a9a3b0ea19a5844572dd2 [0,0,0,0,1,0|3,0,0]=4 1540 B10R1.66 C[C@@H](O)CNc1ccoc1 fd903a674ccc7cf00a948503b0af1e4d [0,0,0,0,1,0|2,0,0]=3 1541 B10R1.66 C[C@@H](O)CNc1ccsc1 fedd9adc74acc64a3f97271f932d33d3 [0,0,0,0,1,0|2,0,0]=3 1542 B10R1.66 C[C@@H](O)CNc1cn[nH]c1 510338f6da1475922072305c5aa38f52 [0,0,0,0,1,0|3,0,0]=4 1543 B10R1.66 C[C@@H](O)CNc1cnoc1 bbc77e6cb4c132d2fefa54c74d737beb [0,0,0,0,1,0|3,0,0]=4 1544 B10R1.66 C[C@@H](O)CNc1cnsc1 78b0fdf6499373b13bbcbc849a1cd1e4 [0,0,0,0,1,0|3,0,0]=4 1545 B10R1.66 C[C@@H](O)CNc1cscn1 cedda5debe0db4e52eaeb30c07b40aec [0,0,0,0,1,0|3,0,0]=4 1546 B10R1.66 C[C@@H](O)CNc1ncc[nH]1 2f371776e5e64ad060e9c1c13575acbf [0,0,0,0,1,0|3,0,0]=4 1547 B10R1.66 C[C@@H](O)CNc1nccs1 81acd9a7ce0c73493f489bca1a71a310 [0,0,0,0,1,0|3,0,0]=4 1548 B10R1.66 C[C@H](O)CNc1cc[nH]n1 7d9f57f52c654584ce90502cbb57604c [0,0,0,0,1,0|3,0,0]=4 1549 B10R1.66 C[C@H](O)CNc1cccs1 50770c2e03ac9b3dc06cb895694b0084 [0,0,0,0,1,0|2,0,0]=3 1550 B10R1.66 C[C@H](O)CNc1ccno1 b567b272d6456f38b0c757b753177355 [0,0,0,0,1,0|3,0,0]=4 1551 B10R1.66 C[C@H](O)CNc1ccns1 aa6e4e12fa8afb63ab13fe820d70be5d [0,0,0,0,1,0|3,0,0]=4 1552 B10R1.66 C[C@H](O)CNc1ccoc1 4d244057da13584ca4afd3e1eba91d0e [0,0,0,0,1,0|2,0,0]=3 1553 B10R1.66 C[C@H](O)CNc1ccon1 ab6b6b2700dc3afe450988f993c60ab1 [0,0,0,0,1,0|3,0,0]=4 1554 B10R1.66 C[C@H](O)CNc1ccsc1 78de29156c9e729912982c390f56307c [0,0,0,0,1,0|2,0,0]=3 1555 B10R1.66 C[C@H](O)CNc1cn[nH]c1 31753e21608092ac4b698ac34e043be0 [0,0,0,0,1,0|3,0,0]=4 1556 B10R1.66 C[C@H](O)CNc1cncs1 51fe0070914369f516ff9d72cf160f25 [0,0,0,0,1,0|3,0,0]=4 1557 B10R1.66 C[C@H](O)CNc1cnoc1 6a98d63f38e981c15533842014483427 [0,0,0,0,1,0|3,0,0]=4 1558 B10R1.66 C[C@H](O)CNc1cnsc1 b5379815567ea5aaefe8ab366c3d8ba2 [0,0,0,0,1,0|3,0,0]=4 1559 B10R1.66 C[C@H](O)CNc1cocn1 f579b5f66780e00794fa6c6f2ff96b69 [0,0,0,0,1,0|3,0,0]=4 1560 B10R1.66 C[C@H](O)CNc1cscn1 8275318a266690cd932782ff41159b62 [0,0,0,0,1,0|3,0,0]=4 1561 B10R1.66 C[C@H](O)CNc1ncc[nH]1 84884ead1a8c77b23ab9a41877184fce [0,0,0,0,1,0|3,0,0]=4 1562 B10R1.66 C[C@H](O)CNc1ncco1 569a0fbf6aed9f8a7593b5734237721d [0,0,0,0,1,0|3,0,0]=4 1563 B10R1.66 C[C@H](O)CNc1nccs1 f960205417890178f2361a8d894134f2 [0,0,0,0,1,0|3,0,0]=4 1564 B12R1.252 C/C(=C/CNc1ccccc1)/I 0655b4b8bd1a651f428f8af38afb9805 [0,0,0,0,0,1|1,0,2]=4 1565 B12R1.252 C/C(=C\CNc1ccccc1)/Cl 03a2a67b224185dfa00dfc501ddc5144 [0,0,0,0,0,1|1,0,2]=4 1566 B12R1.252 C=C(Br)CNCc1ccccc1 9c1b05ca270d752c1d4010b95922e620 [0,0,0,0,0,1|1,0,2]=4 1567 B12R1.252 C=C(Br)COCc1ccccc1 03171f9a997e7b5e8cadd59a879b8b6c [0,0,0,0,0,1|1,0,2]=4 1568 B12R1.252 C=C(C)CCNc1ccccc1 6b5b9510ef6be8f5a83e582e3308e56d [0,0,0,0,0,1|1,0,1]=3 1569 B12R1.252 C=C(C)CCNc1ccccn1 5994b7e570337056fbe6b8ee68c83a74 [0,0,0,0,0,1|2,0,1]=4 1570 B12R1.252 C=C(C)CCNc1cccnc1 dcc89e34d299a787ec22fb495cec5588 [0,0,0,0,0,1|2,0,1]=4 1571 B12R1.252 C=C(C)CCNc1ccncc1 922d92a6de36274534be2ae1cfc3557f [0,0,0,0,0,1|2,0,1]=4 1572 B12R1.252 C=C(C)CCOc1ccccn1 b9dcf3d8853aa13bb161ef3e0a8cb2ac [0,0,0,0,0,1|2,0,1]=4 1573 B12R1.252 C=C(C)CCOc1cccnc1 d43cc30ba2b0fd5d44c99c3588da0768 [0,0,0,0,0,1|2,0,1]=4 1574 B12R1.252 C=C(C)CCOc1ccncc1 898536726fe290623b1b4e2f99fbff1d [0,0,0,0,0,1|2,0,1]=4 1575 B12R1.252 C=C(C)CNCc1ccccc1 5d90204cfd05ab0918bdacf95677a05b [0,0,0,0,0,1|1,0,1]=3 1576 B12R1.252 C=C(C)CNCc1ccccn1 788a85ae04da57a30dfed7c4f6861e88 [0,0,0,0,0,1|2,0,1]=4 1577 B12R1.252 C=C(C)CNCc1cccnc1 192e89945e3f944c819998a53866b100 [0,0,0,0,0,1|2,0,1]=4 1578 B12R1.252 C=C(C)CNCc1ccncc1 e4f63cc6fa926c0fb5bcf5ca7df3c639 [0,0,0,0,0,1|2,0,1]=4 1579 B12R1.252 C=C(C)COCc1ccccc1 f4499d14dd2f7bb4726f716f15e929df [0,0,0,0,0,1|1,0,1]=3 1580 B12R1.252 C=C(C)COCc1ccccn1 6969eb42119ffe7768529c61d80d21e6 [0,0,0,0,0,1|2,0,1]=4 1581 B12R1.252 C=C(C)COCc1cccnc1 b1309dd5e0e34a6f1f94f4da7e73dca6 [0,0,0,0,0,1|2,0,1]=4 1582 B12R1.252 C=C(C)COCc1ccncc1 59009e1728de50bbf4f23e46b346867c [0,0,0,0,0,1|2,0,1]=4 1583 B12R1.252 C=C(Cl)CNCc1ccccc1 d045578b64ad4263f98d93d0c0da8316 [0,0,0,0,0,1|1,0,2]=4 1584 B12R1.252 C=C(Cl)COCc1ccccc1 8ea87585e2ec6fc9c83af9159d3e33eb [0,0,0,0,0,1|1,0,2]=4 1585 B12R1.252 C=C(F)CNCc1ccccc1 e1a9166891b5eedd5de2496e23c16415 [0,0,0,0,0,1|1,0,2]=4 1586 B12R1.252 C=C(F)COCc1ccccc1 0270311e0993ffc2a11a2318afb6410f [0,0,0,0,0,1|1,0,2]=4 1587 B12R1.252 C=C(I)COCc1ccccc1 516dafeab05685e2cd864f8688136ad5 [0,0,0,0,0,1|1,0,2]=4 1588 B12R1.252 CC(=CCNc1ccccc1)C eb01c4541faf3d2e0c0e5ab3c7071819 [0,0,0,0,0,1|1,0,2]=4 1589 B12R1.252 CC(=CCNc1ccccc1)Cl f13a71d1d4148a74f0302cf2c11de8f3 [0,0,0,0,0,1|1,0,2]=4 1590 B12R1.252 CC(=CCNc1ccccc1)I ca45f16e4e3e563d8f77df266f95064c [0,0,0,0,0,1|1,0,2]=4 1591 B12R1.252 CC(=O)CCNc1ccccc1 9b0f0a0043bcfdd99ee44d3d72b922e5 [0,0,0,0,0,1|0,0,2]=3 1592 B12R1.252 CC(=O)CCNc1ccccn1 997919901794ee27201838f3f268a693 [0,0,0,0,0,1|1,0,2]=4 1593 B12R1.252 CC(=O)CCNc1cccnc1 d55d133f13b833b5bf8507a979c71c53 [0,0,0,0,0,1|1,0,2]=4 1594 B12R1.252 CC(=O)CCNc1ccncc1 bbf0d1b9e62272e08678140c87e735f6 [0,0,0,0,0,1|1,0,2]=4 1595 B12R1.252 CC(=O)CCOc1ccccn1 f0d6b589e7af691479be38abbd6bcdf3 [0,0,0,0,0,1|1,0,2]=4 1596 B12R1.252 CC(=O)CCOc1cccnc1 67dae2709723517ab5af883d0837054b [0,0,0,0,0,1|1,0,2]=4 1597 B12R1.252 CC(=O)CCOc1ccncc1 1ac74c4f9261a84ccdad1c4e049e9ece [0,0,0,0,0,1|1,0,2]=4 1598 B12R1.252 CC(=O)CNCc1ccccc1 5e4599c3af112643425e1a35238a896f [0,0,0,0,0,1|0,0,2]=3 1599 B12R1.252 CC(=O)CNCc1ccccn1 6857f6976c347e411d9abdd48f8982fb [0,0,0,0,0,1|1,0,2]=4 1600 B12R1.252 CC(=O)CNCc1cccnc1 39d89333d7252b4434a1fdfd17a4d718 [0,0,0,0,0,1|1,0,2]=4 1601 B12R1.252 CC(=O)COCc1ccccc1 18daaa7c0d669a182de591929c861cbe [0,0,0,0,0,1|0,0,2]=3 1602 B12R1.252 CC(=O)COCc1ccccn1 f8ed3ffb815bee7f1737eacfe042d64f [0,0,0,0,0,1|1,0,2]=4 1603 B12R1.252 CC(=O)COCc1cccnc1 36638c01e0a61511be9d007508b97b48 [0,0,0,0,0,1|1,0,2]=4 1604 B12R1.252 CC(=O)NCCc1ccccc1 1052e9521fedb3e85cab4ef571c55982 [0,0,0,0,0,1|0,0,2]=3 1605 B12R1.252 CC(=O)NCCc1ccccn1 3ad8e2876430ef8ccd3cbeba8ed6119f [0,0,0,0,0,1|1,0,2]=4 1606 B12R1.252 CC(=O)NCCc1cccnc1 3962e9654ba13e9ef1bdd3c037e7deff [0,0,0,0,0,1|1,0,2]=4 1607 B12R1.252 CC(=O)NCCc1ccncc1 56311f224412b2ab7d4e3e56f79fd239 [0,0,0,0,0,1|1,0,2]=4 1608 B12R1.252 CC(=O)OCNc1ccccc1 6887be863fb786ec7dd333ad6d1f93a1 [0,0,0,0,0,1|1,0,2]=4 1609 B12R1.252 CC(C)CCNc1ccccc1 a9665cd268e7b4518a4ee939be46ff28 [0,0,0,0,0,1|1,0,0]=2 1610 B12R1.252 CC(C)CCNc1ccccn1 5b6942b64e33834b458baec7cf378581 [0,0,0,0,0,1|2,0,0]=3 1611 B12R1.252 CC(C)CCNc1cccnc1 69f5877c25712220cf9d8582cf74056f [0,0,0,0,0,1|2,0,0]=3 1612 B12R1.252 CC(C)CCNc1cccnn1 49603a690558b49ae61b3e35c8c0d434 [0,0,0,0,0,1|3,0,0]=4 1613 B12R1.252 CC(C)CCNc1ccncc1 51f5e7e7cccdd7bf4f868dbc1d306bf9 [0,0,0,0,0,1|2,0,0]=3 1614 B12R1.252 CC(C)CCNc1ccncn1 ecd6f70845650d07dedc7bc6c4ecaf3e [0,0,0,0,0,1|3,0,0]=4 1615 B12R1.252 CC(C)CCNc1ccnnc1 e97971f91d8080802d8d384ce559991b [0,0,0,0,0,1|3,0,0]=4 1616 B12R1.252 CC(C)CCNc1cnccn1 97e2470ed9c067d0275d682bf33fd1a4 [0,0,0,0,0,1|3,0,0]=4 1617 B12R1.252 CC(C)CCNc1cncnc1 26b8835dec95f3fb5d76438a06f580b5 [0,0,0,0,0,1|3,0,0]=4 1618 B12R1.252 CC(C)CCNc1ncccn1 fa06639a03be4eb7f54f05de582700f7 [0,0,0,0,0,1|3,0,0]=4 1619 B12R1.252 CC(C)CCOc1ccccn1 7f883afab874ab8f83be331ad8cd7edb [0,0,0,0,0,1|2,0,0]=3 1620 B12R1.252 CC(C)CCOc1cccnc1 b89b58f2b508e626016a4b78466a2d25 [0,0,0,0,0,1|2,0,0]=3 1621 B12R1.252 CC(C)CCOc1ccncc1 d280f435e28fd77803bc44ac9ebf5e18 [0,0,0,0,0,1|2,0,0]=3 1622 B12R1.252 CC(C)CCOc1ccnnc1 7baaf15abe4368b26e2fb152c1b407a1 [0,0,0,0,0,1|3,0,0]=4 1623 B12R1.252 CC(C)CCOc1cnccn1 73ba6622223f14158ed8b6786344556e [0,0,0,0,0,1|3,0,0]=4 1624 B12R1.252 CC(C)CCOc1cncnc1 f13c236cab6a25e32a87a9e0cf542271 [0,0,0,0,0,1|3,0,0]=4 1625 B12R1.252 CC(C)CCOc1ncccn1 d292c3b5e983ca259d629766547f8fee [0,0,0,0,0,1|3,0,0]=4 1626 B12R1.252 CC(C)CNCc1ccccc1 c48ab8ad76cb980676fd518bfed01255 [0,0,0,0,0,1|1,0,0]=2 1627 B12R1.252 CC(C)CNCc1ccccn1 6d7ebb6c45d12163344e2670abad50d7 [0,0,0,0,0,1|2,0,0]=3 1628 B12R1.252 CC(C)CNCc1cccnc1 317cc81cae733d174c088ce8c918791e [0,0,0,0,0,1|2,0,0]=3 1629 B12R1.252 CC(C)CNCc1cccnn1 84be549ae7f23e584a9cd16132c3740f [0,0,0,0,0,1|3,0,0]=4 1630 B12R1.252 CC(C)CNCc1ccncc1 e68ace07204ad5f64fa8daf124fe226c [0,0,0,0,0,1|2,0,0]=3 1631 B12R1.252 CC(C)CNCc1ccncn1 7c1867cd40dfe052b1c70621dd586356 [0,0,0,0,0,1|3,0,0]=4 1632 B12R1.252 CC(C)CNCc1ccnnc1 e272f82a038176e960733a3193d82b39 [0,0,0,0,0,1|3,0,0]=4 1633 B12R1.252 CC(C)CNCc1cnccn1 0929626c3926e9b5408d0567fa20c060 [0,0,0,0,0,1|3,0,0]=4 1634 B12R1.252 CC(C)CNCc1cncnc1 b12fe9f286ba850c74878865cff93b90 [0,0,0,0,0,1|3,0,0]=4 1635 B12R1.252 CC(C)CNCc1ncccn1 056b2d50b9d93d6eca9e998d6d806e1a [0,0,0,0,0,1|3,0,0]=4 1636 B12R1.252 CC(C)COCc1ccccc1 5769ac6c29ea9be863f0068a3148d1e9 [0,0,0,0,0,1|1,0,0]=2 1637 B12R1.252 CC(C)COCc1ccccn1 41f471be8d0443a395a59a6edd4b2170 [0,0,0,0,0,1|2,0,0]=3 1638 B12R1.252 CC(C)COCc1cccnc1 e949ee90c476dd3afee631c02891b751 [0,0,0,0,0,1|2,0,0]=3 1639 B12R1.252 CC(C)COCc1cccnn1 bcec46c8daa86302f285ba1f41a4db4d [0,0,0,0,0,1|3,0,0]=4 1640 B12R1.252 CC(C)COCc1ccncc1 243716518cbf836169ff83c6e87d1a68 [0,0,0,0,0,1|2,0,0]=3 1641 B12R1.252 CC(C)COCc1ccncn1 504e9144090fa54e034f83efb4a8bc6c [0,0,0,0,0,1|3,0,0]=4 1642 B12R1.252 CC(C)COCc1ccnnc1 ff5d3e92e07d7c89d2f784ea78b2a712 [0,0,0,0,0,1|3,0,0]=4 1643 B12R1.252 CC(C)COCc1cnccn1 54d1f572f89be35af98ac5c6d0a00bd4 [0,0,0,0,0,1|3,0,0]=4 1644 B12R1.252 CC(C)COCc1cncnc1 82d59111480f34498710471232a2f8e6 [0,0,0,0,0,1|3,0,0]=4 1645 B12R1.252 CC(C)COCc1ncccn1 33688b887bd33e4027684b65bbdc620c [0,0,0,0,0,1|3,0,0]=4 1646 B12R1.252 CC(C)NCCc1ccccc1 800f62166be48d31d0f1f8e8246a3d11 [0,0,0,0,0,1|1,0,0]=2 1647 B12R1.252 CC(C)NCCc1ccccn1 60db3ccccaed87369474311fbbb2ee61 [0,0,0,0,0,1|2,0,0]=3 1648 B12R1.252 CC(C)NCCc1cccnc1 f39609cf740b878733069b3389a379d4 [0,0,0,0,0,1|2,0,0]=3 1649 B12R1.252 CC(C)NCCc1ccncc1 2e03fedf55e71e95c0abd0f4865dc22e [0,0,0,0,0,1|2,0,0]=3 1650 B12R1.252 CC(C)NCCc1ccncn1 f7502abf563207bb5d53cb2d326dbabf [0,0,0,0,0,1|3,0,0]=4 1651 B12R1.252 CC(C)NCCc1cnccn1 35c3b70c1897dffd7b3a32c2343123fc [0,0,0,0,0,1|3,0,0]=4 1652 B12R1.252 CC(C)NCCc1ncccn1 794cc03a494745a4fc8f3acdee35c851 [0,0,0,0,0,1|3,0,0]=4 1653 B12R1.252 CC(C)OCCc1ccccc1 cd2036e50db53ec52d80c5b70290b19c [0,0,0,0,0,1|1,0,0]=2 1654 B12R1.252 CC(C)OCCc1ccccn1 618810b4708a73ec52035c34c4054b87 [0,0,0,0,0,1|2,0,0]=3 1655 B12R1.252 CC(C)OCCc1cccnc1 ad83d4217e0420d4f686447a978fc953 [0,0,0,0,0,1|2,0,0]=3 1656 B12R1.252 CC(C)OCCc1ccncc1 07cefd4f30952a7fff1efa12f3f8cb0e [0,0,0,0,0,1|2,0,0]=3 1657 B12R1.252 CC(C)OCCc1ccncn1 f1ce6c97a497c9e91937eebb9f30c7a6 [0,0,0,0,0,1|3,0,0]=4 1658 B12R1.252 CC(C)OCCc1cnccn1 ae26b65e22ea6fcf5c22fdff048110ff [0,0,0,0,0,1|3,0,0]=4 1659 B12R1.252 CC(C)OCCc1ncccn1 c1c5cf56502b5e60b3dba4a7a219c587 [0,0,0,0,0,1|3,0,0]=4 1660 B12R1.252 CC(C)OCNc1ccccc1 4ab9f406843d3d3dea8c678f7ec5fd29 [0,0,0,0,0,1|2,0,0]=3 1661 B12R1.252 CC(C)OCNc1ccccn1 f79533e956cd51a6f0cee4ac927e1136 [0,0,0,0,0,1|3,0,0]=4 1662 B12R1.252 CC(C)OCNc1cccnc1 6dd37a3ca9a4168d344f1af36676e50f [0,0,0,0,0,1|3,0,0]=4 1663 B12R1.252 CC(C)OCNc1ccncc1 8f9b47fcb224f8aeae405dd2ac59e733 [0,0,0,0,0,1|3,0,0]=4 1664 B12R1.252 CC(C)OCOc1ccccn1 1f60fa9657a31d54ae86707f451d8353 [0,0,0,0,0,1|3,0,0]=4 1665 B12R1.252 CC(C)OCOc1cccnc1 0adf6c0a61ffae293502a60ec48e9b78 [0,0,0,0,0,1|3,0,0]=4 1666 B12R1.252 CC(C)OCOc1ccncc1 2419024f861ffb40c39021803c819ad7 [0,0,0,0,0,1|3,0,0]=4 1667 B12R1.252 CC(F)COCc1ccccc1 ceaaa348669e5aa8cbad2a4c64558f8e [0,0,0,0,0,1|1,0,0]=2 1668 B12R1.252 CC(F)COCc1ccccn1 476695497df80cb7c084184b5b43d035 [0,0,0,0,0,1|2,0,0]=3 1669 B12R1.252 CC(F)COCc1cccnc1 c074e95bfd5d6d05bfe23c42186cba2a [0,0,0,0,0,1|2,0,0]=3 1670 B12R1.252 CC(F)COCc1cccnn1 a8676d0003d9a388121c44b40728d121 [0,0,0,0,0,1|3,0,0]=4 1671 B12R1.252 CC(F)COCc1ccncn1 e66fcc367d7980f6bc6aae01f6a3dcca [0,0,0,0,0,1|3,0,0]=4 1672 B12R1.252 CC(F)COCc1cncnc1 8a1dba7261b289eecc7c37a372cdfe43 [0,0,0,0,0,1|3,0,0]=4 1673 B12R1.252 CC(F)COCc1ncccn1 b164a01eba2e6ffed2b68a89c16a263d [0,0,0,0,0,1|3,0,0]=4 1674 B12R1.252 CC(O)CCNc1ccccc1 5c6c9358fbd8939fc6c9f54dcb2d3a37 [0,0,0,0,0,1|0,0,0]=1 1675 B12R1.252 CC(O)CCNc1ccccn1 97031b4d64979d289ef04acc206d003e [0,0,0,0,0,1|1,0,0]=2 1676 B12R1.252 CC(O)CCNc1cccnc1 ddabe466465a030ebf6055c0cc168740 [0,0,0,0,0,1|1,0,0]=2 1677 B12R1.252 CC(O)CCNc1cccnn1 47b97190e8ab1842f9cd5e0dee7ed3e8 [0,0,0,0,0,1|2,0,0]=3 1678 B12R1.252 CC(O)CCNc1ccncc1 c1ccc95455595767ca368700397c2d43 [0,0,0,0,0,1|1,0,0]=2 1679 B12R1.252 CC(O)CCNc1ccncn1 ebd00d7ab06f73cce67a72b6f0de4119 [0,0,0,0,0,1|2,0,0]=3 1680 B12R1.252 CC(O)CCNc1ccnnc1 a504757203161e263e7f337405390bb3 [0,0,0,0,0,1|2,0,0]=3 1681 B12R1.252 CC(O)CCNc1cnccn1 6eb47df63aaf1411aa20597fd2d69a7f [0,0,0,0,0,1|2,0,0]=3 1682 B12R1.252 CC(O)CCNc1cncnc1 0b737784ac7e5816d1ebeb3501421956 [0,0,0,0,0,1|2,0,0]=3 1683 B12R1.252 CC(O)CCNc1cnncn1 b26836ffce9cf584c150cee5df66e839 [0,0,0,0,0,1|3,0,0]=4 1684 B12R1.252 CC(O)CCNc1ncccn1 225479af487259f3587dee9eb87e8f0e [0,0,0,0,0,1|2,0,0]=3 1685 B12R1.252 CC(O)CCNc1nccnn1 0df909486d4b1b02ba70babde138c59a [0,0,0,0,0,1|3,0,0]=4 1686 B12R1.252 CC(O)CCNc1ncncn1 becc022bb4dfc4bd1f2087cdb263cc29 [0,0,0,0,0,1|3,0,0]=4 1687 B12R1.252 CC(O)CNCc1ccccc1 19d19f96fb686d7cbd72f5df359e9dd8 [0,0,0,0,0,1|0,0,0]=1 1688 B12R1.252 CC(O)CNCc1ccccn1 e28c29c938e18ad1238cd975f89a06a8 [0,0,0,0,0,1|1,0,0]=2 1689 B12R1.252 CC(O)CNCc1cccnc1 0379a455e7b583f17fba58d3189059b6 [0,0,0,0,0,1|1,0,0]=2 1690 B12R1.252 CC(O)CNCc1cccnn1 ca0f502bcc801933ee5c767e5093148e [0,0,0,0,0,1|2,0,0]=3 1691 B12R1.252 CC(O)CNCc1ccncc1 e21fcdc654ebe2a7b579b387cc55b8af [0,0,0,0,0,1|1,0,0]=2 1692 B12R1.252 CC(O)CNCc1ccncn1 7a5d78fb681ded42d2d147fe1c55e164 [0,0,0,0,0,1|2,0,0]=3 1693 B12R1.252 CC(O)CNCc1ccnnc1 63d088ff8ad7b93fb69e3ad1f2381588 [0,0,0,0,0,1|2,0,0]=3 1694 B12R1.252 CC(O)CNCc1cnccn1 c8835bddb9845c918606787997b443d4 [0,0,0,0,0,1|2,0,0]=3 1695 B12R1.252 CC(O)CNCc1cncnc1 151206bce7a643e1e4818f076bf8f1d9 [0,0,0,0,0,1|2,0,0]=3 1696 B12R1.252 CC(O)CNCc1ncccn1 94e03f4ed43c28d3bc90554d2a7d489e [0,0,0,0,0,1|2,0,0]=3 1697 B12R1.252 CC(S)COCc1ccccc1 a2dbb8c27ced04cd31e27a2a08aed095 [0,0,0,0,0,1|0,1,0]=2 1698 B12R1.252 CC(S)COCc1ccccn1 a4f3c7b4dcc63c52aaa45bb366b1ace4 [0,0,0,0,0,1|1,1,0]=3 1699 B12R1.252 CC(S)COCc1cccnc1 355ce467de5bbf28efe4538348b90e14 [0,0,0,0,0,1|1,1,0]=3 1700 B12R1.252 CC(S)COCc1cccnn1 d2ecb2d0e631a99f442e857229dbdd98 [0,0,0,0,0,1|2,1,0]=4 1701 B12R1.252 CC(S)COCc1ccncn1 950c30d73f3928e6c48b7ade8fe9fd37 [0,0,0,0,0,1|2,1,0]=4 1702 B12R1.252 CC(S)COCc1cncnc1 d68e602e35e59e87317aa2e9eec6f5f4 [0,0,0,0,0,1|2,1,0]=4 1703 B12R1.252 CC(S)COCc1ncccn1 f43e202e339061758ab99ff5a34648cc [0,0,0,0,0,1|2,1,0]=4 1704 B12R1.252 CN(C)CCNc1ccccc1 d3b2e620d30900fb427915c44cfde5dc [0,0,0,0,0,1|2,0,0]=3 1705 B12R1.252 CN(C)CCNc1ccccn1 3770115323c648ae32f4fd74bb45de81 [0,0,0,0,0,1|3,0,0]=4 1706 B12R1.252 CN(C)CCNc1cccnc1 22a4008b463a870f2daa263a95fbffba [0,0,0,0,0,1|3,0,0]=4 1707 B12R1.252 CN(C)CCNc1ccncc1 d9f8952e88bdc30a4e0e7629ce419405 [0,0,0,0,0,1|3,0,0]=4 1708 B12R1.252 CN(C)CCOc1ccccn1 97e00588b90af414fe2d070a8bfe7282 [0,0,0,0,0,1|3,0,0]=4 1709 B12R1.252 CN(C)CCOc1cccnc1 f5e21fc4088e0b2f79fcf350bb578a86 [0,0,0,0,0,1|3,0,0]=4 1710 B12R1.252 CN(C)CCOc1ccncc1 97bba66a3292910c48ac90e816f26fa6 [0,0,0,0,0,1|3,0,0]=4 1711 B12R1.252 CN(C)CNCc1ccccc1 0202e986c8da8d9c48034425b18c3dfe [0,0,0,0,0,1|2,0,0]=3 1712 B12R1.252 CN(C)CNCc1ccccn1 3e94ae66f4eb87252a917a8d226960eb [0,0,0,0,0,1|3,0,0]=4 1713 B12R1.252 CN(C)CNCc1cccnc1 0ce03a303d2964fc78c4354a4a9686bb [0,0,0,0,0,1|3,0,0]=4 1714 B12R1.252 CN(C)CNCc1ccncc1 5e49afaadf13dc7066741f62250ed2bc [0,0,0,0,0,1|3,0,0]=4 1715 B12R1.252 CN(C)COCc1ccccc1 a063060d7f5ce478c07330412cbf8447 [0,0,0,0,0,1|2,0,0]=3 1716 B12R1.252 CN(C)COCc1ccccn1 3a10a8f32d4655fe62f905c50c31c2d8 [0,0,0,0,0,1|3,0,0]=4 1717 B12R1.252 CN(C)COCc1cccnc1 0f0029a575393373338b79601babfc55 [0,0,0,0,0,1|3,0,0]=4 1718 B12R1.252 CN(C)COCc1ccncc1 64013abc6fb1891b992e5cf59135b9d7 [0,0,0,0,0,1|3,0,0]=4 1719 B12R1.252 CS(=O)CCNc1ccccc1 5cc8a55dee9bbafc2b2ae46532475526 [0,0,0,0,0,1|1,0,1]=3 1720 B12R1.252 CS(=O)CCNc1ccccn1 32809cdd694b5d2997184adf79ab8936 [0,0,0,0,0,1|2,0,1]=4 1721 B12R1.252 CS(=O)CCNc1cccnc1 c989b0c74f35fcb5f1937809390bfccd [0,0,0,0,0,1|2,0,1]=4 1722 B12R1.252 CS(=O)CCNc1ccncc1 9c85c1df8c533539c8e3b95bc4a48623 [0,0,0,0,0,1|2,0,1]=4 1723 B12R1.252 CS(=O)CCOc1ccccn1 30133f9bf19ef8b3fdfb27b7644f2fa7 [0,0,0,0,0,1|2,0,1]=4 1724 B12R1.252 CS(=O)CCOc1cccnc1 fba82d99e9c5926738121fef3b403577 [0,0,0,0,0,1|2,0,1]=4 1725 B12R1.252 CS(=O)CCOc1ccncc1 42f0efa364a33090ad2bbdd483f409f6 [0,0,0,0,0,1|2,0,1]=4 1726 B12R1.252 C[C@@H](F)COCc1ccccc1 ba1a50f79e3a1a52d90fe2949f8a3658 [0,0,0,0,0,1|1,0,0]=2 1727 B12R1.252 C[C@@H](F)COCc1ccccn1 25305c43f86a522a8b001eca7d58c6e1 [0,0,0,0,0,1|2,0,0]=3 1728 B12R1.252 C[C@@H](F)COCc1cccnc1 aed0ead164612a30bbdf73120135ebce [0,0,0,0,0,1|2,0,0]=3 1729 B12R1.252 C[C@@H](F)COCc1cccnn1 06cb4b03e5d2138a02ec68b491d736db [0,0,0,0,0,1|3,0,0]=4 1730 B12R1.252 C[C@@H](F)COCc1ccncn1 719b49a72c09f7d762d98352aa2ee153 [0,0,0,0,0,1|3,0,0]=4 1731 B12R1.252 C[C@@H](F)COCc1cncnc1 6c6b988da2bf934da719d30239039da0 [0,0,0,0,0,1|3,0,0]=4 1732 B12R1.252 C[C@@H](F)COCc1ncccn1 0be2c0fc83116bf68d16d48e2175abbd [0,0,0,0,0,1|3,0,0]=4 1733 B12R1.252 C[C@@H](O)CCNc1ccccc1 3c324f6ae4acc93f637fccf82ee7ce0d [0,0,0,0,0,1|0,0,0]=1 1734 B12R1.252 C[C@@H](O)CCNc1cccnc1 d2f9effd7c499379710e94d2300db828 [0,0,0,0,0,1|1,0,0]=2 1735 B12R1.252 C[C@@H](O)CCNc1cccnn1 cf73112336214ad7cbf0dc1846b2b8b5 [0,0,0,0,0,1|2,0,0]=3 1736 B12R1.252 C[C@@H](O)CCNc1ccncc1 1357dd9581462a38875d3aa4d1c252b3 [0,0,0,0,0,1|1,0,0]=2 1737 B12R1.252 C[C@@H](O)CCNc1ccncn1 e9c337d98b4124b083ec155c782d5afc [0,0,0,0,0,1|2,0,0]=3 1738 B12R1.252 C[C@@H](O)CCNc1cnccn1 d98d70b012f52698df30b7825b3d3f44 [0,0,0,0,0,1|2,0,0]=3 1739 B12R1.252 C[C@@H](O)CNCc1ccccc1 6c2312c00225852faacfd748f3e179a9 [0,0,0,0,0,1|0,0,0]=1 1740 B12R1.252 C[C@@H](O)CNCc1ccccn1 451f5ffb0f29e3e72e062344afb5a2f0 [0,0,0,0,0,1|1,0,0]=2 1741 B12R1.252 C[C@@H](O)CNCc1cccnc1 b84ffcc76f02e485a00f4000a256d608 [0,0,0,0,0,1|1,0,0]=2 1742 B12R1.252 C[C@@H](O)CNCc1cccnn1 cd1031e294d6f0d361dd47fa33d49ff3 [0,0,0,0,0,1|2,0,0]=3 1743 B12R1.252 C[C@@H](O)CNCc1ccncc1 ae74cf20bb99ef533f01677aac980ef0 [0,0,0,0,0,1|1,0,0]=2 1744 B12R1.252 C[C@@H](O)CNCc1ccncn1 736b6f19c1f730535787b4bd97f49fab [0,0,0,0,0,1|2,0,0]=3 1745 B12R1.252 C[C@@H](O)CNCc1ccnnc1 a6adabbfe9ec36728297c10c7c100d6e [0,0,0,0,0,1|2,0,0]=3 1746 B12R1.252 C[C@@H](O)CNCc1cnccn1 eef2e176f843886c7abc553819e37052 [0,0,0,0,0,1|2,0,0]=3 1747 B12R1.252 C[C@@H](O)CNCc1cncnc1 19165fd007380eca62afeda6cfb37644 [0,0,0,0,0,1|2,0,0]=3 1748 B12R1.252 C[C@@H](O)CNCc1ncccn1 0624e3b4e312bb88305cee2546fdfafe [0,0,0,0,0,1|2,0,0]=3 1749 B12R1.252 C[C@H](F)COCc1ccccc1 bbc793e84de595855390c7dc0e162e4e [0,0,0,0,0,1|1,0,0]=2 1750 B12R1.252 C[C@H](F)COCc1ccccn1 1c3e68e8b7d209c95b5abd8e99134585 [0,0,0,0,0,1|2,0,0]=3 1751 B12R1.252 C[C@H](F)COCc1cccnc1 0c09d4ffa6c243373fe47064ad603e31 [0,0,0,0,0,1|2,0,0]=3 1752 B12R1.252 C[C@H](F)COCc1cccnn1 2be52db7760fdc7844e251123071f59c [0,0,0,0,0,1|3,0,0]=4 1753 B12R1.252 C[C@H](F)COCc1ccncn1 7bca4df3c29ccb83ca7218b56534d104 [0,0,0,0,0,1|3,0,0]=4 1754 B12R1.252 C[C@H](F)COCc1cncnc1 9eff2fbe069ecca8868c961efa887e39 [0,0,0,0,0,1|3,0,0]=4 1755 B12R1.252 C[C@H](F)COCc1ncccn1 7af5a27af441f4087010aeedfc65f0ba [0,0,0,0,0,1|3,0,0]=4 1756 B12R1.252 C[C@H](O)CCNc1ccccc1 6e2f4bd6880dfbdf2c0288d2956dbdc6 [0,0,0,0,0,1|0,0,0]=1 1757 B12R1.252 C[C@H](O)CCNc1cccnc1 a74a77e227ccf23689573201eeb443f8 [0,0,0,0,0,1|1,0,0]=2 1758 B12R1.252 C[C@H](O)CCNc1cccnn1 c62b16aa58dfc3c8ac3d7053343062a4 [0,0,0,0,0,1|2,0,0]=3 1759 B12R1.252 C[C@H](O)CCNc1ccncc1 b387b9f25ac0f7430597235bfa1a1caf [0,0,0,0,0,1|1,0,0]=2 1760 B12R1.252 C[C@H](O)CCNc1ccncn1 4320134883fca98ee018037af11033ea [0,0,0,0,0,1|2,0,0]=3 1761 B12R1.252 C[C@H](O)CCNc1cnccn1 5d34a9c581c97e3e5cec72109f7ba47d [0,0,0,0,0,1|2,0,0]=3 1762 B12R1.252 C[C@H](O)CNCc1ccccc1 300dc860ca45284f1e63efe30c8515f8 [0,0,0,0,0,1|0,0,0]=1 1763 B12R1.252 C[C@H](O)CNCc1ccccn1 b271f5c0c0f30c343eeedababca7e2eb [0,0,0,0,0,1|1,0,0]=2 1764 B12R1.252 C[C@H](O)CNCc1cccnc1 4f2f0e9e68ec9a4c8887410d5a461943 [0,0,0,0,0,1|1,0,0]=2 1765 B12R1.252 C[C@H](O)CNCc1cccnn1 30faf4d5d2d2cfc53436874f05fa4323 [0,0,0,0,0,1|2,0,0]=3 1766 B12R1.252 C[C@H](O)CNCc1ccncc1 efb723b5ed38065d1ff8f191a8967ccc [0,0,0,0,0,1|1,0,0]=2 1767 B12R1.252 C[C@H](O)CNCc1ccncn1 f524766be8fbe3d3ed19bfa5c9a61a28 [0,0,0,0,0,1|2,0,0]=3 1768 B12R1.252 C[C@H](O)CNCc1ccnnc1 a7bd5629dc85409dec43db9307521148 [0,0,0,0,0,1|2,0,0]=3 1769 B12R1.252 C[C@H](O)CNCc1cnccn1 3fe1c33c64283497dd89455f2ff7b9fd [0,0,0,0,0,1|2,0,0]=3 1770 B12R1.252 C[C@H](O)CNCc1cncnc1 43c1e13a89f1e44e47019870762f2938 [0,0,0,0,0,1|2,0,0]=3 1771 B12R1.252 C[C@H](O)CNCc1ncccn1 76fcffd630239efd786e389061949a13 [0,0,0,0,0,1|2,0,0]=3 1772 B12R1.252 FC(F)CCNc1ccccc1 197e931474a81ea0a384c18be7d88578 [0,0,0,0,0,1|2,0,0]=3 1773 B12R1.252 FC(F)CCNc1ccccn1 cc81dcc876994e19229f366729c14f42 [0,0,0,0,0,1|3,0,0]=4 1774 B12R1.252 FC(F)CCNc1cccnc1 8ff2eecd22f347407ae84953032c8976 [0,0,0,0,0,1|3,0,0]=4 1775 B12R1.252 FC(F)CCNc1ccncc1 c10e0c18270587f23d4e0bc7d1e1531a [0,0,0,0,0,1|3,0,0]=4 1776 B12R1.252 FC(F)CNCc1ccccc1 b372a4b49b84fd81f05ebb43fbf5746e [0,0,0,0,0,1|2,0,0]=3 1777 B12R1.252 FC(F)CNCc1ccccn1 77bd5b4958e554940a2488a652c3c227 [0,0,0,0,0,1|3,0,0]=4 1778 B12R1.252 FC(F)CNCc1cccnc1 10faa1bbbf72a799d263592383123ca2 [0,0,0,0,0,1|3,0,0]=4 1779 B12R1.252 FC(F)CNCc1ccncc1 f3d3277b17c89093bef62c3dbc8803ae [0,0,0,0,0,1|3,0,0]=4 1780 B12R1.252 FC(F)COCc1ccccc1 2df81e9a81e7d6e6e6f5c475fa361af0 [0,0,0,0,0,1|2,0,0]=3 1781 B12R1.252 FC(F)COCc1ccccn1 0c03e4bfe601ba3a265a9d65726e12d8 [0,0,0,0,0,1|3,0,0]=4 1782 B12R1.252 FC(F)COCc1cccnc1 3532f1ad3bafa18adc371def44f6b40f [0,0,0,0,0,1|3,0,0]=4 1783 B12R1.252 FC(F)COCc1ccncc1 a025e7264740e28a91818ddabc8a4228 [0,0,0,0,0,1|3,0,0]=4 1784 B12R1.252 NC(=O)CCNc1ccccc1 e3f281a2334f3d253ae1981a98fa192d [0,0,0,0,0,1|1,0,2]=4 1785 B12R1.252 NC(=O)CNCc1ccccc1 83654b4ad4ce52b5beb58e8e02b043be [0,0,0,0,0,1|1,0,2]=4 1786 B12R1.252 NC(=O)COCc1ccccc1 eacdadd1a099559aa1699a209237e0c7 [0,0,0,0,0,1|1,0,2]=4 1787 B12R1.252 NC(=S)CCNc1ccccc1 fdd014489a9f5fc5a2655cbf4a4fb01b [0,0,0,0,0,1|1,1,1]=4 1788 B12R1.252 NC(=S)COCc1ccccc1 397a628005598ffe9bcc09a6e0a362e3 [0,0,0,0,0,1|1,1,1]=4 1789 B12R1.252 O=C(O)CCNc1ccccc1 ed7f72bbe0b1599eda9c30db2d051414 [0,0,0,0,0,1|1,0,1]=3 1790 B12R1.252 O=C(O)CCNc1ccccn1 0537ea6c1dceaf8751238bf02ee3d095 [0,0,0,0,0,1|2,0,1]=4 1791 B12R1.252 O=C(O)CCNc1cccnc1 5ce9abae26295a33d354a7af3429e5db [0,0,0,0,0,1|2,0,1]=4 1792 B12R1.252 O=C(O)CCNc1ccncc1 c76a2848f4b88ba3bf9880e1598d6cd8 [0,0,0,0,0,1|2,0,1]=4 1793 B12R1.252 O=C(O)CCOc1cccnc1 a9700a007db2ce9b0e7a0a82d7a2830b [0,0,0,0,0,1|2,0,1]=4 1794 B12R1.252 O=C(O)CNCc1ccccc1 db9e4b752c6e68fd22fb535c2b9167d2 [0,0,0,0,0,1|1,0,1]=3 1795 B12R1.252 O=C(O)CNCc1ccccn1 3c84db281076170db068c06ad4fa1558 [0,0,0,0,0,1|2,0,1]=4 1796 B12R1.252 O=C(O)CNCc1cccnc1 0f23cde99dad163ff1a43f270a6b97df [0,0,0,0,0,1|2,0,1]=4 1797 B12R1.252 O=C(O)CNCc1ccncc1 572927dbbf5d53ea5ca9341b6194c6ae [0,0,0,0,0,1|2,0,1]=4 1798 B12R1.252 O=C(O)COCc1ccccc1 a919d4e5b6621fc6b657c329a5a5b2a3 [0,0,0,0,0,1|1,0,1]=3 1799 B12R1.252 O=C(O)COCc1ccccn1 23d47dd96051fd1e4e6f2b6ade2c5861 [0,0,0,0,0,1|2,0,1]=4 1800 B12R1.252 O=C(O)COCc1cccnc1 f0ccee5ed9ee69c492f291b8d433ec22 [0,0,0,0,0,1|2,0,1]=4 1801 B12R1.252 O=C(O)COCc1ccncc1 5c10a3aeb68608515bbdc7a10de9fb73 [0,0,0,0,0,1|2,0,1]=4 1802 B12R1.252 O=S(O)CCNc1ccccc1 0ff7b55f6ed3d9a491931fe66155130d [0,0,0,0,0,1|2,0,0]=3 1803 B12R1.252 O=S(O)CCNc1ccccn1 52912e49a54a8727cdb7fa7cdbaa0329 [0,0,0,0,0,1|3,0,0]=4 1804 B12R1.252 O=S(O)CCNc1cccnc1 8f3cc3d54c366194ea7c1d90eedb2769 [0,0,0,0,0,1|3,0,0]=4 1805 B12R1.252 O=S(O)CCNc1ccncc1 1bccbbd349ab32d08b8e6cc196f228c1 [0,0,0,0,0,1|3,0,0]=4 1806 B12R1.252 O=S(O)COCc1ccccc1 b3f70ea663599ebd17c7712fcc9ee3f6 [0,0,0,0,0,1|2,0,0]=3 1807 B12R1.252 O=S(O)COCc1ccccn1 82f7ef930a26c74110028b3fbc96ff09 [0,0,0,0,0,1|3,0,0]=4 1808 B12R1.252 O=S(O)COCc1cccnc1 83e3ec94332cb681c92d904cbf5092fb [0,0,0,0,0,1|3,0,0]=4 1809 B12R1.252 O=[N+]([O-])CNCc1ccccc1 003ae0a8ef4956ccaf12e059439e2939 [0,0,0,0,0,1|2,0,1]=4 1810 B12R1.252 O=[N+]([O-])COCc1ccccc1 ee8d233480e436ac44b29eeacba4e8fe [0,0,0,0,0,1|2,0,1]=4 1811 B9R0.18 C=C/C=C/C(=O)NCCC cdb1993c899e293034914219ee12d2cc [1,0,1,0,0,0|2,0,0]=4 1812 B9R0.18 C=C/C=C/C(=O)NCCO 84cabd46bcaa3ce54eced688b872193d [1,0,1,0,0,0|2,0,0]=4 1813 B9R0.18 C=C/C=C\C(=O)NCCC c0156ffebe98b66f4e26bb3d1670da8c [1,0,1,0,0,0|2,0,0]=4 1814 B9R0.18 C=C/C=C\C(=O)NCCO 1c213bed3877e97a951b6dd41834f3a2 [1,0,1,0,0,0|2,0,0]=4 1815 B9R0.18 C=CC=CC(=O)NCCC 4ac7d936250849aaf88bec9640f41d33 [1,0,1,0,0,0|2,0,0]=4 1816 B9R0.18 C=CC=CC(=O)NCCO 33efd795c69b3cd508d0081edd0a1405 [1,0,1,0,0,0|2,0,0]=4 1817 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [2,0,0,0,0,0|1,0,0]=3 1818 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [2,0,0,0,0,0|2,0,0]=4 1819 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [2,0,0,0,0,0|2,0,0]=4 1820 B9R1.8 CCNc1ccncc1 76118d388bf159fc52a5b3b43773c6d0 [2,0,0,0,0,0|2,0,0]=4 1821 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [2,0,0,0,0,0|2,0,0]=4 1822 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [2,0,0,0,0,0|2,0,0]=4 1823 B9R1.8 CCOc1ccncc1 365c1eef106f5326bc3144a980f01ba5 [2,0,0,0,0,0|2,0,0]=4 1824 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [2,0,0,0,0,0|2,0,0]=4 1825 B9R1.8 OCNc1ccccc1 6a26daba1a11b7282126aadb7f7b8f97 [2,0,0,0,0,0|1,0,0]=3 1826 B9R1.8 OCNc1ccccn1 d59bc8d9974c705420d0aeed6cce1b06 [2,0,0,0,0,0|2,0,0]=4 1827 B9R1.8 OCNc1cccnc1 68add967e09ec2eee2b71061a3bb94f5 [2,0,0,0,0,0|2,0,0]=4 1828 B9R1.8 OCNc1ccncc1 25e64b963b18028da179c82ed337c929 [2,0,0,0,0,0|2,0,0]=4 1829 B11R0.46 C/C=C/C=C/C(=O)NCC(C)O bbe4fbf32f3460dd74f13121d43d5fd8 [0,1,1,0,0,0|1,0,1]=4 1830 B11R0.46 C/C=C/C=C/C(=O)NC[C@@H](C)O 8cb97146bb1ea3a48c4d213992efcd82 [0,1,1,0,0,0|1,0,1]=4 1831 B11R0.46 C/C=C/C=C/C(=O)NC[C@H](C)O f77b644e4b673ed0b1eb8468dcacd558 [0,1,1,0,0,0|1,0,1]=4 1832 B11R0.46 CC=CC=CC(=O)NCC(C)O e26aaeb6fc2735b7175f43855b6bce4a [0,1,1,0,0,0|1,0,1]=4 1833 B11R0.46 CC=CC=CC(=O)NC[C@@H](C)O 5bb226d15b880a8f6d79f926cdeed558 [0,1,1,0,0,0|1,0,1]=4 1834 B11R0.46 CC=CC=CC(=O)NC[C@H](C)O 90ec7a98d394daeea7b7230c02fdffa0 [0,1,1,0,0,0|1,0,1]=4 1835 B11R0.147 C=C/C=C/C(=O)NCCC(C)C f18d94e6ef784a3f506f3e451fa63d08 [0,1,1,0,0,0|2,0,0]=4 1836 B11R0.147 C=C/C=C/C(=O)NCCC(C)O 2f5b9eb732d8c19eddc654c5ee11e5fd [0,1,1,0,0,0|1,0,0]=3 1837 B11R0.147 C=C/C=C/C(=O)NCC[C@@H](C)O 9861a42da1d6c58f099ab52eae62f9fe [0,1,1,0,0,0|1,0,0]=3 1838 B11R0.147 C=C/C=C/C(=O)NCC[C@H](C)O 20446bd7bdf5bc3f8363c3eb8269149a [0,1,1,0,0,0|1,0,0]=3 1839 B11R0.147 C=C/C=C\C(=O)NCCC(C)C 2ae5eb05a04ab6607636d599273f8f64 [0,1,1,0,0,0|2,0,0]=4 1840 B11R0.147 C=C/C=C\C(=O)NCCC(C)O 21c9d4f195706468819f047cbd5320ad [0,1,1,0,0,0|1,0,0]=3 1841 B11R0.147 C=C/C=C\C(=O)NCC[C@@H](C)O 9dce3ab8ddd755d4eef93d598f5c6bd5 [0,1,1,0,0,0|1,0,0]=3 1842 B11R0.147 C=C/C=C\C(=O)NCC[C@H](C)O 90e0f4d28f2742d488d9ccef1bdae3e8 [0,1,1,0,0,0|1,0,0]=3 1843 B11R0.147 C=CC=CC(=O)NCCC(C)C ff3acd03de51ebd5fbd9be8285828085 [0,1,1,0,0,0|2,0,0]=4 1844 B11R0.147 C=CC=CC(=O)NCCC(C)O ff675b0886fdfa9130aa1e5a216c2db2 [0,1,1,0,0,0|1,0,0]=3 1845 B11R0.147 C=CC=CC(=O)NCC[C@@H](C)O 59ee544967596edba09422ecbf217a8d [0,1,1,0,0,0|1,0,0]=3 1846 B11R0.147 C=CC=CC(=O)NCC[C@H](C)O 236bf0e92636b28533b494c6964c8eb9 [0,1,1,0,0,0|1,0,0]=3 1847 B11R0.148 C=C/C=C/CCNCCC(C)O 1280c558b8c1ada0f277e0e8453ce1e7 [0,1,1,0,0,0|0,0,2]=4 1848 B11R0.280 C=CCN(CC=C)CCC(C)O d7db6b6dcc11df6c7f0b12008fef3f3b [0,1,1,0,0,0|1,0,1]=4 1849 B11R0.68 C=C/C=C/C(=O)N(C)CC(C)O 1fd726ff08fcbf21c073a862b7e8372b [0,1,1,0,0,0|2,0,0]=4 1850 B11R0.68 C=C/C=C/C(=O)N(C)C[C@H](C)O 1e27221941dd7f0a9a659ade72a17675 [0,1,1,0,0,0|2,0,0]=4 1851 B11R0.68 C=C/C=C\C(=O)N(C)CC(C)O 436ed1d0a75d36b5908d76ab8fba4cfc [0,1,1,0,0,0|2,0,0]=4 1852 B11R0.68 C=C/C=C\C(=O)N(C)C[C@H](C)O 29a6848c9820cbf1de7031ee45cf463b [0,1,1,0,0,0|2,0,0]=4 1853 B11R0.68 C=CC=CC(=O)N(C)CC(C)O a76a0dba062fa1d5a70b9d6f6fe1377f [0,1,1,0,0,0|2,0,0]=4 1854 B11R0.68 C=CC=CC(=O)N(C)C[C@H](C)O 02e3f4d60c7416645351a4ca8437e8b4 [0,1,1,0,0,0|2,0,0]=4 1855 B11R0.70 C=C/C=C/C(=O)NCC(C)CO 95c66029e84c98c5fae1c3224701339c [0,1,1,0,0,0|2,0,0]=4 1856 B11R0.70 C=C/C=C/C(=O)NCC(O)CC 46b3d7ae40ee4895356ce79870f07402 [0,1,1,0,0,0|2,0,0]=4 1857 B11R0.70 C=C/C=C/C(=O)NCC(O)CO 5a121754a6aac9ccae83f1d08b679ca7 [0,1,1,0,0,0|2,0,0]=4 1858 B11R0.70 C=C/C=C/C(=O)NC[C@@H](C)OC 5b4eb087d492cf26cf1f5f088495fb86 [0,1,1,0,0,0|2,0,0]=4 1859 B11R0.70 C=C/C=C/C(=O)NC[C@@H](O)CO ebe883640dfcf48c06c4cc5593cd0bd2 [0,1,1,0,0,0|2,0,0]=4 1860 B11R0.70 C=C/C=C/C(=O)NC[C@H](C)CO 6cf0caafe0c928049a72ce5b1ccc4539 [0,1,1,0,0,0|2,0,0]=4 1861 B11R0.70 C=C/C=C/C(=O)NC[C@H](C)OC 91ec68cc58e5965587e1650515403f4e [0,1,1,0,0,0|2,0,0]=4 1862 B11R0.70 C=C/C=C/C(=O)NC[C@H](O)CC 35f23d209147f2bc212da611ab13d385 [0,1,1,0,0,0|2,0,0]=4 1863 B11R0.70 C=C/C=C/C(=O)NC[C@H](O)CO 966d1c77be579f95369b810dbfb82d69 [0,1,1,0,0,0|2,0,0]=4 1864 B11R0.70 C=C/C=C\C(=O)NCC(C)CO 8ffa8a17ba8d2a564c7b009d8d513a85 [0,1,1,0,0,0|2,0,0]=4 1865 B11R0.70 C=C/C=C\C(=O)NCC(O)CC 66bf34d36a3ba10842a35c5299faffb3 [0,1,1,0,0,0|2,0,0]=4 1866 B11R0.70 C=C/C=C\C(=O)NCC(O)CO bbb3d7590f444ce8e18ea87b2deb6012 [0,1,1,0,0,0|2,0,0]=4 1867 B11R0.70 C=C/C=C\C(=O)NC[C@@H](C)OC 169f6d438d5df0110dd52088b28936bd [0,1,1,0,0,0|2,0,0]=4 1868 B11R0.70 C=C/C=C\C(=O)NC[C@@H](O)CO c981bd9369fab3823f9a5f415b15be0f [0,1,1,0,0,0|2,0,0]=4 1869 B11R0.70 C=C/C=C\C(=O)NC[C@H](C)CO d067fef20a7922b4e58324b74c1b192d [0,1,1,0,0,0|2,0,0]=4 1870 B11R0.70 C=C/C=C\C(=O)NC[C@H](C)OC 772c8824aeed8f038ce59f4d4e815db5 [0,1,1,0,0,0|2,0,0]=4 1871 B11R0.70 C=C/C=C\C(=O)NC[C@H](O)CC eb1db659a45fd48bbf2d666c9a4c288f [0,1,1,0,0,0|2,0,0]=4 1872 B11R0.70 C=C/C=C\C(=O)NC[C@H](O)CO 0479206c4dcc2eb33a25cae19841a8f1 [0,1,1,0,0,0|2,0,0]=4 1873 B11R0.70 C=CC=CC(=O)NCC(C)CO 4f2810b3f6b35e69b95236a3d4a74d12 [0,1,1,0,0,0|2,0,0]=4 1874 B11R0.70 C=CC=CC(=O)NCC(O)CC 4fd5926990dbe98890293f18d8ff8e02 [0,1,1,0,0,0|2,0,0]=4 1875 B11R0.70 C=CC=CC(=O)NCC(O)CO 22d91e22b0d824b52dbe32d6743c6745 [0,1,1,0,0,0|2,0,0]=4 1876 B11R0.70 C=CC=CC(=O)NC[C@@H](C)OC 42add3193ff6aac532ea6f68b0c16eb0 [0,1,1,0,0,0|2,0,0]=4 1877 B11R0.70 C=CC=CC(=O)NC[C@@H](O)CO 61693b192ac6fabe489ef772c544f6e3 [0,1,1,0,0,0|2,0,0]=4 1878 B11R0.70 C=CC=CC(=O)NC[C@H](C)CO b0ed8944d1d4c155df6e92901bb9cae7 [0,1,1,0,0,0|2,0,0]=4 1879 B11R0.70 C=CC=CC(=O)NC[C@H](C)OC 73c676b3418950ee1b253424a034bc11 [0,1,1,0,0,0|2,0,0]=4 1880 B11R0.70 C=CC=CC(=O)NC[C@H](O)CC 101fc6d7fcc37cad5b6a9abe86e4013d [0,1,1,0,0,0|2,0,0]=4 1881 B11R0.70 C=CC=CC(=O)NC[C@H](O)CO 03a9a700838ce0da23d61abd932b327d [0,1,1,0,0,0|2,0,0]=4 1882 B11R0.82 C=C/C=C/C(=O)NCC(C)(C)O 8510e9600535bf58f7d727539068ece9 [0,1,1,0,0,0|2,0,0]=4 1883 B11R0.82 C=C/C=C\C(=O)NCC(C)(C)O 9ed6e896c0a894a1cd3a9a66eb875209 [0,1,1,0,0,0|2,0,0]=4 1884 B11R0.82 C=CC=CC(=O)NCC(C)(C)O 00d3e19b32b496dccc1fa24283a589e1 [0,1,1,0,0,0|2,0,0]=4 1885 B11R0.163 C=C/C=C/C(=O)NC(C)C(C)O f7ec4649f101eff70005f809c83773d9 [0,1,1,0,0,0|2,0,0]=4 1886 B11R0.163 C=C/C=C\C(=O)NC(C)C(C)O 26b10b409ca4dc3da888e7b5bbdf3721 [0,1,1,0,0,0|2,0,0]=4 1887 B11R0.163 C=CC=CC(=O)NC(C)C(C)O dfd45f2cfd432ad2f6ab867c29760e6d [0,1,1,0,0,0|2,0,0]=4 1888 B11R1.1 CCCNc1ccc(=O)[nH]c1 788491b37865b7508a806e3465be9c1e [1,1,0,0,0,0|2,0,0]=4 1889 B11R1.1 CCCNc1ccc(cc1)Br 95e3de2d252597fde5ce9a477304d00e [1,1,0,0,0,0|1,0,0]=3 1890 B11R1.1 CCCNc1ccc(cc1)C 60206ed79d50ce0b51d2c9baa6a9bfd8 [1,1,0,0,0,0|1,0,0]=3 1891 B11R1.1 CCCNc1ccc(cc1)Cl 78619a742ccf6ba08a4394e2ee033c54 [1,1,0,0,0,0|1,0,0]=3 1892 B11R1.1 CCCNc1ccc(cc1)F 03593481ab116133e85310d463cb3940 [1,1,0,0,0,0|1,0,0]=3 1893 B11R1.1 CCCNc1ccc(cc1)I 1d619469e460bbb1d49ca10b65682c62 [1,1,0,0,0,0|1,0,0]=3 1894 B11R1.1 CCCNc1ccc(cc1)S 5de90476a8c0464c76157dc952d2c04c [1,1,0,0,0,0|1,0,0]=3 1895 B11R1.1 CCCNc1ccc(cn1)Br 21ad52c0b7cad2f16279c41b12c3dd20 [1,1,0,0,0,0|2,0,0]=4 1896 B11R1.1 CCCNc1ccc(cn1)C 49b1b111cca17d95ac5b969044ae90fe [1,1,0,0,0,0|2,0,0]=4 1897 B11R1.1 CCCNc1ccc(cn1)Cl a95c01f05e53613156fba3b0f8d7f780 [1,1,0,0,0,0|2,0,0]=4 1898 B11R1.1 CCCNc1ccc(cn1)F bd191ccc5254163826bb8b5b65ee6ba9 [1,1,0,0,0,0|2,0,0]=4 1899 B11R1.1 CCCNc1ccc(cn1)I 3117f77f4a2d396d13ad23c0ed5be14e [1,1,0,0,0,0|2,0,0]=4 1900 B11R1.1 CCCNc1ccc(nc1)Br c94a8cb0ce30ba24f74624f4b9b038a4 [1,1,0,0,0,0|2,0,0]=4 1901 B11R1.1 CCCNc1ccc(nc1)C 7d88a307944adac731bde6f988e446cd [1,1,0,0,0,0|2,0,0]=4 1902 B11R1.1 CCCNc1ccc(nc1)Cl b1c722121661a42e5d6842a9b28519ac [1,1,0,0,0,0|2,0,0]=4 1903 B11R1.1 CCCNc1ccc(nc1)F 85865fae01c522e244e3ef69d8b38878 [1,1,0,0,0,0|2,0,0]=4 1904 B11R1.1 CCCNc1ccc(nc1)I b4159aeffce60ad6131e4364b9368e94 [1,1,0,0,0,0|2,0,0]=4 1905 B11R1.1 CCCOc1ccc(cc1)Br fcee74d69e8e023a5434abc8b0385424 [1,1,0,0,0,0|1,0,0]=3 1906 B11R1.1 CCCOc1ccc(cc1)C 4fdcf2ff939bb0420513a197f77843e9 [1,1,0,0,0,0|1,0,0]=3 1907 B11R1.1 CCCOc1ccc(cc1)Cl 6ca291266ab2c05a274ea67a7fbcb647 [1,1,0,0,0,0|1,0,0]=3 1908 B11R1.1 CCCOc1ccc(cc1)F 18444060e70b801a4550e15d090495f3 [1,1,0,0,0,0|1,0,0]=3 1909 B11R1.1 CCCOc1ccc(cc1)I 1cc2cc68a2ed4244fd1e94b3d6df9d5e [1,1,0,0,0,0|1,0,0]=3 1910 B11R1.1 CCCOc1ccc(cc1)S 5c2ad8fc9e5698065bd7177da22c3e46 [1,1,0,0,0,0|1,0,0]=3 1911 B11R1.1 CCCOc1ccc(cn1)C a2aa3425c184ebbd01762c44679803c0 [1,1,0,0,0,0|2,0,0]=4 1912 B11R1.1 CCCOc1ccc(cn1)Cl 0c1b7fe9f246d104ebcbc468a16004c1 [1,1,0,0,0,0|2,0,0]=4 1913 B11R1.1 CCCOc1ccc(cn1)F 6a93fffcdab2ace921c013c1d2a630f1 [1,1,0,0,0,0|2,0,0]=4 1914 B11R1.1 CCCOc1ccc(cn1)I ca1682e59f74f1735f8a64800a62750a [1,1,0,0,0,0|2,0,0]=4 1915 B11R1.1 CCCOc1ccc(nc1)Br c0aef75a4817cab606425a2121c50d36 [1,1,0,0,0,0|2,0,0]=4 1916 B11R1.1 CCCOc1ccc(nc1)C e7dbc804100b6abbbe2b0f45f45546ba [1,1,0,0,0,0|2,0,0]=4 1917 B11R1.1 CCCOc1ccc(nc1)Cl 18ab5a610d56358eac2068ee56cbca89 [1,1,0,0,0,0|2,0,0]=4 1918 B11R1.1 CCCOc1ccc(nc1)F d5473478a7dbdb85a03b2038e1b4207d [1,1,0,0,0,0|2,0,0]=4 1919 B11R1.1 CCCOc1ccc(nc1)I 8a80b63748b30da8afc9dd9cedc24183 [1,1,0,0,0,0|2,0,0]=4 1920 B11R1.1 CCNCc1ccc(=O)[nH]c1 1254ebee348ff16c368fd1d2a91b5fef [1,1,0,0,0,0|2,0,0]=4 1921 B11R1.1 CCNCc1ccc(cc1)Br 2cd51938999c20d02733c25a0b5c4804 [1,1,0,0,0,0|1,0,0]=3 1922 B11R1.1 CCNCc1ccc(cc1)C 587aa1ee1f45a7f7f3762adcf6ab1e89 [1,1,0,0,0,0|1,0,0]=3 1923 B11R1.1 CCNCc1ccc(cc1)Cl 521dc09ab663236062b599824b274153 [1,1,0,0,0,0|1,0,0]=3 1924 B11R1.1 CCNCc1ccc(cc1)F 507a49f5c428a46a95718b00a3fd1bd9 [1,1,0,0,0,0|1,0,0]=3 1925 B11R1.1 CCNCc1ccc(cc1)I cb00fc5924e1405950f010ec806d6a94 [1,1,0,0,0,0|1,0,0]=3 1926 B11R1.1 CCNCc1ccc(cn1)Br 882a30c5c31be62d8df2ad05ade9700e [1,1,0,0,0,0|2,0,0]=4 1927 B11R1.1 CCNCc1ccc(cn1)C ce28a7edd6e5cb339d15632619449df9 [1,1,0,0,0,0|2,0,0]=4 1928 B11R1.1 CCNCc1ccc(cn1)Cl a8b3098af6f06b71ef76b0a789adb905 [1,1,0,0,0,0|2,0,0]=4 1929 B11R1.1 CCNCc1ccc(cn1)F 8ce16a3c3b9cfcc722411ae28895539b [1,1,0,0,0,0|2,0,0]=4 1930 B11R1.1 CCNCc1ccc(nc1)Br 459eae4b7edb145b4c74858ed5083f2a [1,1,0,0,0,0|2,0,0]=4 1931 B11R1.1 CCNCc1ccc(nc1)C be9f6396d87f569ee4a97d2c73536694 [1,1,0,0,0,0|2,0,0]=4 1932 B11R1.1 CCNCc1ccc(nc1)Cl e61d7305db5ae395b6483f66380e1fe0 [1,1,0,0,0,0|2,0,0]=4 1933 B11R1.1 CCNCc1ccc(nc1)F bfcb52b611bb6fe9e54b00a336ddce06 [1,1,0,0,0,0|2,0,0]=4 1934 B11R1.1 CCOCc1cc[n+](cc1)[O-] c821ee3885c58d89975b7f31b845487a [1,1,0,0,0,0|2,0,0]=4 1935 B11R1.1 CCOCc1ccc(cc1)Br 55e365425e5287f17bedcdf9c6cf8797 [1,1,0,0,0,0|1,0,0]=3 1936 B11R1.1 CCOCc1ccc(cc1)C 4d215a4a9529a309b910ed7006942890 [1,1,0,0,0,0|1,0,0]=3 1937 B11R1.1 CCOCc1ccc(cc1)Cl 162fb8a5396843344a75f2243153a2a9 [1,1,0,0,0,0|1,0,0]=3 1938 B11R1.1 CCOCc1ccc(cc1)F 67e386059816bee45125127b16cfcbee [1,1,0,0,0,0|1,0,0]=3 1939 B11R1.1 CCOCc1ccc(cc1)I 25d977d51d9f47d9f153070d57dca8b8 [1,1,0,0,0,0|1,0,0]=3 1940 B11R1.1 CCOCc1ccc(cc1)S 51de74da01a41ad35713330690173be6 [1,1,0,0,0,0|1,0,0]=3 1941 B11R1.1 CCOCc1ccc(cn1)Br 7fa2d6660ca0fac0c5d496c90646d302 [1,1,0,0,0,0|2,0,0]=4 1942 B11R1.1 CCOCc1ccc(cn1)C d87497b35c5f44e142aec59de5813e88 [1,1,0,0,0,0|2,0,0]=4 1943 B11R1.1 CCOCc1ccc(cn1)Cl 6991b553b81a946d1923a2d827bfdbc3 [1,1,0,0,0,0|2,0,0]=4 1944 B11R1.1 CCOCc1ccc(cn1)F c13b565598015e639c197d30e6fbe232 [1,1,0,0,0,0|2,0,0]=4 1945 B11R1.1 CCOCc1ccc(cn1)I 401d1ae041509fd6bf393ad89597efa1 [1,1,0,0,0,0|2,0,0]=4 1946 B11R1.1 CCOCc1ccc(nc1)Br 16508d9e74e22116b4378afff1fa9aa5 [1,1,0,0,0,0|2,0,0]=4 1947 B11R1.1 CCOCc1ccc(nc1)C a880cc0302e1c9d4e4d89c1a296d8d06 [1,1,0,0,0,0|2,0,0]=4 1948 B11R1.1 CCOCc1ccc(nc1)Cl 78e1cd2f782133a4dfac861a528ccf0c [1,1,0,0,0,0|2,0,0]=4 1949 B11R1.1 CCOCc1ccc(nc1)F 965c536d19c11eee65b05ccac1580358 [1,1,0,0,0,0|2,0,0]=4 1950 B11R1.1 COCNc1ccc(cc1)Br 239c0132d7f14bf3bf07ff69790489a4 [1,1,0,0,0,0|2,0,0]=4 1951 B11R1.1 COCNc1ccc(cc1)C e4f246b36607f9f18bc5aa859e62100a [1,1,0,0,0,0|2,0,0]=4 1952 B11R1.1 COCNc1ccc(cc1)Cl 9367c645aa9d92ecdc3a5eedabcc13c5 [1,1,0,0,0,0|2,0,0]=4 1953 B11R1.1 COCNc1ccc(cc1)F f296a10dbbbc66104f13afdffc18051f [1,1,0,0,0,0|2,0,0]=4 1954 B11R1.1 COCNc1ccc(cc1)I 021e3c73bb722af1abf9e932759670c7 [1,1,0,0,0,0|2,0,0]=4 1955 B11R1.1 COCNc1ccc(cc1)S b5677477be0bd1f2c09ba9bfaae89e50 [1,1,0,0,0,0|2,0,0]=4 1956 B11R1.1 COCOc1ccc(cc1)Br 4c7a6b8e747219dccfee467c9fcd68b9 [1,1,0,0,0,0|2,0,0]=4 1957 B11R1.1 COCOc1ccc(cc1)C 6de4302c41d46032c578a0645b570acc [1,1,0,0,0,0|2,0,0]=4 1958 B11R1.1 COCOc1ccc(cc1)Cl fdd4da30c0d821dac2a0c1ce91307d0f [1,1,0,0,0,0|2,0,0]=4 1959 B11R1.1 COCOc1ccc(cc1)F d726aa507ee8c13d395daa40b41c2957 [1,1,0,0,0,0|2,0,0]=4 1960 B11R1.1 COCOc1ccc(cc1)I df653f5f1ee1638a0aae84a7d8d68f8d [1,1,0,0,0,0|2,0,0]=4 1961 B11R1.1 COCOc1ccc(cc1)S eb0b44c1e1c77f48cae0fd09b89123bf [1,1,0,0,0,0|2,0,0]=4 1962 B11R1.1 CSCNc1ccc(cc1)Br 7d08b9f3e3f2fe34f6d8e854d51e1202 [1,1,0,0,0,0|2,0,0]=4 1963 B11R1.1 CSCNc1ccc(cc1)C 7cc547f88ae9a9501b6ce615095d8aea [1,1,0,0,0,0|2,0,0]=4 1964 B11R1.1 CSCNc1ccc(cc1)Cl bf742730b893efd050ccc2ddd2ce37af [1,1,0,0,0,0|2,0,0]=4 1965 B11R1.1 CSCNc1ccc(cc1)F 475459e06b9cf82ddf55d707b377d320 [1,1,0,0,0,0|2,0,0]=4 1966 B11R1.1 CSCNc1ccc(cc1)I 8b3c0b54c1e3dd9102ae085ef652923c [1,1,0,0,0,0|2,0,0]=4 1967 B11R1.1 CSCNc1ccc(cc1)S b2c1b0484112c3320d0a0a482bf3fabe [1,1,0,0,0,0|2,0,0]=4 1968 B11R1.1 CSCOc1ccc(cc1)Br f5a0542c9ba04fa96a3d6a460de6215d [1,1,0,0,0,0|2,0,0]=4 1969 B11R1.1 CSCOc1ccc(cc1)C 35277f269b6e4bad5ee1cc6923a583fd [1,1,0,0,0,0|2,0,0]=4 1970 B11R1.1 CSCOc1ccc(cc1)Cl 818101ab26ff3d96beedc8f3f9d2fff2 [1,1,0,0,0,0|2,0,0]=4 1971 B11R1.1 CSCOc1ccc(cc1)F aa65f6b5260241febe6e598cb66d47bd [1,1,0,0,0,0|2,0,0]=4 1972 B11R1.1 CSCOc1ccc(cc1)I 0cc9619b354e201460eaff3ce7c4b6e3 [1,1,0,0,0,0|2,0,0]=4 1973 B11R1.1 CSCOc1ccc(cc1)S 5eb766d81a2c5ac1d793ebde9bbc88c4 [1,1,0,0,0,0|2,0,0]=4 1974 B11R1.1 Cc1ccc(cc1)CNCF 3d235376bf58ba37ce4fc4687e7358b9 [1,1,0,0,0,0|2,0,0]=4 1975 B11R1.1 Cc1ccc(cc1)CNCO a64a75f18e5667093ebf917d1b07eefc [1,1,0,0,0,0|1,0,0]=3 1976 B11R1.1 Cc1ccc(cc1)COCF be23a3cdf78a8f91f485a087d32e2751 [1,1,0,0,0,0|2,0,0]=4 1977 B11R1.1 Cc1ccc(cc1)NCCF 386681a63315a2a02458b9e317339172 [1,1,0,0,0,0|2,0,0]=4 1978 B11R1.1 Cc1ccc(cc1)NCCI 021b0820ca00ee1bd1c722072e28fcea [1,1,0,0,0,0|2,0,0]=4 1979 B11R1.1 Cc1ccc(cc1)NCCO c023022501f62f6373bdd984b07a8e61 [1,1,0,0,0,0|1,0,0]=3 1980 B11R1.1 Cc1ccc(cc1)NCCS 6ed2fe969f35f3c0b0884c2a5f799763 [1,1,0,0,0,0|1,1,0]=4 1981 B11R1.1 Cc1ccc(cc1)OCCF e658fde0065759000a395a993eb3f831 [1,1,0,0,0,0|2,0,0]=4 1982 B11R1.1 Cc1ccc(cc1)OCCS 11a5d5c742743cac8e072d93bc1a4fc6 [1,1,0,0,0,0|1,1,0]=4 1983 B11R1.1 Cc1ccc(cn1)CNCO dee3af3568e11618521f283cbcaf609a [1,1,0,0,0,0|2,0,0]=4 1984 B11R1.1 Cc1ccc(cn1)NCCO 30ed0c915c1452fa052e397b7ae40d59 [1,1,0,0,0,0|2,0,0]=4 1985 B11R1.1 Cc1ccc(nc1)CNCO 8b5ed39717274fd8ed92909f510b435c [1,1,0,0,0,0|2,0,0]=4 1986 B11R1.1 Cc1ccc(nc1)NCCO 89539a4a1231df63bf072dde77e69a2d [1,1,0,0,0,0|2,0,0]=4 1987 B11R1.1 FCCNc1ccc(cc1)Br 795a720a4c9b19afbc5301fa123947f2 [1,1,0,0,0,0|2,0,0]=4 1988 B11R1.1 FCCNc1ccc(cc1)Cl e3d2a59ab56b1cb94b6555756f53e4df [1,1,0,0,0,0|2,0,0]=4 1989 B11R1.1 FCCNc1ccc(cc1)F 7c335ec10923f1e5e1c0a802d22815aa [1,1,0,0,0,0|2,0,0]=4 1990 B11R1.1 FCCNc1ccc(cc1)I 7a3114f1b82f1ae9c3e9d91f867c2aec [1,1,0,0,0,0|2,0,0]=4 1991 B11R1.1 FCCNc1ccc(cc1)S 4cf1191b5d4fa0438db5fb212abc0568 [1,1,0,0,0,0|2,0,0]=4 1992 B11R1.1 FCCOc1ccc(cc1)Br 44af21b9bd08ebef7a3593bbf1c00f13 [1,1,0,0,0,0|2,0,0]=4 1993 B11R1.1 FCCOc1ccc(cc1)Cl f8953730f3c70ba1c351ddf061f5adb9 [1,1,0,0,0,0|2,0,0]=4 1994 B11R1.1 FCCOc1ccc(cc1)F b8491737d875b8a9ba1853dfb7c71826 [1,1,0,0,0,0|2,0,0]=4 1995 B11R1.1 FCCOc1ccc(cc1)I b3c3da697e2c7b319e1842d4b6e652a6 [1,1,0,0,0,0|2,0,0]=4 1996 B11R1.1 FCCOc1ccc(cc1)S c0287c49d3bee2c771e7d9f8b8b1a91d [1,1,0,0,0,0|2,0,0]=4 1997 B11R1.1 FCNCc1ccc(cc1)Br b716c1dcd41bf6fd6d535897c1b8ce0c [1,1,0,0,0,0|2,0,0]=4 1998 B11R1.1 FCNCc1ccc(cc1)Cl 699409f205c611587d6f375bf5f31fce [1,1,0,0,0,0|2,0,0]=4 1999 B11R1.1 FCNCc1ccc(cc1)F 25a744931aeb914e659c9f9632eb93fc [1,1,0,0,0,0|2,0,0]=4 2000 B11R1.1 FCNCc1ccc(cc1)I d9e1151471912873877eda8a2b6050e5 [1,1,0,0,0,0|2,0,0]=4 2001 B11R1.1 FCOCc1ccc(cc1)Br 5272f40abeb8f9788218e0855efe7f99 [1,1,0,0,0,0|2,0,0]=4 2002 B11R1.1 FCOCc1ccc(cc1)Cl a424b465d05ec98f468ea1690dfb41e3 [1,1,0,0,0,0|2,0,0]=4 2003 B11R1.1 FCOCc1ccc(cc1)F 40afdc034cb36d38932d0008a2d4420f [1,1,0,0,0,0|2,0,0]=4 2004 B11R1.1 FCOCc1ccc(cc1)I 614cbd3d7d1898e18b49cf57a3be3c96 [1,1,0,0,0,0|2,0,0]=4 2005 B11R1.1 FCOCc1ccc(cc1)S caeca7060fe6aa9edb0562b9e232c2bd [1,1,0,0,0,0|2,0,0]=4 2006 B11R1.1 Fc1ccc(cc1)NCCS 96eb09cf1d4b57152e2f391fd4e4c79f [1,1,0,0,0,0|1,1,0]=4 2007 B11R1.1 Fc1ccc(cc1)OCCS c98699e8299c427f19ef74ef43ecdb98 [1,1,0,0,0,0|1,1,0]=4 2008 B11R1.1 O=c1ccc(c[nH]1)CNCO bb83acf187d7f19d584f105f6810294f [1,1,0,0,0,0|2,0,0]=4 2009 B11R1.1 O=c1ccc(c[nH]1)NCCO 410d745dee12fa60b560903e314fdf23 [1,1,0,0,0,0|2,0,0]=4 2010 B11R1.1 OCCNc1ccc(cc1)Br 535465584ac9d4ff57889448ec1b0af0 [1,1,0,0,0,0|1,0,0]=3 2011 B11R1.1 OCCNc1ccc(cc1)Cl 4d55580a2576d97655667590feb9394c [1,1,0,0,0,0|1,0,0]=3 2012 B11R1.1 OCCNc1ccc(cc1)F f0dccf24099a23c54c8c24ea89525ac0 [1,1,0,0,0,0|1,0,0]=3 2013 B11R1.1 OCCNc1ccc(cc1)I 9010f3f5111bb57e7ee5fcc7037cafde [1,1,0,0,0,0|1,0,0]=3 2014 B11R1.1 OCCNc1ccc(cc1)S 4de960e6b8963c27bc320732a003972b [1,1,0,0,0,0|1,0,0]=3 2015 B11R1.1 OCCNc1ccc(cn1)Br 697c3de2afaae9bbb982c9a6366dab99 [1,1,0,0,0,0|2,0,0]=4 2016 B11R1.1 OCCNc1ccc(cn1)Cl bece4a641c5ba21cb6f601a8cec5b6e4 [1,1,0,0,0,0|2,0,0]=4 2017 B11R1.1 OCCNc1ccc(cn1)F 9ca695181e9e504e36cd02cea32905b6 [1,1,0,0,0,0|2,0,0]=4 2018 B11R1.1 OCCNc1ccc(cn1)I d44ab634a65882279d333c5c872969b4 [1,1,0,0,0,0|2,0,0]=4 2019 B11R1.1 OCCNc1ccc(nc1)Br 74240f00e06bbc9166f70ac3706f1bc0 [1,1,0,0,0,0|2,0,0]=4 2020 B11R1.1 OCCNc1ccc(nc1)Cl a52b48650756b8abe6a408b1a544273d [1,1,0,0,0,0|2,0,0]=4 2021 B11R1.1 OCCNc1ccc(nc1)F 119781327aeb530935e1633b31598aa6 [1,1,0,0,0,0|2,0,0]=4 2022 B11R1.1 OCCNc1ccc(nc1)I 35eb69a431b7bdc38ff4ec6a1cca945c [1,1,0,0,0,0|2,0,0]=4 2023 B11R1.1 OCNCc1ccc(cc1)Br 29941d371c032fabf1b94e49679e2b91 [1,1,0,0,0,0|1,0,0]=3 2024 B11R1.1 OCNCc1ccc(cc1)Cl 66d7e1612c59e389035460da5f165c29 [1,1,0,0,0,0|1,0,0]=3 2025 B11R1.1 OCNCc1ccc(cc1)F e82a245e5fea20cb06713ef60eb282ff [1,1,0,0,0,0|1,0,0]=3 2026 B11R1.1 OCNCc1ccc(cc1)I bba7fc5edf7c0932c8de644faad89e3d [1,1,0,0,0,0|1,0,0]=3 2027 B11R1.1 OCNCc1ccc(cn1)Br 7f3d19f9771c479964bba22b4616ef61 [1,1,0,0,0,0|2,0,0]=4 2028 B11R1.1 OCNCc1ccc(cn1)Cl ad113e6a1148f2e84481c6ee13c725cd [1,1,0,0,0,0|2,0,0]=4 2029 B11R1.1 OCNCc1ccc(cn1)F 2e534136875f673e3baed66e480ece0d [1,1,0,0,0,0|2,0,0]=4 2030 B11R1.1 OCNCc1ccc(nc1)Br 6cc1a4aa1eb5f5b5bbe925f3bb7a418b [1,1,0,0,0,0|2,0,0]=4 2031 B11R1.1 OCNCc1ccc(nc1)Cl d558b4ed5167005d1f26f4617ff5147d [1,1,0,0,0,0|2,0,0]=4 2032 B11R1.1 OCNCc1ccc(nc1)F 5789e6b9ee5afb311be62d111026ef87 [1,1,0,0,0,0|2,0,0]=4 2033 B11R1.1 SCCNc1ccc(cc1)Br 41e93a2a025b2d31a08348072d46995d [1,1,0,0,0,0|1,1,0]=4 2034 B11R1.1 SCCNc1ccc(cc1)Cl ee69b35444ec478b79ac20b53c76c74b [1,1,0,0,0,0|1,1,0]=4 2035 B11R1.1 SCCNc1ccc(cc1)I feb446bc7f74f6fc3358374bc85a5fa6 [1,1,0,0,0,0|1,1,0]=4 2036 B11R1.1 SCCNc1ccc(cc1)S 2b2c1e7e53c6fe298543f5113fe04de1 [1,1,0,0,0,0|1,1,0]=4 2037 B11R1.1 SCCOc1ccc(cc1)Br bec71d6fa1c3471b8eb02dbdf51052b8 [1,1,0,0,0,0|1,1,0]=4 2038 B11R1.1 SCCOc1ccc(cc1)Cl 4097eb53f6e8a186542d58da584632ba [1,1,0,0,0,0|1,1,0]=4 2039 B11R1.1 SCCOc1ccc(cc1)I d7cb4bc51a02120fb1493ad10574d07c [1,1,0,0,0,0|1,1,0]=4 2040 B11R1.1 SCCOc1ccc(cc1)S 82e09f61a6f4576bab72abe9784dd780 [1,1,0,0,0,0|1,1,0]=4 2041 B11R1.1 Sc1ccc(cc1)NCCBr 2fd36e3b90e35bd113cc6aa6559ccbb3 [1,1,0,0,0,0|2,0,0]=4 2042 B11R1.1 Sc1ccc(cc1)NCCI 3102b13fbfd44fa9c9c245c461b01292 [1,1,0,0,0,0|2,0,0]=4 2043 B11R1.16 CC(NCO)c1ccccn1 92e2d7a3e5eb4a0cf656a3abd8120ca1 [1,1,0,0,0,0|2,0,0]=4 2044 B11R1.16 CC(NCO)c1cccnc1 862c30acc11398ef9d9eed839c208db8 [1,1,0,0,0,0|2,0,0]=4 2045 B11R1.16 CC(NCO)c1ccncc1 c1d5cc5db08b36fc1a8cd8b573f9e139 [1,1,0,0,0,0|2,0,0]=4 2046 B11R1.16 CC(OCF)c1ccccc1 a5a4510633c1500ac034b294490d7f65 [1,1,0,0,0,0|2,0,0]=4 2047 B11R1.16 CCCN(C)c1ccccc1 5333b12ce18e2a38096b8e486fed114a [1,1,0,0,0,0|1,0,0]=3 2048 B11R1.16 CCCN(C)c1ccccn1 8ff1db8620efe8553f2af13d547cf9e1 [1,1,0,0,0,0|2,0,0]=4 2049 B11R1.16 CCCN(C)c1cccnc1 28cb54c9c808eaf7ba52852976110e8a [1,1,0,0,0,0|2,0,0]=4 2050 B11R1.16 CCCN(C)c1ccncc1 f3869aa81991c685d55848e048247f3e [1,1,0,0,0,0|2,0,0]=4 2051 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [1,1,0,0,0,0|1,0,0]=3 2052 B11R1.16 CCNC(C)c1ccccn1 1349d82fdb3aca31d54d33a892f4429f [1,1,0,0,0,0|2,0,0]=4 2053 B11R1.16 CCNC(C)c1cccnc1 c47433cc5cae1ddbdb53f6ca3e6bfaaf [1,1,0,0,0,0|2,0,0]=4 2054 B11R1.16 CCNC(C)c1ccncc1 4381b6d20643b9397cf1c3275f14ef7f [1,1,0,0,0,0|2,0,0]=4 2055 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [1,1,0,0,0,0|1,0,0]=3 2056 B11R1.16 CCN[C@@H](C)c1ccccn1 6becaa5dd299afbde8d9e40b8df2b64b [1,1,0,0,0,0|2,0,0]=4 2057 B11R1.16 CCN[C@@H](C)c1cccnc1 330151f91eef2953e097f24cd8fe5255 [1,1,0,0,0,0|2,0,0]=4 2058 B11R1.16 CCN[C@@H](C)c1ccncc1 00312d91ebda62098fbd65a2d65ba17c [1,1,0,0,0,0|2,0,0]=4 2059 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [1,1,0,0,0,0|1,0,0]=3 2060 B11R1.16 CCN[C@H](C)c1ccccn1 de5b9d337b6c15bb985fd6d76426b016 [1,1,0,0,0,0|2,0,0]=4 2061 B11R1.16 CCN[C@H](C)c1cccnc1 7cb1b35ff9549b4a705f07ae86659632 [1,1,0,0,0,0|2,0,0]=4 2062 B11R1.16 CCN[C@H](C)c1ccncc1 d9dd8baf03e60276588d8bf323f0d599 [1,1,0,0,0,0|2,0,0]=4 2063 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [1,1,0,0,0,0|1,0,0]=3 2064 B11R1.16 CCOC(C)c1ccccn1 2349fef21e807c42cd2b612eadfb89fd [1,1,0,0,0,0|2,0,0]=4 2065 B11R1.16 CCOC(C)c1cccnc1 9c9e8ee26a948f6734fe8bca4ac259d1 [1,1,0,0,0,0|2,0,0]=4 2066 B11R1.16 CCOC(C)c1ccncc1 e4e418e4b9933d9ffab69561c2ee0b8d [1,1,0,0,0,0|2,0,0]=4 2067 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [1,1,0,0,0,0|1,0,0]=3 2068 B11R1.16 CCO[C@@H](C)c1ccccn1 d31d85c16530817c2b81fb1a03fe7e57 [1,1,0,0,0,0|2,0,0]=4 2069 B11R1.16 CCO[C@@H](C)c1cccnc1 4f79e80bc80f924c1d9263e4c7a80e48 [1,1,0,0,0,0|2,0,0]=4 2070 B11R1.16 CCO[C@@H](C)c1ccncc1 10c7e45b7f2432aed0d2d85f0e9de43f [1,1,0,0,0,0|2,0,0]=4 2071 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [1,1,0,0,0,0|1,0,0]=3 2072 B11R1.16 CCO[C@H](C)c1ccccn1 c768b24f1cd72ff8137851b753ae2d04 [1,1,0,0,0,0|2,0,0]=4 2073 B11R1.16 CCO[C@H](C)c1cccnc1 cd637b20fb4bf525c6de41c7953f4069 [1,1,0,0,0,0|2,0,0]=4 2074 B11R1.16 CCO[C@H](C)c1ccncc1 be826d73c7c9b4a2a044295b6bfe0a2c [1,1,0,0,0,0|2,0,0]=4 2075 B11R1.16 CN(CCF)c1ccccc1 10541e2e32dac0db7a85ea44620c0e3e [1,1,0,0,0,0|2,0,0]=4 2076 B11R1.16 CN(CCO)c1ccccc1 4b734b8d391d02ddf47f0308fb1d22c8 [1,1,0,0,0,0|1,0,0]=3 2077 B11R1.16 CN(CCO)c1ccccn1 e37523a54a1bd0bac80e99fe2cbc8f05 [1,1,0,0,0,0|2,0,0]=4 2078 B11R1.16 CN(CCO)c1cccnc1 47cb1f96fe61f8c7bd838cc6c9d317ed [1,1,0,0,0,0|2,0,0]=4 2079 B11R1.16 CN(CCO)c1ccncc1 3a6a0ee6c83dc5948a0c721338083c57 [1,1,0,0,0,0|2,0,0]=4 2080 B11R1.16 COCN(C)c1ccccc1 6231e4bc9ebe3bdb02fd15faeb34634f [1,1,0,0,0,0|2,0,0]=4 2081 B11R1.16 CSCN(C)c1ccccc1 6fe637e44a17092ac12098dbdcb5352f [1,1,0,0,0,0|2,0,0]=4 2082 B11R1.16 C[C@@H](NCO)c1ccccn1 06a1df171fb3e867c231d94d30fe4c59 [1,1,0,0,0,0|2,0,0]=4 2083 B11R1.16 C[C@@H](NCO)c1cccnc1 cf5dbaaa37b8cb4e2f16350a55683027 [1,1,0,0,0,0|2,0,0]=4 2084 B11R1.16 C[C@@H](NCO)c1ccncc1 7d10d857a4fd7fe5ca5ccba46504091e [1,1,0,0,0,0|2,0,0]=4 2085 B11R1.16 C[C@@H](OCF)c1ccccc1 f6dc1405e5744871891f84657f997fd4 [1,1,0,0,0,0|2,0,0]=4 2086 B11R1.16 C[C@H](NCO)c1ccccn1 d98746896574333cf45787ddae8ffaa8 [1,1,0,0,0,0|2,0,0]=4 2087 B11R1.16 C[C@H](NCO)c1cccnc1 476af247167559627f6aa699dfa54495 [1,1,0,0,0,0|2,0,0]=4 2088 B11R1.16 C[C@H](NCO)c1ccncc1 6f6a1ba3773069295a22e913e615ab17 [1,1,0,0,0,0|2,0,0]=4 2089 B11R1.16 C[C@H](OCF)c1ccccc1 0bdd092ad3daed19f52c193b52481cfc [1,1,0,0,0,0|2,0,0]=4 2090 B11R1.17 CCCNc1c[nH]ccc1=O 30490874c6a3d6f814f9956a624f9fd7 [1,1,0,0,0,0|2,0,0]=4 2091 B11R1.17 CCCNc1c[nH]ccc1=S 5028a294c65f2e90d2d2851d905f870a [1,1,0,0,0,0|2,0,0]=4 2092 B11R1.17 CCCNc1ccc[nH]c1=S 95b7466acbed8c0b7f8cbffc47d54420 [1,1,0,0,0,0|2,0,0]=4 2093 B11R1.17 CCCNc1cccc[n+]1[O-] 9aa6a23beaed595bd0e08509502f2e88 [1,1,0,0,0,0|2,0,0]=4 2094 B11R1.17 CCCNc1ccccc1Cl f06644db92e5a5e5c88ba3d72e76b09c [1,1,0,0,0,0|1,0,0]=3 2095 B11R1.17 CCCNc1ccccc1F b26d422a9020f42016e9a773ea4da59b [1,1,0,0,0,0|1,0,0]=3 2096 B11R1.17 CCCNc1ccccc1I 9667c1f0fcc826e8e0c3d31e03051206 [1,1,0,0,0,0|1,0,0]=3 2097 B11R1.17 CCCNc1cccnc1Br 806ab32b880ec60eaa8de37c8b9a09b3 [1,1,0,0,0,0|2,0,0]=4 2098 B11R1.17 CCCNc1cccnc1C 22a2471d4061d7e8b2734dc78b59847f [1,1,0,0,0,0|2,0,0]=4 2099 B11R1.17 CCCNc1cccnc1Cl d863e25eb1d7fae0beb4f2a560b9b1a5 [1,1,0,0,0,0|2,0,0]=4 2100 B11R1.17 CCCNc1cccnc1F 6429f1513f49f5fa6ff7fe16885b526b [1,1,0,0,0,0|2,0,0]=4 2101 B11R1.17 CCCNc1cccnc1I 9bb718503ad944c42a1784cec5f7c8f8 [1,1,0,0,0,0|2,0,0]=4 2102 B11R1.17 CCCNc1ccncc1Br 5baccc8ac20f503351c093fe202f5f71 [1,1,0,0,0,0|2,0,0]=4 2103 B11R1.17 CCCNc1ccncc1C ed096cc09ac09389a33110eb02659afe [1,1,0,0,0,0|2,0,0]=4 2104 B11R1.17 CCCNc1ccncc1Cl caa35332e0171bc74c66981862eeba0a [1,1,0,0,0,0|2,0,0]=4 2105 B11R1.17 CCCNc1ccncc1F 4edd1964ca584c942ef3c4bc7c8fe94f [1,1,0,0,0,0|2,0,0]=4 2106 B11R1.17 CCCNc1ccncc1I 816ce29e0ba508b65573d6a0f07ce58d [1,1,0,0,0,0|2,0,0]=4 2107 B11R1.17 CCCNc1cnccc1Br 007b289babfb84404970e908ef031a59 [1,1,0,0,0,0|2,0,0]=4 2108 B11R1.17 CCCNc1cnccc1C dcefa786e0d72c346e2c2a750f3eb355 [1,1,0,0,0,0|2,0,0]=4 2109 B11R1.17 CCCNc1cnccc1Cl 2b75a2dd8a9c947a7db5a224583f2e53 [1,1,0,0,0,0|2,0,0]=4 2110 B11R1.17 CCCNc1cnccc1F 0c96675d5ae34365508907ee1228ef3a [1,1,0,0,0,0|2,0,0]=4 2111 B11R1.17 CCCNc1cnccc1I 39c336e4f6a77f3ce348958797714058 [1,1,0,0,0,0|2,0,0]=4 2112 B11R1.17 CCCNc1ncccc1Br afdad602cc18eba6538110beb8225730 [1,1,0,0,0,0|2,0,0]=4 2113 B11R1.17 CCCNc1ncccc1C abec0375ee082a7d48f7cf43776cf112 [1,1,0,0,0,0|2,0,0]=4 2114 B11R1.17 CCCNc1ncccc1Cl b509a2ca435f1e67a922e5764a1cf9c5 [1,1,0,0,0,0|2,0,0]=4 2115 B11R1.17 CCCNc1ncccc1F af3a157f218544df912ffebf16be14cb [1,1,0,0,0,0|2,0,0]=4 2116 B11R1.17 CCCNc1ncccc1I c4c7e827ce85817f94824160ced25561 [1,1,0,0,0,0|2,0,0]=4 2117 B11R1.17 CCCOc1ccc[nH]c1=S 823c5427471293a6b4877bd1519315ca [1,1,0,0,0,0|2,0,0]=4 2118 B11R1.17 CCCOc1cccc[n+]1[O-] 82deb6f6c59813d3c334fbb145a1cf35 [1,1,0,0,0,0|2,0,0]=4 2119 B11R1.17 CCCOc1ccccc1C 6c1a4dc1e6028f3da6f849553f219900 [1,1,0,0,0,0|1,0,0]=3 2120 B11R1.17 CCCOc1ccccc1Cl 4721246108b2629d9b8b29c6ad627685 [1,1,0,0,0,0|1,0,0]=3 2121 B11R1.17 CCCOc1ccccc1F e002653ab86def653a9f4f2e92420612 [1,1,0,0,0,0|1,0,0]=3 2122 B11R1.17 CCCOc1ccccc1I 2ec532f87a4a1971649b297302a06402 [1,1,0,0,0,0|1,0,0]=3 2123 B11R1.17 CCCOc1ccccc1S a0d26031bd542d5d05da52b2adf5a399 [1,1,0,0,0,0|1,0,0]=3 2124 B11R1.17 CCCOc1cccnc1Br 115afbdd34d18eb1d8ab3c1f8d43d3be [1,1,0,0,0,0|2,0,0]=4 2125 B11R1.17 CCCOc1cccnc1C 1ed437f8fbe2f5e0b870ba84e31d17c0 [1,1,0,0,0,0|2,0,0]=4 2126 B11R1.17 CCCOc1cccnc1Cl edf30018692c32749c24b87a6d0498a1 [1,1,0,0,0,0|2,0,0]=4 2127 B11R1.17 CCCOc1cccnc1F 5ee70f4822753bd9da31b99184a90a77 [1,1,0,0,0,0|2,0,0]=4 2128 B11R1.17 CCCOc1cccnc1I 3e57bebc485592a1e6ceadbef8f3a8b5 [1,1,0,0,0,0|2,0,0]=4 2129 B11R1.17 CCCOc1cccoc1=O 6138b137437ffe69557e48d4e459d7b1 [1,1,0,0,0,0|2,0,0]=4 2130 B11R1.17 CCCOc1ccncc1Br d86fdc6f369361e6dd143014c3fcc95b [1,1,0,0,0,0|2,0,0]=4 2131 B11R1.17 CCCOc1ccncc1C 3073b76d6073e61bbeb487a8fcbb554b [1,1,0,0,0,0|2,0,0]=4 2132 B11R1.17 CCCOc1ccncc1Cl 2e20845339f1a9b7a13d7a11772fe9ba [1,1,0,0,0,0|2,0,0]=4 2133 B11R1.17 CCCOc1ccncc1F d068a6fff4820cdae1a2251c79e22937 [1,1,0,0,0,0|2,0,0]=4 2134 B11R1.17 CCCOc1cnccc1Br 33eee72d4b7297486d5285207fea74a8 [1,1,0,0,0,0|2,0,0]=4 2135 B11R1.17 CCCOc1cnccc1C 45ff092a3d49118757409dc90c0d8b53 [1,1,0,0,0,0|2,0,0]=4 2136 B11R1.17 CCCOc1cnccc1Cl 129434639f839466cae39279066d29a9 [1,1,0,0,0,0|2,0,0]=4 2137 B11R1.17 CCCOc1cnccc1F 7275b9af8dd5f2cc96d1a4ae1db2b570 [1,1,0,0,0,0|2,0,0]=4 2138 B11R1.17 CCCOc1cnccc1I 398d79496d40e0c234bb46c874339373 [1,1,0,0,0,0|2,0,0]=4 2139 B11R1.17 CCCOc1coccc1=O b6bf03e1584dff0542ba5ae4918d593d [1,1,0,0,0,0|2,0,0]=4 2140 B11R1.17 CCCOc1ncccc1Br 591cb4e29b3d78165b95627fad6003be [1,1,0,0,0,0|2,0,0]=4 2141 B11R1.17 CCCOc1ncccc1C 75d7921d560a6b2f851a2acab9f2614a [1,1,0,0,0,0|2,0,0]=4 2142 B11R1.17 CCCOc1ncccc1Cl 0a16720fcbf52b5cf544018f35b8eeec [1,1,0,0,0,0|2,0,0]=4 2143 B11R1.17 CCCOc1ncccc1F ee3952c45bf36a13ea36600dcc4a174a [1,1,0,0,0,0|2,0,0]=4 2144 B11R1.17 CCCOn1ccccc1=N c3e5c6befd39507962097d04a5993bb6 [1,1,0,0,0,0|2,0,0]=4 2145 B11R1.17 CCCOn1ccccc1=O 92412e4a3e132ee80b8a961a7007d7f9 [1,1,0,0,0,0|2,0,0]=4 2146 B11R1.17 CCCOn1ccccc1=S 7e6c660224fc15a11584e60a50320275 [1,1,0,0,0,0|2,0,0]=4 2147 B11R1.17 CCNCc1cccc[n+]1[O-] 4482be04b13bf2a14654c2b7dc44e9ba [1,1,0,0,0,0|2,0,0]=4 2148 B11R1.17 CCNCc1ccccc1Br 8f6bd2781373b66afc29396cae666f02 [1,1,0,0,0,0|1,0,0]=3 2149 B11R1.17 CCNCc1ccccc1C 284345fa1eb882542c433fcb95919ca4 [1,1,0,0,0,0|1,0,0]=3 2150 B11R1.17 CCNCc1ccccc1Cl db65b4e8d8ccf115e617990e552ab4c8 [1,1,0,0,0,0|1,0,0]=3 2151 B11R1.17 CCNCc1ccccc1F 9048c9b0864184d75154ea96f3fe50b8 [1,1,0,0,0,0|1,0,0]=3 2152 B11R1.17 CCNCc1ccccc1I d0f5abf080424e879ba8e6dfea920ca7 [1,1,0,0,0,0|1,0,0]=3 2153 B11R1.17 CCNCc1cccnc1Br 32ff08bdc8b36f4fd72794d17b8094db [1,1,0,0,0,0|2,0,0]=4 2154 B11R1.17 CCNCc1cccnc1C 0a1b3485e2e73031e3e3fc0c87c75e22 [1,1,0,0,0,0|2,0,0]=4 2155 B11R1.17 CCNCc1cccnc1Cl 9f0320d1cb7ffe46922a86002c904be4 [1,1,0,0,0,0|2,0,0]=4 2156 B11R1.17 CCNCc1cccnc1F 2e93965ca7c62978c851e96fc991f385 [1,1,0,0,0,0|2,0,0]=4 2157 B11R1.17 CCNCc1ccncc1Br 4146c57719c4214353b9e0a0192ab294 [1,1,0,0,0,0|2,0,0]=4 2158 B11R1.17 CCNCc1ccncc1C 959f5887b5695b7da0c1d9119cd1d02d [1,1,0,0,0,0|2,0,0]=4 2159 B11R1.17 CCNCc1ccncc1Cl c88983b00bc64b2923854d4c84d9ac44 [1,1,0,0,0,0|2,0,0]=4 2160 B11R1.17 CCNCc1ccncc1F b7377fd886bb5422ff2b6a184eefb6a7 [1,1,0,0,0,0|2,0,0]=4 2161 B11R1.17 CCNCc1cnccc1C 4bf7654e6c7ab59c2c967e90494ba077 [1,1,0,0,0,0|2,0,0]=4 2162 B11R1.17 CCNCc1ncccc1Br 09995fa96814a8c54c9bca09512a1c87 [1,1,0,0,0,0|2,0,0]=4 2163 B11R1.17 CCNCc1ncccc1C 87bcb20686c74c1349ceb9aba049bbf8 [1,1,0,0,0,0|2,0,0]=4 2164 B11R1.17 CCNCc1ncccc1Cl 3fcb8c6a497a9d9b3a48e230bfe378a1 [1,1,0,0,0,0|2,0,0]=4 2165 B11R1.17 CCNCc1ncccc1F dda2cc3453d8ca1ee059e44555253881 [1,1,0,0,0,0|2,0,0]=4 2166 B11R1.17 CCOCc1ccc[nH]c1=O 5a855846d572bde3e5fb10b6739b9742 [1,1,0,0,0,0|2,0,0]=4 2167 B11R1.17 CCOCc1ccccc1C 939ca93b69bfa487d1d8ecb62c2d84e3 [1,1,0,0,0,0|1,0,0]=3 2168 B11R1.17 CCOCc1ccccc1Cl e7556758f6c778f3c386ca652094b5cc [1,1,0,0,0,0|1,0,0]=3 2169 B11R1.17 CCOCc1ccccc1F 5a297cb41f57dfedbabc975eceaf6126 [1,1,0,0,0,0|1,0,0]=3 2170 B11R1.17 CCOCc1ccccc1I 7a255f979ee626f845777c39e07b9738 [1,1,0,0,0,0|1,0,0]=3 2171 B11R1.17 CCOCc1cccnc1Br 84c896bbf791f636167b96d78239b3f5 [1,1,0,0,0,0|2,0,0]=4 2172 B11R1.17 CCOCc1cccnc1C 10fe290309f01ddd76b919ada33fcfb8 [1,1,0,0,0,0|2,0,0]=4 2173 B11R1.17 CCOCc1cccnc1Cl 0fdb01e029eba9fd77978b05f349ad64 [1,1,0,0,0,0|2,0,0]=4 2174 B11R1.17 CCOCc1cccnc1F 26b203b8b1a12b477d6336928b6ab8d4 [1,1,0,0,0,0|2,0,0]=4 2175 B11R1.17 CCOCc1ccncc1Br 7fea4acea2c5526a7051925c6a3e6d0b [1,1,0,0,0,0|2,0,0]=4 2176 B11R1.17 CCOCc1ccncc1C c2e03a76229a18838878f9a03032e5ea [1,1,0,0,0,0|2,0,0]=4 2177 B11R1.17 CCOCc1ccncc1Cl 1c546d21bdf269acd61e737db0aac5c9 [1,1,0,0,0,0|2,0,0]=4 2178 B11R1.17 CCOCc1ccncc1F e413c9ff65fce8974f443c480b5d6247 [1,1,0,0,0,0|2,0,0]=4 2179 B11R1.17 CCOCc1ccncc1I 8c85472884ce798142cf3dd5a07777d9 [1,1,0,0,0,0|2,0,0]=4 2180 B11R1.17 CCOCc1cnccc1Br 750cda4e9bc34f5a91eb935189c60ab8 [1,1,0,0,0,0|2,0,0]=4 2181 B11R1.17 CCOCc1cnccc1C c7331a6c4dde5c450ee6a5c1e8ddd68f [1,1,0,0,0,0|2,0,0]=4 2182 B11R1.17 CCOCc1cnccc1Cl d0ea2c29bb03569328f3a86c14865fe2 [1,1,0,0,0,0|2,0,0]=4 2183 B11R1.17 CCOCc1cnccc1F 35e2ec5af2d1d295476ee94596fb4fa5 [1,1,0,0,0,0|2,0,0]=4 2184 B11R1.17 CCOCc1ncccc1Br a900f8070f81c4dcfb6829872fbeb70d [1,1,0,0,0,0|2,0,0]=4 2185 B11R1.17 CCOCc1ncccc1C 22c6c25dddf153fd6e4a707af4b8068f [1,1,0,0,0,0|2,0,0]=4 2186 B11R1.17 CCOCc1ncccc1Cl 3c0fdcad26845cb45b2978d3ea158930 [1,1,0,0,0,0|2,0,0]=4 2187 B11R1.17 CCOCc1ncccc1F 27994f3f8111644da417064253c7144c [1,1,0,0,0,0|2,0,0]=4 2188 B11R1.17 COCNc1ccccc1C fb9a5d913c4919343dd03f9e91ff77a7 [1,1,0,0,0,0|2,0,0]=4 2189 B11R1.17 COCNc1ccccc1Cl 37814819f7301c2697cb787bf3caaaf8 [1,1,0,0,0,0|2,0,0]=4 2190 B11R1.17 COCNc1ccccc1F 012796c2f433b353de6e293cf868c18c [1,1,0,0,0,0|2,0,0]=4 2191 B11R1.17 COCNc1ccccc1I 35361f687b9768a5f1a636654e8c5a8e [1,1,0,0,0,0|2,0,0]=4 2192 B11R1.17 COCOc1ccccc1C 716fa0606a50157c01134bcaabfa95bd [1,1,0,0,0,0|2,0,0]=4 2193 B11R1.17 COCOc1ccccc1Cl 63c703b93e4b02a8003a5132c238f561 [1,1,0,0,0,0|2,0,0]=4 2194 B11R1.17 COCOc1ccccc1F e22b80c6c7e596d1bc182ef8d0d8cb18 [1,1,0,0,0,0|2,0,0]=4 2195 B11R1.17 CSCNc1ccccc1F 9b4d3e42ede948c3ffb1bbc9d3fe8d03 [1,1,0,0,0,0|2,0,0]=4 2196 B11R1.17 CSCNc1ccccc1I a0076d1329bc09c3003b2ceb79d20cbe [1,1,0,0,0,0|2,0,0]=4 2197 B11R1.17 CSCOc1ccccc1C bbddea75066310ddae50c52e1fce5d3e [1,1,0,0,0,0|2,0,0]=4 2198 B11R1.17 CSCOc1ccccc1Cl 5d51d1316509893e2db24974b33cf402 [1,1,0,0,0,0|2,0,0]=4 2199 B11R1.17 CSCOc1ccccc1F 14f1053691f335280e6f60bd9f75106c [1,1,0,0,0,0|2,0,0]=4 2200 B11R1.17 CSCOc1ccccc1I 4e0705c8c2f09f68040c0c612c698d64 [1,1,0,0,0,0|2,0,0]=4 2201 B11R1.17 Cc1ccccc1CNCF 15e4bda543c50e3e0f080863eb75d61e [1,1,0,0,0,0|2,0,0]=4 2202 B11R1.17 Cc1ccccc1CNCO f33352c0e02ea4b4ea9a0720598f200e [1,1,0,0,0,0|1,0,0]=3 2203 B11R1.17 Cc1ccccc1COCF 26a9ff4e1acee4455bed5578adee3d1b [1,1,0,0,0,0|2,0,0]=4 2204 B11R1.17 Cc1ccccc1NCCBr 1a7be6e12078aed98559b61c844bde43 [1,1,0,0,0,0|2,0,0]=4 2205 B11R1.17 Cc1ccccc1NCCF 0e5d4c97f9157c508297bd93ae8f5371 [1,1,0,0,0,0|2,0,0]=4 2206 B11R1.17 Cc1ccccc1NCCO 5035e646db6f3a444835335ac8083c14 [1,1,0,0,0,0|1,0,0]=3 2207 B11R1.17 Cc1ccccc1NCCS 2a25a74370bfe5d7316ba8388c7b4945 [1,1,0,0,0,0|1,1,0]=4 2208 B11R1.17 Cc1ccccc1OCCF f6d7b302f46f820a9e73f4fb8f637bde [1,1,0,0,0,0|2,0,0]=4 2209 B11R1.17 Cc1ccccc1OCCS b005873ca988c2b5b3e2488fe6505c14 [1,1,0,0,0,0|1,1,0]=4 2210 B11R1.17 Cc1cccnc1CNCO 30441c00bc8726da80cd698c0c87c74c [1,1,0,0,0,0|2,0,0]=4 2211 B11R1.17 Cc1cccnc1NCCO 478e63720a6f78f7fa3d3c8fa6de1dc4 [1,1,0,0,0,0|2,0,0]=4 2212 B11R1.17 Cc1ccncc1CNCO 8820a85b37c3e4693661ff6b2f5470a7 [1,1,0,0,0,0|2,0,0]=4 2213 B11R1.17 Cc1ccncc1NCCO 71303c497b4f37f3acd74a0343a0436a [1,1,0,0,0,0|2,0,0]=4 2214 B11R1.17 Cc1cnccc1CNCO f46edf824f8d525036629a5904a74512 [1,1,0,0,0,0|2,0,0]=4 2215 B11R1.17 Cc1cnccc1NCCO 0a487d14b9965ddf673112095ea27432 [1,1,0,0,0,0|2,0,0]=4 2216 B11R1.17 Cc1ncccc1CNCO ebac33228c10df30635cfd2541d72802 [1,1,0,0,0,0|2,0,0]=4 2217 B11R1.17 Cc1ncccc1NCCO ab9708ed7eee969d0130cff840722f62 [1,1,0,0,0,0|2,0,0]=4 2218 B11R1.17 FCCNc1ccccc1Cl f556874146c6a72f9a84f0bd26070247 [1,1,0,0,0,0|2,0,0]=4 2219 B11R1.17 FCCNc1ccccc1F e2cbe2a439b6bba8166d18f4a8de4742 [1,1,0,0,0,0|2,0,0]=4 2220 B11R1.17 FCCNc1ccccc1I 3c8616ee89755bf6f05caef3c69371bd [1,1,0,0,0,0|2,0,0]=4 2221 B11R1.17 FCCOc1ccccc1Cl 01c3ab339b3cc97f239d998f0df99ac6 [1,1,0,0,0,0|2,0,0]=4 2222 B11R1.17 FCCOc1ccccc1F 89d9f7646bebd63d142c637ad96d7af6 [1,1,0,0,0,0|2,0,0]=4 2223 B11R1.17 FCCOc1ccccc1I e68149bbe7bd740697745ed331d108ad [1,1,0,0,0,0|2,0,0]=4 2224 B11R1.17 FCNCc1ccccc1Br dc60c3e5196679a6ad7a9fd07289336a [1,1,0,0,0,0|2,0,0]=4 2225 B11R1.17 FCNCc1ccccc1Cl b2a7e5b738ab7ee1b7f97a02c137519e [1,1,0,0,0,0|2,0,0]=4 2226 B11R1.17 FCNCc1ccccc1F c6a27c7f8e1ab840ee4f8b21e6ebec91 [1,1,0,0,0,0|2,0,0]=4 2227 B11R1.17 FCNCc1ccccc1I 072ca4290b9a717a2a3ef28ccf6dc79f [1,1,0,0,0,0|2,0,0]=4 2228 B11R1.17 FCOCc1ccccc1Br 1e405168174e3e5a39762fd8efcb0e02 [1,1,0,0,0,0|2,0,0]=4 2229 B11R1.17 FCOCc1ccccc1Cl 1bf9ea1561018dfe59c2c98ef1a6a3e2 [1,1,0,0,0,0|2,0,0]=4 2230 B11R1.17 FCOCc1ccccc1F 3daad749644938528762801a7655c80c [1,1,0,0,0,0|2,0,0]=4 2231 B11R1.17 FCOCc1ccccc1I 31f2d72b4794f19953f85fef60c6eb00 [1,1,0,0,0,0|2,0,0]=4 2232 B11R1.17 FCOCc1ccccc1S ccd959bb9897533e9284e6c6e657b910 [1,1,0,0,0,0|2,0,0]=4 2233 B11R1.17 Fc1ccccc1NCCS 4e9be5faedc4f5d0920a07998748916a [1,1,0,0,0,0|1,1,0]=4 2234 B11R1.17 Fc1ccccc1OCCS b5b3c652dc21fd01fc4857235680bf44 [1,1,0,0,0,0|1,1,0]=4 2235 B11R1.17 O=c1[nH]cccc1NCCO cc68334eb3c628cfa3c24f07b04e588e [1,1,0,0,0,0|2,0,0]=4 2236 B11R1.17 O=c1cc[nH]cc1NCCO 458d9a72e8a917a80d0959ca46d24b10 [1,1,0,0,0,0|2,0,0]=4 2237 B11R1.17 OCCNc1c[nH]ccc1=S 5f1ade7dda9e1b5f565201b95b73f1fb [1,1,0,0,0,0|2,0,0]=4 2238 B11R1.17 OCCNc1ccc[nH]c1=S b18b5b8249c6732cb3b93d7dc4d173d9 [1,1,0,0,0,0|2,0,0]=4 2239 B11R1.17 OCCNc1ccccc1Cl 7e00c321a95d99f226af9355a5b8fd97 [1,1,0,0,0,0|1,0,0]=3 2240 B11R1.17 OCCNc1ccccc1F 4c6208b79575fb1b4efb9bc595ec7419 [1,1,0,0,0,0|1,0,0]=3 2241 B11R1.17 OCCNc1ccccc1I 7422a69e1fe9722f423454637884bff2 [1,1,0,0,0,0|1,0,0]=3 2242 B11R1.17 OCCNc1ccccc1S 987e6c2de89f4ccfc6bc2df488fb2f56 [1,1,0,0,0,0|1,0,0]=3 2243 B11R1.17 OCCNc1cccnc1Br 632fae30d029a1c8ef0a9e6f61a983a9 [1,1,0,0,0,0|2,0,0]=4 2244 B11R1.17 OCCNc1cccnc1Cl 4e43b583e8ff101b60a4e7e9502f1ee3 [1,1,0,0,0,0|2,0,0]=4 2245 B11R1.17 OCCNc1cccnc1F 491a8db0e71e9cf9b49f5b0b7b046e39 [1,1,0,0,0,0|2,0,0]=4 2246 B11R1.17 OCCNc1cccnc1I 7a6f746233f4e6bd5fec2cf961b376a4 [1,1,0,0,0,0|2,0,0]=4 2247 B11R1.17 OCCNc1ccncc1Br 2211ba876dd3a8159d70bed4d722d56b [1,1,0,0,0,0|2,0,0]=4 2248 B11R1.17 OCCNc1ccncc1Cl 60c6f2518e071d1ae0e5a82422510783 [1,1,0,0,0,0|2,0,0]=4 2249 B11R1.17 OCCNc1ccncc1F ef4e40a51c04130c9155c74dbf9133e9 [1,1,0,0,0,0|2,0,0]=4 2250 B11R1.17 OCCNc1ccncc1I a2a0550d234a33f36a2beb202155df7a [1,1,0,0,0,0|2,0,0]=4 2251 B11R1.17 OCCNc1cnccc1Br 17bda48140229f336d0cc327d867300f [1,1,0,0,0,0|2,0,0]=4 2252 B11R1.17 OCCNc1cnccc1Cl 2d5ffbe6dc64de930d7f8c5236e689bb [1,1,0,0,0,0|2,0,0]=4 2253 B11R1.17 OCCNc1cnccc1F 12bb173d1fe6407e66aaac0e9d6e0b91 [1,1,0,0,0,0|2,0,0]=4 2254 B11R1.17 OCCNc1cnccc1I 86596fa8ff18bc6049ebc8196c621ea7 [1,1,0,0,0,0|2,0,0]=4 2255 B11R1.17 OCCNc1ncccc1Br 0548355e3244a92d79969bfcd2d73738 [1,1,0,0,0,0|2,0,0]=4 2256 B11R1.17 OCCNc1ncccc1Cl fb24191d2ae955de5523cbc99ed0e194 [1,1,0,0,0,0|2,0,0]=4 2257 B11R1.17 OCCNc1ncccc1F d121ec624e5ab5f9b9966d8d8f14f0d4 [1,1,0,0,0,0|2,0,0]=4 2258 B11R1.17 OCCNc1ncccc1I 572fad78fee75cd5b25db51cecd6f336 [1,1,0,0,0,0|2,0,0]=4 2259 B11R1.17 OCNCc1ccccc1Br 0209dca586483b54ccb56f7ccd9012ce [1,1,0,0,0,0|1,0,0]=3 2260 B11R1.17 OCNCc1ccccc1Cl 5475d2d62064a77dd3e8f040ca795a73 [1,1,0,0,0,0|1,0,0]=3 2261 B11R1.17 OCNCc1ccccc1F a78f02dd794e5b9637da439e4010cc0a [1,1,0,0,0,0|1,0,0]=3 2262 B11R1.17 OCNCc1ccccc1I 6ad26aea5b9fc20136e87fd70971bc76 [1,1,0,0,0,0|1,0,0]=3 2263 B11R1.17 OCNCc1cccnc1Br fa04fbdfe2ab7ab585c87e8888997fde [1,1,0,0,0,0|2,0,0]=4 2264 B11R1.17 OCNCc1cccnc1Cl e098226076d1bf05b07c0db61b1608b0 [1,1,0,0,0,0|2,0,0]=4 2265 B11R1.17 OCNCc1cccnc1F becc02815a15c17406558b70fdb845a8 [1,1,0,0,0,0|2,0,0]=4 2266 B11R1.17 OCNCc1ccncc1Br 217383617b17a78941bd521a0c40dae7 [1,1,0,0,0,0|2,0,0]=4 2267 B11R1.17 OCNCc1ccncc1Cl 6d17554379bde9c33e92fb7fd7d0b9f9 [1,1,0,0,0,0|2,0,0]=4 2268 B11R1.17 OCNCc1ccncc1F aa8afb20a67cbc48484f103b5e2b4346 [1,1,0,0,0,0|2,0,0]=4 2269 B11R1.17 OCNCc1ncccc1Br b3063f47e1ec26ad2317599d840e6a3f [1,1,0,0,0,0|2,0,0]=4 2270 B11R1.17 OCNCc1ncccc1Cl 00c0e4e1c0f5be5f03ce1610dfdfc900 [1,1,0,0,0,0|2,0,0]=4 2271 B11R1.17 OCNCc1ncccc1F 3eb4781c927959737348d1749c1cc471 [1,1,0,0,0,0|2,0,0]=4 2272 B11R1.17 SCCNc1ccccc1Cl 8eb275d5fd7aa75f04843d2c9b15e888 [1,1,0,0,0,0|1,1,0]=4 2273 B11R1.17 SCCNc1ccccc1I 7aa64189a44cf315624ec283017501ec [1,1,0,0,0,0|1,1,0]=4 2274 B11R1.17 SCCNc1ccccc1S 7f3f9d44512381b1f5e117db6c186831 [1,1,0,0,0,0|1,1,0]=4 2275 B11R1.17 SCCOc1ccccc1Br 2c9be4111e88e1cef97e0afbaa43f88c [1,1,0,0,0,0|1,1,0]=4 2276 B11R1.17 SCCOc1ccccc1Cl 3c48aa6ff52eb58ee2e3c87740c748bd [1,1,0,0,0,0|1,1,0]=4 2277 B11R1.17 SCCOc1ccccc1I 5f761222ba044a2385a944adcc40619f [1,1,0,0,0,0|1,1,0]=4 2278 B11R1.17 SCCOc1ccccc1S 761c20209c9eb8a0b566991b5c1ab081 [1,1,0,0,0,0|1,1,0]=4 2279 B11R1.17 [O-][n+]1ccccc1CNCO f44a10283482acb4e38bb9f793c09558 [1,1,0,0,0,0|2,0,0]=4 2280 B11R1.17 [O-][n+]1ccccc1NCCO 22efb9f86d8049f196573cec9343adc3 [1,1,0,0,0,0|2,0,0]=4 2281 B11R1.24 CCCNc1cc(ccn1)Br f1c13a780ea072a97f4918a3ae5fe793 [1,1,0,0,0,0|2,0,0]=4 2282 B11R1.24 CCCNc1cc(ccn1)C 9dd4b3ccbbc29296234e9ff62794f94d [1,1,0,0,0,0|2,0,0]=4 2283 B11R1.24 CCCNc1cc(ccn1)Cl e2748ea47500b5c43ad80436ec365351 [1,1,0,0,0,0|2,0,0]=4 2284 B11R1.24 CCCNc1cc(ccn1)F 19627d65edc699fb72ffad9630193c09 [1,1,0,0,0,0|2,0,0]=4 2285 B11R1.24 CCCNc1cc(ccn1)I 84f5d93869eede5ea29829b3c07bd844 [1,1,0,0,0,0|2,0,0]=4 2286 B11R1.24 CCCNc1cc[nH]c(=S)c1 360300b5400595cc8e7a69cc96fcab9d [1,1,0,0,0,0|2,0,0]=4 2287 B11R1.24 CCCNc1cccc(c1)Br acb1f2bb5e7b1b5520f3f6cb5aa22aaf [1,1,0,0,0,0|1,0,0]=3 2288 B11R1.24 CCCNc1cccc(c1)C e421761759f1c746a8f404b8a3a2f9e1 [1,1,0,0,0,0|1,0,0]=3 2289 B11R1.24 CCCNc1cccc(c1)Cl 5f3ddf9c366c2329c81257ae31beedbd [1,1,0,0,0,0|1,0,0]=3 2290 B11R1.24 CCCNc1cccc(c1)F ea1b244e71e5a96c27eaf1a47c4045c2 [1,1,0,0,0,0|1,0,0]=3 2291 B11R1.24 CCCNc1cccc(c1)I 25b73dbb892b7f389897d5a43a220453 [1,1,0,0,0,0|1,0,0]=3 2292 B11R1.24 CCCNc1cccc(c1)S 225c14a2af7bde79a1ce2cf37e4d273b [1,1,0,0,0,0|1,0,0]=3 2293 B11R1.24 CCCNc1cccc(n1)Br 922806381eb036239ce652ef71179a3c [1,1,0,0,0,0|2,0,0]=4 2294 B11R1.24 CCCNc1cccc(n1)C ac360e9e258569f548399e28fa3180d8 [1,1,0,0,0,0|2,0,0]=4 2295 B11R1.24 CCCNc1cccc(n1)Cl dce45d6f17ac605453290d833800c971 [1,1,0,0,0,0|2,0,0]=4 2296 B11R1.24 CCCNc1cccc(n1)F 6c39e109efcbcaf4d3a5d07f4418f5de [1,1,0,0,0,0|2,0,0]=4 2297 B11R1.24 CCCNc1cccc(n1)I 257cf609e45e5409e5f7885d77dcd130 [1,1,0,0,0,0|2,0,0]=4 2298 B11R1.24 CCCNc1ccnc(c1)Br b90db3b5c651f3912bd587d5844c555e [1,1,0,0,0,0|2,0,0]=4 2299 B11R1.24 CCCNc1ccnc(c1)C b66f498b52f5cbd7e72f509e0a6f41be [1,1,0,0,0,0|2,0,0]=4 2300 B11R1.24 CCCNc1ccnc(c1)Cl 72efba47fe28dc78535cf0d2b78b85d7 [1,1,0,0,0,0|2,0,0]=4 2301 B11R1.24 CCCNc1ccnc(c1)F e126bb77c767f16e4a7cb3dc41a6ccca [1,1,0,0,0,0|2,0,0]=4 2302 B11R1.24 CCCNc1ccnc(c1)I 9604ffc88e9cb615da6af887aba38dd5 [1,1,0,0,0,0|2,0,0]=4 2303 B11R1.24 CCCNc1cncc(c1)Br df91207309bb098127db46b0c6c28373 [1,1,0,0,0,0|2,0,0]=4 2304 B11R1.24 CCCNc1cncc(c1)C 17cc7df963debf4f8ee3c67f6dbccd63 [1,1,0,0,0,0|2,0,0]=4 2305 B11R1.24 CCCNc1cncc(c1)Cl 0c2e6062e8edca14a7c30617675a1f46 [1,1,0,0,0,0|2,0,0]=4 2306 B11R1.24 CCCNc1cncc(c1)F ee0c8e82c86888a5308b2d5ae8e4dc3e [1,1,0,0,0,0|2,0,0]=4 2307 B11R1.24 CCCNc1cncc(c1)I 6d9481f5c9f1d1a015a6a7e6ac1b7f83 [1,1,0,0,0,0|2,0,0]=4 2308 B11R1.24 CCCOc1cc(ccn1)Br 733fbc0062452a6d408b5de5a71ee204 [1,1,0,0,0,0|2,0,0]=4 2309 B11R1.24 CCCOc1cc(ccn1)C e0a5b7a4ceaf137253b09aaa74d8a523 [1,1,0,0,0,0|2,0,0]=4 2310 B11R1.24 CCCOc1cc(ccn1)Cl 9bec7845ed0cc2ec4528299e79a75327 [1,1,0,0,0,0|2,0,0]=4 2311 B11R1.24 CCCOc1cc(ccn1)F 0dc309ef3e091b80292d2495314d3e88 [1,1,0,0,0,0|2,0,0]=4 2312 B11R1.24 CCCOc1ccc[n+](c1)[O-] 68ae6157371b1d08945de942e24dbfcb [1,1,0,0,0,0|2,0,0]=4 2313 B11R1.24 CCCOc1cccc(=O)[nH]1 5737faf370dd02b121376f36c61aae8a [1,1,0,0,0,0|2,0,0]=4 2314 B11R1.24 CCCOc1cccc(c1)Br a13e2d3b97569660f2094ead5808f8a1 [1,1,0,0,0,0|1,0,0]=3 2315 B11R1.24 CCCOc1cccc(c1)C d7061e70aaece534ca2df7008d458f1f [1,1,0,0,0,0|1,0,0]=3 2316 B11R1.24 CCCOc1cccc(c1)Cl dd576836e51eec77f1708e34dc442061 [1,1,0,0,0,0|1,0,0]=3 2317 B11R1.24 CCCOc1cccc(c1)F cef2c69d3852855819ee350cb218d7bc [1,1,0,0,0,0|1,0,0]=3 2318 B11R1.24 CCCOc1cccc(c1)I 5e7b3431fe9595b36463e1f6c0c6091a [1,1,0,0,0,0|1,0,0]=3 2319 B11R1.24 CCCOc1cccc(c1)S 9cc4d5ce9f1a372f0235b118438f64df [1,1,0,0,0,0|1,0,0]=3 2320 B11R1.24 CCCOc1cccc(n1)Br a9055c800f7a8bea8f5823944b85de73 [1,1,0,0,0,0|2,0,0]=4 2321 B11R1.24 CCCOc1cccc(n1)C 39c146d9d455282915fb415280d9321f [1,1,0,0,0,0|2,0,0]=4 2322 B11R1.24 CCCOc1cccc(n1)F 64f38a887ca7a2ad9537d774a3104a70 [1,1,0,0,0,0|2,0,0]=4 2323 B11R1.24 CCCOc1ccnc(c1)Br 08e99557792cbfff2d46d9cecbba3e9e [1,1,0,0,0,0|2,0,0]=4 2324 B11R1.24 CCCOc1ccnc(c1)C fb2ea1b15a9dd2b3d4e9dfb65ec1523f [1,1,0,0,0,0|2,0,0]=4 2325 B11R1.24 CCCOc1ccnc(c1)Cl 52dcc4688b93657011ed58be18dc1a12 [1,1,0,0,0,0|2,0,0]=4 2326 B11R1.24 CCCOc1ccnc(c1)F 35f6013f4437d8100afe1dae43133855 [1,1,0,0,0,0|2,0,0]=4 2327 B11R1.24 CCCOc1cncc(c1)Br 6b4e60f933e3d32ce41374eabb594281 [1,1,0,0,0,0|2,0,0]=4 2328 B11R1.24 CCCOc1cncc(c1)C d5edc0e29a183d0a30f574eab2102c23 [1,1,0,0,0,0|2,0,0]=4 2329 B11R1.24 CCCOc1cncc(c1)Cl adace2f1506c9567632091a7287ad895 [1,1,0,0,0,0|2,0,0]=4 2330 B11R1.24 CCCOc1cncc(c1)F 304c595ae441bc7dd304adfb8c15aedf [1,1,0,0,0,0|2,0,0]=4 2331 B11R1.24 CCCOc1cncc(c1)I 4ab44cea02f047116b93f5e680e20338 [1,1,0,0,0,0|2,0,0]=4 2332 B11R1.24 CCNCc1cc(ccn1)Br e896276c8fa14cddbcb38ebcdac27e5d [1,1,0,0,0,0|2,0,0]=4 2333 B11R1.24 CCNCc1cc(ccn1)C 774f66d8e453a57270dc32842d55134b [1,1,0,0,0,0|2,0,0]=4 2334 B11R1.24 CCNCc1cc(ccn1)Cl 5028728b9ac7ebc1c9518284f0807fbd [1,1,0,0,0,0|2,0,0]=4 2335 B11R1.24 CCNCc1cc[nH]c(=O)c1 822b19063e584d1569bd185314da610c [1,1,0,0,0,0|2,0,0]=4 2336 B11R1.24 CCNCc1ccc[n+](c1)[O-] cecacd94085945062f1860b53e5dce46 [1,1,0,0,0,0|2,0,0]=4 2337 B11R1.24 CCNCc1cccc(c1)Br 7cc097aea1efe8376684166a5d7a74a3 [1,1,0,0,0,0|1,0,0]=3 2338 B11R1.24 CCNCc1cccc(c1)C 8711965bd65b9b9cae0b5574aaf9df19 [1,1,0,0,0,0|1,0,0]=3 2339 B11R1.24 CCNCc1cccc(c1)Cl 35f4a4fcd3415e84e248be1142a75e6e [1,1,0,0,0,0|1,0,0]=3 2340 B11R1.24 CCNCc1cccc(c1)F a045945dd7664750cd4517426a30ddec [1,1,0,0,0,0|1,0,0]=3 2341 B11R1.24 CCNCc1cccc(c1)I a0250fe998532bc25a8c10c3d959951b [1,1,0,0,0,0|1,0,0]=3 2342 B11R1.24 CCNCc1cccc(n1)Br c978bb899b1e5a401c33708277506b25 [1,1,0,0,0,0|2,0,0]=4 2343 B11R1.24 CCNCc1cccc(n1)C 152e97bb6eb9a6a331f50dff3115da53 [1,1,0,0,0,0|2,0,0]=4 2344 B11R1.24 CCNCc1cccc(n1)Cl 1bd8ce8886953bed1784a34d49705dec [1,1,0,0,0,0|2,0,0]=4 2345 B11R1.24 CCNCc1cccc(n1)F 6624bbae6e7a27ced67aeeba1b15f696 [1,1,0,0,0,0|2,0,0]=4 2346 B11R1.24 CCNCc1ccnc(c1)Br dcddfd2d86118276109741fc7cde9cb6 [1,1,0,0,0,0|2,0,0]=4 2347 B11R1.24 CCNCc1ccnc(c1)C 7d2184712237385ae4b34f01a3fd0b0c [1,1,0,0,0,0|2,0,0]=4 2348 B11R1.24 CCNCc1ccnc(c1)Cl 45b9b38e5dbeec1d363a87b7cf99e249 [1,1,0,0,0,0|2,0,0]=4 2349 B11R1.24 CCNCc1ccnc(c1)F 52858d7d1efd604efa0a0172f4639a18 [1,1,0,0,0,0|2,0,0]=4 2350 B11R1.24 CCNCc1cncc(c1)Br 53d212050b12d7981e083ad8ce2cf307 [1,1,0,0,0,0|2,0,0]=4 2351 B11R1.24 CCNCc1cncc(c1)C a8be4d48927f0aa569ae65469d8564f6 [1,1,0,0,0,0|2,0,0]=4 2352 B11R1.24 CCNCc1cncc(c1)Cl c844100d4e6cc69aa1cd866fcfd7b483 [1,1,0,0,0,0|2,0,0]=4 2353 B11R1.24 CCNCc1cncc(c1)F c98b0bf2a9946ab8a72db48c349e2252 [1,1,0,0,0,0|2,0,0]=4 2354 B11R1.24 CCOCc1cc(ccn1)Br 0726b8a141caded4ec904623fca2ab22 [1,1,0,0,0,0|2,0,0]=4 2355 B11R1.24 CCOCc1cc(ccn1)C 2d5b6d2e2d714975e85774b9da739956 [1,1,0,0,0,0|2,0,0]=4 2356 B11R1.24 CCOCc1cc(ccn1)Cl 158638af681bb2c0924168dfb0c4809a [1,1,0,0,0,0|2,0,0]=4 2357 B11R1.24 CCOCc1cc(ccn1)F a0a517bf4ebe3f482da9efb1f014fd4e [1,1,0,0,0,0|2,0,0]=4 2358 B11R1.24 CCOCc1cc(ccn1)I 52a26a3ba97e706ba155b551bf3cce2f [1,1,0,0,0,0|2,0,0]=4 2359 B11R1.24 CCOCc1cc[nH]c(=O)c1 6c337d7db6361773b01fc7c16459aa70 [1,1,0,0,0,0|2,0,0]=4 2360 B11R1.24 CCOCc1ccc[n+](c1)[O-] a8e2d16f1a35335eb42973ab1ece394f [1,1,0,0,0,0|2,0,0]=4 2361 B11R1.24 CCOCc1cccc(c1)Br 68ab38873ddd37fd78370dbba526e703 [1,1,0,0,0,0|1,0,0]=3 2362 B11R1.24 CCOCc1cccc(c1)C a074366dc5260a76a26e1b3a17ce68f7 [1,1,0,0,0,0|1,0,0]=3 2363 B11R1.24 CCOCc1cccc(c1)Cl 8933445146c771b808a03b867c201e1e [1,1,0,0,0,0|1,0,0]=3 2364 B11R1.24 CCOCc1cccc(c1)F 01b8eda252200f38637020bb494cc211 [1,1,0,0,0,0|1,0,0]=3 2365 B11R1.24 CCOCc1cccc(c1)I ee21a715b45c835bc7170e7ff62f202c [1,1,0,0,0,0|1,0,0]=3 2366 B11R1.24 CCOCc1cccc(n1)Br 90a68360acfece20f90108990bcd1149 [1,1,0,0,0,0|2,0,0]=4 2367 B11R1.24 CCOCc1cccc(n1)C 28a36ef1d20cbd44690d599ab87bdc5f [1,1,0,0,0,0|2,0,0]=4 2368 B11R1.24 CCOCc1cccc(n1)Cl 82ebf630bd981fc4893dc75cb0bef897 [1,1,0,0,0,0|2,0,0]=4 2369 B11R1.24 CCOCc1cccc(n1)F 2089888f25135651426c37a52be6c99b [1,1,0,0,0,0|2,0,0]=4 2370 B11R1.24 CCOCc1cccc(n1)I fe037eb715fee04a280f82d502bd179d [1,1,0,0,0,0|2,0,0]=4 2371 B11R1.24 CCOCc1ccnc(c1)Br 522343afd8b5d1bc5fe8f5b5480e00d3 [1,1,0,0,0,0|2,0,0]=4 2372 B11R1.24 CCOCc1ccnc(c1)C d26a680f89e28ac8a7fa03bb8fe9903c [1,1,0,0,0,0|2,0,0]=4 2373 B11R1.24 CCOCc1ccnc(c1)Cl e39e3a3a4987b51bf255ed0ef5aa72f6 [1,1,0,0,0,0|2,0,0]=4 2374 B11R1.24 CCOCc1ccnc(c1)F b98f40a0d3b636a9028eda0ac3b5ab69 [1,1,0,0,0,0|2,0,0]=4 2375 B11R1.24 CCOCc1cncc(c1)C 121fa46d697e1516e023ead6822cc1d1 [1,1,0,0,0,0|2,0,0]=4 2376 B11R1.24 CCOCc1cncc(c1)Cl 1e91e3fbb4e3d0c3d9fd920c89ee7a2b [1,1,0,0,0,0|2,0,0]=4 2377 B11R1.24 CCOCc1cncc(c1)F eb720cd1e153d372dc09203bc199f583 [1,1,0,0,0,0|2,0,0]=4 2378 B11R1.24 CCOCc1cncc(c1)I c0a034a0c75135b9cb15b78e0a4a7802 [1,1,0,0,0,0|2,0,0]=4 2379 B11R1.24 COCNc1cccc(c1)Br 54ab518230cb656eb7b0f706a3b2523d [1,1,0,0,0,0|2,0,0]=4 2380 B11R1.24 COCNc1cccc(c1)C e40cafddbc69f7d986c84fd2fd7b2e65 [1,1,0,0,0,0|2,0,0]=4 2381 B11R1.24 COCNc1cccc(c1)Cl 5fec63d5af13dc5d09181347c67375b7 [1,1,0,0,0,0|2,0,0]=4 2382 B11R1.24 COCNc1cccc(c1)F a32f433ac1e292f556ca8a506f48aba3 [1,1,0,0,0,0|2,0,0]=4 2383 B11R1.24 COCNc1cccc(c1)I 5e0a4810bcf60771391fa32e6e53c7f0 [1,1,0,0,0,0|2,0,0]=4 2384 B11R1.24 COCNc1cccc(c1)S 7a5e42ef93f395ab2ea451d763121924 [1,1,0,0,0,0|2,0,0]=4 2385 B11R1.24 COCOc1cccc(c1)Br 2a6abf33039da8d6a127bf06afc59684 [1,1,0,0,0,0|2,0,0]=4 2386 B11R1.24 COCOc1cccc(c1)C 7f6034c6ce7e0cf435553f03c34eb3b4 [1,1,0,0,0,0|2,0,0]=4 2387 B11R1.24 COCOc1cccc(c1)Cl 48ebca3e91d1b94d31eb01f0ebd1d5f5 [1,1,0,0,0,0|2,0,0]=4 2388 B11R1.24 COCOc1cccc(c1)F 57852b600c5c4949aa6afcf99594de8a [1,1,0,0,0,0|2,0,0]=4 2389 B11R1.24 COCOc1cccc(c1)I dc0a1558ee1d114659f7cd3e8038db45 [1,1,0,0,0,0|2,0,0]=4 2390 B11R1.24 COCOc1cccc(c1)S 41f2d43a0582d926af82f7cd52bdead1 [1,1,0,0,0,0|2,0,0]=4 2391 B11R1.24 CSCNc1cccc(c1)Br 29a70d1c57b2a6862900b92143c88670 [1,1,0,0,0,0|2,0,0]=4 2392 B11R1.24 CSCNc1cccc(c1)C c0825a11246fc57479dbaf679e542a1e [1,1,0,0,0,0|2,0,0]=4 2393 B11R1.24 CSCNc1cccc(c1)Cl f4c5ef06861d0e83dfcececc5dd6c4c5 [1,1,0,0,0,0|2,0,0]=4 2394 B11R1.24 CSCNc1cccc(c1)F 5fd25ec6b3de63445bbe39f47d6bd6b1 [1,1,0,0,0,0|2,0,0]=4 2395 B11R1.24 CSCNc1cccc(c1)I 6760b1b4a0cbda7b058b59cca3341fc5 [1,1,0,0,0,0|2,0,0]=4 2396 B11R1.24 CSCNc1cccc(c1)S 82af3cc22613e1ec78dab2837f1b662e [1,1,0,0,0,0|2,0,0]=4 2397 B11R1.24 CSCOc1cccc(c1)Br 2fc2decfaeed8e2637e59ef79e480e2e [1,1,0,0,0,0|2,0,0]=4 2398 B11R1.24 CSCOc1cccc(c1)C 3bbece07bfd11b6c7fccb7bd794595e6 [1,1,0,0,0,0|2,0,0]=4 2399 B11R1.24 CSCOc1cccc(c1)Cl d969539c0fc634f8b06467139de899ee [1,1,0,0,0,0|2,0,0]=4 2400 B11R1.24 CSCOc1cccc(c1)F 9962e38297c29e8aa2aa2e5b5084ce29 [1,1,0,0,0,0|2,0,0]=4 2401 B11R1.24 CSCOc1cccc(c1)I f67cf1bee76b71349f1961d39d8971e2 [1,1,0,0,0,0|2,0,0]=4 2402 B11R1.24 CSCOc1cccc(c1)S 3789f145b0fcf7ff307990a1edfd11fc [1,1,0,0,0,0|2,0,0]=4 2403 B11R1.24 Cc1cc(ccn1)CNCO 220fd9dc96cf7acc9670e8e8f858e714 [1,1,0,0,0,0|2,0,0]=4 2404 B11R1.24 Cc1cc(ccn1)NCCO 4b5fda830696a55c8dc770d11c7ac6ab [1,1,0,0,0,0|2,0,0]=4 2405 B11R1.24 Cc1cccc(c1)CNCF 26331ce248fc61a15345fc123ac841ae [1,1,0,0,0,0|2,0,0]=4 2406 B11R1.24 Cc1cccc(c1)CNCO d0a6ec7f4afcd99e7d28be3d4dacede0 [1,1,0,0,0,0|1,0,0]=3 2407 B11R1.24 Cc1cccc(c1)COCF 11267dea5d808124a105735821eaa460 [1,1,0,0,0,0|2,0,0]=4 2408 B11R1.24 Cc1cccc(c1)NCCBr b97f20affb757b68290bd66ce1b22b5b [1,1,0,0,0,0|2,0,0]=4 2409 B11R1.24 Cc1cccc(c1)NCCF f4aa25c81ffda72c7e085e967a29bd7e [1,1,0,0,0,0|2,0,0]=4 2410 B11R1.24 Cc1cccc(c1)NCCI 1dd161cd96cff309cd4fab79d94b8f2a [1,1,0,0,0,0|2,0,0]=4 2411 B11R1.24 Cc1cccc(c1)NCCO 788520a7b5122ba23efd60ec7af11b62 [1,1,0,0,0,0|1,0,0]=3 2412 B11R1.24 Cc1cccc(c1)NCCS 7b98a9c950cebe1dd8819c5a884e6fc9 [1,1,0,0,0,0|1,1,0]=4 2413 B11R1.24 Cc1cccc(c1)OCCF a1c1a8f8d1b8dd943777980aef0cd973 [1,1,0,0,0,0|2,0,0]=4 2414 B11R1.24 Cc1cccc(c1)OCCS c6d124754d0867f0c038fb362a7e43c1 [1,1,0,0,0,0|1,1,0]=4 2415 B11R1.24 Cc1cccc(n1)CNCO fe42a0006039c5b282c8b0832528d029 [1,1,0,0,0,0|2,0,0]=4 2416 B11R1.24 Cc1cccc(n1)NCCO 2f6549d226cf28bd97ca9c8eed2ac2de [1,1,0,0,0,0|2,0,0]=4 2417 B11R1.24 Cc1ccnc(c1)CNCO 5f13cb4049c3b8923e25988be44c27eb [1,1,0,0,0,0|2,0,0]=4 2418 B11R1.24 Cc1ccnc(c1)NCCO 19d12f5117ef4128697081bba6fe0041 [1,1,0,0,0,0|2,0,0]=4 2419 B11R1.24 Cc1cncc(c1)CNCO 7a4427168da0170ab18b195344f9dc2f [1,1,0,0,0,0|2,0,0]=4 2420 B11R1.24 Cc1cncc(c1)NCCO 0669641702644658e91d090c8a779de5 [1,1,0,0,0,0|2,0,0]=4 2421 B11R1.24 FCCNc1cccc(c1)Br a0d0349e1b2d40b05cc1bfe14bd197ca [1,1,0,0,0,0|2,0,0]=4 2422 B11R1.24 FCCNc1cccc(c1)Cl 9349b62cb412641ee884eb579a3f9bdb [1,1,0,0,0,0|2,0,0]=4 2423 B11R1.24 FCCNc1cccc(c1)F c96c058abaf24744205bd606ad9daa10 [1,1,0,0,0,0|2,0,0]=4 2424 B11R1.24 FCCNc1cccc(c1)I 504a4adcecca797bc0ba40fa19488c7d [1,1,0,0,0,0|2,0,0]=4 2425 B11R1.24 FCCNc1cccc(c1)S aece59adaa14c81c1f80f1dd56827823 [1,1,0,0,0,0|2,0,0]=4 2426 B11R1.24 FCCOc1cccc(c1)Br dc7f08a58233cf92115127accf5a3b35 [1,1,0,0,0,0|2,0,0]=4 2427 B11R1.24 FCCOc1cccc(c1)Cl c66ffbbe922aa739c018d5aa4816af47 [1,1,0,0,0,0|2,0,0]=4 2428 B11R1.24 FCCOc1cccc(c1)F ce9f0d6a6eed787c7ba2b20b9d6cd5cc [1,1,0,0,0,0|2,0,0]=4 2429 B11R1.24 FCCOc1cccc(c1)I 96f9406b79ce29e6a0cb635643af7fc7 [1,1,0,0,0,0|2,0,0]=4 2430 B11R1.24 FCCOc1cccc(c1)S 5e27e494d241022e1e68313fade9dc4b [1,1,0,0,0,0|2,0,0]=4 2431 B11R1.24 FCNCc1cccc(c1)Br 7d04e2339b42e8f2d0122b4fdbb3009d [1,1,0,0,0,0|2,0,0]=4 2432 B11R1.24 FCNCc1cccc(c1)Cl e145b682fefd1d3baa7ebff04addc07b [1,1,0,0,0,0|2,0,0]=4 2433 B11R1.24 FCNCc1cccc(c1)F 6e9400ce8cf9ff79d0c0062ec100268a [1,1,0,0,0,0|2,0,0]=4 2434 B11R1.24 FCNCc1cccc(c1)I 3974009fe99bec9ffdffbaebd85438b2 [1,1,0,0,0,0|2,0,0]=4 2435 B11R1.24 FCOCc1cccc(c1)Br 06fd5492a825faa19dd2b0a6ce53ff70 [1,1,0,0,0,0|2,0,0]=4 2436 B11R1.24 FCOCc1cccc(c1)Cl bc6f623318574bc18fb6d005c3b19654 [1,1,0,0,0,0|2,0,0]=4 2437 B11R1.24 FCOCc1cccc(c1)F 54b20c54954574867369722c4db6da9a [1,1,0,0,0,0|2,0,0]=4 2438 B11R1.24 FCOCc1cccc(c1)I 20971ddf8a9eb4748299b05e02229bbd [1,1,0,0,0,0|2,0,0]=4 2439 B11R1.24 Fc1cccc(c1)NCCI 8a6f044d8ed2ec996c87b3f7662b5d9e [1,1,0,0,0,0|2,0,0]=4 2440 B11R1.24 Fc1cccc(c1)NCCS 111e99f9a18e94deed9c071f45698da5 [1,1,0,0,0,0|1,1,0]=4 2441 B11R1.24 Fc1cccc(c1)OCCS 6a888b3fc77bfaa56db9101dd1183ce5 [1,1,0,0,0,0|1,1,0]=4 2442 B11R1.24 O=c1cc(cc[nH]1)CNCO c4aad1d382df6023dbb9bfc71918fa08 [1,1,0,0,0,0|2,0,0]=4 2443 B11R1.24 O=c1cc(cc[nH]1)NCCO 129cf860ef94c7e192de21f9b1db83ab [1,1,0,0,0,0|2,0,0]=4 2444 B11R1.24 O=c1cccc([nH]1)NCCO e1b5fac943594d1367740fc431b7f68f [1,1,0,0,0,0|2,0,0]=4 2445 B11R1.24 OCCNc1cc(ccn1)Br 0e5845a9d75897934a7ce851325e636b [1,1,0,0,0,0|2,0,0]=4 2446 B11R1.24 OCCNc1cc(ccn1)Cl 7c04defb8496760f37c26173d358f1c7 [1,1,0,0,0,0|2,0,0]=4 2447 B11R1.24 OCCNc1cc(ccn1)F 394032aa62c6106ac2a0a110fc66bc09 [1,1,0,0,0,0|2,0,0]=4 2448 B11R1.24 OCCNc1cc(ccn1)I c9c07f7ea916c489386a21b821d3dbff [1,1,0,0,0,0|2,0,0]=4 2449 B11R1.24 OCCNc1cc[nH]c(=S)c1 bbbfd2bf2db3ba0eaa7bdfe622694e84 [1,1,0,0,0,0|2,0,0]=4 2450 B11R1.24 OCCNc1cccc(c1)Br 72567362870bfac93c93e7b10c66dbef [1,1,0,0,0,0|1,0,0]=3 2451 B11R1.24 OCCNc1cccc(c1)Cl e17e7e92e4c4d52ba070bc2481182aec [1,1,0,0,0,0|1,0,0]=3 2452 B11R1.24 OCCNc1cccc(c1)F efdd551ee0f00745ebb911089af2cb0e [1,1,0,0,0,0|1,0,0]=3 2453 B11R1.24 OCCNc1cccc(c1)I f3c298b6e86d76fb00282800b71da201 [1,1,0,0,0,0|1,0,0]=3 2454 B11R1.24 OCCNc1cccc(c1)S bc3a43ad2a55514906329a47347a3147 [1,1,0,0,0,0|1,0,0]=3 2455 B11R1.24 OCCNc1cccc(n1)Br 16afda6c91c8eb0785eae3aaeedeb0ff [1,1,0,0,0,0|2,0,0]=4 2456 B11R1.24 OCCNc1cccc(n1)Cl 0dd354cac868e8a2f5e6b90d2720b521 [1,1,0,0,0,0|2,0,0]=4 2457 B11R1.24 OCCNc1cccc(n1)F 5cca75db912fddd5272d0cd29841e998 [1,1,0,0,0,0|2,0,0]=4 2458 B11R1.24 OCCNc1cccc(n1)I c4affa9525427bd84927869b068208bf [1,1,0,0,0,0|2,0,0]=4 2459 B11R1.24 OCCNc1ccnc(c1)Br b200f0856d5da5e2a16447f55e9aa61a [1,1,0,0,0,0|2,0,0]=4 2460 B11R1.24 OCCNc1ccnc(c1)Cl 3ffc831c5d727a7d566cfb2f2129d6e9 [1,1,0,0,0,0|2,0,0]=4 2461 B11R1.24 OCCNc1ccnc(c1)F 5ba3ed8dbf00788462e880b9e109daef [1,1,0,0,0,0|2,0,0]=4 2462 B11R1.24 OCCNc1ccnc(c1)I 93104159a05486eee76aacf8b07b4419 [1,1,0,0,0,0|2,0,0]=4 2463 B11R1.24 OCCNc1cncc(c1)Br a75dcf2c2e63145cd782ada60acb2864 [1,1,0,0,0,0|2,0,0]=4 2464 B11R1.24 OCCNc1cncc(c1)Cl a2b4c7a5a212bf04c94411f62e5ad358 [1,1,0,0,0,0|2,0,0]=4 2465 B11R1.24 OCCNc1cncc(c1)F 31f36ced4ee71c6d0d3124d50ec8de63 [1,1,0,0,0,0|2,0,0]=4 2466 B11R1.24 OCCNc1cncc(c1)I d65eed8002ee9bcaa63e0e96e66af7b7 [1,1,0,0,0,0|2,0,0]=4 2467 B11R1.24 OCNCc1cc(ccn1)Br 06cb0b6f11d2df317f076a34cca73254 [1,1,0,0,0,0|2,0,0]=4 2468 B11R1.24 OCNCc1cc(ccn1)Cl 5646effac8639f8535d15a6b99ad056c [1,1,0,0,0,0|2,0,0]=4 2469 B11R1.24 OCNCc1cccc(c1)Br 9ae94d6fc4c7aac28899119fef51b5ec [1,1,0,0,0,0|1,0,0]=3 2470 B11R1.24 OCNCc1cccc(c1)Cl 713c7b0184423731a15a73fa223201b6 [1,1,0,0,0,0|1,0,0]=3 2471 B11R1.24 OCNCc1cccc(c1)F a12edc0401d7c1be2d7abc20d4ca38fc [1,1,0,0,0,0|1,0,0]=3 2472 B11R1.24 OCNCc1cccc(c1)I f7370a634a3488ab18a27f63d6247824 [1,1,0,0,0,0|1,0,0]=3 2473 B11R1.24 OCNCc1cccc(n1)Br 23296dee875c9669a422613f06aeef06 [1,1,0,0,0,0|2,0,0]=4 2474 B11R1.24 OCNCc1cccc(n1)Cl faf46ab43f1e9a23a22115d506a7017c [1,1,0,0,0,0|2,0,0]=4 2475 B11R1.24 OCNCc1cccc(n1)F c5b650412f060761f1cc75a8aca4b5dd [1,1,0,0,0,0|2,0,0]=4 2476 B11R1.24 OCNCc1ccnc(c1)Br 3a0e55a9ff73d236d99460783912071e [1,1,0,0,0,0|2,0,0]=4 2477 B11R1.24 OCNCc1ccnc(c1)Cl e808e8311876b6a3d48faefd4bc8115e [1,1,0,0,0,0|2,0,0]=4 2478 B11R1.24 OCNCc1ccnc(c1)F 5c6920251d116376c180ff91e7c1250a [1,1,0,0,0,0|2,0,0]=4 2479 B11R1.24 OCNCc1cncc(c1)Br ffec339e7a0fc11ba77bb4ac904f8f20 [1,1,0,0,0,0|2,0,0]=4 2480 B11R1.24 OCNCc1cncc(c1)Cl 8574d223ab5ee8845117148de06cee06 [1,1,0,0,0,0|2,0,0]=4 2481 B11R1.24 OCNCc1cncc(c1)F b3a6ffb96c10c52c53c936dac726e05c [1,1,0,0,0,0|2,0,0]=4 2482 B11R1.24 Oc1cccc(c1)NCCS 90fb0bece5f4ef3440fd1c51e48f120a [1,1,0,0,0,0|1,1,0]=4 2483 B11R1.24 SCCNc1cccc(c1)Br cbcc30b1e277f7e40eb9e326ae777bb5 [1,1,0,0,0,0|1,1,0]=4 2484 B11R1.24 SCCNc1cccc(c1)Cl 2f57001a83ec8d5ce3c44dce9353a13f [1,1,0,0,0,0|1,1,0]=4 2485 B11R1.24 SCCNc1cccc(c1)I f5616d4701847e6288fc4af92fec75a5 [1,1,0,0,0,0|1,1,0]=4 2486 B11R1.24 SCCNc1cccc(c1)S 0e0fd34954253302d73110367a83e4a4 [1,1,0,0,0,0|1,1,0]=4 2487 B11R1.24 SCCOc1cccc(c1)Br e29f1287cdedf4ced05629d8ec3308ee [1,1,0,0,0,0|1,1,0]=4 2488 B11R1.24 SCCOc1cccc(c1)Cl c6106fdfdfada56aa5873825021fa0eb [1,1,0,0,0,0|1,1,0]=4 2489 B11R1.24 SCCOc1cccc(c1)I fe2c18f3e6909e773b949d048cdd6619 [1,1,0,0,0,0|1,1,0]=4 2490 B11R1.24 SCCOc1cccc(c1)S 9191721e00952c64cadf2154be9938a1 [1,1,0,0,0,0|1,1,0]=4 2491 B11R1.24 [O-][n+]1cccc(c1)CNCO aa03904d5dcf4d8ab04ff277c5e28dc8 [1,1,0,0,0,0|2,0,0]=4 2492 B11R1.24 [O-][n+]1cccc(c1)NCCO 08efe197244e0f689fc986199286df25 [1,1,0,0,0,0|2,0,0]=4 2493 B11R1.28 BrCCNCc1ccccc1 ac057fc43e8d6ea85181427003cd8239 [1,1,0,0,0,0|1,0,0]=3 2494 B11R1.28 BrCCNCc1ccccn1 90bb93ff46fc49bde9265b45b65f9d87 [1,1,0,0,0,0|2,0,0]=4 2495 B11R1.28 BrCCNCc1cccnc1 a9888ba9b6c914af5c547c17a572df8f [1,1,0,0,0,0|2,0,0]=4 2496 B11R1.28 C#CCCNc1ccccc1 a50e6468b9593b4ac45e12d5e3b3638a [1,1,0,0,0,0|0,0,2]=4 2497 B11R1.28 C#CCNCc1ccccc1 5ab7d08152aaaf12430a9163e509ecd1 [1,1,0,0,0,0|0,0,2]=4 2498 B11R1.28 C#CCOCc1ccccc1 4aff10236737b564a9b29132113db7f4 [1,1,0,0,0,0|0,0,2]=4 2499 B11R1.28 C/C=C/CNc1ccccc1 e02cbeaffef0ff2c4795b558e93457ed [1,1,0,0,0,0|0,0,2]=4 2500 B11R1.28 C/C=C\CNc1ccccc1 f25f4c9ee5d52b5a340bd4a7fd720817 [1,1,0,0,0,0|0,0,2]=4 2501 B11R1.28 C=CCCNc1ccccc1 41e5ae44107c117783190eb282a3dc50 [1,1,0,0,0,0|0,0,2]=4 2502 B11R1.28 C=CCNCc1ccccc1 c3088ea78b0f7fe35bdb5a0a79f4eb2a [1,1,0,0,0,0|0,0,2]=4 2503 B11R1.28 C=CCOCc1ccccc1 38f1b42f9627b73302287ed7d9c08f3f [1,1,0,0,0,0|0,0,2]=4 2504 B11R1.28 CC=CCNc1ccccc1 c43b41b8b675349badfe26c48e3f7c5f [1,1,0,0,0,0|0,0,2]=4 2505 B11R1.28 CCCCNc1ccccc1 178647391839dfbe95aed182d7dc43ba [1,1,0,0,0,0|0,0,0]=2 2506 B11R1.28 CCCCNc1ccccn1 91c5e93b79177d6bf2e79f08485f5335 [1,1,0,0,0,0|1,0,0]=3 2507 B11R1.28 CCCCNc1cccnc1 b72453a6fd2f6ec63a951a849bd6d4ab [1,1,0,0,0,0|1,0,0]=3 2508 B11R1.28 CCCCNc1cccnn1 3dfd51777ba04f9375640c74ab9fa2e6 [1,1,0,0,0,0|2,0,0]=4 2509 B11R1.28 CCCCNc1ccncc1 24fb8abdae77c89030f13cd0949f55ff [1,1,0,0,0,0|1,0,0]=3 2510 B11R1.28 CCCCNc1ccncn1 285343aee96e8f045fe913fc70b195a9 [1,1,0,0,0,0|2,0,0]=4 2511 B11R1.28 CCCCNc1ccnnc1 ff8398fcae5d1b92f9ec3bc78a562cec [1,1,0,0,0,0|2,0,0]=4 2512 B11R1.28 CCCCNc1cnccn1 94ad2094a4d853e068f8fa7ebd18c7ff [1,1,0,0,0,0|2,0,0]=4 2513 B11R1.28 CCCCNc1cncnc1 5898f2b85902d6f8660c7182ee3b2170 [1,1,0,0,0,0|2,0,0]=4 2514 B11R1.28 CCCCNc1ncccn1 1c9a1ed7a4872dfade79e48decc1fc1d [1,1,0,0,0,0|2,0,0]=4 2515 B11R1.28 CCCCOc1ccccn1 6484ab4f70c598bfd74c056129d64bfe [1,1,0,0,0,0|1,0,0]=3 2516 B11R1.28 CCCCOc1cccnc1 5afbbe8f7376fe71bb9dd4caf03cbd91 [1,1,0,0,0,0|1,0,0]=3 2517 B11R1.28 CCCCOc1ccncc1 fc01d35869db11789e0b4af0f1677b1b [1,1,0,0,0,0|1,0,0]=3 2518 B11R1.28 CCCCOc1ccnnc1 667207acd2d82bae5786ac94d3b108de [1,1,0,0,0,0|2,0,0]=4 2519 B11R1.28 CCCCOc1cnccn1 74c5e85aaa9b94ec4e088971edd3244b [1,1,0,0,0,0|2,0,0]=4 2520 B11R1.28 CCCCOc1cncnc1 d754e073f477d30ef4fb9949b36048b9 [1,1,0,0,0,0|2,0,0]=4 2521 B11R1.28 CCCCOc1ncccn1 cea963446efaea4e45d8684cc469bd67 [1,1,0,0,0,0|2,0,0]=4 2522 B11R1.28 CCCNCc1ccccc1 6e74fa6187fccbc3617e9cc264b3e7aa [1,1,0,0,0,0|0,0,0]=2 2523 B11R1.28 CCCNCc1ccccn1 80119cb7f5f54b354b4e2a1110975477 [1,1,0,0,0,0|1,0,0]=3 2524 B11R1.28 CCCNCc1cccnc1 bc1eb1c5ec13776685acded27d44c636 [1,1,0,0,0,0|1,0,0]=3 2525 B11R1.28 CCCNCc1cccnn1 f9771734910ebcad90f8cb14178ca09d [1,1,0,0,0,0|2,0,0]=4 2526 B11R1.28 CCCNCc1ccncc1 a4e33f26d038f90cea08a211a6327f1b [1,1,0,0,0,0|1,0,0]=3 2527 B11R1.28 CCCNCc1ccncn1 4c6d605a0ccf50e124c7a439ea71cca1 [1,1,0,0,0,0|2,0,0]=4 2528 B11R1.28 CCCNCc1ccnnc1 f0dc052fccb98d09ed6a02caf7ad77f6 [1,1,0,0,0,0|2,0,0]=4 2529 B11R1.28 CCCNCc1cnccn1 c9890f6f5a4e09bed341b3daf3b2c549 [1,1,0,0,0,0|2,0,0]=4 2530 B11R1.28 CCCNCc1cncnc1 b63f5b77d0d35d3228827f3601ca0c32 [1,1,0,0,0,0|2,0,0]=4 2531 B11R1.28 CCCNCc1ncccn1 9d6cc7b3819df7e77a589192f2bf91c0 [1,1,0,0,0,0|2,0,0]=4 2532 B11R1.28 CCCOCc1ccccc1 112c1e14e862b8fbffa225764759b8ec [1,1,0,0,0,0|0,0,0]=2 2533 B11R1.28 CCCOCc1ccccn1 a2de9c7a7551b2ca6641b10a888e1203 [1,1,0,0,0,0|1,0,0]=3 2534 B11R1.28 CCCOCc1cccnc1 02843d33c5a54d2140670eb60a4dfb7b [1,1,0,0,0,0|1,0,0]=3 2535 B11R1.28 CCCOCc1cccnn1 b324e54ae74b0a57b2f9b766e3c0e490 [1,1,0,0,0,0|2,0,0]=4 2536 B11R1.28 CCCOCc1ccncc1 56ee45f2e5ce25d41ded46b7cfbb89b5 [1,1,0,0,0,0|1,0,0]=3 2537 B11R1.28 CCCOCc1ccncn1 c21e413653b185c946f470cd3c989a49 [1,1,0,0,0,0|2,0,0]=4 2538 B11R1.28 CCCOCc1ccnnc1 835d98ea225e99027be93ac65a9ecaeb [1,1,0,0,0,0|2,0,0]=4 2539 B11R1.28 CCCOCc1cnccn1 2f92d9f2b0d873450f90961d7406570a [1,1,0,0,0,0|2,0,0]=4 2540 B11R1.28 CCCOCc1cncnc1 62dd4b6cbce5110705e084fd1f6898a2 [1,1,0,0,0,0|2,0,0]=4 2541 B11R1.28 CCCOCc1ncccn1 aded070bc849868bd77e139f41cc86fb [1,1,0,0,0,0|2,0,0]=4 2542 B11R1.28 CCNCCc1ccccc1 a4bcdd097e726e04ab2794cdb42f5f71 [1,1,0,0,0,0|0,0,0]=2 2543 B11R1.28 CCNCCc1ccccn1 08ffb64a8c703d8e611cb4b81d73ea48 [1,1,0,0,0,0|1,0,0]=3 2544 B11R1.28 CCNCCc1cccnc1 4a3a0c73e4e732e57ab84a312bb6bfb2 [1,1,0,0,0,0|1,0,0]=3 2545 B11R1.28 CCNCCc1ccncc1 8e4e115f84a67e767e5e9ff1560cacbe [1,1,0,0,0,0|1,0,0]=3 2546 B11R1.28 CCNCCc1ccncn1 dba79812e975c4d64e5e25d258f9e6a6 [1,1,0,0,0,0|2,0,0]=4 2547 B11R1.28 CCNCCc1cnccn1 2497cab3d04dd1dac7aa9e87fb020630 [1,1,0,0,0,0|2,0,0]=4 2548 B11R1.28 CCNCCc1ncccn1 8878621879d60c35f5e690c8ce15ae29 [1,1,0,0,0,0|2,0,0]=4 2549 B11R1.28 CCOCCc1ccccc1 4c8fc52cc53157c0b0cd10959d18f86a [1,1,0,0,0,0|0,0,0]=2 2550 B11R1.28 CCOCCc1ccccn1 0d3553a98e2eb283c6e354f56bb7c09d [1,1,0,0,0,0|1,0,0]=3 2551 B11R1.28 CCOCCc1cccnc1 fde9743ce24696d5aa5aa82dfaaaf4a7 [1,1,0,0,0,0|1,0,0]=3 2552 B11R1.28 CCOCCc1ccncc1 630579b198392670c66e884689fb17ef [1,1,0,0,0,0|1,0,0]=3 2553 B11R1.28 CCOCCc1ccncn1 bedc028f31c05778aab48e9543338256 [1,1,0,0,0,0|2,0,0]=4 2554 B11R1.28 CCOCCc1cnccn1 df7cb588e7f62873ee34f1155b413714 [1,1,0,0,0,0|2,0,0]=4 2555 B11R1.28 CCOCCc1cncnc1 58c96cb82c933f213a2e027db9cf3e79 [1,1,0,0,0,0|2,0,0]=4 2556 B11R1.28 CCOCCc1ncccn1 3fe5ff61de16184188b5260ddcb372ea [1,1,0,0,0,0|2,0,0]=4 2557 B11R1.28 CCOCNc1ccccc1 00b4118c5fbc36d206f093517b5cafbb [1,1,0,0,0,0|1,0,0]=3 2558 B11R1.28 CCOCNc1ccccn1 ac3729b96ca810b5bc3bde9ed19bf9fa [1,1,0,0,0,0|2,0,0]=4 2559 B11R1.28 CCOCNc1cccnc1 d3b3fa022b30954b0290fed1cdafa77a [1,1,0,0,0,0|2,0,0]=4 2560 B11R1.28 CCOCNc1ccncc1 7b541819d70b7814c284336c668c77e2 [1,1,0,0,0,0|2,0,0]=4 2561 B11R1.28 CCOCOc1ccccn1 54f1e3cb35931cbfff15b357666888af [1,1,0,0,0,0|2,0,0]=4 2562 B11R1.28 CCOCOc1cccnc1 ead2fcc768ce8c5c30053e5139f1a3f8 [1,1,0,0,0,0|2,0,0]=4 2563 B11R1.28 CCOCOc1ccncc1 432375e2a4c080d14e68465c24c6befc [1,1,0,0,0,0|2,0,0]=4 2564 B11R1.28 COCCNc1ccccc1 5ef0d3255ad59be77d905fd9c0e71e6d [1,1,0,0,0,0|1,0,0]=3 2565 B11R1.28 COCCNc1ccccn1 89ce959fbd9c09f77faba6fd797cd6ad [1,1,0,0,0,0|2,0,0]=4 2566 B11R1.28 COCCNc1cccnc1 3616fb0bfda365de01dc790c24f19ca2 [1,1,0,0,0,0|2,0,0]=4 2567 B11R1.28 COCCNc1ccncc1 e86302258d425dce02b6a807adbdf19d [1,1,0,0,0,0|2,0,0]=4 2568 B11R1.28 COCCOc1ccccn1 c15a0f2a35a14a6120db222de8e43d40 [1,1,0,0,0,0|2,0,0]=4 2569 B11R1.28 COCCOc1cccnc1 7d9dde4ce0ac45ab046b208edae409a9 [1,1,0,0,0,0|2,0,0]=4 2570 B11R1.28 COCCOc1ccncc1 13c01b88dd4fec82579627c21ba6ed06 [1,1,0,0,0,0|2,0,0]=4 2571 B11R1.28 COCNCc1ccccc1 658bb4bb78d053244c07843f6f02f062 [1,1,0,0,0,0|1,0,0]=3 2572 B11R1.28 COCNCc1ccccn1 cb969ddff5a45a0c4df4b7717e547f81 [1,1,0,0,0,0|2,0,0]=4 2573 B11R1.28 COCNCc1cccnc1 35b8b6083a32f9db8795c63f618b2f12 [1,1,0,0,0,0|2,0,0]=4 2574 B11R1.28 COCNCc1ccncc1 3fb6af955e4c1e6a3044742c559cc5ae [1,1,0,0,0,0|2,0,0]=4 2575 B11R1.28 COCOCc1ccccc1 33758b3ae4df68a136cb96076fbeb2ee [1,1,0,0,0,0|1,0,0]=3 2576 B11R1.28 COCOCc1ccccn1 c7e2d466f64f2796a0fb099c19cb65e2 [1,1,0,0,0,0|2,0,0]=4 2577 B11R1.28 COCOCc1cccnc1 f4d73442b3dd40c1495fadfe4fccda61 [1,1,0,0,0,0|2,0,0]=4 2578 B11R1.28 COCOCc1ccncc1 99c1a2805ee24504fc8830c71e80abe6 [1,1,0,0,0,0|2,0,0]=4 2579 B11R1.28 CSCCNc1ccccc1 f8eb965b60d0615781c928cdcd30bc15 [1,1,0,0,0,0|1,0,0]=3 2580 B11R1.28 CSCCNc1ccccn1 1ebdb7d56171ddc5a7c67867cc88039f [1,1,0,0,0,0|2,0,0]=4 2581 B11R1.28 CSCCNc1cccnc1 5c27e85010b1a349b69a05e89d2c3c43 [1,1,0,0,0,0|2,0,0]=4 2582 B11R1.28 CSCCNc1ccncc1 54710d8ef290046b70669623e9f1800b [1,1,0,0,0,0|2,0,0]=4 2583 B11R1.28 CSCCOc1ccccn1 8b8b6f4f12e2bd5052045e36f5e8d7b9 [1,1,0,0,0,0|2,0,0]=4 2584 B11R1.28 CSCCOc1cccnc1 035ac2b2fc138dfaa1d6bea025347e4a [1,1,0,0,0,0|2,0,0]=4 2585 B11R1.28 CSCCOc1ccncc1 bc39eaa4e5a78fcb3ef7ff94e955c20b [1,1,0,0,0,0|2,0,0]=4 2586 B11R1.28 CSCNCc1ccccc1 5b3aef5f0ecdedc4b2903ec980e5dc72 [1,1,0,0,0,0|1,0,0]=3 2587 B11R1.28 CSCNCc1ccccn1 2c467e079eb5903cc68e04796a70abe6 [1,1,0,0,0,0|2,0,0]=4 2588 B11R1.28 CSCNCc1cccnc1 3f297bb785f90b40b12fe1a85e9c71ce [1,1,0,0,0,0|2,0,0]=4 2589 B11R1.28 CSCNCc1ccncc1 f9e31be92d2ea3f9692e6bd87f906a5c [1,1,0,0,0,0|2,0,0]=4 2590 B11R1.28 CSCOCc1ccccc1 5941de554d8996d7d45b8f8eee2daf73 [1,1,0,0,0,0|1,0,0]=3 2591 B11R1.28 CSCOCc1ccccn1 15e9634e2b7543dc2be21ac6d26f304b [1,1,0,0,0,0|2,0,0]=4 2592 B11R1.28 CSCOCc1cccnc1 43f679691f8dba66a7e0f36103db118e [1,1,0,0,0,0|2,0,0]=4 2593 B11R1.28 CSCOCc1ccncc1 11cf6b0bd99fe96e04f2abe6d07a06aa [1,1,0,0,0,0|2,0,0]=4 2594 B11R1.28 ClCCCNc1ccccc1 b7f587f82b83ca90917a5139ff536b22 [1,1,0,0,0,0|1,0,0]=3 2595 B11R1.28 ClCCCNc1ccccn1 8bdf4144e9a2a7a9c2cc08aafaf861f1 [1,1,0,0,0,0|2,0,0]=4 2596 B11R1.28 ClCCCNc1cccnc1 46d49c887f9c8f9ac001059b66aa76f9 [1,1,0,0,0,0|2,0,0]=4 2597 B11R1.28 ClCCCNc1ccncc1 970fb2252914a50a867c4051715341da [1,1,0,0,0,0|2,0,0]=4 2598 B11R1.28 FCCCNc1ccccc1 b3f41abfb84c10f658d04a58ad820f46 [1,1,0,0,0,0|1,0,0]=3 2599 B11R1.28 FCCCNc1ccccn1 565f4368802921f33e165ca06a4e0884 [1,1,0,0,0,0|2,0,0]=4 2600 B11R1.28 FCCCNc1cccnc1 bf0c678c727f753f2416107c8fb7c2aa [1,1,0,0,0,0|2,0,0]=4 2601 B11R1.28 FCCCNc1ccncc1 6a3cdf6587efe4480e7c908186350ce5 [1,1,0,0,0,0|2,0,0]=4 2602 B11R1.28 FCCCOc1ccccn1 cbed731556df3029ce519d57f9054d0b [1,1,0,0,0,0|2,0,0]=4 2603 B11R1.28 FCCCOc1cccnc1 c358cc6076a85c51e04e470481f11a56 [1,1,0,0,0,0|2,0,0]=4 2604 B11R1.28 FCCCOc1ccncc1 df30532896d176c22270c75c82382b5e [1,1,0,0,0,0|2,0,0]=4 2605 B11R1.28 FCCNCc1ccccc1 562ef8707f4288c2162274968d966312 [1,1,0,0,0,0|1,0,0]=3 2606 B11R1.28 FCCNCc1ccccn1 4b02ff9e4d9d7623f6691b060ab82228 [1,1,0,0,0,0|2,0,0]=4 2607 B11R1.28 FCCNCc1cccnc1 baa596bf0364075f3290f4a60a205b9b [1,1,0,0,0,0|2,0,0]=4 2608 B11R1.28 FCCNCc1ccncc1 50b686a8fc08fd5effeaeb333b2ed93d [1,1,0,0,0,0|2,0,0]=4 2609 B11R1.28 FCCOCc1ccccc1 d9b83bdc5263ec616987dc5988d5ee5b [1,1,0,0,0,0|1,0,0]=3 2610 B11R1.28 FCCOCc1ccccn1 eeb2239e9027d0ce3a24146b5979566a [1,1,0,0,0,0|2,0,0]=4 2611 B11R1.28 FCCOCc1cccnc1 e02a816ea65f063a58402293132849f2 [1,1,0,0,0,0|2,0,0]=4 2612 B11R1.28 FCCOCc1ccncc1 14445d664118b43034c3d85510da7389 [1,1,0,0,0,0|2,0,0]=4 2613 B11R1.28 FCNCCc1ccccc1 0081f6dcce701ffe77378524f92f490b [1,1,0,0,0,0|1,0,0]=3 2614 B11R1.28 FCNCCc1ccccn1 e15d9eaa28b96f67f0199ee7ab918bb8 [1,1,0,0,0,0|2,0,0]=4 2615 B11R1.28 FCNCCc1cccnc1 ca44ff0aa2770a7476d8fe29ab7de27f [1,1,0,0,0,0|2,0,0]=4 2616 B11R1.28 FCNCCc1ccncc1 534789a7dc9aa58bac25bdd251ebaa53 [1,1,0,0,0,0|2,0,0]=4 2617 B11R1.28 FCOCCc1ccccc1 f68582be9a805c98452f747e5a13d902 [1,1,0,0,0,0|1,0,0]=3 2618 B11R1.28 FCOCCc1ccccn1 a87eac3bbe6c96cceb2ad793702bad9f [1,1,0,0,0,0|2,0,0]=4 2619 B11R1.28 FCOCCc1cccnc1 95fb7ccc93ac5365251261a770f3e438 [1,1,0,0,0,0|2,0,0]=4 2620 B11R1.28 FCOCCc1ccncc1 6e5a2cb5c96fa3a2dd4f846c43af9a9a [1,1,0,0,0,0|2,0,0]=4 2621 B11R1.28 ICCNCc1ccccc1 697ca1617b546014ae02b06ad2981d8a [1,1,0,0,0,0|1,0,0]=3 2622 B11R1.28 ICCNCc1ccccn1 33a419599dd52be8486dfb89562c6ffa [1,1,0,0,0,0|2,0,0]=4 2623 B11R1.28 ICCNCc1cccnc1 7ed4e3e46a4c12f8a4c531489f3ab39c [1,1,0,0,0,0|2,0,0]=4 2624 B11R1.28 N#CCCNc1ccccc1 11cc2433e70294ae10477f88fd0e31d0 [1,1,0,0,0,0|1,0,1]=4 2625 B11R1.28 N#CCNCc1ccccc1 f23a3b4a1088925db39a0117b8e4d4c1 [1,1,0,0,0,0|1,0,1]=4 2626 B11R1.28 N#CCOCc1ccccc1 c6fb0c0fa9f97c70e5fbc997cccd1b4f [1,1,0,0,0,0|1,0,1]=4 2627 B11R1.28 N#CNCCc1ccccc1 cc0f6fa18b1c1eb0550ef90401294e13 [1,1,0,0,0,0|1,0,1]=4 2628 B11R1.28 NOCCNc1ccccc1 6c5b7062e9d75a57daf03317347aff96 [1,1,0,0,0,0|1,0,0]=3 2629 B11R1.28 NOCCNc1ccccn1 e682b49988380a8ee2db570ecbf6f017 [1,1,0,0,0,0|2,0,0]=4 2630 B11R1.28 NOCCNc1cccnc1 5721f45685d149370a94b93edd914a85 [1,1,0,0,0,0|2,0,0]=4 2631 B11R1.28 NOCCNc1ccncc1 dbc7f0b0ff4b2266b3814bdc52c6fe58 [1,1,0,0,0,0|2,0,0]=4 2632 B11R1.28 O/C=C\CNc1ccccc1 8e43d75b756e053c042884ec195cf7a7 [1,1,0,0,0,0|0,0,2]=4 2633 B11R1.28 O=CCCNc1ccccc1 5adfd28b693cf17e4441c0e8b873a1f0 [1,1,0,0,0,0|0,0,2]=4 2634 B11R1.28 O=CCNCc1ccccc1 2b4b8121ff6ad050b40b87d13d8f5a1a [1,1,0,0,0,0|0,0,2]=4 2635 B11R1.28 O=CCOCc1ccccc1 7bd4c1ac5902422e7c3cafad9115c4f2 [1,1,0,0,0,0|0,0,2]=4 2636 B11R1.28 O=CNCCc1ccccc1 d1fab3f35b45ae0bc45cf7bf9f19384c [1,1,0,0,0,0|0,0,2]=4 2637 B11R1.28 OCCCNc1ccccc1 6f65c15387fc952c20110ea29ef53956 [1,1,0,0,0,0|0,0,0]=2 2638 B11R1.28 OCCCNc1ccccn1 587693fe3960ae4ed00c51618661aeab [1,1,0,0,0,0|1,0,0]=3 2639 B11R1.28 OCCCNc1cccnc1 90b07b63ba2da4339e6031d93f7df208 [1,1,0,0,0,0|1,0,0]=3 2640 B11R1.28 OCCCNc1cccnn1 247aa2fcb6c99ae0f56cb06724ac3034 [1,1,0,0,0,0|2,0,0]=4 2641 B11R1.28 OCCCNc1ccncc1 7676a46d9ab85382fda372d12f0ec436 [1,1,0,0,0,0|1,0,0]=3 2642 B11R1.28 OCCCNc1ccncn1 8f8e0fe811bf9371817f728d08c59f5f [1,1,0,0,0,0|2,0,0]=4 2643 B11R1.28 OCCCNc1ccnnc1 14a18a2253a6a9e0d46f0f1c7fc618ae [1,1,0,0,0,0|2,0,0]=4 2644 B11R1.28 OCCCNc1cnccn1 394ab3fd80b46dcc8203d15389985779 [1,1,0,0,0,0|2,0,0]=4 2645 B11R1.28 OCCCNc1cncnc1 8445dccdce1bef71ff1db635903cefb8 [1,1,0,0,0,0|2,0,0]=4 2646 B11R1.28 OCCCNc1ncccn1 1db3dee2f5e622c36a01a6f642b42373 [1,1,0,0,0,0|2,0,0]=4 2647 B11R1.28 OCCNCc1ccccc1 6075728aab81556d5096d2980e4afa2d [1,1,0,0,0,0|0,0,0]=2 2648 B11R1.28 OCCNCc1ccccn1 aee8d8851b64ae441b47dd7c19255c9b [1,1,0,0,0,0|1,0,0]=3 2649 B11R1.28 OCCNCc1cccnc1 882a81680203d781920d7144e525a6cd [1,1,0,0,0,0|1,0,0]=3 2650 B11R1.28 OCCNCc1cccnn1 e41c460ec8467c13b31f38e40901bc04 [1,1,0,0,0,0|2,0,0]=4 2651 B11R1.28 OCCNCc1ccncc1 9ecc8a72acff6784c82756ff768b065d [1,1,0,0,0,0|1,0,0]=3 2652 B11R1.28 OCCNCc1ccncn1 fef527a9dde408a7b55664eab4f2eb99 [1,1,0,0,0,0|2,0,0]=4 2653 B11R1.28 OCCNCc1ccnnc1 f4386b298971cd36b164bebcf2929040 [1,1,0,0,0,0|2,0,0]=4 2654 B11R1.28 OCCNCc1cnccn1 2ee89dc8c04206d44948d3c79c8e8f8a [1,1,0,0,0,0|2,0,0]=4 2655 B11R1.28 OCCNCc1cncnc1 8015e7e3ea00625cbc8df3281a43f01a [1,1,0,0,0,0|2,0,0]=4 2656 B11R1.28 OCCNCc1ncccn1 34cde4fdd469b9280baca8a787271f1f [1,1,0,0,0,0|2,0,0]=4 2657 B11R1.28 OCNCCc1ccccc1 dba1af705064b03a49f56a10af922b9a [1,1,0,0,0,0|0,0,0]=2 2658 B11R1.28 OCNCCc1ccccn1 870a6b93d6f817d2b7b76ee4a753e49e [1,1,0,0,0,0|1,0,0]=3 2659 B11R1.28 OCNCCc1cccnc1 5a238842d821729331c809bafe95118a [1,1,0,0,0,0|1,0,0]=3 2660 B11R1.28 OCNCCc1ccncc1 d4fdef2a16a1c89c93b39a7d349558eb [1,1,0,0,0,0|1,0,0]=3 2661 B11R1.28 OCNCCc1ccncn1 6744261abdd24d42c96fea72d14f993a [1,1,0,0,0,0|2,0,0]=4 2662 B11R1.28 OCNCCc1cnccn1 f4950c420442047f83981ab203d27aa5 [1,1,0,0,0,0|2,0,0]=4 2663 B11R1.28 OCNCCc1ncccn1 ef945efe9c2fffc4c52fc2c7c7ec1101 [1,1,0,0,0,0|2,0,0]=4 2664 B11R1.28 SCCCNc1ccccc1 0ed9842b503e3cd70fca4624b001f5d8 [1,1,0,0,0,0|0,1,0]=3 2665 B11R1.28 SCCCNc1ccccn1 6e9255137fb1e7130c483b51e209e603 [1,1,0,0,0,0|1,1,0]=4 2666 B11R1.28 SCCCNc1cccnc1 9d7b88e69ec7c6b34ca7771b6e0b91e4 [1,1,0,0,0,0|1,1,0]=4 2667 B11R1.28 SCCCNc1ccncc1 ca21b760b7ec316b64d15f3538d2549c [1,1,0,0,0,0|1,1,0]=4 2668 B11R1.28 SCCCOc1ccccn1 a6c411fcae0c9e021a422469b3fdfe87 [1,1,0,0,0,0|1,1,0]=4 2669 B11R1.28 SCCCOc1cccnc1 134743f8f7a869616fe16d61afd2d0e6 [1,1,0,0,0,0|1,1,0]=4 2670 B11R1.28 SCCCOc1ccncc1 e86746acf63686675a8e18fe26221a62 [1,1,0,0,0,0|1,1,0]=4 2671 B11R1.28 SCCNCc1ccccc1 842b711568e585283783756ca8279842 [1,1,0,0,0,0|0,1,0]=3 2672 B11R1.28 SCCNCc1ccccn1 ace948b27200a431fbd41a7ba53deb87 [1,1,0,0,0,0|1,1,0]=4 2673 B11R1.28 SCCNCc1cccnc1 8ab6cc5726329dc3b917c71b0e8e3a12 [1,1,0,0,0,0|1,1,0]=4 2674 B11R1.28 SCCNCc1ccncc1 3b6ef2e293d7e6f2b9cd175d9cbecd46 [1,1,0,0,0,0|1,1,0]=4 2675 B11R1.28 SCCOCc1ccccc1 ef1d3bfcf77b316513e3e84b7d85c143 [1,1,0,0,0,0|0,1,0]=3 2676 B11R1.28 SCCOCc1ccccn1 922bd68bb819886f081031e9f73951e2 [1,1,0,0,0,0|1,1,0]=4 2677 B11R1.28 SCCOCc1cccnc1 c1c52e309e8814a28fb8d713bda79484 [1,1,0,0,0,0|1,1,0]=4 2678 B11R1.28 SCCOCc1ccncc1 5a71ae8d634b1ad8f983b65a8abfb1e3 [1,1,0,0,0,0|1,1,0]=4 2679 B11R1.40 CC(CO)Nc1ccccc1 28944821b2a2502f940043c73e5bee97 [1,1,0,0,0,0|1,0,0]=3 2680 B11R1.40 CC(CO)Nc1ccccn1 2e21620844440b7bb083395c24fa5d12 [1,1,0,0,0,0|2,0,0]=4 2681 B11R1.40 CC(CO)Nc1cccnc1 1993973453fc1c9eb0295a2e45197541 [1,1,0,0,0,0|2,0,0]=4 2682 B11R1.40 CC(CO)Nc1ccncc1 014df859a1aaecd67e68db71b7c7ef69 [1,1,0,0,0,0|2,0,0]=4 2683 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [1,1,0,0,0,0|1,0,0]=3 2684 B11R1.40 CCC(C)Nc1ccccn1 bb895d27f1d9ed94ab4cd5f93b01f0bd [1,1,0,0,0,0|2,0,0]=4 2685 B11R1.40 CCC(C)Nc1cccnc1 a0e745f4d44915557790daf72381f523 [1,1,0,0,0,0|2,0,0]=4 2686 B11R1.40 CCC(C)Nc1ccncc1 8150e11adca204128a3ae62428597250 [1,1,0,0,0,0|2,0,0]=4 2687 B11R1.40 CCC(C)Oc1ccccn1 b8b4a806c6af90298cf0d1454fda0647 [1,1,0,0,0,0|2,0,0]=4 2688 B11R1.40 CCC(C)Oc1cccnc1 ea8ea3a935f9f1da0dc64162c872e010 [1,1,0,0,0,0|2,0,0]=4 2689 B11R1.40 CCC(C)Oc1ccncc1 0e7c13edf9ed6b6addf466a3a8481e15 [1,1,0,0,0,0|2,0,0]=4 2690 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [1,1,0,0,0,0|1,0,0]=3 2691 B11R1.40 CCN(C)Cc1ccccn1 e347cf6623c9ce49a1c94570b5d3844c [1,1,0,0,0,0|2,0,0]=4 2692 B11R1.40 CCN(C)Cc1cccnc1 69e9bc72fe902e2c097b1bc797c43254 [1,1,0,0,0,0|2,0,0]=4 2693 B11R1.40 CCN(C)Cc1ccncc1 ebfb44d53a95f23536771c3c1b41adfd [1,1,0,0,0,0|2,0,0]=4 2694 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [1,1,0,0,0,0|1,0,0]=3 2695 B11R1.40 CC[C@@H](C)Nc1cccnc1 d5c354fec9aa4824593a6aa370b31f97 [1,1,0,0,0,0|2,0,0]=4 2696 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [1,1,0,0,0,0|1,0,0]=3 2697 B11R1.40 CC[C@H](C)Nc1cccnc1 a188aeb369243191dc243d4fb98ce075 [1,1,0,0,0,0|2,0,0]=4 2698 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [1,1,0,0,0,0|2,0,0]=4 2699 B11R1.40 CN(CO)Cc1ccccc1 c1d08d2d2c7de731954ebcb428d333e2 [1,1,0,0,0,0|1,0,0]=3 2700 B11R1.40 CN(CO)Cc1ccccn1 a4ef6b4247ef0972f7871752389806bb [1,1,0,0,0,0|2,0,0]=4 2701 B11R1.40 CN(CO)Cc1cccnc1 bdae5dd3c0107b4a15ddef98331c4b4c [1,1,0,0,0,0|2,0,0]=4 2702 B11R1.40 CN(CO)Cc1ccncc1 82d474736717cd4ad3b664282e77f89c [1,1,0,0,0,0|2,0,0]=4 2703 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [1,1,0,0,0,0|1,0,0]=3 2704 B11R1.40 C[C@@H](CO)Nc1ccccn1 9ac7427612f5553e5180ee81712e35fd [1,1,0,0,0,0|2,0,0]=4 2705 B11R1.40 C[C@@H](CO)Nc1cccnc1 b4b83540aa924934ce25b37024c4f475 [1,1,0,0,0,0|2,0,0]=4 2706 B11R1.40 C[C@@H](CO)Nc1ccncc1 495de922b28b07b689b24b08a715b1b6 [1,1,0,0,0,0|2,0,0]=4 2707 B11R1.40 C[C@H](CO)Nc1ccccc1 b7592eed2c2b10dda06f47547223c567 [1,1,0,0,0,0|1,0,0]=3 2708 B11R1.40 C[C@H](CO)Nc1ccccn1 01d2d5e2403842048f8ac810f41680f1 [1,1,0,0,0,0|2,0,0]=4 2709 B11R1.40 C[C@H](CO)Nc1cccnc1 0388d126da012bf4a1e005fb7424e864 [1,1,0,0,0,0|2,0,0]=4 2710 B11R1.40 C[C@H](CO)Nc1ccncc1 12aec410035ef0ee1b8933a8e56e1a8b [1,1,0,0,0,0|2,0,0]=4 2711 B11R1.20 CC(C)Nc1ccc(cc1)Br e5f70783ec71726153c102e5801f7c8a [0,1,0,0,1,0|2,0,0]=4 2712 B11R1.20 CC(C)Nc1ccc(cc1)Cl b33a847c825901d9dbcf3f8815c5869c [0,1,0,0,1,0|2,0,0]=4 2713 B11R1.20 CC(C)Nc1ccc(cc1)F 689ddbde83a9a9429aa2388668fed19a [0,1,0,0,1,0|2,0,0]=4 2714 B11R1.20 CC(C)Nc1ccc(cc1)I fa67ab606e8380aaae6be79fda5faf68 [0,1,0,0,1,0|2,0,0]=4 2715 B11R1.20 CC(C)Nc1ccc(cc1)S e681327c1f8eccf785cd674735bc98be [0,1,0,0,1,0|2,0,0]=4 2716 B11R1.20 CC(C)Oc1ccc(cc1)Br c830042d81f1762ab02a381b9eac79a4 [0,1,0,0,1,0|2,0,0]=4 2717 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7f20d83f4f9b33a7fd797ee07caaf887 [0,1,0,0,1,0|2,0,0]=4 2718 B11R1.20 CC(C)Oc1ccc(cc1)F 4b3257094d99fffc8c1b5f1ead656595 [0,1,0,0,1,0|2,0,0]=4 2719 B11R1.20 CC(C)Oc1ccc(cc1)I d09c2b32d485e0c585ea84ecec015274 [0,1,0,0,1,0|2,0,0]=4 2720 B11R1.20 CC(C)Oc1ccc(cc1)S bc2b7db7696d219aecddb9042131dcc3 [0,1,0,0,1,0|2,0,0]=4 2721 B11R1.20 Cc1ccc(cc1)NC(C)C bd77af8bd7263855741bad7d9283a59e [0,1,0,0,1,0|2,0,0]=4 2722 B11R1.20 Cc1ccc(cc1)OC(C)C afaa4b057d8f12ac5846fcc0accc69e4 [0,1,0,0,1,0|2,0,0]=4 2723 B11R1.86 CC(C)Nc1ccccc1I 3eed1e6c2f407ecc428748af6151fed6 [0,1,0,0,1,0|2,0,0]=4 2724 B11R1.86 CC(C)Oc1ccccc1Cl c23b66f89632f42c5d307b4af3111d42 [0,1,0,0,1,0|2,0,0]=4 2725 B11R1.86 CC(C)Oc1ccccc1F 883d2c1cc9d854cb85fa804d83d6f507 [0,1,0,0,1,0|2,0,0]=4 2726 B11R1.86 CC(C)Oc1ccccc1I 5b38c2c613687166fa94711069ce6a86 [0,1,0,0,1,0|2,0,0]=4 2727 B11R1.86 CC(C)Oc1ccccc1S 75d24c98473e29b4fc09eb15793f8071 [0,1,0,0,1,0|2,0,0]=4 2728 B11R1.86 Cc1ccccc1OC(C)C e336697c807367b5d2038eeb2d20cb38 [0,1,0,0,1,0|2,0,0]=4 2729 B11R1.157 CC(C)Nc1cccc(c1)Br c1a310149209bebd05d401b8d9453768 [0,1,0,0,1,0|2,0,0]=4 2730 B11R1.157 CC(C)Nc1cccc(c1)Cl 88b649511dda4c3138b09b24b4cdf85e [0,1,0,0,1,0|2,0,0]=4 2731 B11R1.157 CC(C)Nc1cccc(c1)F 2469bb14dda7a11ffa1e171e9579afdb [0,1,0,0,1,0|2,0,0]=4 2732 B11R1.157 CC(C)Nc1cccc(c1)I 28c8d38bd4c860795c7f6ab5b08202d3 [0,1,0,0,1,0|2,0,0]=4 2733 B11R1.157 CC(C)Nc1cccc(c1)S 4d5403275c38f6ee6364ab78831bae52 [0,1,0,0,1,0|2,0,0]=4 2734 B11R1.157 CC(C)Oc1cccc(c1)Br 03d6e4f39dc83644234524de153060f8 [0,1,0,0,1,0|2,0,0]=4 2735 B11R1.157 CC(C)Oc1cccc(c1)Cl b05958621a80ad10943fb41bda6c4ff4 [0,1,0,0,1,0|2,0,0]=4 2736 B11R1.157 CC(C)Oc1cccc(c1)F cc5136a263bfb966a933f5c182f882fd [0,1,0,0,1,0|2,0,0]=4 2737 B11R1.157 CC(C)Oc1cccc(c1)I eecf4227dddae0c4ffe51c7d1a2196a6 [0,1,0,0,1,0|2,0,0]=4 2738 B11R1.157 CC(C)Oc1cccc(c1)S c0ecc340d31d590be5ee243f9c89bfa6 [0,1,0,0,1,0|2,0,0]=4 2739 B11R1.157 Cc1cccc(c1)NC(C)C 6995924353e7f43790a327361636dd3c [0,1,0,0,1,0|2,0,0]=4 2740 B11R1.157 Cc1cccc(c1)OC(C)C 768a0b78053567f181c821d541878835 [0,1,0,0,1,0|2,0,0]=4 2741 B11R1.509 CC(C)(C)Nc1ccccc1 820b34717c3d9476c22fcc3db6fccee9 [0,1,0,0,1,0|2,0,0]=4 2742 B11R1.25 CC(CO)CNc1ccco1 71d7f730861dec4d36bae70874e1302c [0,1,0,0,1,0|2,0,0]=4 2743 B11R1.25 CC(CO)CNc1cccs1 7d154d13e493f7700e0144525fd94345 [0,1,0,0,1,0|2,0,0]=4 2744 B11R1.25 CC(CO)CNc1ccsc1 6fdae7f7c4fbe9be6fa4b9a206af4552 [0,1,0,0,1,0|2,0,0]=4 2745 B11R1.25 CC(CO)NCc1cc[nH]c1 877ba2184a0c7d8eb73e144ae5917dae [0,1,0,0,1,0|2,0,0]=4 2746 B11R1.25 CC(CO)NCc1ccc[nH]1 3badc24526bcc1179321e6501359d917 [0,1,0,0,1,0|2,0,0]=4 2747 B11R1.25 CC(CO)NCc1ccco1 e11a1dcc997402b9ca10ebd6c1d728d8 [0,1,0,0,1,0|2,0,0]=4 2748 B11R1.25 CC(CO)NCc1cccs1 00a9c9f16ef261f122a5837659fa4e9f [0,1,0,0,1,0|2,0,0]=4 2749 B11R1.25 CC(CO)NCc1ccoc1 e6df631b5f401ce02b113655fd204a1b [0,1,0,0,1,0|2,0,0]=4 2750 B11R1.25 CC(CO)NCc1ccsc1 d2434e6f52dabfae333338bcfa32ddbe [0,1,0,0,1,0|2,0,0]=4 2751 B11R1.25 CCC(O)CNc1ccoc1 af3de1eebca676b63539dc0f61addb24 [0,1,0,0,1,0|2,0,0]=4 2752 B11R1.25 CCC(O)CNc1ccsc1 0e260aa3c6da0b07eb63be37c7451a28 [0,1,0,0,1,0|2,0,0]=4 2753 B11R1.25 CC[C@@H](O)CNc1ccoc1 adb57c64716ed05698c95128eb081729 [0,1,0,0,1,0|2,0,0]=4 2754 B11R1.25 CN(CO)CCc1cccs1 2c618cafcfd691f591f410a932ec48ac [0,1,0,0,1,0|2,0,0]=4 2755 B11R1.25 COC(C)CNc1cccs1 c4c2fecde12301d8b0282dddfd2f9504 [0,1,0,0,1,0|2,0,0]=4 2756 B11R1.25 COC(C)CNc1ccsc1 51700bb5eb4ec7029dc713f2b05ec8ad [0,1,0,0,1,0|2,0,0]=4 2757 B11R1.25 COC(C)COc1ccco1 93065ea5c69b6fbdb33bcca608d73f09 [0,1,0,0,1,0|2,0,0]=4 2758 B11R1.25 COC(C)COc1cccs1 9f10d3bbe54420e35376d35fa4ea22f5 [0,1,0,0,1,0|2,0,0]=4 2759 B11R1.25 COC(C)COc1ccsc1 7102903d914026e4c9118ee57b7a4ba1 [0,1,0,0,1,0|2,0,0]=4 2760 B11R1.25 CO[C@@H](C)CNc1cccs1 525908e5c54683eedd0d5312dda56c1f [0,1,0,0,1,0|2,0,0]=4 2761 B11R1.25 CO[C@@H](C)CNc1ccoc1 f831657b5384d41e308bc2ac1b833dd1 [0,1,0,0,1,0|2,0,0]=4 2762 B11R1.25 CO[C@@H](C)CNc1ccsc1 a381c77e06aa5ea730e2f295afa18e02 [0,1,0,0,1,0|2,0,0]=4 2763 B11R1.25 CO[C@@H](C)COc1ccco1 e557909e371149b446b7f97226f650cc [0,1,0,0,1,0|2,0,0]=4 2764 B11R1.25 CO[C@@H](C)COc1cccs1 f1cbc3c28cc6639889fa3b36ddc0bb2a [0,1,0,0,1,0|2,0,0]=4 2765 B11R1.25 CO[C@@H](C)COc1ccsc1 d48caf88d4a5fdeee006b06334c029e5 [0,1,0,0,1,0|2,0,0]=4 2766 B11R1.25 CO[C@H](C)CNc1cccs1 2c7e909abe7649dec8a45da80c668e6e [0,1,0,0,1,0|2,0,0]=4 2767 B11R1.25 CO[C@H](C)CNc1ccoc1 a1ad865022ef503f359061071d26d873 [0,1,0,0,1,0|2,0,0]=4 2768 B11R1.25 CO[C@H](C)CNc1ccsc1 9568497d5f451fee5cb7225b0cc91124 [0,1,0,0,1,0|2,0,0]=4 2769 B11R1.25 CO[C@H](C)COc1ccco1 a1992187ae1c40f3e1e43f18845ac2cf [0,1,0,0,1,0|2,0,0]=4 2770 B11R1.25 CO[C@H](C)COc1cccs1 4cf78b41a8911247d096ddceaf26e53e [0,1,0,0,1,0|2,0,0]=4 2771 B11R1.25 CO[C@H](C)COc1ccsc1 8ec335abadbbb897779b6423c15003a7 [0,1,0,0,1,0|2,0,0]=4 2772 B11R1.25 C[C@@H](CO)CNc1cccs1 3c221bbfdbd70a2e7151c5eaca058c12 [0,1,0,0,1,0|2,0,0]=4 2773 B11R1.25 C[C@@H](CO)CNc1ccsc1 330b159a79cd95951af64a3893507a33 [0,1,0,0,1,0|2,0,0]=4 2774 B11R1.25 C[C@@H](CO)NCc1cc[nH]c1 9cf6fea2d87a0365fb814687749c5087 [0,1,0,0,1,0|2,0,0]=4 2775 B11R1.25 C[C@@H](CO)NCc1ccc[nH]1 ef9ac39ef16e2c829e4a3ac58e5822d9 [0,1,0,0,1,0|2,0,0]=4 2776 B11R1.25 C[C@@H](CO)NCc1ccco1 2b9b1d2922178f6f79ded161cd99a8d3 [0,1,0,0,1,0|2,0,0]=4 2777 B11R1.25 C[C@@H](CO)NCc1cccs1 d8fcc910bc3e48f8aa76ce1963b2b15b [0,1,0,0,1,0|2,0,0]=4 2778 B11R1.25 C[C@@H](CO)NCc1ccoc1 7a372abb1697576859682d94c0140c30 [0,1,0,0,1,0|2,0,0]=4 2779 B11R1.25 C[C@@H](CO)NCc1ccsc1 56f681eb39e98203a9e4ca448f1fbc26 [0,1,0,0,1,0|2,0,0]=4 2780 B11R1.25 C[C@H](CO)CNc1ccco1 1f73a8f603f63c0fa3041d3cfeae2992 [0,1,0,0,1,0|2,0,0]=4 2781 B11R1.25 C[C@H](CO)CNc1cccs1 9da4c361a8dcef4f13e49dae1801c663 [0,1,0,0,1,0|2,0,0]=4 2782 B11R1.25 C[C@H](CO)CNc1ccsc1 9da8683cb75ba830a17960f37f17788b [0,1,0,0,1,0|2,0,0]=4 2783 B11R1.25 C[C@H](CO)NCc1cc[nH]c1 36d4de56e28aab4498d9687d1a30419f [0,1,0,0,1,0|2,0,0]=4 2784 B11R1.25 C[C@H](CO)NCc1ccc[nH]1 7318914e1b5735f2e8c544fefe9a8c93 [0,1,0,0,1,0|2,0,0]=4 2785 B11R1.25 C[C@H](CO)NCc1ccco1 d1c1d3584d51f54226efd246214dd928 [0,1,0,0,1,0|2,0,0]=4 2786 B11R1.25 C[C@H](CO)NCc1cccs1 3a6767b03ae7d2d9b73ba88d96827a42 [0,1,0,0,1,0|2,0,0]=4 2787 B11R1.25 C[C@H](CO)NCc1ccoc1 4e74c5fe422c084f8cf7d614a73791a9 [0,1,0,0,1,0|2,0,0]=4 2788 B11R1.25 C[C@H](CO)NCc1ccsc1 e18ec142a4c6aff0cf7600c1a120be0d [0,1,0,0,1,0|2,0,0]=4 2789 B11R1.25 OC(CF)CNc1cccs1 b7f9fa2424c1fe424a39adfe29d1078f [0,1,0,0,1,0|2,0,0]=4 2790 B11R1.25 OC(CF)CNc1ccsc1 39b6b5c16c9705e526797f2c7072457d [0,1,0,0,1,0|2,0,0]=4 2791 B11R1.25 OCC(O)CNc1ccco1 7b9c5f5e56970f10dc520432573197fd [0,1,0,0,1,0|2,0,0]=4 2792 B11R1.25 OCC(O)CNc1cccs1 77c982f409918a86c11fe0b9627df5b8 [0,1,0,0,1,0|2,0,0]=4 2793 B11R1.25 OCC(O)CNc1ccoc1 29b198b150cef0fe90118e78912567a2 [0,1,0,0,1,0|2,0,0]=4 2794 B11R1.25 OCC(O)CNc1ccsc1 395138f1d28a79faeb7abbbe0df4bf7e [0,1,0,0,1,0|2,0,0]=4 2795 B11R1.25 OCC(O)COc1ccco1 dc2d0395a69f183df492a923cb6135fe [0,1,0,0,1,0|2,0,0]=4 2796 B11R1.25 OCC(O)COc1cccs1 d942cc2b9f99552b080fa14953e7f6d4 [0,1,0,0,1,0|2,0,0]=4 2797 B11R1.25 OCC(O)COc1ccsc1 a6388478eaae03f493bb76776ecaa485 [0,1,0,0,1,0|2,0,0]=4 2798 B11R1.25 OC[C@@H](O)CNc1ccco1 5bdffd493ff70e4c17df01516b7b710e [0,1,0,0,1,0|2,0,0]=4 2799 B11R1.25 OC[C@@H](O)CNc1cccs1 95f16135754376f05aac9b4c78f1e07f [0,1,0,0,1,0|2,0,0]=4 2800 B11R1.25 OC[C@@H](O)CNc1ccoc1 f04a97d9ae0299b90456247d2a155432 [0,1,0,0,1,0|2,0,0]=4 2801 B11R1.25 OC[C@@H](O)CNc1ccsc1 e5e2faa334a498cda1bdbf1660214b8f [0,1,0,0,1,0|2,0,0]=4 2802 B11R1.25 OC[C@@H](O)COc1ccco1 a2b3e11dbfc8d2a213f5cf3d47f6f47c [0,1,0,0,1,0|2,0,0]=4 2803 B11R1.25 OC[C@@H](O)COc1cccs1 d92ed2c839a3d576bb09ed648bf40a70 [0,1,0,0,1,0|2,0,0]=4 2804 B11R1.25 OC[C@@H](O)COc1ccsc1 2b8bbe46419416ea85d1fe8ce51ede0f [0,1,0,0,1,0|2,0,0]=4 2805 B11R1.25 OC[C@H](O)CNc1ccco1 9ee578a59bfbcffe6d64fa58e61adc7a [0,1,0,0,1,0|2,0,0]=4 2806 B11R1.25 OC[C@H](O)CNc1cccs1 9de01a47f3216d5764e19045268337bf [0,1,0,0,1,0|2,0,0]=4 2807 B11R1.25 OC[C@H](O)CNc1ccoc1 6de4c503eba0f3bd298c2bd27c35f093 [0,1,0,0,1,0|2,0,0]=4 2808 B11R1.25 OC[C@H](O)CNc1ccsc1 38c3c16b0d0ec169bc9dc6342497f523 [0,1,0,0,1,0|2,0,0]=4 2809 B11R1.25 OC[C@H](O)COc1ccco1 d2c1f9a4756405de44337580e6551280 [0,1,0,0,1,0|2,0,0]=4 2810 B11R1.25 OC[C@H](O)COc1cccs1 fd38fb97a821305e25676fc64f4b03ce [0,1,0,0,1,0|2,0,0]=4 2811 B11R1.25 OC[C@H](O)COc1ccsc1 c1cc1fbc2a0853aa0a37b27b33475865 [0,1,0,0,1,0|2,0,0]=4 2812 B11R1.75 CC(O)CNc1ccc(s1)Br 105e06bb9b2d11f9f1b27f9fdd111815 [0,1,0,0,1,0|2,0,0]=4 2813 B11R1.75 CC(O)CNc1ccc(s1)F d3fb02ca94a1faad0cb94a0685a652e8 [0,1,0,0,1,0|2,0,0]=4 2814 B11R1.75 C[C@@H](O)CNc1ccc(s1)Br 4558d0f07ad0ca56887793cc8e357db6 [0,1,0,0,1,0|2,0,0]=4 2815 B11R1.75 C[C@@H](O)CNc1ccc(s1)F c9d05c3ceef217c6a494fa79f6acfacb [0,1,0,0,1,0|2,0,0]=4 2816 B11R1.75 C[C@H](O)CNc1ccc(s1)Br 40849fef6f9c516b7d78a08281bf5bec [0,1,0,0,1,0|2,0,0]=4 2817 B11R1.75 C[C@H](O)CNc1ccc(s1)F e7db5e5955088fa69b2a8bfa585ac596 [0,1,0,0,1,0|2,0,0]=4 2818 B11R1.75 Cc1ccc(o1)NCC(C)O e4cda00768d23bd0fe9bcceae70111d1 [0,1,0,0,1,0|2,0,0]=4 2819 B11R1.75 Cc1ccc(o1)NC[C@@H](C)O c548e972b429550527852a47333680d3 [0,1,0,0,1,0|2,0,0]=4 2820 B11R1.75 Cc1ccc(o1)NC[C@H](C)O b64e0b40fe170bb547457627e8d6a85e [0,1,0,0,1,0|2,0,0]=4 2821 B11R1.75 Cc1ccc(s1)NCC(C)O 4b3bff952982cfda974dcbcd7f603337 [0,1,0,0,1,0|2,0,0]=4 2822 B11R1.75 Cc1ccc(s1)NC[C@@H](C)O d69b7106d25d4d890ffcf545cda17083 [0,1,0,0,1,0|2,0,0]=4 2823 B11R1.75 Cc1ccc(s1)NC[C@H](C)O 6448057a2506c5b28f90fa7a04a594d1 [0,1,0,0,1,0|2,0,0]=4 2824 B11R1.77 CC(O)CN(C)c1ccsc1 787ff28f3b02e59b92e1c10b65917c59 [0,1,0,0,1,0|2,0,0]=4 2825 B11R1.77 C[C@H](O)CN(C)c1ccsc1 1190770b2517d3d4b029f797bfe96880 [0,1,0,0,1,0|2,0,0]=4 2826 B11R1.90 CC(O)CNc1cscc1Br 111b0430a207804b7e7fc2975d105e07 [0,1,0,0,1,0|2,0,0]=4 2827 B11R1.90 C[C@H](O)CNc1cscc1Br 3fed8b712d552cf14490415e3127c8ef [0,1,0,0,1,0|2,0,0]=4 2828 B11R1.90 Cc1cscc1NCC(C)O 3158c3cbf4516af99f0149970e25d152 [0,1,0,0,1,0|2,0,0]=4 2829 B11R1.90 Cc1cscc1NC[C@H](C)O 51a99a11d343aaeeee93c14916e38d99 [0,1,0,0,1,0|2,0,0]=4 2830 B11R1.90 Cc1sccc1NCC(C)O 8fc8d2a49842c583c78c02db29ba6f62 [0,1,0,0,1,0|2,0,0]=4 2831 B11R1.90 Cc1sccc1NC[C@H](C)O ecb5525c1fe997b79263e45d4e5f4173 [0,1,0,0,1,0|2,0,0]=4 2832 B11R1.510 CC(C)(O)CNc1ccco1 56f31733a969c9ca63406cd8cb509b13 [0,1,0,0,1,0|2,0,0]=4 2833 B11R1.510 CC(C)(O)CNc1cccs1 8e3d12ddc89f29aa850c2d1566c6b066 [0,1,0,0,1,0|2,0,0]=4 2834 B11R1.510 CC(C)(O)CNc1ccoc1 ea2bcce545c78205566a0da40007a552 [0,1,0,0,1,0|2,0,0]=4 2835 B11R1.510 CC(C)(O)CNc1ccsc1 aeb81c520597f18748c95e0633414a55 [0,1,0,0,1,0|2,0,0]=4 2836 B11R1.510 CC(C)(O)COc1ccco1 de1bfb25193492f91c96c030f00d3306 [0,1,0,0,1,0|2,0,0]=4 2837 B11R1.510 CC(C)(O)COc1cccs1 0d9e714c3d5c3a28dbd67bc218a92820 [0,1,0,0,1,0|2,0,0]=4 2838 B11R1.510 CC(C)(O)COc1ccsc1 3c06548bddb214c7d2c85f0b9561a60d [0,1,0,0,1,0|2,0,0]=4 2839 B13R1.45 C=C(C)CNC(C)c1ccccc1 96a07a0b01f7d27a0605cdf3e961a39d [0,1,0,0,0,1|1,0,1]=4 2840 B13R1.45 C=C(C)CN[C@@H](C)c1ccccc1 f509ab942fa31eca8f7b10abc4c30b1a [0,1,0,0,0,1|1,0,1]=4 2841 B13R1.45 C=C(C)CN[C@H](C)c1ccccc1 549a94c91eb031892c4cbe73a28b64c5 [0,1,0,0,0,1|1,0,1]=4 2842 B13R1.45 C=C(C)COC(C)c1ccccc1 e61df747fd27049a942457d909826b12 [0,1,0,0,0,1|1,0,1]=4 2843 B13R1.45 C=C(C)CO[C@@H](C)c1ccccc1 c178b66be30696ed9c05998b7e583b0e [0,1,0,0,0,1|1,0,1]=4 2844 B13R1.45 C=C(C)CO[C@H](C)c1ccccc1 f3097012c4c792591409151b78a238bc [0,1,0,0,0,1|1,0,1]=4 2845 B13R1.45 C=C(COC(C)C)c1ccccc1 c46326accaa0df25e6f5b70ed8df995e [0,1,0,0,0,1|1,0,1]=4 2846 B13R1.45 CC(=O)NCC(C)c1ccccc1 605838f13626664b2f33081202ec2bc5 [0,1,0,0,0,1|0,0,2]=4 2847 B13R1.45 CC(=O)NCC(O)c1ccccc1 338fd8ffb5a5b3263ec1b7d66185bbe1 [0,1,0,0,0,1|0,0,2]=4 2848 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 3c11938df208c26416c9256f7ea627c2 [0,1,0,0,0,1|0,0,2]=4 2849 B13R1.45 CC(=O)NC[C@@H](O)c1ccccc1 63185760d23ecc3a7db9fda738b2ead6 [0,1,0,0,0,1|0,0,2]=4 2850 B13R1.45 CC(=O)NC[C@H](C)c1ccccc1 5bf75215a0ba164735bf6fc81e4e8b22 [0,1,0,0,0,1|0,0,2]=4 2851 B13R1.45 CC(=O)NC[C@H](O)c1ccccc1 1a789d2dbdb75e4d6d04d7189c08238f [0,1,0,0,0,1|0,0,2]=4 2852 B13R1.45 CC(C)CCN(C)c1ccccc1 ee25433740b2055fca5a498af1d6b40b [0,1,0,0,0,1|1,0,0]=3 2853 B13R1.45 CC(C)CCN(C)c1ccccn1 1e8fc883dee4bd43a48709e0440afe70 [0,1,0,0,0,1|2,0,0]=4 2854 B13R1.45 CC(C)CCN(C)c1cccnc1 6042f9369f1cfb330458fce26cbc22eb [0,1,0,0,0,1|2,0,0]=4 2855 B13R1.45 CC(C)CCN(C)c1ccncc1 15ee56f3d9e81348ac0bd9112d643a6b [0,1,0,0,0,1|2,0,0]=4 2856 B13R1.45 CC(C)CNC(=O)c1ccccc1 e24d07508e1f4c32ab6066e627a71e08 [0,1,0,0,0,1|1,0,1]=4 2857 B13R1.45 CC(C)CNC(C)c1ccccc1 1a8ed7a47c47c28fcbae58c50dcc8cfb [0,1,0,0,0,1|1,0,0]=3 2858 B13R1.45 CC(C)CNC(C)c1ccccn1 b9b473423ccb43dda9cac20952f57ebd [0,1,0,0,0,1|2,0,0]=4 2859 B13R1.45 CC(C)CNC(C)c1cccnc1 ddddc74aaaf27589d3834f34e01f91fb [0,1,0,0,0,1|2,0,0]=4 2860 B13R1.45 CC(C)CNC(C)c1ccncc1 11e70707f98b8c1ba9847fd9d748ff7e [0,1,0,0,0,1|2,0,0]=4 2861 B13R1.45 CC(C)CN[C@@H](C)c1ccccc1 0e1d1975e0dee5224fe5ca3cbd45c906 [0,1,0,0,0,1|1,0,0]=3 2862 B13R1.45 CC(C)CN[C@@H](C)c1ccccn1 5967780310b6920d3779f1a80363a7ca [0,1,0,0,0,1|2,0,0]=4 2863 B13R1.45 CC(C)CN[C@@H](C)c1cccnc1 067d81c2619d84e7559eaf4e6a53c681 [0,1,0,0,0,1|2,0,0]=4 2864 B13R1.45 CC(C)CN[C@@H](C)c1ccncc1 3d823a1ee770b21cd8da4ffce5d23742 [0,1,0,0,0,1|2,0,0]=4 2865 B13R1.45 CC(C)CN[C@H](C)c1ccccc1 3b8e4ab918a68755a3dd66398362cf93 [0,1,0,0,0,1|1,0,0]=3 2866 B13R1.45 CC(C)CN[C@H](C)c1ccccn1 4fb2ea94530cbeaffeb62e91d426522f [0,1,0,0,0,1|2,0,0]=4 2867 B13R1.45 CC(C)CN[C@H](C)c1cccnc1 8cbf6c02ed1bae196728d9b44322419d [0,1,0,0,0,1|2,0,0]=4 2868 B13R1.45 CC(C)CN[C@H](C)c1ccncc1 90aa6c11d41b6fc0786081851e125046 [0,1,0,0,0,1|2,0,0]=4 2869 B13R1.45 CC(C)COC(C)c1ccccc1 a431719ff60ac10602452d9f6000ed98 [0,1,0,0,0,1|1,0,0]=3 2870 B13R1.45 CC(C)COC(C)c1ccccn1 59003c839906b252274a4700c77accc0 [0,1,0,0,0,1|2,0,0]=4 2871 B13R1.45 CC(C)COC(C)c1cccnc1 a29621c54734459d3b39dba51f07dd91 [0,1,0,0,0,1|2,0,0]=4 2872 B13R1.45 CC(C)COC(C)c1ccncc1 ec5f66b9d8429b257df94222a9a0d6a6 [0,1,0,0,0,1|2,0,0]=4 2873 B13R1.45 CC(C)CO[C@@H](C)c1ccccc1 c918fde3f01335c4594a3cdd44a5c245 [0,1,0,0,0,1|1,0,0]=3 2874 B13R1.45 CC(C)CO[C@@H](C)c1ccccn1 22586d40f699e7b28a0e9b933e901462 [0,1,0,0,0,1|2,0,0]=4 2875 B13R1.45 CC(C)CO[C@@H](C)c1cccnc1 f07ffbe593cf23596fa77353db40d331 [0,1,0,0,0,1|2,0,0]=4 2876 B13R1.45 CC(C)CO[C@@H](C)c1ccncc1 3ac4d63178151dc4189e06ada3fc3aaa [0,1,0,0,0,1|2,0,0]=4 2877 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 76f93aeb672136c41969299f8af62234 [0,1,0,0,0,1|1,0,0]=3 2878 B13R1.45 CC(C)CO[C@H](C)c1ccccn1 8565820cc34943603f10b017d1e738f0 [0,1,0,0,0,1|2,0,0]=4 2879 B13R1.45 CC(C)CO[C@H](C)c1cccnc1 11d5f66dad6297b6dd5f773a7655bc0f [0,1,0,0,0,1|2,0,0]=4 2880 B13R1.45 CC(C)CO[C@H](C)c1ccncc1 4f2ddbaee10978c7ec6a82ffc7bbc5bd [0,1,0,0,0,1|2,0,0]=4 2881 B13R1.45 CC(C)NCC(=O)c1ccccc1 e4ded4d81dacb28522b7b23f367a5817 [0,1,0,0,0,1|1,0,1]=4 2882 B13R1.45 CC(C)NCC(O)c1ccccn1 b8e7bb67a47895ae90dd5feb96033573 [0,1,0,0,0,1|2,0,0]=4 2883 B13R1.45 CC(C)NCC(O)c1cccnc1 3c3a14a062dfddc6f0ca412ad3efbcba [0,1,0,0,0,1|2,0,0]=4 2884 B13R1.45 CC(C)NCC(O)c1ccncc1 4ae4c0fe61339ec9e186d35b4bbdc248 [0,1,0,0,0,1|2,0,0]=4 2885 B13R1.45 CC(C)OCC(=O)c1ccccc1 1a2559ca9ca27a395e5d70680cd4fdb5 [0,1,0,0,0,1|1,0,1]=4 2886 B13R1.45 CC(C)OCC(C)c1ccccc1 ec931c631196ee710bfc24252b11b1e8 [0,1,0,0,0,1|1,0,0]=3 2887 B13R1.45 CC(C)OCC(C)c1ccccn1 ae638a71b222725299f4febcb292b4a2 [0,1,0,0,0,1|2,0,0]=4 2888 B13R1.45 CC(C)OCN(C)c1ccccc1 72f6dffffdb48619a1aa5d446fd288f4 [0,1,0,0,0,1|2,0,0]=4 2889 B13R1.45 CC(C)OC[C@@H](C)c1ccccc1 dc86bab03a7acc808db6858717777ba4 [0,1,0,0,0,1|1,0,0]=3 2890 B13R1.45 CC(NCC(=O)O)c1ccccc1 6cd1c18d6d7b686116c2e80c73f04289 [0,1,0,0,0,1|1,0,1]=4 2891 B13R1.45 CC(NC[C@@H](C)O)c1ccccn1 45f7621c2933898635d0bea9ab5e9398 [0,1,0,0,0,1|1,0,0]=3 2892 B13R1.45 CC(NC[C@@H](C)O)c1ccncc1 449a89f08863d277184c05c14f1b75ff [0,1,0,0,0,1|1,0,0]=3 2893 B13R1.45 CC(NC[C@@H](C)O)c1ccncn1 1695abd99744820cb5a1db9bd7543440 [0,1,0,0,0,1|2,0,0]=4 2894 B13R1.45 CC(NC[C@@H](C)O)c1ccnnc1 ec5a307c3f61528070d53dd85885efca [0,1,0,0,0,1|2,0,0]=4 2895 B13R1.45 CC(NC[C@@H](C)O)c1cnccn1 9eb882fb04dada17811c9a12bee3b779 [0,1,0,0,0,1|2,0,0]=4 2896 B13R1.45 CC(NC[C@@H](C)O)c1ncccn1 bfd2783b2cf5f847de75eb2cad82539c [0,1,0,0,0,1|2,0,0]=4 2897 B13R1.45 CC(NC[C@H](C)O)c1ccccc1 654fe78be9da3356fceacec64527fef5 [0,1,0,0,0,1|0,0,0]=2 2898 B13R1.45 CC(NC[C@H](C)O)c1ccccn1 509e94e47c7a67ce91aebeffe431ad06 [0,1,0,0,0,1|1,0,0]=3 2899 B13R1.45 CC(NC[C@H](C)O)c1cccnc1 a802a44c9b8366f5c5c1307e53e4c66a [0,1,0,0,0,1|1,0,0]=3 2900 B13R1.45 CC(NC[C@H](C)O)c1cccnn1 059e37f47c50568cbab7b027c68cf00d [0,1,0,0,0,1|2,0,0]=4 2901 B13R1.45 CC(NC[C@H](C)O)c1ccncc1 1d62d00489a1fc5bd558c0eb0959c476 [0,1,0,0,0,1|1,0,0]=3 2902 B13R1.45 CC(NC[C@H](C)O)c1ccncn1 540bbfd6e3e314ff0747abe3110e4b51 [0,1,0,0,0,1|2,0,0]=4 2903 B13R1.45 CC(NC[C@H](C)O)c1ccnnc1 a3736d0d5dcce21023e1b0eaac2545e6 [0,1,0,0,0,1|2,0,0]=4 2904 B13R1.45 CC(NC[C@H](C)O)c1cnccn1 1e575d38548859e36bc828a77771fcf8 [0,1,0,0,0,1|2,0,0]=4 2905 B13R1.45 CC(NC[C@H](C)O)c1cncnc1 edcc0bb4ab1b9429ce58add545d70772 [0,1,0,0,0,1|2,0,0]=4 2906 B13R1.45 CC(NC[C@H](C)O)c1ncccn1 6bf5b45e2e5b4fa358205f4205473dc2 [0,1,0,0,0,1|2,0,0]=4 2907 B13R1.45 CC(O)CCN(C)c1ccccc1 67f8cb5e20b8e2eb9a338d1aa9237e41 [0,1,0,0,0,1|0,0,0]=2 2908 B13R1.45 CC(O)CCN(C)c1ccccn1 5602f79dc3b02c4743227f78f17dfb19 [0,1,0,0,0,1|1,0,0]=3 2909 B13R1.45 CC(O)CCN(C)c1cccnc1 ba2e76134424684dbbe28cf7ce71b381 [0,1,0,0,0,1|1,0,0]=3 2910 B13R1.45 CC(O)CCN(C)c1cccnn1 f9318aac58c75f3b09f8aa1dbac9993a [0,1,0,0,0,1|2,0,0]=4 2911 B13R1.45 CC(O)CCN(C)c1ccncc1 7cef6a6ba8890065c1aa136a251c9c69 [0,1,0,0,0,1|1,0,0]=3 2912 B13R1.45 CC(O)CCN(C)c1ccncn1 2b57dd05ddf461a7cdacd9d3867201c3 [0,1,0,0,0,1|2,0,0]=4 2913 B13R1.45 CC(O)CCN(C)c1ccnnc1 cf6d62c808d8ea7071671cdd4264371f [0,1,0,0,0,1|2,0,0]=4 2914 B13R1.45 CC(O)CCN(C)c1cnccn1 227466840c98047a7379798e0ff54df7 [0,1,0,0,0,1|2,0,0]=4 2915 B13R1.45 CC(O)CCN(C)c1ncccn1 9b24def23727f5cbf9a5266310cec32a [0,1,0,0,0,1|2,0,0]=4 2916 B13R1.45 CC(O)CNC(=O)c1ccccc1 59dfb517b08db2cf84f86f45a76faf2d [0,1,0,0,0,1|0,0,1]=3 2917 B13R1.45 CC(O)CNC(=O)c1ccccn1 f8123eccef02603d277cf8a0b8b2f312 [0,1,0,0,0,1|1,0,1]=4 2918 B13R1.45 CC(O)CNC(=O)c1cccnc1 9438b88e1e84f80390cf5f817c5bc03f [0,1,0,0,0,1|1,0,1]=4 2919 B13R1.45 CC(O)CNC(=O)c1ccncc1 3ecb6a22d2c17269ff3eb94e73a100fe [0,1,0,0,0,1|1,0,1]=4 2920 B13R1.45 CC(O)CNC(C)c1ccccc1 d9f0bebfc19dc692825c4559fb9aaa87 [0,1,0,0,0,1|0,0,0]=2 2921 B13R1.45 CC(O)CNC(C)c1ccccn1 96939f7b9b26d6397db9b2181611e4af [0,1,0,0,0,1|1,0,0]=3 2922 B13R1.45 CC(O)CNC(C)c1cccnc1 5d7068fdc67246e91fa8f43d27d76d41 [0,1,0,0,0,1|1,0,0]=3 2923 B13R1.45 CC(O)CNC(C)c1cccnn1 539f7a44926b3c82a46442ad057f1672 [0,1,0,0,0,1|2,0,0]=4 2924 B13R1.45 CC(O)CNC(C)c1ccncc1 c3e9549919f1f3e9fc6fc01c8970c8a5 [0,1,0,0,0,1|1,0,0]=3 2925 B13R1.45 CC(O)CNC(C)c1ccncn1 7ce7055e97e1c1128d8e093a3a31d4b4 [0,1,0,0,0,1|2,0,0]=4 2926 B13R1.45 CC(O)CNC(C)c1ccnnc1 9e283e0cda8cb3d3b967d8ee07e46f83 [0,1,0,0,0,1|2,0,0]=4 2927 B13R1.45 CC(O)CNC(C)c1cnccn1 776e18b5ad7195508399f60eb800635e [0,1,0,0,0,1|2,0,0]=4 2928 B13R1.45 CC(O)CNC(C)c1cncnc1 80abd423a892999c60cd279338ac3d7c [0,1,0,0,0,1|2,0,0]=4 2929 B13R1.45 CC(O)CNC(C)c1ncccn1 a4fcc2bcb2f99e4838161a4d84906618 [0,1,0,0,0,1|2,0,0]=4 2930 B13R1.45 CC(O)CN[C@@H](C)c1ccccc1 d44e88f4801ca53bc9b4acefbb4d6214 [0,1,0,0,0,1|0,0,0]=2 2931 B13R1.45 CC(O)CN[C@@H](C)c1ccccn1 eb7c6796fcfab5269977209e98811d90 [0,1,0,0,0,1|1,0,0]=3 2932 B13R1.45 CC(O)CN[C@@H](C)c1cccnc1 2ac667758087ec7e5b05b945009880e3 [0,1,0,0,0,1|1,0,0]=3 2933 B13R1.45 CC(O)CN[C@@H](C)c1ccncc1 d012adad068279474cda6ee8e064d1fa [0,1,0,0,0,1|1,0,0]=3 2934 B13R1.45 CC(O)CN[C@@H](C)c1cncnc1 99e157fc69772b52920cb32fbdd95f5c [0,1,0,0,0,1|2,0,0]=4 2935 B13R1.45 CC(O)CN[C@H](C)c1ccccc1 7ddf90be408fb1d3293ac51ba0725863 [0,1,0,0,0,1|0,0,0]=2 2936 B13R1.45 CC(O)CN[C@H](C)c1ccccn1 d3cc2b2307f58a377135a74583264819 [0,1,0,0,0,1|1,0,0]=3 2937 B13R1.45 CC(O)CN[C@H](C)c1cccnc1 0ead3d86eaa5470a67e3431e854ef584 [0,1,0,0,0,1|1,0,0]=3 2938 B13R1.45 CC(O)CN[C@H](C)c1ccncc1 294271b0a3f989113f2312b792ee9275 [0,1,0,0,0,1|1,0,0]=3 2939 B13R1.45 CC(O)CN[C@H](C)c1cncnc1 88189306aee45999110cc6e799cdd898 [0,1,0,0,0,1|2,0,0]=4 2940 B13R1.45 CC(OCC(=O)O)c1ccccc1 96b216adb540c329efb593b486d328ea [0,1,0,0,0,1|1,0,1]=4 2941 B13R1.45 CC(OCC(F)F)c1ccccc1 eebaccaa0861319c7b78eaf7a7fc6487 [0,1,0,0,0,1|2,0,0]=4 2942 B13R1.45 CC(OCN(C)C)c1ccccc1 967a1047250afa34ddf4922969031615 [0,1,0,0,0,1|2,0,0]=4 2943 B13R1.45 CN(C)CCN(C)c1ccccc1 2cd433b171e346e7b81d2e9ec408e014 [0,1,0,0,0,1|2,0,0]=4 2944 B13R1.45 CN(CCC(=O)O)c1ccccc1 3ac5370b4a211dcf60c65690fe2ddc5c [0,1,0,0,0,1|1,0,1]=4 2945 B13R1.45 CN(CCC(F)F)c1ccccc1 202f051b7d3e814e208488d2864cc789 [0,1,0,0,0,1|2,0,0]=4 2946 B13R1.45 C[C@@H](NCC(=O)O)c1ccccc1 c46367538eb8b3b151e91addfe62caaf [0,1,0,0,0,1|1,0,1]=4 2947 B13R1.45 C[C@@H](O)CNC(=O)c1ccccc1 58658cc6384a558b469db82070a6d0b9 [0,1,0,0,0,1|0,0,1]=3 2948 B13R1.45 C[C@@H](O)CNC(=O)c1ccccn1 680b684ff3760aefb6e8965f481f2328 [0,1,0,0,0,1|1,0,1]=4 2949 B13R1.45 C[C@@H](O)CNC(=O)c1cccnc1 99e7c20d59b7374dc290dea06fdfe6b6 [0,1,0,0,0,1|1,0,1]=4 2950 B13R1.45 C[C@@H](O)CNC(=O)c1ccncc1 f7a888c6424189852c55ae9ef85c3960 [0,1,0,0,0,1|1,0,1]=4 2951 B13R1.45 C[C@@H](O)CN[C@H](C)c1ccccn1 c6b042514ddcdbc7d442f1a85d3df54a [0,1,0,0,0,1|1,0,0]=3 2952 B13R1.45 C[C@@H](O)CN[C@H](C)c1ccncc1 673ffd128404da9656af007249b5d875 [0,1,0,0,0,1|1,0,0]=3 2953 B13R1.45 C[C@@H](OCC(=O)O)c1ccccc1 f0f3e4192d0bec80877cea198dfe883c [0,1,0,0,0,1|1,0,1]=4 2954 B13R1.45 C[C@@H](OCC(F)F)c1ccccc1 9d39fc1a4a66e4a94cea9780f10fccd6 [0,1,0,0,0,1|2,0,0]=4 2955 B13R1.45 C[C@@H](OCN(C)C)c1ccccc1 e22c97ac4e40be1f36d36e9869941526 [0,1,0,0,0,1|2,0,0]=4 2956 B13R1.45 C[C@H](NCC(=O)O)c1ccccc1 d0e3b4bb7bb2fcc1bf9c831e52c7d7b4 [0,1,0,0,0,1|1,0,1]=4 2957 B13R1.45 C[C@H](NC[C@@H](C)O)c1ccccn1 219667447845e4caa3cb2fd4615ed7ed [0,1,0,0,0,1|1,0,0]=3 2958 B13R1.45 C[C@H](NC[C@@H](C)O)c1ccncc1 8f894bd1bc2ae0ee3570b8370edc16b3 [0,1,0,0,0,1|1,0,0]=3 2959 B13R1.45 C[C@H](O)CNC(=O)c1ccccc1 df4e2d9b61843b0cec186f242ac9a4b7 [0,1,0,0,0,1|0,0,1]=3 2960 B13R1.45 C[C@H](O)CNC(=O)c1ccccn1 307f363213be1a66d9dcc7c1afe64983 [0,1,0,0,0,1|1,0,1]=4 2961 B13R1.45 C[C@H](O)CNC(=O)c1cccnc1 e8b982e52d18f073856d9321fe1bab81 [0,1,0,0,0,1|1,0,1]=4 2962 B13R1.45 C[C@H](O)CNC(=O)c1ccncc1 db246af33f86f60c7e6a0d0cb86ecf99 [0,1,0,0,0,1|1,0,1]=4 2963 B13R1.45 C[C@H](O)CN[C@@H](C)c1ccccc1 8fabeb4c3dfe1b581cc19234d70d27b9 [0,1,0,0,0,1|0,0,0]=2 2964 B13R1.45 C[C@H](O)CN[C@@H](C)c1ccccn1 db69911a578dad99f8fc3c81818aa469 [0,1,0,0,0,1|1,0,0]=3 2965 B13R1.45 C[C@H](O)CN[C@@H](C)c1cccnc1 971d935cb427e66ea1fecbfafdf007eb [0,1,0,0,0,1|1,0,0]=3 2966 B13R1.45 C[C@H](O)CN[C@@H](C)c1ccncc1 945345383419b4fb50a95586dec4cbfb [0,1,0,0,0,1|1,0,0]=3 2967 B13R1.45 C[C@H](O)CN[C@@H](C)c1cncnc1 4378d5881681ec41cc83c25dabdd8bad [0,1,0,0,0,1|2,0,0]=4 2968 B13R1.45 C[C@H](O)CN[C@H](C)c1ccccc1 ef252d9e63a8f57f8c20b7f73c95cbf4 [0,1,0,0,0,1|0,0,0]=2 2969 B13R1.45 C[C@H](O)CN[C@H](C)c1ccccn1 55c13f013b3734632c8fa44503860238 [0,1,0,0,0,1|1,0,0]=3 2970 B13R1.45 C[C@H](O)CN[C@H](C)c1cccnc1 48eb850011f9cdd93998d17088162606 [0,1,0,0,0,1|1,0,0]=3 2971 B13R1.45 C[C@H](O)CN[C@H](C)c1ccncc1 0e383a8a30119487740bf2223015ca3b [0,1,0,0,0,1|1,0,0]=3 2972 B13R1.45 C[C@H](O)CN[C@H](C)c1cncnc1 a7eb014ed333be490adcc1f5acf29a75 [0,1,0,0,0,1|2,0,0]=4 2973 B13R1.45 C[C@H](OCC(=O)O)c1ccccc1 55deadec1f7765518c50db81438d15eb [0,1,0,0,0,1|1,0,1]=4 2974 B13R1.45 C[C@H](OCC(F)F)c1ccccc1 617a17fb9ad917e5627b15283ed406c1 [0,1,0,0,0,1|2,0,0]=4 2975 B13R1.45 C[C@H](OCN(C)C)c1ccccc1 c55a44ee789df974ce1f33d66c89e4f2 [0,1,0,0,0,1|2,0,0]=4 2976 B13R1.149 C=C(C)CCNc1cccc(c1)Br 86e66b315b07e2ef1564ab9e67cd2854 [0,1,0,0,0,1|1,0,1]=4 2977 B13R1.149 C=C(C)CCNc1cccc(c1)C 167ec5cda6afa3cd4e2ff7343421fa2f [0,1,0,0,0,1|1,0,1]=4 2978 B13R1.149 C=C(C)CCNc1cccc(c1)Cl cb192097e800dd856a0fb21962f4de66 [0,1,0,0,0,1|1,0,1]=4 2979 B13R1.149 C=C(C)CCNc1cccc(c1)F 40e50b56547c0ca199f25b815f8c7005 [0,1,0,0,0,1|1,0,1]=4 2980 B13R1.149 C=C(C)CCNc1cccc(c1)I c74ff2519adb7249e5ee99ae821ee15c [0,1,0,0,0,1|1,0,1]=4 2981 B13R1.149 C=C(C)CCNc1cccc(c1)O cf7cbd7b31aeb0182bf8e8c4f6ac3962 [0,1,0,0,0,1|1,0,1]=4 2982 B13R1.149 C=C(C)CCNc1cccc(c1)S c17db0926bc246dc711db8898c07494b [0,1,0,0,0,1|1,0,1]=4 2983 B13R1.149 C=C(C)CCOc1cccc(c1)Br 7799115a7cdc48f3ca0c530de36108e4 [0,1,0,0,0,1|1,0,1]=4 2984 B13R1.149 C=C(C)CCOc1cccc(c1)C 22115a9a8e7515d8bc310ca911bc2259 [0,1,0,0,0,1|1,0,1]=4 2985 B13R1.149 C=C(C)CCOc1cccc(c1)Cl 53208acbf2cd9c4040c472da986e7f74 [0,1,0,0,0,1|1,0,1]=4 2986 B13R1.149 C=C(C)CCOc1cccc(c1)F cedec91e0b0cf5fcfdd513b10534a5cd [0,1,0,0,0,1|1,0,1]=4 2987 B13R1.149 C=C(C)CCOc1cccc(c1)I 4b0a06136cdb6cd4fac008b5b9aca4d0 [0,1,0,0,0,1|1,0,1]=4 2988 B13R1.149 C=C(C)CCOc1cccc(c1)S ea8a709abe253cf8af0e3160100b420a [0,1,0,0,0,1|1,0,1]=4 2989 B13R1.149 C=C(C)CNCc1cccc(c1)Br bb8bcbedf7dc6a8979669f32a92aeba0 [0,1,0,0,0,1|1,0,1]=4 2990 B13R1.149 C=C(C)CNCc1cccc(c1)C 66cec174fb2d7698404a4d94d06d39e6 [0,1,0,0,0,1|1,0,1]=4 2991 B13R1.149 C=C(C)CNCc1cccc(c1)Cl d81560a72fbc236e8d7f4fef354dd4b2 [0,1,0,0,0,1|1,0,1]=4 2992 B13R1.149 C=C(C)CNCc1cccc(c1)F d6bc452fc3a4e36889d4ce261db7fd06 [0,1,0,0,0,1|1,0,1]=4 2993 B13R1.149 C=C(C)CNCc1cccc(c1)I cede4d5a346c8bffe2609fe09f50fa43 [0,1,0,0,0,1|1,0,1]=4 2994 B13R1.149 C=C(C)COCc1cccc(c1)Br 82e58a2d070de5c04bfc2f8c3acf43eb [0,1,0,0,0,1|1,0,1]=4 2995 B13R1.149 C=C(C)COCc1cccc(c1)C 5d60e857647ce96030f84cbcdd7b782b [0,1,0,0,0,1|1,0,1]=4 2996 B13R1.149 C=C(C)COCc1cccc(c1)Cl fc2671fbfe68874695b2e032d03c7cfb [0,1,0,0,0,1|1,0,1]=4 2997 B13R1.149 C=C(C)COCc1cccc(c1)F 080d152472bcf53009bcc1f041804455 [0,1,0,0,0,1|1,0,1]=4 2998 B13R1.149 C=C(C)COCc1cccc(c1)I a34bd72552a1700079b122acaff45318 [0,1,0,0,0,1|1,0,1]=4 2999 B13R1.149 CC(=O)CCNc1cccc(c1)Br 0757ba5ec4b6110d4e347426ccd0cb2e [0,1,0,0,0,1|0,0,2]=4 3000 B13R1.149 CC(=O)CCNc1cccc(c1)C 14526006f6c9f61a24e77df47edb31cc [0,1,0,0,0,1|0,0,2]=4 3001 B13R1.149 CC(=O)CCNc1cccc(c1)Cl c904f4f9032a4b0a4dfc619af93ace49 [0,1,0,0,0,1|0,0,2]=4 3002 B13R1.149 CC(=O)CCNc1cccc(c1)F ffc513b56a03e992455b2e93a1ce452e [0,1,0,0,0,1|0,0,2]=4 3003 B13R1.149 CC(=O)CCNc1cccc(c1)I cbefe6b21533142b98570139002b8328 [0,1,0,0,0,1|0,0,2]=4 3004 B13R1.149 CC(=O)CCNc1cccc(c1)S ae02b19cd71d87540496678758fcf618 [0,1,0,0,0,1|0,0,2]=4 3005 B13R1.149 CC(=O)CCOc1cccc(c1)Br f0966d016a4b0e3a5bb60bc922112d6d [0,1,0,0,0,1|0,0,2]=4 3006 B13R1.149 CC(=O)CCOc1cccc(c1)C d29f9de59a4cddbab2be589e3723c29d [0,1,0,0,0,1|0,0,2]=4 3007 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 1e4eaf89191a19c0ccce407e9bd90395 [0,1,0,0,0,1|0,0,2]=4 3008 B13R1.149 CC(=O)CCOc1cccc(c1)F 4169ed4c8a26d6bd73d4bf35a278a4bd [0,1,0,0,0,1|0,0,2]=4 3009 B13R1.149 CC(=O)CCOc1cccc(c1)I f367a52be54bfb12b6a82d6ac4cfdf6e [0,1,0,0,0,1|0,0,2]=4 3010 B13R1.149 CC(=O)CCOc1cccc(c1)S e2de3780f33ec8acd458ec6140464487 [0,1,0,0,0,1|0,0,2]=4 3011 B13R1.149 CC(=O)CNCc1cccc(c1)Br 3469f562c0fcbf5d08afdb010d185315 [0,1,0,0,0,1|0,0,2]=4 3012 B13R1.149 CC(=O)CNCc1cccc(c1)C 7f3d6978bc417baa0744c4c635c5816b [0,1,0,0,0,1|0,0,2]=4 3013 B13R1.149 CC(=O)CNCc1cccc(c1)Cl 656019b89221c733faeb253efab91621 [0,1,0,0,0,1|0,0,2]=4 3014 B13R1.149 CC(=O)CNCc1cccc(c1)F cbbeb98d28816b0a1a93c324b8116cea [0,1,0,0,0,1|0,0,2]=4 3015 B13R1.149 CC(=O)CNCc1cccc(c1)I 18bcbb712d508e837e2f638bf59cb6ab [0,1,0,0,0,1|0,0,2]=4 3016 B13R1.149 CC(=O)COCc1cccc(c1)Br 3be2ab6072d9984bf0176d692b4931d8 [0,1,0,0,0,1|0,0,2]=4 3017 B13R1.149 CC(=O)COCc1cccc(c1)C 16a5fb1a90730c55e1129d02503de49c [0,1,0,0,0,1|0,0,2]=4 3018 B13R1.149 CC(=O)COCc1cccc(c1)Cl 78d020f5194c6c246320d6b0b049c431 [0,1,0,0,0,1|0,0,2]=4 3019 B13R1.149 CC(=O)COCc1cccc(c1)F 1ee09730646175d58d3d5dbde4ae041d [0,1,0,0,0,1|0,0,2]=4 3020 B13R1.149 CC(=O)COCc1cccc(c1)I a6a1e468fa018cbb3b9d5c9fbd16fd9d [0,1,0,0,0,1|0,0,2]=4 3021 B13R1.149 CC(=O)NCCc1cccc(c1)Br 8202131f3aa3263a92393847e2e5c11e [0,1,0,0,0,1|0,0,2]=4 3022 B13R1.149 CC(=O)NCCc1cccc(c1)C 04fcba57b515841f1f1d9a044ec6473c [0,1,0,0,0,1|0,0,2]=4 3023 B13R1.149 CC(=O)NCCc1cccc(c1)Cl d1d03190e0c04e944f92fbae168d6388 [0,1,0,0,0,1|0,0,2]=4 3024 B13R1.149 CC(=O)NCCc1cccc(c1)F 193a0bdbef44d9aa6cc7fc807fc9b2f1 [0,1,0,0,0,1|0,0,2]=4 3025 B13R1.149 CC(=O)NCCc1cccc(c1)I d0de4b155688f488d78e5c6ac7692103 [0,1,0,0,0,1|0,0,2]=4 3026 B13R1.149 CC(=O)NCCc1cccc(c1)O c926c4963477095ca6de2d98b4084a6e [0,1,0,0,0,1|0,0,2]=4 3027 B13R1.149 CC(C)CCNc1cc(ccn1)Br c325b16657fb7bcd30e2bbbe076f9ba0 [0,1,0,0,0,1|2,0,0]=4 3028 B13R1.149 CC(C)CCNc1cc(ccn1)Cl ca09d5ee7823fdb7720ce41140c80b83 [0,1,0,0,0,1|2,0,0]=4 3029 B13R1.149 CC(C)CCNc1cc(ccn1)F cd36d2dd8fea675a5daaa2b51be56ed9 [0,1,0,0,0,1|2,0,0]=4 3030 B13R1.149 CC(C)CCNc1cc(ccn1)I 18c80922240fa0b40ed1ebe17aa1d7bc [0,1,0,0,0,1|2,0,0]=4 3031 B13R1.149 CC(C)CCNc1cc[nH]c(=O)c1 c1ba960691ca95f526ae03fea9e7d0ca [0,1,0,0,0,1|2,0,0]=4 3032 B13R1.149 CC(C)CCNc1cc[nH]c(=S)c1 8bb7190e7655d16f884ac18d7f05e245 [0,1,0,0,0,1|2,0,0]=4 3033 B13R1.149 CC(C)CCNc1cccc(c1)Br c0c9db3281de426d0f0e3da0b592ea16 [0,1,0,0,0,1|1,0,0]=3 3034 B13R1.149 CC(C)CCNc1cccc(c1)Cl b478c1e58dbde2b5c9303f459bd41bfa [0,1,0,0,0,1|1,0,0]=3 3035 B13R1.149 CC(C)CCNc1cccc(c1)F e6f5ebcb22a8150ef3e97da097b46c2e [0,1,0,0,0,1|1,0,0]=3 3036 B13R1.149 CC(C)CCNc1cccc(c1)I 4d352f50adf80771ca10c8a1e313380d [0,1,0,0,0,1|1,0,0]=3 3037 B13R1.149 CC(C)CCNc1cccc(c1)S 21276ee639dcb8385dec7ab37ba4a6f3 [0,1,0,0,0,1|1,0,0]=3 3038 B13R1.149 CC(C)CCNc1cccc(n1)Br b6a8a391b6c57f3020cc4ee5d284d115 [0,1,0,0,0,1|2,0,0]=4 3039 B13R1.149 CC(C)CCNc1cccc(n1)Cl fd71117d0ab12ea3075ab6dd3b02c485 [0,1,0,0,0,1|2,0,0]=4 3040 B13R1.149 CC(C)CCNc1cccc(n1)F 0fd35affddec5711254dd408d47ed2cd [0,1,0,0,0,1|2,0,0]=4 3041 B13R1.149 CC(C)CCNc1cccc(n1)I 57f5512e6c9f316d0b291390dbe4a455 [0,1,0,0,0,1|2,0,0]=4 3042 B13R1.149 CC(C)CCNc1ccnc(c1)Br 735e65a811a641346b919cd44d2f62a6 [0,1,0,0,0,1|2,0,0]=4 3043 B13R1.149 CC(C)CCNc1ccnc(c1)Cl 2647426ea4ed401c7953024e77daab3e [0,1,0,0,0,1|2,0,0]=4 3044 B13R1.149 CC(C)CCNc1ccnc(c1)F 149f33f5f357e49a30ff382b69760996 [0,1,0,0,0,1|2,0,0]=4 3045 B13R1.149 CC(C)CCNc1ccnc(c1)I 6c996a6f31ba0a4b40b187fd26083873 [0,1,0,0,0,1|2,0,0]=4 3046 B13R1.149 CC(C)CCNc1cncc(c1)Br d2625d999c7e2c8b3b3a5ca570deed99 [0,1,0,0,0,1|2,0,0]=4 3047 B13R1.149 CC(C)CCNc1cncc(c1)Cl 18645e3bc8b6cd963fb36ae96eae4525 [0,1,0,0,0,1|2,0,0]=4 3048 B13R1.149 CC(C)CCNc1cncc(c1)F 1dccd7af5d69644b78624e379fb81c62 [0,1,0,0,0,1|2,0,0]=4 3049 B13R1.149 CC(C)CCNc1cncc(c1)I 805fc53d5a3e961a949e59c30122cca4 [0,1,0,0,0,1|2,0,0]=4 3050 B13R1.149 CC(C)CCOc1cc(ccn1)Br 48983036bb00bca5de839de8ab5cf5e0 [0,1,0,0,0,1|2,0,0]=4 3051 B13R1.149 CC(C)CCOc1cc(ccn1)Cl b1be8bf989f390a4333ddfd479bab08d [0,1,0,0,0,1|2,0,0]=4 3052 B13R1.149 CC(C)CCOc1cc(ccn1)F 137cd945d2491c6af229cb7491280b0b [0,1,0,0,0,1|2,0,0]=4 3053 B13R1.149 CC(C)CCOc1ccc[n+](c1)[O-] 87c67c4889d7cc0a479e74e83ebcab65 [0,1,0,0,0,1|2,0,0]=4 3054 B13R1.149 CC(C)CCOc1cccc(=O)[nH]1 6617317216283c819da549bebc096260 [0,1,0,0,0,1|2,0,0]=4 3055 B13R1.149 CC(C)CCOc1cccc(c1)Br b0dce33868fdc94f17827a74732ea079 [0,1,0,0,0,1|1,0,0]=3 3056 B13R1.149 CC(C)CCOc1cccc(c1)Cl ee0d28f3dcea533da3349be080100f81 [0,1,0,0,0,1|1,0,0]=3 3057 B13R1.149 CC(C)CCOc1cccc(c1)F 90aac71b85e4ed240956314416860f77 [0,1,0,0,0,1|1,0,0]=3 3058 B13R1.149 CC(C)CCOc1cccc(c1)I 5b5684e96b8673ee543da59a61fd307a [0,1,0,0,0,1|1,0,0]=3 3059 B13R1.149 CC(C)CCOc1cccc(c1)S 8d62308cf44a0d25ecf9b5d6e04df76e [0,1,0,0,0,1|1,0,0]=3 3060 B13R1.149 CC(C)CCOc1cccc(n1)Br 13be18eef3c21b69459f3b1932f7e3e1 [0,1,0,0,0,1|2,0,0]=4 3061 B13R1.149 CC(C)CCOc1cccc(n1)F 2916d111d4686e847a797fdb7cf55d53 [0,1,0,0,0,1|2,0,0]=4 3062 B13R1.149 CC(C)CCOc1ccnc(c1)Br 4af13916042836d9e1013dedde49c48d [0,1,0,0,0,1|2,0,0]=4 3063 B13R1.149 CC(C)CCOc1ccnc(c1)Cl 1fcf12f47b5d199dcd302d17f1ccce87 [0,1,0,0,0,1|2,0,0]=4 3064 B13R1.149 CC(C)CCOc1ccnc(c1)F 5950a05eed2f8398dfda51f9b97b45f0 [0,1,0,0,0,1|2,0,0]=4 3065 B13R1.149 CC(C)CCOc1cncc(c1)Br 166e94f5ea0a0da53c654049d0ae64a9 [0,1,0,0,0,1|2,0,0]=4 3066 B13R1.149 CC(C)CCOc1cncc(c1)Cl 18ef0065b3106d14b72435486a72d18e [0,1,0,0,0,1|2,0,0]=4 3067 B13R1.149 CC(C)CCOc1cncc(c1)F 1c4d95ff6f93124eb84f58c31ef8f208 [0,1,0,0,0,1|2,0,0]=4 3068 B13R1.149 CC(C)CCOc1cncc(c1)I 655b9bf2f0d34717f74de3ec2e4b9fab [0,1,0,0,0,1|2,0,0]=4 3069 B13R1.149 CC(C)CNCc1cc(ccn1)Br 04abaa939c7bbd46e34860c87bddceb0 [0,1,0,0,0,1|2,0,0]=4 3070 B13R1.149 CC(C)CNCc1cc(ccn1)Cl dd72dfaae67b8be95de50e68a1686d09 [0,1,0,0,0,1|2,0,0]=4 3071 B13R1.149 CC(C)CNCc1cc[nH]c(=O)c1 2f76f33438e2ef1f06a2f7c605af2356 [0,1,0,0,0,1|2,0,0]=4 3072 B13R1.149 CC(C)CNCc1ccc[n+](c1)[O-] 4900b8652e7a8cb89b8f12ebbba5aa7e [0,1,0,0,0,1|2,0,0]=4 3073 B13R1.149 CC(C)CNCc1cccc(c1)Br 158cabc92a94009f2714cda73f3cb9b5 [0,1,0,0,0,1|1,0,0]=3 3074 B13R1.149 CC(C)CNCc1cccc(c1)Cl fcb04b624a02b5c6c45fcd2bfdcf38e4 [0,1,0,0,0,1|1,0,0]=3 3075 B13R1.149 CC(C)CNCc1cccc(c1)F ea4ae6161c29ad5890528e0d690eae62 [0,1,0,0,0,1|1,0,0]=3 3076 B13R1.149 CC(C)CNCc1cccc(c1)I 597b045d4c6dd3b5509b829b665131f4 [0,1,0,0,0,1|1,0,0]=3 3077 B13R1.149 CC(C)CNCc1cccc(n1)Br e28a3011b682f48b8b8db3e0a6bf41ec [0,1,0,0,0,1|2,0,0]=4 3078 B13R1.149 CC(C)CNCc1cccc(n1)Cl 7fb43cb34770ecbf9d0de58783d1cdfe [0,1,0,0,0,1|2,0,0]=4 3079 B13R1.149 CC(C)CNCc1cccc(n1)F b09e45033b1e3229a1adacc9bdb1d204 [0,1,0,0,0,1|2,0,0]=4 3080 B13R1.149 CC(C)CNCc1ccnc(c1)Br 1a18160586d76ce812980bd0c578c2f7 [0,1,0,0,0,1|2,0,0]=4 3081 B13R1.149 CC(C)CNCc1ccnc(c1)Cl fb96952ac72c1149e4771c0a1cdaabc4 [0,1,0,0,0,1|2,0,0]=4 3082 B13R1.149 CC(C)CNCc1ccnc(c1)F eaf727f78cbec8a620fc01c59febee69 [0,1,0,0,0,1|2,0,0]=4 3083 B13R1.149 CC(C)CNCc1cncc(c1)Br 2d1793382eab4fee97f7936882e9067f [0,1,0,0,0,1|2,0,0]=4 3084 B13R1.149 CC(C)CNCc1cncc(c1)Cl e9e87b5d43ea932f1c5962e67a597312 [0,1,0,0,0,1|2,0,0]=4 3085 B13R1.149 CC(C)CNCc1cncc(c1)F 1116ed359dafdbef603b7584b3b4cc5b [0,1,0,0,0,1|2,0,0]=4 3086 B13R1.149 CC(C)COCc1cc(ccn1)Br 4fcc11aba823481c37aa62be16fea992 [0,1,0,0,0,1|2,0,0]=4 3087 B13R1.149 CC(C)COCc1cc(ccn1)Cl 197df98f049aa8a6ccba83ca0052273f [0,1,0,0,0,1|2,0,0]=4 3088 B13R1.149 CC(C)COCc1cc(ccn1)F 700858b0bc3b69351db67adbe6682380 [0,1,0,0,0,1|2,0,0]=4 3089 B13R1.149 CC(C)COCc1cc(ccn1)I 5647339a63e52b388e59b4072e51e99e [0,1,0,0,0,1|2,0,0]=4 3090 B13R1.149 CC(C)COCc1cc[nH]c(=O)c1 4e972f969f92dcd734f1952a84d65d4f [0,1,0,0,0,1|2,0,0]=4 3091 B13R1.149 CC(C)COCc1ccc[n+](c1)[O-] 5b3ab5dce42bd44c08b32ded04eb3435 [0,1,0,0,0,1|2,0,0]=4 3092 B13R1.149 CC(C)COCc1cccc(c1)Br 3f6f4466f8a025e2ef783bad24f7989f [0,1,0,0,0,1|1,0,0]=3 3093 B13R1.149 CC(C)COCc1cccc(c1)Cl ef0582628be7c6f10b2610587d28cf64 [0,1,0,0,0,1|1,0,0]=3 3094 B13R1.149 CC(C)COCc1cccc(c1)F 65aeebf9dcbfe0d1cbf16d41affc9310 [0,1,0,0,0,1|1,0,0]=3 3095 B13R1.149 CC(C)COCc1cccc(c1)I 15a67c80e5880dd60fb46d1517814b0d [0,1,0,0,0,1|1,0,0]=3 3096 B13R1.149 CC(C)COCc1cccc(n1)Br 26a79f09bdc642ec8229c19e6499ef23 [0,1,0,0,0,1|2,0,0]=4 3097 B13R1.149 CC(C)COCc1cccc(n1)Cl 06aac3b54972c1e4bf430b8de457b3de [0,1,0,0,0,1|2,0,0]=4 3098 B13R1.149 CC(C)COCc1cccc(n1)F 274e5bb5dc53acc5c6a5c1c57cea2d00 [0,1,0,0,0,1|2,0,0]=4 3099 B13R1.149 CC(C)COCc1cccc(n1)I 18a8c481ae2f617d88ea1c72308ba61a [0,1,0,0,0,1|2,0,0]=4 3100 B13R1.149 CC(C)COCc1ccnc(c1)Br d5584541282b1c8a8aeb8a90ed9fc305 [0,1,0,0,0,1|2,0,0]=4 3101 B13R1.149 CC(C)COCc1ccnc(c1)Cl 9d78d1e4f096b8e624b00403b0109571 [0,1,0,0,0,1|2,0,0]=4 3102 B13R1.149 CC(C)COCc1ccnc(c1)F 2cd1b19dbd8fc5538fec41fa0be7d69d [0,1,0,0,0,1|2,0,0]=4 3103 B13R1.149 CC(C)COCc1cncc(c1)Br 8d1a6aa4f5c6f4cbca693ba076841c1d [0,1,0,0,0,1|2,0,0]=4 3104 B13R1.149 CC(C)COCc1cncc(c1)Cl 376561be4df1a599de567709cc24598e [0,1,0,0,0,1|2,0,0]=4 3105 B13R1.149 CC(C)COCc1cncc(c1)F f3f330b708c9f2d110d9f2c916e75804 [0,1,0,0,0,1|2,0,0]=4 3106 B13R1.149 CC(C)COCc1cncc(c1)I b99a87607ad5665bfe21b84bbe2e8da7 [0,1,0,0,0,1|2,0,0]=4 3107 B13R1.149 CC(C)NCCc1cccc(c1)Br 8de20e1121b931370da151be05b3a039 [0,1,0,0,0,1|1,0,0]=3 3108 B13R1.149 CC(C)NCCc1cccc(c1)Cl b6d9a799d14c868f44fb0830438d0b51 [0,1,0,0,0,1|1,0,0]=3 3109 B13R1.149 CC(C)NCCc1cccc(c1)F 5fe75d0459c58fdaa11161dd3e5ec8ed [0,1,0,0,0,1|1,0,0]=3 3110 B13R1.149 CC(C)NCCc1cccc(c1)I 6ba10e440219a1bac9651c81bdc990d5 [0,1,0,0,0,1|1,0,0]=3 3111 B13R1.149 CC(C)NCCc1cncc(c1)F 0ab0ab5b79021504b422f6619ab3846c [0,1,0,0,0,1|2,0,0]=4 3112 B13R1.149 CC(C)OCCc1cc(ccn1)Br 338160f0e45c11f9f07262a9b4016d96 [0,1,0,0,0,1|2,0,0]=4 3113 B13R1.149 CC(C)OCCc1cccc(c1)Br 6c3b910e9b9bc913f927157e8874b9f4 [0,1,0,0,0,1|1,0,0]=3 3114 B13R1.149 CC(C)OCCc1cccc(c1)Cl 2ded6407717a9d8ce2f096b2120c7b1b [0,1,0,0,0,1|1,0,0]=3 3115 B13R1.149 CC(C)OCCc1cccc(c1)F 1b022fc8cb1f6530ac57f59b3e47e2f7 [0,1,0,0,0,1|1,0,0]=3 3116 B13R1.149 CC(C)OCCc1cccc(c1)I 685700cdc2a0c3a460a07e5b2973908f [0,1,0,0,0,1|1,0,0]=3 3117 B13R1.149 CC(C)OCCc1ccnc(c1)Cl 8c6f18d785af9aca8200261cafdf2245 [0,1,0,0,0,1|2,0,0]=4 3118 B13R1.149 CC(C)OCCc1cncc(c1)F a719d9c79e8e4a7c087eff77fc8fcf6c [0,1,0,0,0,1|2,0,0]=4 3119 B13R1.149 CC(C)OCNc1cccc(c1)Br dc9423240f4d7d0ebe081f4df4816b16 [0,1,0,0,0,1|2,0,0]=4 3120 B13R1.149 CC(C)OCNc1cccc(c1)Cl c0051ecaa9927c38070fb88237682816 [0,1,0,0,0,1|2,0,0]=4 3121 B13R1.149 CC(C)OCNc1cccc(c1)F a7dc305e72dd094c9277249f16ee960f [0,1,0,0,0,1|2,0,0]=4 3122 B13R1.149 CC(C)OCNc1cccc(c1)I 26c25ca1bb742d2d232b20e1f29b5d73 [0,1,0,0,0,1|2,0,0]=4 3123 B13R1.149 CC(C)OCNc1cccc(c1)S 2d4aab725170161695edbd475a7da9c1 [0,1,0,0,0,1|2,0,0]=4 3124 B13R1.149 CC(C)OCOc1cccc(c1)Br a82c34a4a00fbb47f803b0648261454a [0,1,0,0,0,1|2,0,0]=4 3125 B13R1.149 CC(C)OCOc1cccc(c1)Cl 786d0d3e03cb8bf223fa410f3651c67b [0,1,0,0,0,1|2,0,0]=4 3126 B13R1.149 CC(C)OCOc1cccc(c1)F 2270f7e2df3e327d56f9422c8be46ed5 [0,1,0,0,0,1|2,0,0]=4 3127 B13R1.149 CC(C)OCOc1cccc(c1)I b9c4ddc42cea3688b23537cf6c5d1d02 [0,1,0,0,0,1|2,0,0]=4 3128 B13R1.149 CC(C)OCOc1cccc(c1)S 0fa57fcd0668c4b496a9744b5e1ba69e [0,1,0,0,0,1|2,0,0]=4 3129 B13R1.149 CC(F)COCc1cc(ccn1)Br 393019dc4b30ab0a6acf28cb1b4b8a67 [0,1,0,0,0,1|2,0,0]=4 3130 B13R1.149 CC(F)COCc1cc(ccn1)Cl 91c4e79d281f3d2681962af09d2281a5 [0,1,0,0,0,1|2,0,0]=4 3131 B13R1.149 CC(F)COCc1cc[nH]c(=O)c1 dc49457e6dc45607fb98f415b89a06ec [0,1,0,0,0,1|2,0,0]=4 3132 B13R1.149 CC(F)COCc1cccc(c1)Br 28d2a8a60c002911121ebba946e62946 [0,1,0,0,0,1|1,0,0]=3 3133 B13R1.149 CC(F)COCc1cccc(c1)Cl 13e28dac92c97e560c132eea5e6316da [0,1,0,0,0,1|1,0,0]=3 3134 B13R1.149 CC(F)COCc1cccc(c1)F 18e455b4e5b71b1ee65f062a6d21c581 [0,1,0,0,0,1|1,0,0]=3 3135 B13R1.149 CC(F)COCc1cccc(c1)I 0c1aad849a8374c912b0747a46ba1a7a [0,1,0,0,0,1|1,0,0]=3 3136 B13R1.149 CC(F)COCc1cccc(n1)Br c9eb3ed8d7285d1b3dae941bb52b9598 [0,1,0,0,0,1|2,0,0]=4 3137 B13R1.149 CC(F)COCc1cccc(n1)Cl 651a00e1c31dfb93e08f63a947d60837 [0,1,0,0,0,1|2,0,0]=4 3138 B13R1.149 CC(F)COCc1cccc(n1)F d5895683c60c72c6375f104cd1b8569b [0,1,0,0,0,1|2,0,0]=4 3139 B13R1.149 CC(F)COCc1ccnc(c1)Br fc91a3e44162b3e6b28fa5895bc02084 [0,1,0,0,0,1|2,0,0]=4 3140 B13R1.149 CC(F)COCc1ccnc(c1)Cl 60d9d74c08b046f8f9e779aeb9a0d416 [0,1,0,0,0,1|2,0,0]=4 3141 B13R1.149 CC(F)COCc1ccnc(c1)F e3f23a0ad6e38a398f502789c168e26b [0,1,0,0,0,1|2,0,0]=4 3142 B13R1.149 CC(F)COCc1cncc(c1)Br 769b4a8856b207e3d5aaa789dce4d268 [0,1,0,0,0,1|2,0,0]=4 3143 B13R1.149 CC(F)COCc1cncc(c1)Cl b86ceab754cdee9ab47692c5bcb5e892 [0,1,0,0,0,1|2,0,0]=4 3144 B13R1.149 CC(F)COCc1cncc(c1)F 6364f1d8c257d48f23154c3a406cd1de [0,1,0,0,0,1|2,0,0]=4 3145 B13R1.149 CC(O)CCNc1cc(ccn1)Br 01e1d1506c5f3f61452df2e15c582a26 [0,1,0,0,0,1|1,0,0]=3 3146 B13R1.149 CC(O)CCNc1cc(ccn1)Cl 81456a28819849b16a2b9ee3fde2fbcc [0,1,0,0,0,1|1,0,0]=3 3147 B13R1.149 CC(O)CCNc1cc(ccn1)F aacf1ee53d8ea70a6394bb5594be25b6 [0,1,0,0,0,1|1,0,0]=3 3148 B13R1.149 CC(O)CCNc1cc(ccn1)I e2b67d7d6770e73e2b31ce5e21c843a4 [0,1,0,0,0,1|1,0,0]=3 3149 B13R1.149 CC(O)CCNc1cc(ccn1)O ffcf18e962f6644a39e862556597ac80 [0,1,0,0,0,1|1,0,0]=3 3150 B13R1.149 CC(O)CCNc1cc(cnn1)Br bb2800ca6d2dc7772459b5c171ab8283 [0,1,0,0,0,1|2,0,0]=4 3151 B13R1.149 CC(O)CCNc1cc(cnn1)Cl 52451e7a342d88335cfcf8aad8733904 [0,1,0,0,0,1|2,0,0]=4 3152 B13R1.149 CC(O)CCNc1cc(ncn1)Br a7a2410d2d770add38c4a1b9cbd22e58 [0,1,0,0,0,1|2,0,0]=4 3153 B13R1.149 CC(O)CCNc1cc(ncn1)Cl 820023aa40ba57bd265edde344074a9a [0,1,0,0,0,1|2,0,0]=4 3154 B13R1.149 CC(O)CCNc1cc(ncn1)F f6aac9fed1a3f8daa157832b95d37675 [0,1,0,0,0,1|2,0,0]=4 3155 B13R1.149 CC(O)CCNc1cc(ncn1)I c646e54c5af36b80bfde6ea5b21768fc [0,1,0,0,0,1|2,0,0]=4 3156 B13R1.149 CC(O)CCNc1cc[nH]c(=O)n1 ab594316849138914e6438a44c921a72 [0,1,0,0,0,1|2,0,0]=4 3157 B13R1.149 CC(O)CCNc1cc[nH]c(=S)c1 e4c11a4d215c3be898b0314a4621c151 [0,1,0,0,0,1|1,0,0]=3 3158 B13R1.149 CC(O)CCNc1ccc[n+](c1)[O-] 1bda0c5c55103cf3e5f9d913278a4cd4 [0,1,0,0,0,1|1,0,0]=3 3159 B13R1.149 CC(O)CCNc1cccc(c1)Br de49fa03e8539ffac044994033dcb5c1 [0,1,0,0,0,1|0,0,0]=2 3160 B13R1.149 CC(O)CCNc1cccc(c1)Cl acbe11411fcfc3899aba22fe3aa1634c [0,1,0,0,0,1|0,0,0]=2 3161 B13R1.149 CC(O)CCNc1cccc(c1)F ec75dc7ad57a9f0b057ea6f35b3f78f2 [0,1,0,0,0,1|0,0,0]=2 3162 B13R1.149 CC(O)CCNc1cccc(c1)I 9a2d223db75a09fdf1b51d9f4b1bc5d5 [0,1,0,0,0,1|0,0,0]=2 3163 B13R1.149 CC(O)CCNc1cccc(c1)S 92726849de281a59802cb828c5b24f2d [0,1,0,0,0,1|0,0,0]=2 3164 B13R1.149 CC(O)CCNc1cccc(n1)Br 141e2c0f682724e97579ab74bae7d72f [0,1,0,0,0,1|1,0,0]=3 3165 B13R1.149 CC(O)CCNc1cccc(n1)Cl 8832d50f7a66f28585e1b2dcf074ada0 [0,1,0,0,0,1|1,0,0]=3 3166 B13R1.149 CC(O)CCNc1cccc(n1)F 205b5826d41f754a6ef6a74b5b45c86f [0,1,0,0,0,1|1,0,0]=3 3167 B13R1.149 CC(O)CCNc1cccc(n1)I cdaa6a1aa4413b1bdd431c9e64bc9a62 [0,1,0,0,0,1|1,0,0]=3 3168 B13R1.149 CC(O)CCNc1ccnc(c1)Br 6dc81bdc5bd75789683a53c4d4608575 [0,1,0,0,0,1|1,0,0]=3 3169 B13R1.149 CC(O)CCNc1ccnc(c1)Cl 5fc381ea6d54a00648750ab9f2b7c743 [0,1,0,0,0,1|1,0,0]=3 3170 B13R1.149 CC(O)CCNc1ccnc(c1)F 2be012a86981b308739ada9849ade7e4 [0,1,0,0,0,1|1,0,0]=3 3171 B13R1.149 CC(O)CCNc1ccnc(c1)I 1ff5b802219314bc372508b2aa2eb852 [0,1,0,0,0,1|1,0,0]=3 3172 B13R1.149 CC(O)CCNc1ccnc(n1)Br 695f7e08d95a07390a1e47e7d5d383fa [0,1,0,0,0,1|2,0,0]=4 3173 B13R1.149 CC(O)CCNc1ccnc(n1)Cl 1eec7dff2ac1857591dcce509292a3d3 [0,1,0,0,0,1|2,0,0]=4 3174 B13R1.149 CC(O)CCNc1ccnc(n1)F 7bdf814f6d1dd5e0b2db1c8ad58fe04d [0,1,0,0,0,1|2,0,0]=4 3175 B13R1.149 CC(O)CCNc1ccnc(n1)S bf3b4b6c71d5b4a398d4bdf01a9deed8 [0,1,0,0,0,1|2,0,0]=4 3176 B13R1.149 CC(O)CCNc1cn[nH]c(=O)c1 ec784f207a264022a4230b44f91f39fa [0,1,0,0,0,1|2,0,0]=4 3177 B13R1.149 CC(O)CCNc1cncc(c1)Br e54cbb5548dfdf1a689ea794655db272 [0,1,0,0,0,1|1,0,0]=3 3178 B13R1.149 CC(O)CCNc1cncc(c1)Cl 65beb79e455568bcac4c938a2d9fefc2 [0,1,0,0,0,1|1,0,0]=3 3179 B13R1.149 CC(O)CCNc1cncc(c1)F 128c69eecd5b55c84cab1b6058b76bd8 [0,1,0,0,0,1|1,0,0]=3 3180 B13R1.149 CC(O)CCNc1cncc(c1)I 1216f32bb06e1479d978be822389efb9 [0,1,0,0,0,1|1,0,0]=3 3181 B13R1.149 CC(O)CCNc1cncc(n1)Br 633fa152baacd507482eeea8932e86dc [0,1,0,0,0,1|2,0,0]=4 3182 B13R1.149 CC(O)CCNc1cncc(n1)Cl 0d4ba50148926a19a87b96d9acc811df [0,1,0,0,0,1|2,0,0]=4 3183 B13R1.149 CC(O)CCNc1cncc(n1)F b294425ac4bcc44fd0bb9dc00568f93f [0,1,0,0,0,1|2,0,0]=4 3184 B13R1.149 CC(O)CCNc1cnnc(c1)Cl f398337dbd65bc1f38c7d45b0e093dc5 [0,1,0,0,0,1|2,0,0]=4 3185 B13R1.149 CC(O)CCNc1cnnc(c1)F 4592871085b719f4ee4ef32f3ddc4cb8 [0,1,0,0,0,1|2,0,0]=4 3186 B13R1.149 CC(O)CCNc1nccc(=O)[nH]1 8a4242fecc8fe2da0a452f4e8a2e998a [0,1,0,0,0,1|2,0,0]=4 3187 B13R1.149 CC(O)CCNc1nccc(n1)Br 860b963ac2fa06767c946fba79845e90 [0,1,0,0,0,1|2,0,0]=4 3188 B13R1.149 CC(O)CCNc1nccc(n1)Cl 91cc8a3f64403690cb15b1d1e3642a9c [0,1,0,0,0,1|2,0,0]=4 3189 B13R1.149 CC(O)CCNc1nccc(n1)F c948a50818a9bfffddbab26f6f62e5c6 [0,1,0,0,0,1|2,0,0]=4 3190 B13R1.149 CC(O)CCNc1nccc(n1)I 3a5c47e1ca3b4b2f978fd31c77cd01e5 [0,1,0,0,0,1|2,0,0]=4 3191 B13R1.149 CC(O)CCNc1nccc(n1)S 5e0e33880aab8d6a04d3dd7a3c389837 [0,1,0,0,0,1|2,0,0]=4 3192 B13R1.149 CC(O)CNCc1cc(ccn1)Br b42b5c13e6be062e7c051036ae4934d6 [0,1,0,0,0,1|1,0,0]=3 3193 B13R1.149 CC(O)CNCc1cc(ccn1)Cl 59b5e87329bfe6e78fce0d8330d87041 [0,1,0,0,0,1|1,0,0]=3 3194 B13R1.149 CC(O)CNCc1cc[nH]c(=O)c1 3e22582fd8615f5ab591537144010b19 [0,1,0,0,0,1|1,0,0]=3 3195 B13R1.149 CC(O)CNCc1cc[nH]c(=O)n1 5a93f7ccdfaa877a193828e43184c232 [0,1,0,0,0,1|2,0,0]=4 3196 B13R1.149 CC(O)CNCc1ccc[n+](c1)[O-] 65a260840d2ea9fc80dab475e8f87e1d [0,1,0,0,0,1|1,0,0]=3 3197 B13R1.149 CC(O)CNCc1cccc(c1)Br 96c3a210b71936f93aa38f67bf96eb35 [0,1,0,0,0,1|0,0,0]=2 3198 B13R1.149 CC(O)CNCc1cccc(c1)Cl bfa2522930e68a852f8c633c49a75b0c [0,1,0,0,0,1|0,0,0]=2 3199 B13R1.149 CC(O)CNCc1cccc(c1)F 8b2d350c09d7c6f09c1b6adfeb3cde72 [0,1,0,0,0,1|0,0,0]=2 3200 B13R1.149 CC(O)CNCc1cccc(c1)I 6e3819fea386711bc80dd904df96cb02 [0,1,0,0,0,1|0,0,0]=2 3201 B13R1.149 CC(O)CNCc1cccc(n1)Br 988dbaf2f810ff24ae572eec60dc76fe [0,1,0,0,0,1|1,0,0]=3 3202 B13R1.149 CC(O)CNCc1cccc(n1)Cl c15fda34701f063dce91af67b5f54507 [0,1,0,0,0,1|1,0,0]=3 3203 B13R1.149 CC(O)CNCc1cccc(n1)F 5b2cd1d8adfa69c114be7062ec92ed20 [0,1,0,0,0,1|1,0,0]=3 3204 B13R1.149 CC(O)CNCc1ccnc(c1)Br 4f67a698e17b1efe044da8b229308e5a [0,1,0,0,0,1|1,0,0]=3 3205 B13R1.149 CC(O)CNCc1ccnc(c1)Cl 21a620f5f8a8d7df24dda9f0f0f753ff [0,1,0,0,0,1|1,0,0]=3 3206 B13R1.149 CC(O)CNCc1ccnc(c1)F 0043e7a7d25242060eeb3884640ca027 [0,1,0,0,0,1|1,0,0]=3 3207 B13R1.149 CC(O)CNCc1ccnc(n1)Cl 2703165c97fa61e120dc20200be7b988 [0,1,0,0,0,1|2,0,0]=4 3208 B13R1.149 CC(O)CNCc1cncc(c1)Br 6be6d2a8f04e2e75bcd6b1368ae4601c [0,1,0,0,0,1|1,0,0]=3 3209 B13R1.149 CC(O)CNCc1cncc(c1)Cl 615df85bf592ad86be4350df843fa329 [0,1,0,0,0,1|1,0,0]=3 3210 B13R1.149 CC(O)CNCc1cncc(c1)F 9bfa9fc78e6b2a309efde96b20a7c451 [0,1,0,0,0,1|1,0,0]=3 3211 B13R1.149 CC(O)CNCc1cncc(n1)Cl 2e165b6b38a360e64a4c3d4bc6cfaa4e [0,1,0,0,0,1|2,0,0]=4 3212 B13R1.149 CC(O)CNCc1nccc(n1)Cl a35a724898b279814a5400585fcac20c [0,1,0,0,0,1|2,0,0]=4 3213 B13R1.149 CC(S)COCc1cc(ccn1)Br 7e6ed502f527e2c412333271fa307bba [0,1,0,0,0,1|1,1,0]=4 3214 B13R1.149 CC(S)COCc1cc(ccn1)Cl 6bb8a91fe98d7da7eb1f92413496ef8b [0,1,0,0,0,1|1,1,0]=4 3215 B13R1.149 CC(S)COCc1cc[nH]c(=O)c1 f4df3b741e48ac58e832b601749c4ef7 [0,1,0,0,0,1|1,1,0]=4 3216 B13R1.149 CC(S)COCc1cccc(c1)Br 4e4b0a9a54a6d21896c2aa9b2d986515 [0,1,0,0,0,1|0,1,0]=3 3217 B13R1.149 CC(S)COCc1cccc(c1)Cl df58bec81e56d886a9b607d3d3099deb [0,1,0,0,0,1|0,1,0]=3 3218 B13R1.149 CC(S)COCc1cccc(c1)F 0742c947c8c8395b8dd90ba316d60b64 [0,1,0,0,0,1|0,1,0]=3 3219 B13R1.149 CC(S)COCc1cccc(c1)I f8e3b20e5d7b3dbfc46679a270ae382e [0,1,0,0,0,1|0,1,0]=3 3220 B13R1.149 CC(S)COCc1cccc(n1)Br a9b8f09d701d15a7bbfee2d1b80635ad [0,1,0,0,0,1|1,1,0]=4 3221 B13R1.149 CC(S)COCc1cccc(n1)Cl 23723193d3f8b87c54614a5481e552de [0,1,0,0,0,1|1,1,0]=4 3222 B13R1.149 CC(S)COCc1cccc(n1)F 5f8bfb957e6718542b9aec08f2e90297 [0,1,0,0,0,1|1,1,0]=4 3223 B13R1.149 CC(S)COCc1ccnc(c1)Br 840aa283179b16010180228e7f5cf351 [0,1,0,0,0,1|1,1,0]=4 3224 B13R1.149 CC(S)COCc1ccnc(c1)Cl 3948533c8e860433b3229d857971d7f1 [0,1,0,0,0,1|1,1,0]=4 3225 B13R1.149 CC(S)COCc1ccnc(c1)F 68cd86d9a3c8926d8173b1d644b0705a [0,1,0,0,0,1|1,1,0]=4 3226 B13R1.149 CC(S)COCc1cncc(c1)Br 8b9a8424427b265344793946c3dda716 [0,1,0,0,0,1|1,1,0]=4 3227 B13R1.149 CC(S)COCc1cncc(c1)Cl 79650304211c922fc35c978b6225a6b9 [0,1,0,0,0,1|1,1,0]=4 3228 B13R1.149 CC(S)COCc1cncc(c1)F eca75c3260cf57a03c256395d3eafab8 [0,1,0,0,0,1|1,1,0]=4 3229 B13R1.149 CN(C)CCNc1cccc(c1)Br f13f0354abb3ca0cb2b3ff9c62dedb11 [0,1,0,0,0,1|2,0,0]=4 3230 B13R1.149 CN(C)CCNc1cccc(c1)Cl 56361fb90aac779616bb86598b790e60 [0,1,0,0,0,1|2,0,0]=4 3231 B13R1.149 CN(C)CCNc1cccc(c1)F ce64dcee0c029410f34ba5daf507bb00 [0,1,0,0,0,1|2,0,0]=4 3232 B13R1.149 CN(C)CCNc1cccc(c1)I e77bd98ded649b8f699550a9ec3d0934 [0,1,0,0,0,1|2,0,0]=4 3233 B13R1.149 CN(C)CCNc1cccc(c1)S b2ba9faf73ef95bd6bbc28d0a53a7935 [0,1,0,0,0,1|2,0,0]=4 3234 B13R1.149 CN(C)CCOc1cccc(c1)Br 9434d14c4930c446f4ff560d7ee84722 [0,1,0,0,0,1|2,0,0]=4 3235 B13R1.149 CN(C)CCOc1cccc(c1)Cl c824539e6740236e6d8f9d52f6a5823a [0,1,0,0,0,1|2,0,0]=4 3236 B13R1.149 CN(C)CCOc1cccc(c1)F f2f120b71af172d10a574b1d05477be2 [0,1,0,0,0,1|2,0,0]=4 3237 B13R1.149 CN(C)CCOc1cccc(c1)I 9648c7b3a29ee67a98951d06e0e1d098 [0,1,0,0,0,1|2,0,0]=4 3238 B13R1.149 CN(C)CCOc1cccc(c1)S fc151bb4a803e3fd2bde951846fc5e8d [0,1,0,0,0,1|2,0,0]=4 3239 B13R1.149 CN(C)CNCc1cccc(c1)Br c0428de4e6298ff222c0abedf774b83d [0,1,0,0,0,1|2,0,0]=4 3240 B13R1.149 CN(C)CNCc1cccc(c1)Cl 0ab85eba255d7f2a8854eb18d45f27f0 [0,1,0,0,0,1|2,0,0]=4 3241 B13R1.149 CN(C)CNCc1cccc(c1)F c3cfca438e3ea1e33b0189979f240138 [0,1,0,0,0,1|2,0,0]=4 3242 B13R1.149 CN(C)CNCc1cccc(c1)I f678dc35d13b6213a17a272aad8fde5b [0,1,0,0,0,1|2,0,0]=4 3243 B13R1.149 CN(C)COCc1cccc(c1)Br 52e82bcd630d14ed94c2f750247c6af0 [0,1,0,0,0,1|2,0,0]=4 3244 B13R1.149 CN(C)COCc1cccc(c1)Cl 5b695b1d28126d5756bbee6b1d52efa6 [0,1,0,0,0,1|2,0,0]=4 3245 B13R1.149 CN(C)COCc1cccc(c1)F c5f2d704fbb36dd3dd6e4c6a2a24d896 [0,1,0,0,0,1|2,0,0]=4 3246 B13R1.149 CN(C)COCc1cccc(c1)I 1150a2cc9b9454c95bf69a4b07419c9e [0,1,0,0,0,1|2,0,0]=4 3247 B13R1.149 CS(=O)CCNc1cccc(c1)Br 07b9ca14cbe2216bef8937f0f38a0362 [0,1,0,0,0,1|1,0,1]=4 3248 B13R1.149 CS(=O)CCNc1cccc(c1)Cl ef8343e3a07d6e4eae57b2d10013d1e1 [0,1,0,0,0,1|1,0,1]=4 3249 B13R1.149 CS(=O)CCNc1cccc(c1)F b30b7212470e9ed290a923989777e6b8 [0,1,0,0,0,1|1,0,1]=4 3250 B13R1.149 CS(=O)CCNc1cccc(c1)I b3c5e8558de1e9047bb80fb578398cca [0,1,0,0,0,1|1,0,1]=4 3251 B13R1.149 CS(=O)CCNc1cccc(c1)O dfecabc19d123f833754b183c5189421 [0,1,0,0,0,1|1,0,1]=4 3252 B13R1.149 CS(=O)CCNc1cccc(c1)S eaafe6ef9790469c697712437a5ccf00 [0,1,0,0,0,1|1,0,1]=4 3253 B13R1.149 CS(=O)CCOc1cccc(c1)Br fb9878d2e82a4c552399f23444d37bf6 [0,1,0,0,0,1|1,0,1]=4 3254 B13R1.149 CS(=O)CCOc1cccc(c1)Cl f862b17b9158da32912f5235c7738672 [0,1,0,0,0,1|1,0,1]=4 3255 B13R1.149 CS(=O)CCOc1cccc(c1)F e404c95042dd580863c03733870e5db8 [0,1,0,0,0,1|1,0,1]=4 3256 B13R1.149 CS(=O)CCOc1cccc(c1)I 09444e1f5cdf7365d4345f6b9607f083 [0,1,0,0,0,1|1,0,1]=4 3257 B13R1.149 CS(=O)CCOc1cccc(c1)S b5263fd1c9d3fa17a809a5ce8b8d9e60 [0,1,0,0,0,1|1,0,1]=4 3258 B13R1.149 C[C@@H](F)COCc1cc(ccn1)Br 4c9c94084f4304b3237cba815223fb1c [0,1,0,0,0,1|2,0,0]=4 3259 B13R1.149 C[C@@H](F)COCc1cc(ccn1)Cl 2b7ee0cb032d07f77685ffcc12cf1d29 [0,1,0,0,0,1|2,0,0]=4 3260 B13R1.149 C[C@@H](F)COCc1cc[nH]c(=O)c1 49869c121f4ec33d8603834f6598220d [0,1,0,0,0,1|2,0,0]=4 3261 B13R1.149 C[C@@H](F)COCc1cccc(c1)Br cf1cc6262d2a693227c6d4ea409c1595 [0,1,0,0,0,1|1,0,0]=3 3262 B13R1.149 C[C@@H](F)COCc1cccc(c1)Cl 62bf4e37ec89a54c7f5353fceb510bcd [0,1,0,0,0,1|1,0,0]=3 3263 B13R1.149 C[C@@H](F)COCc1cccc(c1)F 4b8e13c530775dd4071dd9a88ff78ef4 [0,1,0,0,0,1|1,0,0]=3 3264 B13R1.149 C[C@@H](F)COCc1cccc(c1)I 9e63ecaae8b9f4c0832f6f3dbcab4847 [0,1,0,0,0,1|1,0,0]=3 3265 B13R1.149 C[C@@H](F)COCc1cccc(n1)Br 42ed97b0aa947c67af42e0da998df518 [0,1,0,0,0,1|2,0,0]=4 3266 B13R1.149 C[C@@H](F)COCc1cccc(n1)Cl 588b6fccb1bdd1cc95801d01584570e5 [0,1,0,0,0,1|2,0,0]=4 3267 B13R1.149 C[C@@H](F)COCc1cccc(n1)F 56cdfc9af32efffd23f14d422c040725 [0,1,0,0,0,1|2,0,0]=4 3268 B13R1.149 C[C@@H](F)COCc1ccnc(c1)Br 458a03c323467b2f4cb1f4743f2cebd5 [0,1,0,0,0,1|2,0,0]=4 3269 B13R1.149 C[C@@H](F)COCc1ccnc(c1)Cl 9c6cc614faf5b8de7a723329d28fc47f [0,1,0,0,0,1|2,0,0]=4 3270 B13R1.149 C[C@@H](F)COCc1ccnc(c1)F 2641fde84fa952bb047ce9c56b7e0bc4 [0,1,0,0,0,1|2,0,0]=4 3271 B13R1.149 C[C@@H](F)COCc1cncc(c1)Br 09514c1a09ece566a762649d33f34bab [0,1,0,0,0,1|2,0,0]=4 3272 B13R1.149 C[C@@H](F)COCc1cncc(c1)Cl 32220d8c2b6f8698d1505cf9b535f53d [0,1,0,0,0,1|2,0,0]=4 3273 B13R1.149 C[C@@H](F)COCc1cncc(c1)F ad40aba41f3160b21a6ada7fa5f0c5e3 [0,1,0,0,0,1|2,0,0]=4 3274 B13R1.149 C[C@@H](O)CCNc1cc(ccn1)O bf3f08225dd16d53d1f67b2a5b34da6b [0,1,0,0,0,1|1,0,0]=3 3275 B13R1.149 C[C@@H](O)CCNc1ccc[n+](c1)[O-] b1923b608386c384ddbb7b633461f624 [0,1,0,0,0,1|1,0,0]=3 3276 B13R1.149 C[C@@H](O)CCNc1cccc(c1)S c01831baa5d1b1a2a99d9e318c0596d4 [0,1,0,0,0,1|0,0,0]=2 3277 B13R1.149 C[C@@H](O)CCNc1ccnc(c1)F 46eb27be1d7a87523bccd3c956398eff [0,1,0,0,0,1|1,0,0]=3 3278 B13R1.149 C[C@@H](O)CCNc1ccnc(n1)F 7481c19b11b6aec9f71e0a09855b20a8 [0,1,0,0,0,1|2,0,0]=4 3279 B13R1.149 C[C@@H](O)CCNc1ccnc(n1)O c3143f65574a5ecaa58b32411cd0bc7d [0,1,0,0,0,1|2,0,0]=4 3280 B13R1.149 C[C@@H](O)CCNc1cn[nH]c(=O)c1 19b7981fdeaa2ffe4ee11ea60baaca7e [0,1,0,0,0,1|2,0,0]=4 3281 B13R1.149 C[C@@H](O)CCNc1cncc(c1)F f3c82a688640f57c03ffb5e7fab72038 [0,1,0,0,0,1|1,0,0]=3 3282 B13R1.149 C[C@@H](O)CCNc1cncc(n1)F 47d38351e4da9d58871823fc90e3e3d7 [0,1,0,0,0,1|2,0,0]=4 3283 B13R1.149 C[C@@H](O)CNCc1cc(ccn1)Br 5c925d0d6a272e8068189da5f405ae78 [0,1,0,0,0,1|1,0,0]=3 3284 B13R1.149 C[C@@H](O)CNCc1cc(ccn1)Cl 4e96dd3d15964daae4d62e9041fd9d86 [0,1,0,0,0,1|1,0,0]=3 3285 B13R1.149 C[C@@H](O)CNCc1cc[nH]c(=O)c1 98e23d35cd8c354ef0e52459042a26d8 [0,1,0,0,0,1|1,0,0]=3 3286 B13R1.149 C[C@@H](O)CNCc1cc[nH]c(=O)n1 bc2860130bae38461fd6f65cb77f34a5 [0,1,0,0,0,1|2,0,0]=4 3287 B13R1.149 C[C@@H](O)CNCc1ccc[n+](c1)[O-] f50bb6726b20c5bc9d05a6c77bcf95aa [0,1,0,0,0,1|1,0,0]=3 3288 B13R1.149 C[C@@H](O)CNCc1cccc(c1)Br 69874046edb7aeb76259b569be3fa78e [0,1,0,0,0,1|0,0,0]=2 3289 B13R1.149 C[C@@H](O)CNCc1cccc(c1)Cl f9ad7dabf65b4f1d156e2d87ab0c2ee1 [0,1,0,0,0,1|0,0,0]=2 3290 B13R1.149 C[C@@H](O)CNCc1cccc(c1)F 4f5e9662828dc90cc515c9d71b89caef [0,1,0,0,0,1|0,0,0]=2 3291 B13R1.149 C[C@@H](O)CNCc1cccc(c1)I 258c7599f672f8fbe7cbdedd9936e6a4 [0,1,0,0,0,1|0,0,0]=2 3292 B13R1.149 C[C@@H](O)CNCc1cccc(n1)Br bf5c3d8cd0f78353b68a34210b01cacb [0,1,0,0,0,1|1,0,0]=3 3293 B13R1.149 C[C@@H](O)CNCc1cccc(n1)Cl 86cb7db700c4fe21d2d82debff0375fa [0,1,0,0,0,1|1,0,0]=3 3294 B13R1.149 C[C@@H](O)CNCc1cccc(n1)F 75e5e6e7be25e631dd6a26df5fb9254d [0,1,0,0,0,1|1,0,0]=3 3295 B13R1.149 C[C@@H](O)CNCc1ccnc(c1)Br 44620ea2d85d73f2ad9ec92338e11961 [0,1,0,0,0,1|1,0,0]=3 3296 B13R1.149 C[C@@H](O)CNCc1ccnc(c1)Cl 5599d983ac458b9500fb079e98053af8 [0,1,0,0,0,1|1,0,0]=3 3297 B13R1.149 C[C@@H](O)CNCc1ccnc(c1)F 1c41dabc7059e378ffc737e34c7172db [0,1,0,0,0,1|1,0,0]=3 3298 B13R1.149 C[C@@H](O)CNCc1ccnc(n1)Cl f61f5382b218f3d2c254207d834753ca [0,1,0,0,0,1|2,0,0]=4 3299 B13R1.149 C[C@@H](O)CNCc1cncc(c1)Br faf32287fb37271c1f2c8baf36678286 [0,1,0,0,0,1|1,0,0]=3 3300 B13R1.149 C[C@@H](O)CNCc1cncc(c1)Cl 42b2f4caef38834d197f19e35d099298 [0,1,0,0,0,1|1,0,0]=3 3301 B13R1.149 C[C@@H](O)CNCc1cncc(c1)F 92e66ac0bdf5ae6aa4fbd5f8f78feb91 [0,1,0,0,0,1|1,0,0]=3 3302 B13R1.149 C[C@@H](O)CNCc1cncc(n1)Cl 5695265addc4f5a5a084f3cd9a60dcb5 [0,1,0,0,0,1|2,0,0]=4 3303 B13R1.149 C[C@@H](O)CNCc1nccc(n1)Cl 999334bd3b1657b37b097fcb35b2745a [0,1,0,0,0,1|2,0,0]=4 3304 B13R1.149 C[C@H](F)COCc1cc(ccn1)Br 4a6cade4c9ce67a33ce1401557c05eab [0,1,0,0,0,1|2,0,0]=4 3305 B13R1.149 C[C@H](F)COCc1cc(ccn1)Cl a1497efa9d329ad08e7c7a754da801b8 [0,1,0,0,0,1|2,0,0]=4 3306 B13R1.149 C[C@H](F)COCc1cc[nH]c(=O)c1 04fcffc3a6ca81b3ca7f8e82c60a43b0 [0,1,0,0,0,1|2,0,0]=4 3307 B13R1.149 C[C@H](F)COCc1cccc(c1)Br 4a39d21bccfaa9b95907c148417192be [0,1,0,0,0,1|1,0,0]=3 3308 B13R1.149 C[C@H](F)COCc1cccc(c1)Cl c71c22b683c9dc015eb02289c9b1ae3f [0,1,0,0,0,1|1,0,0]=3 3309 B13R1.149 C[C@H](F)COCc1cccc(c1)F 83013d8fec29391e2fd05412adfe034d [0,1,0,0,0,1|1,0,0]=3 3310 B13R1.149 C[C@H](F)COCc1cccc(c1)I 56cfd3be5b9b1a7177f5ef5d5983ab4a [0,1,0,0,0,1|1,0,0]=3 3311 B13R1.149 C[C@H](F)COCc1cccc(n1)Br aa7c1cd2b8ac0b586763a31182c86afb [0,1,0,0,0,1|2,0,0]=4 3312 B13R1.149 C[C@H](F)COCc1cccc(n1)Cl f22dffdff3ec6e25b1bbe80d4166fc83 [0,1,0,0,0,1|2,0,0]=4 3313 B13R1.149 C[C@H](F)COCc1cccc(n1)F 8e6a0444804660d08a4b66d651b724cf [0,1,0,0,0,1|2,0,0]=4 3314 B13R1.149 C[C@H](F)COCc1ccnc(c1)Br 63f94e464d89b5c5a8adc0cd768a50ef [0,1,0,0,0,1|2,0,0]=4 3315 B13R1.149 C[C@H](F)COCc1ccnc(c1)Cl 9849373eff92d8ddf9fd94899a8f2817 [0,1,0,0,0,1|2,0,0]=4 3316 B13R1.149 C[C@H](F)COCc1ccnc(c1)F 3e06f3292833c666f0637da4e1c40495 [0,1,0,0,0,1|2,0,0]=4 3317 B13R1.149 C[C@H](F)COCc1cncc(c1)Br 5d81ed1b48a45f2fb848c3ec36c9c149 [0,1,0,0,0,1|2,0,0]=4 3318 B13R1.149 C[C@H](F)COCc1cncc(c1)Cl c6c7388b384c7e4724aceb706d6e59e2 [0,1,0,0,0,1|2,0,0]=4 3319 B13R1.149 C[C@H](F)COCc1cncc(c1)F fdcb63cd72e427b40ca799fb2c8ed1a3 [0,1,0,0,0,1|2,0,0]=4 3320 B13R1.149 C[C@H](O)CCNc1cc(ccn1)O 110a851348f641555e733319881636b0 [0,1,0,0,0,1|1,0,0]=3 3321 B13R1.149 C[C@H](O)CCNc1ccc[n+](c1)[O-] da9ce5404ffac76213171813bac7f0b0 [0,1,0,0,0,1|1,0,0]=3 3322 B13R1.149 C[C@H](O)CCNc1cccc(c1)S 615c850fa48c1799db2bc7f9ddc9798e [0,1,0,0,0,1|0,0,0]=2 3323 B13R1.149 C[C@H](O)CCNc1ccnc(c1)F 002ab2c4217d9e3ace17fc4a40befe7a [0,1,0,0,0,1|1,0,0]=3 3324 B13R1.149 C[C@H](O)CCNc1ccnc(n1)F fc4bc5ef673527d07bb08ae07b9b2b57 [0,1,0,0,0,1|2,0,0]=4 3325 B13R1.149 C[C@H](O)CCNc1ccnc(n1)O 4dccc82fd13436b2057f5822f080c300 [0,1,0,0,0,1|2,0,0]=4 3326 B13R1.149 C[C@H](O)CCNc1cn[nH]c(=O)c1 2eca79ee1a576fc9f7c89df0b635a04f [0,1,0,0,0,1|2,0,0]=4 3327 B13R1.149 C[C@H](O)CCNc1cncc(c1)F 4aaa1a825d1bae8da3c1d9166f9f7381 [0,1,0,0,0,1|1,0,0]=3 3328 B13R1.149 C[C@H](O)CCNc1cncc(n1)F 14ff735711346e6fe9bdc5b910dbf26f [0,1,0,0,0,1|2,0,0]=4 3329 B13R1.149 C[C@H](O)CNCc1cc(ccn1)Br 539f22cd6ef3a5031fca7cf79f463a3c [0,1,0,0,0,1|1,0,0]=3 3330 B13R1.149 C[C@H](O)CNCc1cc(ccn1)Cl 2bb03a79d36d61f4f610e0817108ce4a [0,1,0,0,0,1|1,0,0]=3 3331 B13R1.149 C[C@H](O)CNCc1cc[nH]c(=O)c1 b01520326cd4ee7776d19f639afb1d4c [0,1,0,0,0,1|1,0,0]=3 3332 B13R1.149 C[C@H](O)CNCc1cc[nH]c(=O)n1 69f4656168e3aa4bd00a6ed0315105d9 [0,1,0,0,0,1|2,0,0]=4 3333 B13R1.149 C[C@H](O)CNCc1ccc[n+](c1)[O-] ccb83c1b8b7303f5b33ff573e4c740fe [0,1,0,0,0,1|1,0,0]=3 3334 B13R1.149 C[C@H](O)CNCc1cccc(c1)Br a700fc84111e1d6dbfad025016f8f9dd [0,1,0,0,0,1|0,0,0]=2 3335 B13R1.149 C[C@H](O)CNCc1cccc(c1)Cl f173ac5763c9fdac0f8a064275aa9547 [0,1,0,0,0,1|0,0,0]=2 3336 B13R1.149 C[C@H](O)CNCc1cccc(c1)F b8b5fde3fd2f274022ce343ba3c10973 [0,1,0,0,0,1|0,0,0]=2 3337 B13R1.149 C[C@H](O)CNCc1cccc(c1)I 8a98f34e84eaf0bd0d7cfae126aa46a6 [0,1,0,0,0,1|0,0,0]=2 3338 B13R1.149 C[C@H](O)CNCc1cccc(n1)Br 9b91617262e688769c8162b8bb182363 [0,1,0,0,0,1|1,0,0]=3 3339 B13R1.149 C[C@H](O)CNCc1cccc(n1)Cl 1e8d60d1990683ddc7e0e9a0a73e4a9f [0,1,0,0,0,1|1,0,0]=3 3340 B13R1.149 C[C@H](O)CNCc1cccc(n1)F 4f27dc1d092ddddce9c7bb3a328ca365 [0,1,0,0,0,1|1,0,0]=3 3341 B13R1.149 C[C@H](O)CNCc1ccnc(c1)Br 01d8891e6618dac9e79722fd0117fa4b [0,1,0,0,0,1|1,0,0]=3 3342 B13R1.149 C[C@H](O)CNCc1ccnc(c1)Cl 0b9fe2b9b8a539a447c461ac6110d9f5 [0,1,0,0,0,1|1,0,0]=3 3343 B13R1.149 C[C@H](O)CNCc1ccnc(c1)F a679c133a88917c07e4d6a713a943642 [0,1,0,0,0,1|1,0,0]=3 3344 B13R1.149 C[C@H](O)CNCc1ccnc(n1)Cl 5e79789bd086f88e2ece509bf80ce343 [0,1,0,0,0,1|2,0,0]=4 3345 B13R1.149 C[C@H](O)CNCc1cncc(c1)Br 9cde4f41413c809f1228f782aff5fe27 [0,1,0,0,0,1|1,0,0]=3 3346 B13R1.149 C[C@H](O)CNCc1cncc(c1)Cl 150bc976c36810ee2ebdb5c46eaed081 [0,1,0,0,0,1|1,0,0]=3 3347 B13R1.149 C[C@H](O)CNCc1cncc(c1)F 45a512c32293dc563fae39dac5b0a261 [0,1,0,0,0,1|1,0,0]=3 3348 B13R1.149 C[C@H](O)CNCc1cncc(n1)Cl 3202ff486d86924a7c32430b49c6d4f7 [0,1,0,0,0,1|2,0,0]=4 3349 B13R1.149 C[C@H](O)CNCc1nccc(n1)Cl 0fd2be54ca746a44cb3aa8b1672dca60 [0,1,0,0,0,1|2,0,0]=4 3350 B13R1.149 Cc1cc(ccn1)CCNC(C)C bbd07215278344402fdd3d046203228c [0,1,0,0,0,1|2,0,0]=4 3351 B13R1.149 Cc1cc(ccn1)CNCC(C)C dd6681bfaf9e7bae92ebef385acd024c [0,1,0,0,0,1|2,0,0]=4 3352 B13R1.149 Cc1cc(ccn1)CNCC(C)O 7f65128d875f3f9c083f243e50c82731 [0,1,0,0,0,1|1,0,0]=3 3353 B13R1.149 Cc1cc(ccn1)CNC[C@@H](C)O e31325b06c7f5c8d97fbd6df2cdc08d6 [0,1,0,0,0,1|1,0,0]=3 3354 B13R1.149 Cc1cc(ccn1)CNC[C@H](C)O eb58999d5d454e5dd0ded6afee1afc2d [0,1,0,0,0,1|1,0,0]=3 3355 B13R1.149 Cc1cc(ccn1)COCC(C)C 604de2b4c46e0e22328e699b49b20194 [0,1,0,0,0,1|2,0,0]=4 3356 B13R1.149 Cc1cc(ccn1)COCC(C)F 9c2bc25e5743bf7e14cb642d50aa65d3 [0,1,0,0,0,1|2,0,0]=4 3357 B13R1.149 Cc1cc(ccn1)COCC(C)S 709e1cf3d5229ac109ef972fffa5e2fc [0,1,0,0,0,1|1,1,0]=4 3358 B13R1.149 Cc1cc(ccn1)COC[C@@H](C)F 53026323fd26a7edc00d872a19f57363 [0,1,0,0,0,1|2,0,0]=4 3359 B13R1.149 Cc1cc(ccn1)COC[C@H](C)F 0182696cc093986b9b36fb200b8975ec [0,1,0,0,0,1|2,0,0]=4 3360 B13R1.149 Cc1cc(ccn1)NCCC(C)C 250fcc21b3006fcd2afa9e5c87c107c1 [0,1,0,0,0,1|2,0,0]=4 3361 B13R1.149 Cc1cc(ccn1)NCCC(C)O 0eead1d47698d97f14aa3457f9b8d1f6 [0,1,0,0,0,1|1,0,0]=3 3362 B13R1.149 Cc1cc(ccn1)NCC[C@@H](C)O f49b6787b057becd8c68a9d0ffb9b448 [0,1,0,0,0,1|1,0,0]=3 3363 B13R1.149 Cc1cc(ccn1)NCC[C@H](C)O 2a9679f9353e3c105b958a873d0a6584 [0,1,0,0,0,1|1,0,0]=3 3364 B13R1.149 Cc1cc(ccn1)OCCC(C)C cfafba3740933abab78a479819fa26ad [0,1,0,0,0,1|2,0,0]=4 3365 B13R1.149 Cc1cc(ncn1)NCCC(C)O d2685fd6b7de8bd400c2cbacd8d1dae6 [0,1,0,0,0,1|2,0,0]=4 3366 B13R1.149 Cc1cccc(c1)CCNC(C)C c39e9eb6cd3172a22f2d9d4871d0035b [0,1,0,0,0,1|1,0,0]=3 3367 B13R1.149 Cc1cccc(c1)CCOC(C)C cd2152cc295c42783fd32e0023dabc76 [0,1,0,0,0,1|1,0,0]=3 3368 B13R1.149 Cc1cccc(c1)CNCC(=O)O f92d649607636ba4023200ee45324aa0 [0,1,0,0,0,1|1,0,1]=4 3369 B13R1.149 Cc1cccc(c1)CNCC(C)C bb0334a779fbb99d989ae97d253da6e4 [0,1,0,0,0,1|1,0,0]=3 3370 B13R1.149 Cc1cccc(c1)CNCC(C)O 6cd8b22b8b66596ec7f6cf4781ce8f07 [0,1,0,0,0,1|0,0,0]=2 3371 B13R1.149 Cc1cccc(c1)CNCC(F)F e72cad730c193711e7304ed64b0cd6a5 [0,1,0,0,0,1|2,0,0]=4 3372 B13R1.149 Cc1cccc(c1)CNCN(C)C 50d31c1961e1737dfbfae132ff260b16 [0,1,0,0,0,1|2,0,0]=4 3373 B13R1.149 Cc1cccc(c1)CNC[C@@H](C)O d2b7c55835ed26af16973da42cd2c877 [0,1,0,0,0,1|0,0,0]=2 3374 B13R1.149 Cc1cccc(c1)CNC[C@H](C)O 8519a715397b2285cd74367a46cfad5e [0,1,0,0,0,1|0,0,0]=2 3375 B13R1.149 Cc1cccc(c1)COCC(=O)O 7ccc2970ba5c32cc1d9394fad6349249 [0,1,0,0,0,1|1,0,1]=4 3376 B13R1.149 Cc1cccc(c1)COCC(C)C 83cff12924188163800d8a65ff2e2ffa [0,1,0,0,0,1|1,0,0]=3 3377 B13R1.149 Cc1cccc(c1)COCC(C)F 4c27974e7009d439231850c64086182a [0,1,0,0,0,1|1,0,0]=3 3378 B13R1.149 Cc1cccc(c1)COCC(C)S 4682f7210be9fa1d483415cedf6d9161 [0,1,0,0,0,1|0,1,0]=3 3379 B13R1.149 Cc1cccc(c1)COCC(F)F 00d04b9454c0dd60b2ff30cf0cccfbf5 [0,1,0,0,0,1|2,0,0]=4 3380 B13R1.149 Cc1cccc(c1)COCN(C)C 650cbc4332345ebfacf1c28d58b71287 [0,1,0,0,0,1|2,0,0]=4 3381 B13R1.149 Cc1cccc(c1)COCS(=O)O 6c0f8999606e8750fc8ee725256a8016 [0,1,0,0,0,1|2,0,0]=4 3382 B13R1.149 Cc1cccc(c1)COC[C@@H](C)F beb9987f076613d9a3f70e0d5fc40c08 [0,1,0,0,0,1|1,0,0]=3 3383 B13R1.149 Cc1cccc(c1)COC[C@H](C)F 91d91eac1f7bc52b38fee473aadac7e9 [0,1,0,0,0,1|1,0,0]=3 3384 B13R1.149 Cc1cccc(c1)NCCC(=O)O 0776e6079ba6fba2968a5de84639ab7d [0,1,0,0,0,1|1,0,1]=4 3385 B13R1.149 Cc1cccc(c1)NCCC(C)C 8db9566c14d7eabdc062f980450fbf7e [0,1,0,0,0,1|1,0,0]=3 3386 B13R1.149 Cc1cccc(c1)NCCC(C)O b07cff58b2674b4597cec64c761b6ada [0,1,0,0,0,1|0,0,0]=2 3387 B13R1.149 Cc1cccc(c1)NCCC(F)F 883cf89a683cc2fd185b9a3e947fe343 [0,1,0,0,0,1|2,0,0]=4 3388 B13R1.149 Cc1cccc(c1)NCCN(C)C e948faef25ffeb0be8c9c06a8aab7813 [0,1,0,0,0,1|2,0,0]=4 3389 B13R1.149 Cc1cccc(c1)NCCS(=O)C 2731026e986c3ad26702bf299e758644 [0,1,0,0,0,1|1,0,1]=4 3390 B13R1.149 Cc1cccc(c1)NCCS(=O)O 895904eef9f6ec7cb3185a6ba3555ee3 [0,1,0,0,0,1|2,0,0]=4 3391 B13R1.149 Cc1cccc(c1)NCC[C@@H](C)O b37f185c717ea55d21c399087dc9810a [0,1,0,0,0,1|0,0,0]=2 3392 B13R1.149 Cc1cccc(c1)NCC[C@H](C)O 0645bdc59ab1937e7c831605852b54be [0,1,0,0,0,1|0,0,0]=2 3393 B13R1.149 Cc1cccc(c1)NCOC(C)C 2d70901e325c52f1347e3b6dc5c6170f [0,1,0,0,0,1|2,0,0]=4 3394 B13R1.149 Cc1cccc(c1)OCCC(=O)O f3eb0276d2aea1ad26eee12d54dc2d25 [0,1,0,0,0,1|1,0,1]=4 3395 B13R1.149 Cc1cccc(c1)OCCC(C)C 28d5797108494efc011346ebebffb4c4 [0,1,0,0,0,1|1,0,0]=3 3396 B13R1.149 Cc1cccc(c1)OCCN(C)C 8c01af4729dcf0753da19cb5c4d994cb [0,1,0,0,0,1|2,0,0]=4 3397 B13R1.149 Cc1cccc(c1)OCCS(=O)C 76886273fd34748df374bb329d5dcf39 [0,1,0,0,0,1|1,0,1]=4 3398 B13R1.149 Cc1cccc(c1)OCOC(C)C ac4a78b545f7df30ec8f568860a9b2d7 [0,1,0,0,0,1|2,0,0]=4 3399 B13R1.149 Cc1cccc(n1)CCNC(C)C 919c963320960ea9a28eaea5eb388d52 [0,1,0,0,0,1|2,0,0]=4 3400 B13R1.149 Cc1cccc(n1)CCOC(C)C 0be5b7de39b8cf294823c56493e86900 [0,1,0,0,0,1|2,0,0]=4 3401 B13R1.149 Cc1cccc(n1)CNCC(C)C ff11eee154679a8dd9d18c440b01466d [0,1,0,0,0,1|2,0,0]=4 3402 B13R1.149 Cc1cccc(n1)CNCC(C)O dbe605d552e7b7a32658b082b6c918a6 [0,1,0,0,0,1|1,0,0]=3 3403 B13R1.149 Cc1cccc(n1)CNC[C@@H](C)O 496f3652559425c483c2dd0671b0558f [0,1,0,0,0,1|1,0,0]=3 3404 B13R1.149 Cc1cccc(n1)CNC[C@H](C)O 343e3d694eb954adba06fee9ef16e620 [0,1,0,0,0,1|1,0,0]=3 3405 B13R1.149 Cc1cccc(n1)COCC(C)C 31d233a0afc0449026efad09f271804a [0,1,0,0,0,1|2,0,0]=4 3406 B13R1.149 Cc1cccc(n1)COCC(C)F ee9bb05730777a92efad5aba67b2f923 [0,1,0,0,0,1|2,0,0]=4 3407 B13R1.149 Cc1cccc(n1)COCC(C)S 4d7afe12d3a6083d4b82b392494a3a83 [0,1,0,0,0,1|1,1,0]=4 3408 B13R1.149 Cc1cccc(n1)COC[C@@H](C)F c533d45266adb920a73cd341c0179d2c [0,1,0,0,0,1|2,0,0]=4 3409 B13R1.149 Cc1cccc(n1)COC[C@H](C)F 40febd2f0e7d7f9eca6d58c76d6e33ea [0,1,0,0,0,1|2,0,0]=4 3410 B13R1.149 Cc1cccc(n1)NCCC(C)C 74e7b5fd1046e05eaafd2f1ab4d5b617 [0,1,0,0,0,1|2,0,0]=4 3411 B13R1.149 Cc1cccc(n1)NCCC(C)O ee23b477569d6d3fe068aec6187ef8be [0,1,0,0,0,1|1,0,0]=3 3412 B13R1.149 Cc1cccc(n1)NCC[C@@H](C)O 7bef61ea07af8d7b25c30b40a9bffcf5 [0,1,0,0,0,1|1,0,0]=3 3413 B13R1.149 Cc1cccc(n1)NCC[C@H](C)O 091e8df36232d2062b287d20eecc4c16 [0,1,0,0,0,1|1,0,0]=3 3414 B13R1.149 Cc1cccc(n1)OCCC(C)C bdfe612e4273e729b6e2e74a2302e3c9 [0,1,0,0,0,1|2,0,0]=4 3415 B13R1.149 Cc1ccnc(c1)CNCC(C)C 714bf57c1edbf5ec7caac8542e751d36 [0,1,0,0,0,1|2,0,0]=4 3416 B13R1.149 Cc1ccnc(c1)CNCC(C)O 8f8d2f8c4be0304346330fa789deecec [0,1,0,0,0,1|1,0,0]=3 3417 B13R1.149 Cc1ccnc(c1)CNC[C@@H](C)O 584fd7b9f8240d4a3246f3f3dd542740 [0,1,0,0,0,1|1,0,0]=3 3418 B13R1.149 Cc1ccnc(c1)CNC[C@H](C)O f043a8e61df5dd1eedd4b93e4c11efc9 [0,1,0,0,0,1|1,0,0]=3 3419 B13R1.149 Cc1ccnc(c1)COCC(C)C 730d34729b3ce37c817a02d6c707f62f [0,1,0,0,0,1|2,0,0]=4 3420 B13R1.149 Cc1ccnc(c1)COCC(C)F 81ec7ffac26b84fa787ef8ca2ddf8332 [0,1,0,0,0,1|2,0,0]=4 3421 B13R1.149 Cc1ccnc(c1)COCC(C)S 97940bb1bb3f05048e69dd40d7b1ec7f [0,1,0,0,0,1|1,1,0]=4 3422 B13R1.149 Cc1ccnc(c1)COC[C@@H](C)F 4cd53ffc68b658c9e9cb7a6bd74cf8be [0,1,0,0,0,1|2,0,0]=4 3423 B13R1.149 Cc1ccnc(c1)COC[C@H](C)F 6e3a1f51e34a46c43bde42e3760a46a0 [0,1,0,0,0,1|2,0,0]=4 3424 B13R1.149 Cc1ccnc(c1)NCCC(C)C 82214eecf4bc83fffb9b1f226440a776 [0,1,0,0,0,1|2,0,0]=4 3425 B13R1.149 Cc1ccnc(c1)NCCC(C)O 563f53e85ee48db22a1ddf3fc4b02341 [0,1,0,0,0,1|1,0,0]=3 3426 B13R1.149 Cc1ccnc(c1)NCC[C@@H](C)O 34adecaef7ab810c25b8aac02c53fb62 [0,1,0,0,0,1|1,0,0]=3 3427 B13R1.149 Cc1ccnc(c1)NCC[C@H](C)O 862682ed164e39205889c2b34640f1dc [0,1,0,0,0,1|1,0,0]=3 3428 B13R1.149 Cc1ccnc(c1)OCCC(C)C cc26977101e1ee731b5a3ebaa081464a [0,1,0,0,0,1|2,0,0]=4 3429 B13R1.149 Cc1ccnc(n1)CNCC(C)O e314c4a834775631165039231f2ec6b1 [0,1,0,0,0,1|2,0,0]=4 3430 B13R1.149 Cc1ccnc(n1)CNC[C@@H](C)O d0e038c6b9c087878e3872a74537a669 [0,1,0,0,0,1|2,0,0]=4 3431 B13R1.149 Cc1ccnc(n1)CNC[C@H](C)O 86da75d023048031a3bbc4cee869c751 [0,1,0,0,0,1|2,0,0]=4 3432 B13R1.149 Cc1ccnc(n1)NCCC(C)O 7c43697bc45ac9529f37794e8e0e6e3b [0,1,0,0,0,1|2,0,0]=4 3433 B13R1.149 Cc1ccnc(n1)NCC[C@@H](C)O 4c9b41d03d27d4a249d4efbd58f6773c [0,1,0,0,0,1|2,0,0]=4 3434 B13R1.149 Cc1ccnc(n1)NCC[C@H](C)O 8180477bb2d4a64a451d4094ca0152f1 [0,1,0,0,0,1|2,0,0]=4 3435 B13R1.149 Cc1cncc(c1)CNCC(C)C 3e23447162691aa1c62d00fa6c3d8b92 [0,1,0,0,0,1|2,0,0]=4 3436 B13R1.149 Cc1cncc(c1)CNCC(C)O cd5d40a9cf9fd79e3e3f64a2aa4e543c [0,1,0,0,0,1|1,0,0]=3 3437 B13R1.149 Cc1cncc(c1)CNC[C@@H](C)O 413cb3a8893a491c75230045ff1bcac1 [0,1,0,0,0,1|1,0,0]=3 3438 B13R1.149 Cc1cncc(c1)CNC[C@H](C)O 1fecd554cd57c2345b6db6f609df5733 [0,1,0,0,0,1|1,0,0]=3 3439 B13R1.149 Cc1cncc(c1)COCC(C)C 477f4204274577542be7bd63b17e60ad [0,1,0,0,0,1|2,0,0]=4 3440 B13R1.149 Cc1cncc(c1)NCCC(C)C 7fd28ca51f6c1d20d89cc949bfe3a1d8 [0,1,0,0,0,1|2,0,0]=4 3441 B13R1.149 Cc1cncc(c1)NCCC(C)O be19c555bbda2cd27eed8d55d1cdbf8a [0,1,0,0,0,1|1,0,0]=3 3442 B13R1.149 Cc1cncc(c1)NCC[C@@H](C)O 9c27a4c185e00b887db90d2b093f6601 [0,1,0,0,0,1|1,0,0]=3 3443 B13R1.149 Cc1cncc(c1)NCC[C@H](C)O 0dd767f51a40818ffb89cd5658683597 [0,1,0,0,0,1|1,0,0]=3 3444 B13R1.149 Cc1cncc(c1)OCCC(C)C 38fab7393db804313a8ebe9ae4b8b087 [0,1,0,0,0,1|2,0,0]=4 3445 B13R1.149 Cc1cncc(n1)NCCC(C)O 6c20b06a74ffd3194e21a181c8003974 [0,1,0,0,0,1|2,0,0]=4 3446 B13R1.149 Cc1cnnc(c1)NCCC(C)O 16b56e1134e21e7a3931ee2128964fef [0,1,0,0,0,1|2,0,0]=4 3447 B13R1.149 Cc1nccc(n1)CNCC(C)O f3097061f29c408aa39b6a3808ae908c [0,1,0,0,0,1|2,0,0]=4 3448 B13R1.149 Cc1nccc(n1)CNC[C@@H](C)O 753a6abcc8e99a638fb172aa8ba4a4d7 [0,1,0,0,0,1|2,0,0]=4 3449 B13R1.149 Cc1nccc(n1)CNC[C@H](C)O 8a9871c5efab93005960f4884acdfb0c [0,1,0,0,0,1|2,0,0]=4 3450 B13R1.149 Cc1nccc(n1)NCCC(C)O fc3aa14a7af97f86935b848598e48bc5 [0,1,0,0,0,1|2,0,0]=4 3451 B13R1.149 Cc1nccc(n1)NCC[C@@H](C)O c4088291959d0b2a02bf640114559bad [0,1,0,0,0,1|2,0,0]=4 3452 B13R1.149 Cc1nccc(n1)NCC[C@H](C)O 4254f70f7f9de851a74bd3b5c793555e [0,1,0,0,0,1|2,0,0]=4 3453 B13R1.149 FC(F)CCNc1cccc(c1)S 14cf17d0c98838e625c810b37bd1f046 [0,1,0,0,0,1|2,0,0]=4 3454 B13R1.149 FC(F)CNCc1cccc(c1)Br c2b40bcbf60986184c8d9e8279460e3b [0,1,0,0,0,1|2,0,0]=4 3455 B13R1.149 FC(F)CNCc1cccc(c1)Cl 2d217e9279fcfcc4895a524fd6564209 [0,1,0,0,0,1|2,0,0]=4 3456 B13R1.149 FC(F)CNCc1cccc(c1)I 13dfda58bbe3203a60793374b990efb4 [0,1,0,0,0,1|2,0,0]=4 3457 B13R1.149 FC(F)COCc1cccc(c1)Br 7c95be5891bf058215b003c048065a96 [0,1,0,0,0,1|2,0,0]=4 3458 B13R1.149 FC(F)COCc1cccc(c1)Cl d113319ee41eff71bcd773bf4b18f42d [0,1,0,0,0,1|2,0,0]=4 3459 B13R1.149 FC(F)COCc1cccc(c1)I bf0dfe48273e187543c37ee1e25786ed [0,1,0,0,0,1|2,0,0]=4 3460 B13R1.149 Fc1cccc(c1)CNCC(F)F c9037eb3246b6a7a840d0f8f75dafdde [0,1,0,0,0,1|2,0,0]=4 3461 B13R1.149 Fc1cccc(c1)COCC(F)F 60db1d67e8fb401956e8d6de8d65aba9 [0,1,0,0,0,1|2,0,0]=4 3462 B13R1.149 Fc1cccc(c1)NCCC(F)F 1ee7fbb67e476c4d8549b8e5dcc703fb [0,1,0,0,0,1|2,0,0]=4 3463 B13R1.149 O=C(O)CCNc1cccc(c1)Br 55539f30d59f7dcb4542390574a9a7a3 [0,1,0,0,0,1|1,0,1]=4 3464 B13R1.149 O=C(O)CCNc1cccc(c1)Cl f270439818b9faf736ae7151900804cd [0,1,0,0,0,1|1,0,1]=4 3465 B13R1.149 O=C(O)CCNc1cccc(c1)F 6da96774a712bee771a2a7dd07c50fab [0,1,0,0,0,1|1,0,1]=4 3466 B13R1.149 O=C(O)CCNc1cccc(c1)I 027f08e1815e389ab220096be69fb18c [0,1,0,0,0,1|1,0,1]=4 3467 B13R1.149 O=C(O)CCNc1cccc(c1)O 2bc03786a91d6665a7eb2d5924a05ed2 [0,1,0,0,0,1|1,0,1]=4 3468 B13R1.149 O=C(O)CCNc1cccc(c1)S ecd4ac5d9bcf3082416d26c3560135b9 [0,1,0,0,0,1|1,0,1]=4 3469 B13R1.149 O=C(O)CCOc1cccc(c1)Br 57cd58ca1057a6572df1f6b2af457fe3 [0,1,0,0,0,1|1,0,1]=4 3470 B13R1.149 O=C(O)CCOc1cccc(c1)Cl 648a2875ce7dd466ef4d7aea573a6f47 [0,1,0,0,0,1|1,0,1]=4 3471 B13R1.149 O=C(O)CCOc1cccc(c1)F 567c7d3ce2677377ca253e7f7bec3c1a [0,1,0,0,0,1|1,0,1]=4 3472 B13R1.149 O=C(O)CCOc1cccc(c1)I 448f9f1273b219b0529b1fa2ef4015ba [0,1,0,0,0,1|1,0,1]=4 3473 B13R1.149 O=C(O)CCOc1cccc(c1)S 06573ad6645ade4b0bd0e7c40eadedf7 [0,1,0,0,0,1|1,0,1]=4 3474 B13R1.149 O=C(O)CNCc1cccc(c1)Br 694f9a21103efe5df767ba5a3e6c5c3e [0,1,0,0,0,1|1,0,1]=4 3475 B13R1.149 O=C(O)CNCc1cccc(c1)Cl a3d53873939c822b1cb83586a50fd718 [0,1,0,0,0,1|1,0,1]=4 3476 B13R1.149 O=C(O)CNCc1cccc(c1)F 21ebfe4da236e34bd4e258fb78ad8894 [0,1,0,0,0,1|1,0,1]=4 3477 B13R1.149 O=C(O)CNCc1cccc(c1)I f503f20cbe7f4128336cb13f903fb2e6 [0,1,0,0,0,1|1,0,1]=4 3478 B13R1.149 O=C(O)COCc1cccc(c1)Br 1761abccc32be6433f46e4e72afedaae [0,1,0,0,0,1|1,0,1]=4 3479 B13R1.149 O=C(O)COCc1cccc(c1)Cl ba5824635875cd2ab2df80699c05095a [0,1,0,0,0,1|1,0,1]=4 3480 B13R1.149 O=C(O)COCc1cccc(c1)F 6d14dc0c0796571e9d948ba9e8125591 [0,1,0,0,0,1|1,0,1]=4 3481 B13R1.149 O=C(O)COCc1cccc(c1)I f7ea48f6d055cd51fd7716c4ac46ec3e [0,1,0,0,0,1|1,0,1]=4 3482 B13R1.149 O=S(O)CCNc1cccc(c1)F 17ded2928f6b30cf5873177a9b6f6146 [0,1,0,0,0,1|2,0,0]=4 3483 B13R1.149 O=S(O)CCNc1cccc(c1)O c1ed2a91ef30ebc6a69dfff98710a77d [0,1,0,0,0,1|2,0,0]=4 3484 B13R1.149 O=S(O)CCNc1cccc(c1)S d150f4613cc41b547b099cfa12e064eb [0,1,0,0,0,1|2,0,0]=4 3485 B13R1.149 O=S(O)COCc1cccc(c1)Br 9c6200947348d3f64e9cd1c981f72da3 [0,1,0,0,0,1|2,0,0]=4 3486 B13R1.149 O=S(O)COCc1cccc(c1)Cl a610a47cbc71045265dc9c95ff9827e6 [0,1,0,0,0,1|2,0,0]=4 3487 B13R1.149 O=S(O)COCc1cccc(c1)F 052152820c4a2eae1ac35ec607cc9aca [0,1,0,0,0,1|2,0,0]=4 3488 B13R1.149 O=S(O)COCc1cccc(c1)I bbdffa3387a7f91b6e910188b2d40226 [0,1,0,0,0,1|2,0,0]=4 3489 B13R1.149 Oc1cccc(c1)NCCC(F)F 0ca27dea980d86466a80a3de38b167b8 [0,1,0,0,0,1|2,0,0]=4 3490 B13R1.158 C=C(C)CCNc1ccccc1C 90cc2dc50206f025f6b2ce2069ecac29 [0,1,0,0,0,1|1,0,1]=4 3491 B13R1.158 C=C(C)CCNc1ccccc1Cl e22112e21d6c64fb6f3d8a3062eaf9bb [0,1,0,0,0,1|1,0,1]=4 3492 B13R1.158 C=C(C)CCNc1ccccc1I f174f715faf79b37798dc46f55df1963 [0,1,0,0,0,1|1,0,1]=4 3493 B13R1.158 C=C(C)CCOc1ccccc1Cl 3978582074c5a85005c4577fbbdb032b [0,1,0,0,0,1|1,0,1]=4 3494 B13R1.158 C=C(C)CNCc1ccccc1Br 6708ccdf2b5507d9d7d0ea0e001a6283 [0,1,0,0,0,1|1,0,1]=4 3495 B13R1.158 C=C(C)CNCc1ccccc1C e95b4aab39f49b986ee7bcc4cd4035c5 [0,1,0,0,0,1|1,0,1]=4 3496 B13R1.158 C=C(C)CNCc1ccccc1Cl 9ae3133d401fe4369e55e5660b0b709e [0,1,0,0,0,1|1,0,1]=4 3497 B13R1.158 C=C(C)CNCc1ccccc1F 103606e95afe6f3101fbfdfce98deacb [0,1,0,0,0,1|1,0,1]=4 3498 B13R1.158 C=C(C)CNCc1ccccc1I f03970584aa4d73e2edcbc6ea1f9f56b [0,1,0,0,0,1|1,0,1]=4 3499 B13R1.158 C=C(C)COCc1ccccc1Br 8ec4f24965e3dc6b78babec82ca4f3cb [0,1,0,0,0,1|1,0,1]=4 3500 B13R1.158 C=C(C)COCc1ccccc1C f61e297b233040a48972e6dc80d42969 [0,1,0,0,0,1|1,0,1]=4 3501 B13R1.158 C=C(C)COCc1ccccc1Cl 87762a3f032751881026ade211785d9c [0,1,0,0,0,1|1,0,1]=4 3502 B13R1.158 C=C(C)COCc1ccccc1F 01d218bfbe7025e2ff194ffae89f5561 [0,1,0,0,0,1|1,0,1]=4 3503 B13R1.158 C=C(C)COCc1ccccc1I cb1df010bd76325d4e303b7964267642 [0,1,0,0,0,1|1,0,1]=4 3504 B13R1.158 C=C(C)COCc1ccccc1S 3f57ef3a7bd9c460dddddb94efc22992 [0,1,0,0,0,1|1,0,1]=4 3505 B13R1.158 CC(=O)CCNc1ccccc1C 3b1fa9f19543e8abe90949ffa49c2596 [0,1,0,0,0,1|0,0,2]=4 3506 B13R1.158 CC(=O)CCNc1ccccc1Cl bdbbb29869131470838f50911dbddb8f [0,1,0,0,0,1|0,0,2]=4 3507 B13R1.158 CC(=O)CCNc1ccccc1F 95225969e87a35f985a48cc13b21d161 [0,1,0,0,0,1|0,0,2]=4 3508 B13R1.158 CC(=O)CCNc1ccccc1I 69def4e199810b65a23f52d452c3a14a [0,1,0,0,0,1|0,0,2]=4 3509 B13R1.158 CC(=O)CCOc1ccccc1Cl e7d38adb9010fe93ea2cd4ac544bf657 [0,1,0,0,0,1|0,0,2]=4 3510 B13R1.158 CC(=O)CCOc1ccccc1F e021c8ddd8b18efa5243589537f486d4 [0,1,0,0,0,1|0,0,2]=4 3511 B13R1.158 CC(=O)CCOc1ccccc1I 3974a019deab65ea2e1e1c1dc0d7e070 [0,1,0,0,0,1|0,0,2]=4 3512 B13R1.158 CC(=O)CNCc1ccccc1Br c3d4f603f746358470e0c0a49e1a298d [0,1,0,0,0,1|0,0,2]=4 3513 B13R1.158 CC(=O)CNCc1ccccc1C bf7c3305b48085e4c1ffd88b7a5aeb44 [0,1,0,0,0,1|0,0,2]=4 3514 B13R1.158 CC(=O)CNCc1ccccc1Cl 4a472f9e9116cd4782f51464e6a27a2c [0,1,0,0,0,1|0,0,2]=4 3515 B13R1.158 CC(=O)CNCc1ccccc1F 710ddc4078c31cd2947f7feef846fcef [0,1,0,0,0,1|0,0,2]=4 3516 B13R1.158 CC(=O)CNCc1ccccc1I fa687edde7ebe3b1c00492b5a0ceb122 [0,1,0,0,0,1|0,0,2]=4 3517 B13R1.158 CC(=O)COCc1ccccc1Br 1129985f65460e4ac8fb868f27153469 [0,1,0,0,0,1|0,0,2]=4 3518 B13R1.158 CC(=O)COCc1ccccc1C 66dc454b28e1bc6d9b173c2a4a0dd827 [0,1,0,0,0,1|0,0,2]=4 3519 B13R1.158 CC(=O)COCc1ccccc1Cl c2bd2bb074f5649d83ad91f56e38734d [0,1,0,0,0,1|0,0,2]=4 3520 B13R1.158 CC(=O)COCc1ccccc1F 8f9321512c3d7ba2fa30a85774ece228 [0,1,0,0,0,1|0,0,2]=4 3521 B13R1.158 CC(=O)COCc1ccccc1I 159bbe84eb72bcd197fed907d90ab2b8 [0,1,0,0,0,1|0,0,2]=4 3522 B13R1.158 CC(=O)NCCc1ccccc1Br 414c42bc6a30fed988c730129553d9e2 [0,1,0,0,0,1|0,0,2]=4 3523 B13R1.158 CC(=O)NCCc1ccccc1C b4606f09098b64d9a25eb82a936db50b [0,1,0,0,0,1|0,0,2]=4 3524 B13R1.158 CC(=O)NCCc1ccccc1Cl 57235090bd0f2738bb4b9f80028e7402 [0,1,0,0,0,1|0,0,2]=4 3525 B13R1.158 CC(=O)NCCc1ccccc1F 07dfbf064513a293f98d23feae25991d [0,1,0,0,0,1|0,0,2]=4 3526 B13R1.158 CC(=O)NCCc1ccccc1O eb5602a4fb6d80eb4b340e466746dc41 [0,1,0,0,0,1|0,0,2]=4 3527 B13R1.158 CC(C)CCNc1c[nH]ccc1=O c9d8fc4b0265044f08596d78834e3cc7 [0,1,0,0,0,1|2,0,0]=4 3528 B13R1.158 CC(C)CCNc1c[nH]ccc1=S 354dd8656f14edd85f0164caaa751b52 [0,1,0,0,0,1|2,0,0]=4 3529 B13R1.158 CC(C)CCNc1ccc[nH]c1=S 53daeced37a48c96b7a1807d92bba5a9 [0,1,0,0,0,1|2,0,0]=4 3530 B13R1.158 CC(C)CCNc1cccc[n+]1[O-] c98f522bc77afc083e7237dff0de93da [0,1,0,0,0,1|2,0,0]=4 3531 B13R1.158 CC(C)CCNc1ccccc1Cl c1cced113eac8843a1b98f35ca82bd40 [0,1,0,0,0,1|1,0,0]=3 3532 B13R1.158 CC(C)CCNc1ccccc1F 799fc9bf9991b819194b5afa9b69d2da [0,1,0,0,0,1|1,0,0]=3 3533 B13R1.158 CC(C)CCNc1ccccc1I 1e1570ef5e35423e415cc60dedd44654 [0,1,0,0,0,1|1,0,0]=3 3534 B13R1.158 CC(C)CCNc1ccccc1S 242e3097e83874be7586e93654d2b938 [0,1,0,0,0,1|1,0,0]=3 3535 B13R1.158 CC(C)CCNc1cccnc1Br 487a91776a1d72144d35628e4fabdec7 [0,1,0,0,0,1|2,0,0]=4 3536 B13R1.158 CC(C)CCNc1cccnc1Cl ec52396165f670db657243977ab90c5e [0,1,0,0,0,1|2,0,0]=4 3537 B13R1.158 CC(C)CCNc1cccnc1F dba5855367f0f1d5e3e5e80b8d1235cf [0,1,0,0,0,1|2,0,0]=4 3538 B13R1.158 CC(C)CCNc1cccnc1I 9f8443bc3a81091ef088ecd8392ae351 [0,1,0,0,0,1|2,0,0]=4 3539 B13R1.158 CC(C)CCNc1ccncc1Br fee92998f69deff658e0e7d5d389e3a0 [0,1,0,0,0,1|2,0,0]=4 3540 B13R1.158 CC(C)CCNc1ccncc1Cl 9d00c206df458ea700b06a79cdb9c405 [0,1,0,0,0,1|2,0,0]=4 3541 B13R1.158 CC(C)CCNc1ccncc1F 6e849ede0271e48bcfe0cbf2ceae8e74 [0,1,0,0,0,1|2,0,0]=4 3542 B13R1.158 CC(C)CCNc1ccncc1I 3dc6b0916a2fc2db12530389e0857eef [0,1,0,0,0,1|2,0,0]=4 3543 B13R1.158 CC(C)CCNc1cnccc1Br 904beefd6d74cdbf63db407776c0c62e [0,1,0,0,0,1|2,0,0]=4 3544 B13R1.158 CC(C)CCNc1cnccc1Cl b39ce8e661bc64b00643cf44811fc960 [0,1,0,0,0,1|2,0,0]=4 3545 B13R1.158 CC(C)CCNc1cnccc1F 5dd645b57d450f5e3b993fc625b2159f [0,1,0,0,0,1|2,0,0]=4 3546 B13R1.158 CC(C)CCNc1cnccc1I ec5c1a27e366e55b33fff46c640bfd89 [0,1,0,0,0,1|2,0,0]=4 3547 B13R1.158 CC(C)CCNc1ncccc1Br d75757e0d958b4a4e15c234a3a79b995 [0,1,0,0,0,1|2,0,0]=4 3548 B13R1.158 CC(C)CCNc1ncccc1Cl aa006b3b3944f1b6ae55764ade63a4c2 [0,1,0,0,0,1|2,0,0]=4 3549 B13R1.158 CC(C)CCNc1ncccc1F 457b7d0b747c16c6e7826f4fd35250fa [0,1,0,0,0,1|2,0,0]=4 3550 B13R1.158 CC(C)CCNc1ncccc1I e008a9783e023966bd8f703167d6385e [0,1,0,0,0,1|2,0,0]=4 3551 B13R1.158 CC(C)CCOc1ccc[nH]c1=S 04017e29c78db08c30436b5e05b05aa8 [0,1,0,0,0,1|2,0,0]=4 3552 B13R1.158 CC(C)CCOc1cccc[n+]1[O-] 63674157976f07e7f6782980473158e8 [0,1,0,0,0,1|2,0,0]=4 3553 B13R1.158 CC(C)CCOc1ccccc1Br bf5b53a1fc6ef7fcd522ad06312eafc2 [0,1,0,0,0,1|1,0,0]=3 3554 B13R1.158 CC(C)CCOc1ccccc1Cl eb6f6839f383dc853b4636c8dd13c302 [0,1,0,0,0,1|1,0,0]=3 3555 B13R1.158 CC(C)CCOc1ccccc1F 416cbe9a4633ded954c018b8866d7921 [0,1,0,0,0,1|1,0,0]=3 3556 B13R1.158 CC(C)CCOc1ccccc1I 34d17ce55e2dcc7706bcfbf8dcb6c59e [0,1,0,0,0,1|1,0,0]=3 3557 B13R1.158 CC(C)CCOc1ccccc1S 9fbcceeabe4723adbd574f7aeb2565a4 [0,1,0,0,0,1|1,0,0]=3 3558 B13R1.158 CC(C)CCOc1cccnc1Br f5484491dda4531f56b30b4be7f6a725 [0,1,0,0,0,1|2,0,0]=4 3559 B13R1.158 CC(C)CCOc1cccnc1Cl cc4c28ca307c159ddd1d96a5813e7769 [0,1,0,0,0,1|2,0,0]=4 3560 B13R1.158 CC(C)CCOc1cccnc1F 90863792373ed77e58034cc71b198406 [0,1,0,0,0,1|2,0,0]=4 3561 B13R1.158 CC(C)CCOc1cccnc1I fd9a37de4e89a950073263a9e234563b [0,1,0,0,0,1|2,0,0]=4 3562 B13R1.158 CC(C)CCOc1cccoc1=O 2e90de65eff9a7e21356d216b31b804d [0,1,0,0,0,1|2,0,0]=4 3563 B13R1.158 CC(C)CCOc1ccncc1Br 5b37ff427d71f96223ad4c244f6e68c1 [0,1,0,0,0,1|2,0,0]=4 3564 B13R1.158 CC(C)CCOc1ccncc1Cl b40a272308d9e4c14d86173a6d48c50c [0,1,0,0,0,1|2,0,0]=4 3565 B13R1.158 CC(C)CCOc1ccncc1F 21d6fa19d149e30957b02076b8ed1b9e [0,1,0,0,0,1|2,0,0]=4 3566 B13R1.158 CC(C)CCOc1cnccc1Br 42cedc96cf6bab9c74fbbb1c4cfc6f2e [0,1,0,0,0,1|2,0,0]=4 3567 B13R1.158 CC(C)CCOc1cnccc1Cl 527d4fc595dd6b84e0899aa67d267bd0 [0,1,0,0,0,1|2,0,0]=4 3568 B13R1.158 CC(C)CCOc1cnccc1F a8ca60dce12bd754bffedd22904defc8 [0,1,0,0,0,1|2,0,0]=4 3569 B13R1.158 CC(C)CCOc1cnccc1I 82da4383feb37a8c9fa6a2252fbbecb0 [0,1,0,0,0,1|2,0,0]=4 3570 B13R1.158 CC(C)CCOc1coccc1=O 9b687abd37b54ef7e8dd9620f813bb72 [0,1,0,0,0,1|2,0,0]=4 3571 B13R1.158 CC(C)CCOc1ncccc1Br 7c9319ff1e6202c253253c9d5025b7ed [0,1,0,0,0,1|2,0,0]=4 3572 B13R1.158 CC(C)CCOc1ncccc1Cl 85bbe995ba7d764702a58c0761d1cd2f [0,1,0,0,0,1|2,0,0]=4 3573 B13R1.158 CC(C)CCOc1ncccc1F bcfcbe43c323e8fdbbe3d79b47ccc728 [0,1,0,0,0,1|2,0,0]=4 3574 B13R1.158 CC(C)CCOn1ccccc1=N 206ac52be05d53d39c55270bdfc973f5 [0,1,0,0,0,1|2,0,0]=4 3575 B13R1.158 CC(C)CCOn1ccccc1=O 34b99f39cc2aaa7a521b7463523afeb5 [0,1,0,0,0,1|2,0,0]=4 3576 B13R1.158 CC(C)CCOn1ccccc1=S 4154660bf3a9b75bf3b3f736f53d9f3a [0,1,0,0,0,1|2,0,0]=4 3577 B13R1.158 CC(C)CNCc1cccc[n+]1[O-] 2d159e540f31912e4a5ed7eff52c4feb [0,1,0,0,0,1|2,0,0]=4 3578 B13R1.158 CC(C)CNCc1ccccc1Br 2d17535b24355d2c6cdee923e7f4c984 [0,1,0,0,0,1|1,0,0]=3 3579 B13R1.158 CC(C)CNCc1ccccc1Cl 20b28b20108c4bd613f67035042b910e [0,1,0,0,0,1|1,0,0]=3 3580 B13R1.158 CC(C)CNCc1ccccc1F 91d65ed1b88dd5c1a5ae856c03877a60 [0,1,0,0,0,1|1,0,0]=3 3581 B13R1.158 CC(C)CNCc1ccccc1I 1b21b5a987d32c91f0fb14ce32d11ae8 [0,1,0,0,0,1|1,0,0]=3 3582 B13R1.158 CC(C)CNCc1cccnc1Br 8f52400a1f8ca3bc3a2fa59bc425432f [0,1,0,0,0,1|2,0,0]=4 3583 B13R1.158 CC(C)CNCc1cccnc1Cl e1335a6ba88fa535d49ad613a03882ed [0,1,0,0,0,1|2,0,0]=4 3584 B13R1.158 CC(C)CNCc1cccnc1F 7ffca3c4ea2f11da66949294bc8305de [0,1,0,0,0,1|2,0,0]=4 3585 B13R1.158 CC(C)CNCc1ccncc1Br 8ef28ac396a74e6119c193b397b86674 [0,1,0,0,0,1|2,0,0]=4 3586 B13R1.158 CC(C)CNCc1ccncc1Cl 25df4a3303869f676eb916558ce79102 [0,1,0,0,0,1|2,0,0]=4 3587 B13R1.158 CC(C)CNCc1ccncc1F ddd920605024e0f83e0b1a9b2c3ea5cd [0,1,0,0,0,1|2,0,0]=4 3588 B13R1.158 CC(C)CNCc1ncccc1Br 4d1e7014cefc4f754ab5fe06588053bd [0,1,0,0,0,1|2,0,0]=4 3589 B13R1.158 CC(C)CNCc1ncccc1Cl cf4a993f7b83a99ad860a974f6ff7391 [0,1,0,0,0,1|2,0,0]=4 3590 B13R1.158 CC(C)CNCc1ncccc1F a5959181dd6151e13a620576fb5fdec4 [0,1,0,0,0,1|2,0,0]=4 3591 B13R1.158 CC(C)COCc1ccc[nH]c1=O 0c8e1c5e87b4c22c6f38ca1f2ee62512 [0,1,0,0,0,1|2,0,0]=4 3592 B13R1.158 CC(C)COCc1cccc[n+]1[O-] 3441d9c50d9766a37a12b2a344a26554 [0,1,0,0,0,1|2,0,0]=4 3593 B13R1.158 CC(C)COCc1ccccc1Br 4adcb21bd966903404afa9bc641a135b [0,1,0,0,0,1|1,0,0]=3 3594 B13R1.158 CC(C)COCc1ccccc1Cl fda3346050c9328c64c0f3843f4ca8ed [0,1,0,0,0,1|1,0,0]=3 3595 B13R1.158 CC(C)COCc1ccccc1F 429d30f7e4641796b5d64c80785e9ec1 [0,1,0,0,0,1|1,0,0]=3 3596 B13R1.158 CC(C)COCc1ccccc1I ec0323607c9555babd466a01c77262c6 [0,1,0,0,0,1|1,0,0]=3 3597 B13R1.158 CC(C)COCc1ccccc1S 14a5b7cb6a7179e4040a572b2e57b298 [0,1,0,0,0,1|1,0,0]=3 3598 B13R1.158 CC(C)COCc1cccnc1Br 873827c77df96758b3af78b9d5e03f73 [0,1,0,0,0,1|2,0,0]=4 3599 B13R1.158 CC(C)COCc1cccnc1Cl ab998e1f7dc90aeb3609be30ca0ae9fd [0,1,0,0,0,1|2,0,0]=4 3600 B13R1.158 CC(C)COCc1cccnc1F 3b1c0cabbc891655c45d16e87cbda0ea [0,1,0,0,0,1|2,0,0]=4 3601 B13R1.158 CC(C)COCc1ccncc1Br f34a551b401a52df092d84703dc002f0 [0,1,0,0,0,1|2,0,0]=4 3602 B13R1.158 CC(C)COCc1ccncc1Cl 0269fd678dc9009d3a13702e1d8025ce [0,1,0,0,0,1|2,0,0]=4 3603 B13R1.158 CC(C)COCc1ccncc1F e7b6f8e0ee7ec6f8fdc15272ebfb0ff7 [0,1,0,0,0,1|2,0,0]=4 3604 B13R1.158 CC(C)COCc1ccncc1I d0f4b32b83c4ae1db102a82f364566a1 [0,1,0,0,0,1|2,0,0]=4 3605 B13R1.158 CC(C)COCc1cnccc1Br c82b85c64033ab06cb9044ab9be91c45 [0,1,0,0,0,1|2,0,0]=4 3606 B13R1.158 CC(C)COCc1cnccc1Cl 0f822aa9f13d5a35d0db0c25a2c54faa [0,1,0,0,0,1|2,0,0]=4 3607 B13R1.158 CC(C)COCc1cnccc1F 8d2a6b8b40011e0fb0fa2fe1663c2498 [0,1,0,0,0,1|2,0,0]=4 3608 B13R1.158 CC(C)COCc1ncccc1Br d146a39c530e2dee6d18b1dd3eac3274 [0,1,0,0,0,1|2,0,0]=4 3609 B13R1.158 CC(C)COCc1ncccc1Cl 889dcb259cb4b26b323c6bcfff69461f [0,1,0,0,0,1|2,0,0]=4 3610 B13R1.158 CC(C)COCc1ncccc1F f98a5aad8c49c4f41702de005b09e6a1 [0,1,0,0,0,1|2,0,0]=4 3611 B13R1.158 CC(C)NCCc1ccccc1Cl cc1ed481e29ef72030e5f44c363c1dd2 [0,1,0,0,0,1|1,0,0]=3 3612 B13R1.158 CC(C)NCCc1ccccc1F 116fa100bcea44eff2242136c9cf26fc [0,1,0,0,0,1|1,0,0]=3 3613 B13R1.158 CC(C)NCCc1ncccc1Br 755291b2488573f33f2bee64079b7734 [0,1,0,0,0,1|2,0,0]=4 3614 B13R1.158 CC(C)NCCn1ccccc1=O 9bb775e063c5b6fc888b3325415e9b95 [0,1,0,0,0,1|2,0,0]=4 3615 B13R1.158 CC(C)OCCc1ccccc1Cl a46b59603348b7552d663dc636652d10 [0,1,0,0,0,1|1,0,0]=3 3616 B13R1.158 CC(C)OCCc1ccccc1F 7f5baca07294020c29c0ecec6d51509e [0,1,0,0,0,1|1,0,0]=3 3617 B13R1.158 CC(C)OCCc1ccccc1I d7d8e103f6d39e596cf6e8fc305c6b06 [0,1,0,0,0,1|1,0,0]=3 3618 B13R1.158 CC(C)OCCc1ccncc1Cl 8abce60532b2d6b575c9f9224e5efdb9 [0,1,0,0,0,1|2,0,0]=4 3619 B13R1.158 CC(C)OCCc1ccncc1F 77d73ce6ef3e4c2f9ab90d5d3778c82b [0,1,0,0,0,1|2,0,0]=4 3620 B13R1.158 CC(C)OCCc1ncccc1F a0ca5aa617d8c948f81615d8845f0ff6 [0,1,0,0,0,1|2,0,0]=4 3621 B13R1.158 CC(C)OCCn1ccccc1=O c5ff206e233b15089483f45ac8863c59 [0,1,0,0,0,1|2,0,0]=4 3622 B13R1.158 CC(C)OCNc1ccccc1Cl a9dea7a76be0bc0885baa8ceb928a7b4 [0,1,0,0,0,1|2,0,0]=4 3623 B13R1.158 CC(C)OCNc1ccccc1F ed51dabffae8e90bf2181c1127a78b76 [0,1,0,0,0,1|2,0,0]=4 3624 B13R1.158 CC(C)OCNc1ccccc1I 9ffaf4749421f2de63bda733dae77ca2 [0,1,0,0,0,1|2,0,0]=4 3625 B13R1.158 CC(C)OCOc1ccccc1Cl b1b95548ce864b6590e906f73e69a4e2 [0,1,0,0,0,1|2,0,0]=4 3626 B13R1.158 CC(C)OCOc1ccccc1I f00e715432cb06d3b4a3fad2be1f10a2 [0,1,0,0,0,1|2,0,0]=4 3627 B13R1.158 CC(F)COCc1cccc[n+]1[O-] a2f311b74988180015bb8b5a4068ec07 [0,1,0,0,0,1|2,0,0]=4 3628 B13R1.158 CC(F)COCc1ccccc1Cl 1b3d653936bf5c67f9d7549723f4a292 [0,1,0,0,0,1|1,0,0]=3 3629 B13R1.158 CC(F)COCc1ccccc1F b43529feebae94582cfeedcb7e2dced0 [0,1,0,0,0,1|1,0,0]=3 3630 B13R1.158 CC(F)COCc1ccccc1I 5d5299f22c1739107a321ccbb66d9105 [0,1,0,0,0,1|1,0,0]=3 3631 B13R1.158 CC(F)COCc1cccnc1Br 1488697be67ebd3b568bdee017f32a04 [0,1,0,0,0,1|2,0,0]=4 3632 B13R1.158 CC(F)COCc1cccnc1Cl c51c95244919a1b785a34a65a5d0705b [0,1,0,0,0,1|2,0,0]=4 3633 B13R1.158 CC(F)COCc1cccnc1F b8a9b6c58a7ab10b3e08ec43eef3454e [0,1,0,0,0,1|2,0,0]=4 3634 B13R1.158 CC(F)COCc1ccncc1Cl 529f030f7ecb051867cd104cdb309333 [0,1,0,0,0,1|2,0,0]=4 3635 B13R1.158 CC(F)COCc1ccncc1F ccea2ff556d6595aaa759409d50f1ed8 [0,1,0,0,0,1|2,0,0]=4 3636 B13R1.158 CC(F)COCc1ncccc1Br d7841d50b8051b6edec5b0c7559b3b4d [0,1,0,0,0,1|2,0,0]=4 3637 B13R1.158 CC(F)COCc1ncccc1Cl 5d8981fdf4c61aaaf38f40d008de4841 [0,1,0,0,0,1|2,0,0]=4 3638 B13R1.158 CC(F)COCc1ncccc1F fa8f867fcc43862b9b10effe1c1948ce [0,1,0,0,0,1|2,0,0]=4 3639 B13R1.158 CC(O)CCNc1c[nH]ccc1=O e2da312ff32ae370dee2fcb12cba3cee [0,1,0,0,0,1|1,0,0]=3 3640 B13R1.158 CC(O)CCNc1c[nH]cnc1=O 413a11a26fc5e19e26d6dbdc413aa019 [0,1,0,0,0,1|2,0,0]=4 3641 B13R1.158 CC(O)CCNc1ccc[nH]c1=S 8206a66433e535ea5b306164e0fa775f [0,1,0,0,0,1|1,0,0]=3 3642 B13R1.158 CC(O)CCNc1cccc[n+]1[O-] f14629c537ab11ae4d0e349442e2ba4f [0,1,0,0,0,1|1,0,0]=3 3643 B13R1.158 CC(O)CCNc1ccccc1Cl c3caa9fb52a237f2ab7bac0076e96288 [0,1,0,0,0,1|0,0,0]=2 3644 B13R1.158 CC(O)CCNc1ccccc1F 91abc0ca2d0abb7476769a6adab31a1e [0,1,0,0,0,1|0,0,0]=2 3645 B13R1.158 CC(O)CCNc1ccccc1I 872391b465582e8a028662171a587c48 [0,1,0,0,0,1|0,0,0]=2 3646 B13R1.158 CC(O)CCNc1ccccc1S 33348ebda76ff1a9e90cbc1bd6e5c4a9 [0,1,0,0,0,1|0,0,0]=2 3647 B13R1.158 CC(O)CCNc1cccnc1Br e936d7c7bb01388e63ca56a5d538602d [0,1,0,0,0,1|1,0,0]=3 3648 B13R1.158 CC(O)CCNc1cccnc1Cl 9708410749ff19aa6a926da4bf95e8c2 [0,1,0,0,0,1|1,0,0]=3 3649 B13R1.158 CC(O)CCNc1cccnc1F 6b34d15c1502f062f3b2fff5cdc94cd4 [0,1,0,0,0,1|1,0,0]=3 3650 B13R1.158 CC(O)CCNc1cccnc1I 07c32ac6ffd054f393f9ae72cd39ca0e [0,1,0,0,0,1|1,0,0]=3 3651 B13R1.158 CC(O)CCNc1ccn[nH]c1=O fd79acff4ba70cd55eedf0cfc93c1384 [0,1,0,0,0,1|2,0,0]=4 3652 B13R1.158 CC(O)CCNc1ccn[nH]c1=S 054d43fa95b33b710c3ef4d83fc7134a [0,1,0,0,0,1|2,0,0]=4 3653 B13R1.158 CC(O)CCNc1ccncc1Br 5b1acce0bf5965713ce0269e24fedd09 [0,1,0,0,0,1|1,0,0]=3 3654 B13R1.158 CC(O)CCNc1ccncc1Cl 3b0f1d34b1bf696315b22cd0028e18d8 [0,1,0,0,0,1|1,0,0]=3 3655 B13R1.158 CC(O)CCNc1ccncc1F f07689de231968bb63f2eb45a27576e8 [0,1,0,0,0,1|1,0,0]=3 3656 B13R1.158 CC(O)CCNc1ccncc1I 111aac712769960169ac95651cfac2c9 [0,1,0,0,0,1|1,0,0]=3 3657 B13R1.158 CC(O)CCNc1ccnnc1Br 2335940269bc4d16bc71499d2783ca95 [0,1,0,0,0,1|2,0,0]=4 3658 B13R1.158 CC(O)CCNc1ccnnc1Cl 392ed22398357b55f51945d4095247c9 [0,1,0,0,0,1|2,0,0]=4 3659 B13R1.158 CC(O)CCNc1cnccc1Br b70d7c9b250fef70d26ec95cc0e1b6a9 [0,1,0,0,0,1|1,0,0]=3 3660 B13R1.158 CC(O)CCNc1cnccc1Cl 5910b27ac9514d1c9f0b2bfb1134f008 [0,1,0,0,0,1|1,0,0]=3 3661 B13R1.158 CC(O)CCNc1cnccc1F a785206805d2d1fc627f69c017e81021 [0,1,0,0,0,1|1,0,0]=3 3662 B13R1.158 CC(O)CCNc1cnccc1I 1f81ed0564ead4503cecca45c190e0af [0,1,0,0,0,1|1,0,0]=3 3663 B13R1.158 CC(O)CCNc1cnccc1S 825570dcec8db7b1621f7c10b79d80bb [0,1,0,0,0,1|1,0,0]=3 3664 B13R1.158 CC(O)CCNc1cncnc1Br 63e9b2918b22dcc173794e35c400fec5 [0,1,0,0,0,1|2,0,0]=4 3665 B13R1.158 CC(O)CCNc1cncnc1Cl aaa6d4f5b0c8392d4aead252ac2e28cc [0,1,0,0,0,1|2,0,0]=4 3666 B13R1.158 CC(O)CCNc1cncnc1I c1eac354d60f9a010456d7c1bcc7a256 [0,1,0,0,0,1|2,0,0]=4 3667 B13R1.158 CC(O)CCNc1cnncc1Br dc8945354fabcb3a2d0a32e180cff5bd [0,1,0,0,0,1|2,0,0]=4 3668 B13R1.158 CC(O)CCNc1cnncc1Cl bd07a90d0b1b3ef475508b0072483562 [0,1,0,0,0,1|2,0,0]=4 3669 B13R1.158 CC(O)CCNc1ncc[nH]c1=O 3efbe719f6b7e227dd5bce124b25b65f [0,1,0,0,0,1|2,0,0]=4 3670 B13R1.158 CC(O)CCNc1ncccc1Br c4a0b64de456e7550a66bf607a628a25 [0,1,0,0,0,1|1,0,0]=3 3671 B13R1.158 CC(O)CCNc1ncccc1Cl 152a16c432edc6730471d6cabe1078e5 [0,1,0,0,0,1|1,0,0]=3 3672 B13R1.158 CC(O)CCNc1ncccc1F 7000ac892f74b039281b3318fbb84886 [0,1,0,0,0,1|1,0,0]=3 3673 B13R1.158 CC(O)CCNc1ncccc1I ce9bb4c809c200db55d31ca39c1a0abd [0,1,0,0,0,1|1,0,0]=3 3674 B13R1.158 CC(O)CCNc1nccnc1Br ef9c94a12363f289d1e4b193dd041e74 [0,1,0,0,0,1|2,0,0]=4 3675 B13R1.158 CC(O)CCNc1nccnc1Cl 94e25847463ecf6423fcbcf639d3cae9 [0,1,0,0,0,1|2,0,0]=4 3676 B13R1.158 CC(O)CCNc1nccnc1I 53a61fb977af8bbed1365822d4da3660 [0,1,0,0,0,1|2,0,0]=4 3677 B13R1.158 CC(O)CCNc1ncncc1Br f13b72e123baf8612726cef52abde00e [0,1,0,0,0,1|2,0,0]=4 3678 B13R1.158 CC(O)CCNc1ncncc1Cl 55c9aaac2b1554297131241ceacd88c6 [0,1,0,0,0,1|2,0,0]=4 3679 B13R1.158 CC(O)CCNc1ncncc1F c32416a422ccc15816433367133a8c62 [0,1,0,0,0,1|2,0,0]=4 3680 B13R1.158 CC(O)CCNc1ncncc1I 2e7f688181090fdfc4fec9bbaa8364b5 [0,1,0,0,0,1|2,0,0]=4 3681 B13R1.158 CC(O)CNCc1cccc[n+]1[O-] bcde407eb81fc956f4cab52b99bfa7fd [0,1,0,0,0,1|1,0,0]=3 3682 B13R1.158 CC(O)CNCc1ccccc1Br 413d3daff92f8cc55e3ba330d7c0c9e9 [0,1,0,0,0,1|0,0,0]=2 3683 B13R1.158 CC(O)CNCc1ccccc1Cl e6947468542ef26a1792e02fdee46b4a [0,1,0,0,0,1|0,0,0]=2 3684 B13R1.158 CC(O)CNCc1ccccc1F 02a3ed0a085689ca813f610238397c39 [0,1,0,0,0,1|0,0,0]=2 3685 B13R1.158 CC(O)CNCc1ccccc1I 5ad7e9d53b123e46daba5e0f5a622cc8 [0,1,0,0,0,1|0,0,0]=2 3686 B13R1.158 CC(O)CNCc1cccnc1Br de093f72bd66dc208e6093d42cf62841 [0,1,0,0,0,1|1,0,0]=3 3687 B13R1.158 CC(O)CNCc1cccnc1Cl a213eea15b2a4da69cd1df5c970c048c [0,1,0,0,0,1|1,0,0]=3 3688 B13R1.158 CC(O)CNCc1cccnc1F f581a1b87569f26f2f15891f553da557 [0,1,0,0,0,1|1,0,0]=3 3689 B13R1.158 CC(O)CNCc1ccncc1Br 0d8f875fc69c042bf652d25c4c9ac6d9 [0,1,0,0,0,1|1,0,0]=3 3690 B13R1.158 CC(O)CNCc1ccncc1Cl 157dfcbff6b83b9919c1fdf71b54ce41 [0,1,0,0,0,1|1,0,0]=3 3691 B13R1.158 CC(O)CNCc1ccncc1F 950ceea7da1533b6254108a5c5325ea3 [0,1,0,0,0,1|1,0,0]=3 3692 B13R1.158 CC(O)CNCc1ncccc1Br 5e2ff8fb15288bc3593cdb944f3c0814 [0,1,0,0,0,1|1,0,0]=3 3693 B13R1.158 CC(O)CNCc1ncccc1Cl c009ccc1356908f47db148bd279356e5 [0,1,0,0,0,1|1,0,0]=3 3694 B13R1.158 CC(O)CNCc1ncccc1F 183891a477a7ef01131cbd0be48c2dc2 [0,1,0,0,0,1|1,0,0]=3 3695 B13R1.158 CC(O)CNCc1nccnc1Cl d8087493c228d60b64a3f089af0d4bdc [0,1,0,0,0,1|2,0,0]=4 3696 B13R1.158 CC(S)COCc1cccc[n+]1[O-] 2f210d499381b34de56fd6f3a3c73ba7 [0,1,0,0,0,1|1,1,0]=4 3697 B13R1.158 CC(S)COCc1ccccc1Br 8450876f73f6ba97083c0970b540fd7d [0,1,0,0,0,1|0,1,0]=3 3698 B13R1.158 CC(S)COCc1ccccc1Cl 785bf2e3c71cbb906fc44e0c823d71d2 [0,1,0,0,0,1|0,1,0]=3 3699 B13R1.158 CC(S)COCc1ccccc1F c1c258f29fd414dfed30e3d9e0bbf5c4 [0,1,0,0,0,1|0,1,0]=3 3700 B13R1.158 CC(S)COCc1ccccc1I b3f6f2e0ed3e18fa1d7e52610ab67194 [0,1,0,0,0,1|0,1,0]=3 3701 B13R1.158 CC(S)COCc1cccnc1Br 0dd8aea3fb99be156dcf861e88012d20 [0,1,0,0,0,1|1,1,0]=4 3702 B13R1.158 CC(S)COCc1cccnc1Cl 0a5e3f66d912d9e816f0687d579bd584 [0,1,0,0,0,1|1,1,0]=4 3703 B13R1.158 CC(S)COCc1cccnc1F ace1f6a8c095052454244ed179e9342f [0,1,0,0,0,1|1,1,0]=4 3704 B13R1.158 CC(S)COCc1ccncc1Cl f85cc509af1ff5d35783d821c68e21c2 [0,1,0,0,0,1|1,1,0]=4 3705 B13R1.158 CC(S)COCc1ccncc1F 75663f00519cadd53300bbbe94e41c58 [0,1,0,0,0,1|1,1,0]=4 3706 B13R1.158 CC(S)COCc1ncccc1Br dff87858b79867712144417cee9d6923 [0,1,0,0,0,1|1,1,0]=4 3707 B13R1.158 CC(S)COCc1ncccc1Cl 5ba3c4478278106319e404823ddcd741 [0,1,0,0,0,1|1,1,0]=4 3708 B13R1.158 CC(S)COCc1ncccc1F 2f9d7c2e17de8242597e3323e3a1a077 [0,1,0,0,0,1|1,1,0]=4 3709 B13R1.158 CN(C)CCNc1ccccc1Cl ed2b6a9e0b05102ba8fb2d1c7729ef0b [0,1,0,0,0,1|2,0,0]=4 3710 B13R1.158 CN(C)CCNc1ccccc1I c05eb93d883e4b21ea246b47bf20fd96 [0,1,0,0,0,1|2,0,0]=4 3711 B13R1.158 CN(C)CCOc1ccccc1Br 36ab9817ecec46ae5f819ca425c18699 [0,1,0,0,0,1|2,0,0]=4 3712 B13R1.158 CN(C)CCOc1ccccc1Cl f787e0d21fac62fce7f1fa3ef250bd8a [0,1,0,0,0,1|2,0,0]=4 3713 B13R1.158 CN(C)CCOc1ccccc1F d7bd58e9d43f2ca205402a2f61edc6f5 [0,1,0,0,0,1|2,0,0]=4 3714 B13R1.158 CN(C)CNCc1ccccc1Br 5cc7a145ea978a9575e2019e5d6a0ef3 [0,1,0,0,0,1|2,0,0]=4 3715 B13R1.158 CN(C)CNCc1ccccc1Cl fceeebae03b4fbc304fe1301feafd1fb [0,1,0,0,0,1|2,0,0]=4 3716 B13R1.158 CN(C)CNCc1ccccc1F e0b55791d1eae102a0052b68a8d2f981 [0,1,0,0,0,1|2,0,0]=4 3717 B13R1.158 CN(C)CNCc1ccccc1I f63c8fd557d5e5c73713c9298d14e350 [0,1,0,0,0,1|2,0,0]=4 3718 B13R1.158 CN(C)COCc1ccccc1Cl bd1ef0a6dea2700f5fd64142a1ae1a99 [0,1,0,0,0,1|2,0,0]=4 3719 B13R1.158 CN(C)COCc1ccccc1F e014677bd68ee98522ae84f2871c81b0 [0,1,0,0,0,1|2,0,0]=4 3720 B13R1.158 CN(C)COCc1ccccc1I fdcaa1f779662f9c97010be91b8b9624 [0,1,0,0,0,1|2,0,0]=4 3721 B13R1.158 CS(=O)CCNc1ccccc1Cl 44fd9ad8ab9927f2f9de57648674297e [0,1,0,0,0,1|1,0,1]=4 3722 B13R1.158 CS(=O)CCNc1ccccc1F 1193b13ddf3d74f386cf8eb5ee150955 [0,1,0,0,0,1|1,0,1]=4 3723 B13R1.158 CS(=O)CCNc1ccccc1I 396a2ec1186623e80f8c742c92aa5be5 [0,1,0,0,0,1|1,0,1]=4 3724 B13R1.158 CS(=O)CCOc1ccccc1Cl 7a42344b63b04a9a37de105b1c950211 [0,1,0,0,0,1|1,0,1]=4 3725 B13R1.158 CS(=O)CCOc1ccccc1F 733ff13a9cbee8cf2e485f0824760b6d [0,1,0,0,0,1|1,0,1]=4 3726 B13R1.158 C[C@@H](F)COCc1cccc[n+]1[O-] d2873c07d7b753c8389e29ec8e0cc5f6 [0,1,0,0,0,1|2,0,0]=4 3727 B13R1.158 C[C@@H](F)COCc1ccccc1Cl e3fc71228144c0b967c7546ab2f57150 [0,1,0,0,0,1|1,0,0]=3 3728 B13R1.158 C[C@@H](F)COCc1ccccc1F b263a8888df53e0c4a0a9c8b7746368c [0,1,0,0,0,1|1,0,0]=3 3729 B13R1.158 C[C@@H](F)COCc1ccccc1I 5c9526e1519b9144d725a57e2610bdbc [0,1,0,0,0,1|1,0,0]=3 3730 B13R1.158 C[C@@H](F)COCc1cccnc1Br 765eb33d3b7ec711eae10a21f3bcb0af [0,1,0,0,0,1|2,0,0]=4 3731 B13R1.158 C[C@@H](F)COCc1cccnc1Cl 3dd4b1de39eafe7bf03171dfe68ac4e8 [0,1,0,0,0,1|2,0,0]=4 3732 B13R1.158 C[C@@H](F)COCc1cccnc1F 706fc0c000abce9920c359f4ef3cba79 [0,1,0,0,0,1|2,0,0]=4 3733 B13R1.158 C[C@@H](F)COCc1ccncc1Cl 551501406bbdeef79365baeb3339a09c [0,1,0,0,0,1|2,0,0]=4 3734 B13R1.158 C[C@@H](F)COCc1ccncc1F b423adc49415978fcc638c895dc478e3 [0,1,0,0,0,1|2,0,0]=4 3735 B13R1.158 C[C@@H](F)COCc1ncccc1Br 431c3a658d47adae92720fd692d7e7b5 [0,1,0,0,0,1|2,0,0]=4 3736 B13R1.158 C[C@@H](F)COCc1ncccc1Cl 6a6c57173a11f3ffa7c7b2c367bd4bec [0,1,0,0,0,1|2,0,0]=4 3737 B13R1.158 C[C@@H](F)COCc1ncccc1F dc6b58aa1b0a698fecdc886cea4991ca [0,1,0,0,0,1|2,0,0]=4 3738 B13R1.158 C[C@@H](O)CCNc1c[nH]ccc1=O 0bd2a362abbbc49fc351b6053068e571 [0,1,0,0,0,1|1,0,0]=3 3739 B13R1.158 C[C@@H](O)CCNc1c[nH]ccc1=S 1d716e56bf867eabd78964663d146ba4 [0,1,0,0,0,1|1,0,0]=3 3740 B13R1.158 C[C@@H](O)CCNc1cccc[n+]1[O-] 2d1d2e748a8dd7b8db847425abd90cc3 [0,1,0,0,0,1|1,0,0]=3 3741 B13R1.158 C[C@@H](O)CCNc1cccnc1S ca152dd48fd24f305b5d9ab24899fee3 [0,1,0,0,0,1|1,0,0]=3 3742 B13R1.158 C[C@@H](O)CCNc1cnccc1F 421f274fd1c635b9904b9e571e5ef8dc [0,1,0,0,0,1|1,0,0]=3 3743 B13R1.158 C[C@@H](O)CCNc1ncc[nH]c1=O 987bad1351b39ea9e63a1e1a04a35993 [0,1,0,0,0,1|2,0,0]=4 3744 B13R1.158 C[C@@H](O)CNCc1cccc[n+]1[O-] f979832b503eacf7fc0874cf58583286 [0,1,0,0,0,1|1,0,0]=3 3745 B13R1.158 C[C@@H](O)CNCc1ccccc1Br 918f2e816c796b900847e721c06d7d73 [0,1,0,0,0,1|0,0,0]=2 3746 B13R1.158 C[C@@H](O)CNCc1ccccc1Cl d393105c300a830d2c2bd5941489c025 [0,1,0,0,0,1|0,0,0]=2 3747 B13R1.158 C[C@@H](O)CNCc1ccccc1F 53f8822f5e5d46fd99ad188c8d247bd0 [0,1,0,0,0,1|0,0,0]=2 3748 B13R1.158 C[C@@H](O)CNCc1ccccc1I 9512361bf1a630808f7c9d278abded63 [0,1,0,0,0,1|0,0,0]=2 3749 B13R1.158 C[C@@H](O)CNCc1cccnc1Br 8059cc00834728fc69be326b3f055cbe [0,1,0,0,0,1|1,0,0]=3 3750 B13R1.158 C[C@@H](O)CNCc1cccnc1Cl d2068952f8330a432c0a815e33537cff [0,1,0,0,0,1|1,0,0]=3 3751 B13R1.158 C[C@@H](O)CNCc1cccnc1F 002a2c9c87707ffe3ca33652fcbb5fd4 [0,1,0,0,0,1|1,0,0]=3 3752 B13R1.158 C[C@@H](O)CNCc1ccncc1Br 70261a6586e38a32376348574e3d7296 [0,1,0,0,0,1|1,0,0]=3 3753 B13R1.158 C[C@@H](O)CNCc1ccncc1Cl 6ccc053f281afc052f16d2850ba50388 [0,1,0,0,0,1|1,0,0]=3 3754 B13R1.158 C[C@@H](O)CNCc1ccncc1F 301348792933246b1284eab24b24b0ef [0,1,0,0,0,1|1,0,0]=3 3755 B13R1.158 C[C@@H](O)CNCc1ncccc1Br dd6d43ebc936a4120d6302ae668ee291 [0,1,0,0,0,1|1,0,0]=3 3756 B13R1.158 C[C@@H](O)CNCc1ncccc1Cl dc3e8dd126ff51a9fd5da0e968b5fa3f [0,1,0,0,0,1|1,0,0]=3 3757 B13R1.158 C[C@@H](O)CNCc1ncccc1F 908d1f38212657b11d2559c8d070c2fd [0,1,0,0,0,1|1,0,0]=3 3758 B13R1.158 C[C@@H](O)CNCc1nccnc1Cl 210aae1bfad118a438d3bf71de358217 [0,1,0,0,0,1|2,0,0]=4 3759 B13R1.158 C[C@H](F)COCc1cccc[n+]1[O-] d5b6c13fe462687c9271789ce2205aed [0,1,0,0,0,1|2,0,0]=4 3760 B13R1.158 C[C@H](F)COCc1ccccc1Cl 627ea801010f0a6132b1bb4b320694aa [0,1,0,0,0,1|1,0,0]=3 3761 B13R1.158 C[C@H](F)COCc1ccccc1F 72a6b1051218c0a5766643a40e1146d0 [0,1,0,0,0,1|1,0,0]=3 3762 B13R1.158 C[C@H](F)COCc1ccccc1I d22f3864237cecaadf59342bb3450458 [0,1,0,0,0,1|1,0,0]=3 3763 B13R1.158 C[C@H](F)COCc1cccnc1Br 7156dfae31adfe4430c8a9a352cba0fb [0,1,0,0,0,1|2,0,0]=4 3764 B13R1.158 C[C@H](F)COCc1cccnc1Cl a3eed995dc97871c5d6a4ca94e3de53c [0,1,0,0,0,1|2,0,0]=4 3765 B13R1.158 C[C@H](F)COCc1cccnc1F 3527f7f13627955a25b7e00d1b60ede1 [0,1,0,0,0,1|2,0,0]=4 3766 B13R1.158 C[C@H](F)COCc1ccncc1Cl dccf39145debbf8ff8a2fb9ccb31b199 [0,1,0,0,0,1|2,0,0]=4 3767 B13R1.158 C[C@H](F)COCc1ccncc1F 8f6e67b4235620730364e4b3710cc749 [0,1,0,0,0,1|2,0,0]=4 3768 B13R1.158 C[C@H](F)COCc1ncccc1Br 6f8ea389f5182f32589c30b533917f47 [0,1,0,0,0,1|2,0,0]=4 3769 B13R1.158 C[C@H](F)COCc1ncccc1Cl 171cc62e4537a9d50685146968ffa767 [0,1,0,0,0,1|2,0,0]=4 3770 B13R1.158 C[C@H](F)COCc1ncccc1F d5f13001840bb97684deed5d22aad333 [0,1,0,0,0,1|2,0,0]=4 3771 B13R1.158 C[C@H](O)CCNc1c[nH]ccc1=O b76b84c9d15ef2b8455f02a723e04b08 [0,1,0,0,0,1|1,0,0]=3 3772 B13R1.158 C[C@H](O)CCNc1c[nH]ccc1=S b06bde954ce1530af079f28e40bf25a0 [0,1,0,0,0,1|1,0,0]=3 3773 B13R1.158 C[C@H](O)CCNc1cccc[n+]1[O-] 2b46f26309b69ac17422895b65fb2432 [0,1,0,0,0,1|1,0,0]=3 3774 B13R1.158 C[C@H](O)CCNc1cccnc1S 2a33b2b587fa184cf295c1b91768642a [0,1,0,0,0,1|1,0,0]=3 3775 B13R1.158 C[C@H](O)CCNc1cnccc1F c4640a58d366b0f496a11bdc36229c64 [0,1,0,0,0,1|1,0,0]=3 3776 B13R1.158 C[C@H](O)CCNc1ncc[nH]c1=O ccce8d90d31655d2f05c2e42ae0c006d [0,1,0,0,0,1|2,0,0]=4 3777 B13R1.158 C[C@H](O)CNCc1cccc[n+]1[O-] 192dbb1fe7e60c78d329d431164a31aa [0,1,0,0,0,1|1,0,0]=3 3778 B13R1.158 C[C@H](O)CNCc1ccccc1Br 6a65bc5095f2709be035b09e34b2272c [0,1,0,0,0,1|0,0,0]=2 3779 B13R1.158 C[C@H](O)CNCc1ccccc1Cl 9d127214782c796d8ca132e8650e2d99 [0,1,0,0,0,1|0,0,0]=2 3780 B13R1.158 C[C@H](O)CNCc1ccccc1F 10fff265b9422777ceba5d323c936a7c [0,1,0,0,0,1|0,0,0]=2 3781 B13R1.158 C[C@H](O)CNCc1ccccc1I 484524c8d5c927635712b8636cdcbd24 [0,1,0,0,0,1|0,0,0]=2 3782 B13R1.158 C[C@H](O)CNCc1cccnc1Br b4eb884f9e845d511745b04fdb153847 [0,1,0,0,0,1|1,0,0]=3 3783 B13R1.158 C[C@H](O)CNCc1cccnc1Cl e63ea9679e4d4be6e2c0db18e996ce90 [0,1,0,0,0,1|1,0,0]=3 3784 B13R1.158 C[C@H](O)CNCc1cccnc1F bc19a189f4f322c10a6ead3c9dc1047a [0,1,0,0,0,1|1,0,0]=3 3785 B13R1.158 C[C@H](O)CNCc1ccncc1Br 5d0c45de098b57fe18e240c2271465f2 [0,1,0,0,0,1|1,0,0]=3 3786 B13R1.158 C[C@H](O)CNCc1ccncc1Cl 0b6aff78f2025b1b48466318c5f79686 [0,1,0,0,0,1|1,0,0]=3 3787 B13R1.158 C[C@H](O)CNCc1ccncc1F 4dd6da8208598f4cd5dbd7727a3d18f2 [0,1,0,0,0,1|1,0,0]=3 3788 B13R1.158 C[C@H](O)CNCc1ncccc1Br 4d6b749f1e1ea57fb9d3101cf6e1b4a3 [0,1,0,0,0,1|1,0,0]=3 3789 B13R1.158 C[C@H](O)CNCc1ncccc1Cl 27e806d61796b5759ae79eeae85c34e5 [0,1,0,0,0,1|1,0,0]=3 3790 B13R1.158 C[C@H](O)CNCc1ncccc1F dd45db9ee726c98a8ad839380249d521 [0,1,0,0,0,1|1,0,0]=3 3791 B13R1.158 C[C@H](O)CNCc1nccnc1Cl bd3387a7d9a9613e040b513e49b098ab [0,1,0,0,0,1|2,0,0]=4 3792 B13R1.158 Cc1ccccc1CNCC(=O)O fd99e02e4ed679e628a1d3db533c2077 [0,1,0,0,0,1|1,0,1]=4 3793 B13R1.158 Cc1ccccc1CNCC(C)C 8923d146fea180171fbbc22f54e50329 [0,1,0,0,0,1|1,0,0]=3 3794 B13R1.158 Cc1ccccc1CNCC(C)O 24a1e00122948f4da8d69d82b9b639a5 [0,1,0,0,0,1|0,0,0]=2 3795 B13R1.158 Cc1ccccc1CNCC(F)F 7c08def0b429c61acccf84f50659348d [0,1,0,0,0,1|2,0,0]=4 3796 B13R1.158 Cc1ccccc1CNCN(C)C 84149e571487769c00d9fbeb6a7b00fd [0,1,0,0,0,1|2,0,0]=4 3797 B13R1.158 Cc1ccccc1CNC[C@@H](C)O 52fc843ce37f1d0b378a7a5e61d220c9 [0,1,0,0,0,1|0,0,0]=2 3798 B13R1.158 Cc1ccccc1CNC[C@H](C)O 7c0183b09c2e0d7e8dbe09dee18a1496 [0,1,0,0,0,1|0,0,0]=2 3799 B13R1.158 Cc1ccccc1COCC(C)C dc70d5f79c73bb88303f800f663117bf [0,1,0,0,0,1|1,0,0]=3 3800 B13R1.158 Cc1ccccc1COCC(C)F 88573ad4ea126ea328a72a6d66cea4c5 [0,1,0,0,0,1|1,0,0]=3 3801 B13R1.158 Cc1ccccc1COCC(C)S 70af1bbc55f9dac612c5d08391e01342 [0,1,0,0,0,1|0,1,0]=3 3802 B13R1.158 Cc1ccccc1COCC(F)F 3c5eb3398b2897e89269cc44031c42ae [0,1,0,0,0,1|2,0,0]=4 3803 B13R1.158 Cc1ccccc1COCS(=O)O 3f9a3df5a0793f0d55d48902684b60b1 [0,1,0,0,0,1|2,0,0]=4 3804 B13R1.158 Cc1ccccc1COC[C@@H](C)F 98d22dc69e8c1426fd8aef1c7200de89 [0,1,0,0,0,1|1,0,0]=3 3805 B13R1.158 Cc1ccccc1COC[C@H](C)F b3b166dd5575bc4285c4b0d3ce2612de [0,1,0,0,0,1|1,0,0]=3 3806 B13R1.158 Cc1ccccc1NCCC(=O)O e76ba488a7d9e010444d590095405ff2 [0,1,0,0,0,1|1,0,1]=4 3807 B13R1.158 Cc1ccccc1NCCC(C)C 59063a52756ddbd974ebc80f35de4e60 [0,1,0,0,0,1|1,0,0]=3 3808 B13R1.158 Cc1ccccc1NCCC(C)O e4ff0c3f8869d01a30465c8bacb6a274 [0,1,0,0,0,1|0,0,0]=2 3809 B13R1.158 Cc1ccccc1NCCC(F)F 66ec4a72f0697d55e4dbed591854aa35 [0,1,0,0,0,1|2,0,0]=4 3810 B13R1.158 Cc1ccccc1NCCS(=O)C bad2e55073e6364bb569e5f1db47ccd6 [0,1,0,0,0,1|1,0,1]=4 3811 B13R1.158 Cc1ccccc1NCCS(=O)O 52e18be33c1464501673b6bbca836ca0 [0,1,0,0,0,1|2,0,0]=4 3812 B13R1.158 Cc1ccccc1OCCC(C)C 5f3bcefde459a2357fae5478a23eb7ee [0,1,0,0,0,1|1,0,0]=3 3813 B13R1.158 Cc1ccccc1OCCN(C)C 8bf97db5ee32c542b4e4088104e4ab7c [0,1,0,0,0,1|2,0,0]=4 3814 B13R1.158 Cc1cccnc1CCNC(C)C 037caec0fffef9c67db922e800b3281b [0,1,0,0,0,1|2,0,0]=4 3815 B13R1.158 Cc1cccnc1CCOC(C)C 96d864397515ba39a1b5b10ecf21ea8d [0,1,0,0,0,1|2,0,0]=4 3816 B13R1.158 Cc1cccnc1CNCC(C)C 33d5370cf360f15bc062e37861a80753 [0,1,0,0,0,1|2,0,0]=4 3817 B13R1.158 Cc1cccnc1CNCC(C)O be002e6a4eff8b7153a51875772a1b3e [0,1,0,0,0,1|1,0,0]=3 3818 B13R1.158 Cc1cccnc1CNC[C@@H](C)O 0ac0403799c45aeeb1f980bdb2283160 [0,1,0,0,0,1|1,0,0]=3 3819 B13R1.158 Cc1cccnc1CNC[C@H](C)O bfbf897c9abce76673f6bf919125db4c [0,1,0,0,0,1|1,0,0]=3 3820 B13R1.158 Cc1cccnc1COCC(C)C d739b9eb912b78f4420dad3197bda277 [0,1,0,0,0,1|2,0,0]=4 3821 B13R1.158 Cc1cccnc1COCC(C)F c0d6e9b2d9f2a48cd5f99c97cb56c395 [0,1,0,0,0,1|2,0,0]=4 3822 B13R1.158 Cc1cccnc1COCC(C)S 4b556fe1817ceabbd7371ec6dd128b1a [0,1,0,0,0,1|1,1,0]=4 3823 B13R1.158 Cc1cccnc1COC[C@@H](C)F 911cd42f4cd4daad8d2296bc2d305f84 [0,1,0,0,0,1|2,0,0]=4 3824 B13R1.158 Cc1cccnc1COC[C@H](C)F 2005f83344bf2e067eaa26e54be65aa8 [0,1,0,0,0,1|2,0,0]=4 3825 B13R1.158 Cc1cccnc1NCCC(C)C 68d919017c3383d07f7c84be0b1d344c [0,1,0,0,0,1|2,0,0]=4 3826 B13R1.158 Cc1cccnc1NCCC(C)O 53cb4568e71096c7f3e95b45f1636ee9 [0,1,0,0,0,1|1,0,0]=3 3827 B13R1.158 Cc1cccnc1NCC[C@@H](C)O c90903c6cfbf39a1d9f9544ccb0432fa [0,1,0,0,0,1|1,0,0]=3 3828 B13R1.158 Cc1cccnc1NCC[C@H](C)O 28d63d3d87a7559e9949f2bb1af0c448 [0,1,0,0,0,1|1,0,0]=3 3829 B13R1.158 Cc1cccnc1OCCC(C)C 925f5f5ebf45ba697acaa87eef9eef27 [0,1,0,0,0,1|2,0,0]=4 3830 B13R1.158 Cc1ccncc1CNCC(C)C c096cadb636b1f0b9b10fb83e94b5008 [0,1,0,0,0,1|2,0,0]=4 3831 B13R1.158 Cc1ccncc1CNCC(C)O 0ab10a10bfd637c8cddb415dbeadedf1 [0,1,0,0,0,1|1,0,0]=3 3832 B13R1.158 Cc1ccncc1CNC[C@H](C)O a72ef87669cee94b36ab92c8228dc575 [0,1,0,0,0,1|1,0,0]=3 3833 B13R1.158 Cc1ccncc1COCC(C)C dc25dbd4a30441eaadb6f28cd7b3e69e [0,1,0,0,0,1|2,0,0]=4 3834 B13R1.158 Cc1ccncc1NCCC(C)C 8f225f92b835e709a0ea86ee29d322cc [0,1,0,0,0,1|2,0,0]=4 3835 B13R1.158 Cc1ccncc1NCCC(C)O e0949c15e6a392f61f6eb4d82d6c9463 [0,1,0,0,0,1|1,0,0]=3 3836 B13R1.158 Cc1ccncc1NCC[C@@H](C)O a11eae01cea349fbafdf9158a16c12ba [0,1,0,0,0,1|1,0,0]=3 3837 B13R1.158 Cc1ccncc1NCC[C@H](C)O 19681210e4827dc6170bbcb2518587ed [0,1,0,0,0,1|1,0,0]=3 3838 B13R1.158 Cc1ccncc1OCCC(C)C aedc2c9b03aff4fbc5194b0d1489dfd0 [0,1,0,0,0,1|2,0,0]=4 3839 B13R1.158 Cc1ccnnc1CNCC(C)O f700c9263acd76c77da0d7de2a7b5cae [0,1,0,0,0,1|2,0,0]=4 3840 B13R1.158 Cc1ccnnc1CNC[C@@H](C)O 181c4dca6be7cd115258607f2627b872 [0,1,0,0,0,1|2,0,0]=4 3841 B13R1.158 Cc1ccnnc1CNC[C@H](C)O baa1ba9c191a65f3c0c8806ae0fa7014 [0,1,0,0,0,1|2,0,0]=4 3842 B13R1.158 Cc1ccnnc1NCCC(C)O 0fdc1efd3ac15edec82bad0ad9747a92 [0,1,0,0,0,1|2,0,0]=4 3843 B13R1.158 Cc1cnccc1CCOC(C)C 0f737c6234baad675000ae2d539e7ee9 [0,1,0,0,0,1|2,0,0]=4 3844 B13R1.158 Cc1cnccc1CNCC(C)C 9518ae8bab92ee2eb2062a4dc2548707 [0,1,0,0,0,1|2,0,0]=4 3845 B13R1.158 Cc1cnccc1CNCC(C)O 9ae14f090b736663a6d31d522009ded3 [0,1,0,0,0,1|1,0,0]=3 3846 B13R1.158 Cc1cnccc1CNC[C@@H](C)O ea58491149ac59b6531dbabff1c4dbb1 [0,1,0,0,0,1|1,0,0]=3 3847 B13R1.158 Cc1cnccc1CNC[C@H](C)O c74a2154485f3c3f4f4bca85403775a1 [0,1,0,0,0,1|1,0,0]=3 3848 B13R1.158 Cc1cnccc1COCC(C)C a87f5b5012e9f85150fc60efa4792805 [0,1,0,0,0,1|2,0,0]=4 3849 B13R1.158 Cc1cnccc1NCCC(C)C 1fa9e55251b301a02d8b840b6bbd0a13 [0,1,0,0,0,1|2,0,0]=4 3850 B13R1.158 Cc1cnccc1NCCC(C)O 8db11e5d2c4b27f761fa4234227804fe [0,1,0,0,0,1|1,0,0]=3 3851 B13R1.158 Cc1cnccc1OCCC(C)C 403718669ecd0009a86fb67eb82a1f46 [0,1,0,0,0,1|2,0,0]=4 3852 B13R1.158 Cc1cncnc1NCCC(C)O 60202b736fc377e26d4521adb691fc2f [0,1,0,0,0,1|2,0,0]=4 3853 B13R1.158 Cc1ncccc1CNCC(C)C 430a331b10801f96734daa369902942d [0,1,0,0,0,1|2,0,0]=4 3854 B13R1.158 Cc1ncccc1CNCC(C)O 583daea5fc76fa1f81131d95414264e1 [0,1,0,0,0,1|1,0,0]=3 3855 B13R1.158 Cc1ncccc1CNC[C@@H](C)O 6809c338e7aac8370c76c2ae8dfd9602 [0,1,0,0,0,1|1,0,0]=3 3856 B13R1.158 Cc1ncccc1CNC[C@H](C)O 64e4a721b2f39a1927ef1b7a7dd78ecc [0,1,0,0,0,1|1,0,0]=3 3857 B13R1.158 Cc1ncccc1COCC(C)C f60c94fb2a86e6927cb73c77b0e73901 [0,1,0,0,0,1|2,0,0]=4 3858 B13R1.158 Cc1ncccc1COCC(C)F 9895802d4c1c0f75eef3b6bd117d86e4 [0,1,0,0,0,1|2,0,0]=4 3859 B13R1.158 Cc1ncccc1COCC(C)S 46074b9d2d67371d0731e9bad7643729 [0,1,0,0,0,1|1,1,0]=4 3860 B13R1.158 Cc1ncccc1COC[C@@H](C)F 30e7560425ea68151a60191643ea8011 [0,1,0,0,0,1|2,0,0]=4 3861 B13R1.158 Cc1ncccc1COC[C@H](C)F ae624b9644d8a0b006ad0a3a6eceea75 [0,1,0,0,0,1|2,0,0]=4 3862 B13R1.158 Cc1ncccc1NCCC(C)C 86f7eed20c990d0be826d7c0494ebb88 [0,1,0,0,0,1|2,0,0]=4 3863 B13R1.158 Cc1ncccc1NCCC(C)O 949ebcc74cc61a31652efb964f1d40f2 [0,1,0,0,0,1|1,0,0]=3 3864 B13R1.158 Cc1ncccc1OCCC(C)C 3b25e03880ff2dc9f9b1b39cb72b1833 [0,1,0,0,0,1|2,0,0]=4 3865 B13R1.158 Cc1nccnc1CNCC(C)O 5daf6e56550129de7d0bb9df96c1aa59 [0,1,0,0,0,1|2,0,0]=4 3866 B13R1.158 Cc1nccnc1CNC[C@@H](C)O 82b0b676b4c31f0c22a70ae23aeae7a8 [0,1,0,0,0,1|2,0,0]=4 3867 B13R1.158 Cc1nccnc1CNC[C@H](C)O d7cc23b2fa4157696456e2a88398bae0 [0,1,0,0,0,1|2,0,0]=4 3868 B13R1.158 Cc1nccnc1NCCC(C)O 8f57ac4c329508772981aa4c8d102fbe [0,1,0,0,0,1|2,0,0]=4 3869 B13R1.158 Cc1ncncc1NCCC(C)O ede5b68faa223a16b70ccc1298c55e2a [0,1,0,0,0,1|2,0,0]=4 3870 B13R1.158 Cc1nnccc1NCCC(C)O b41b0c056d4f7bc39007c7f0c1897984 [0,1,0,0,0,1|2,0,0]=4 3871 B13R1.158 FC(F)CNCc1ccccc1Br ba41f6b138b83fa772a7fc559a29d1a0 [0,1,0,0,0,1|2,0,0]=4 3872 B13R1.158 FC(F)CNCc1ccccc1Cl a7aa1be9a5f4b047ade537842ff77d9f [0,1,0,0,0,1|2,0,0]=4 3873 B13R1.158 FC(F)CNCc1ccccc1I ce01c58d49aabf4d3489e5d2c51dd14b [0,1,0,0,0,1|2,0,0]=4 3874 B13R1.158 FC(F)COCc1ccccc1Br c9c753d6ba5b870fdbfc3893f9f8371e [0,1,0,0,0,1|2,0,0]=4 3875 B13R1.158 FC(F)COCc1ccccc1Cl a0991493d4eee6ba11a470d2f8cc0c0c [0,1,0,0,0,1|2,0,0]=4 3876 B13R1.158 FC(F)COCc1ccccc1I c655a4e2331ff0f85a92c312f67d484f [0,1,0,0,0,1|2,0,0]=4 3877 B13R1.158 FC(F)COCc1ccccc1S c5ae3a5f914ffda3928e42c9f4349ab9 [0,1,0,0,0,1|2,0,0]=4 3878 B13R1.158 Fc1ccccc1CNCC(F)F a3db9f998d65c4d088c3aa52f6fcb992 [0,1,0,0,0,1|2,0,0]=4 3879 B13R1.158 Fc1ccccc1COCC(F)F 294049ac334d7055995010e42bc7b7ce [0,1,0,0,0,1|2,0,0]=4 3880 B13R1.158 Fc1ccccc1NCCC(F)F 3f91ce3dc140e177084e74b73815f343 [0,1,0,0,0,1|2,0,0]=4 3881 B13R1.158 O=C(O)CCNc1ccccc1F f58cbcc618f46bf8d148d2132bf9672a [0,1,0,0,0,1|1,0,1]=4 3882 B13R1.158 O=C(O)CCNc1ccccc1I 68225226b6eb63d407493d84f369ae46 [0,1,0,0,0,1|1,0,1]=4 3883 B13R1.158 O=C(O)CNCc1ccccc1Br f0182e11e0467057ce64b5b94ab9a475 [0,1,0,0,0,1|1,0,1]=4 3884 B13R1.158 O=C(O)CNCc1ccccc1Cl 284e03a7b347b72901e61e21f2229abe [0,1,0,0,0,1|1,0,1]=4 3885 B13R1.158 O=C(O)CNCc1ccccc1F 6efa0502d7088f82197fc7b6c7849307 [0,1,0,0,0,1|1,0,1]=4 3886 B13R1.158 O=C(O)CNCc1ccccc1I 8606b4752659dbd6ab5ba6bced7b193c [0,1,0,0,0,1|1,0,1]=4 3887 B13R1.158 O=C(O)COCc1ccccc1Cl e2a271cc2025489b4e5a477437448271 [0,1,0,0,0,1|1,0,1]=4 3888 B13R1.158 O=C(O)COCc1ccccc1F ca3f92aa2a8b00b909b28b5bdc8128a8 [0,1,0,0,0,1|1,0,1]=4 3889 B13R1.158 O=C(O)COCc1ccccc1I 523e33ff41ad596cc9d17715ca33f7ca [0,1,0,0,0,1|1,0,1]=4 3890 B13R1.158 O=S(O)CCNc1ccccc1F 6017d4cc95790e8343c87065837de251 [0,1,0,0,0,1|2,0,0]=4 3891 B13R1.158 O=S(O)COCc1ccccc1Br b60d74ec32a3e1e7c8189de220e8a873 [0,1,0,0,0,1|2,0,0]=4 3892 B13R1.158 O=S(O)COCc1ccccc1Cl 6df1c4c098ae9075ea1f4219226a11b9 [0,1,0,0,0,1|2,0,0]=4 3893 B13R1.158 O=S(O)COCc1ccccc1F 2e384e7fe8917e5b9e753c35e00deb44 [0,1,0,0,0,1|2,0,0]=4 3894 B13R1.158 O=S(O)COCc1ccccc1I f6bb194f5a01c1d8fc247589abc00751 [0,1,0,0,0,1|2,0,0]=4 3895 B13R1.348 C=C(C)CN(C)Cc1ccccc1 a833ce64fc113613dfc5aeeea8d39cf6 [0,1,0,0,0,1|1,0,1]=4 3896 B13R1.348 CC(C)CC(C)Nc1ccccc1 c725022ee842f8debc3081607546c540 [0,1,0,0,0,1|1,0,0]=3 3897 B13R1.348 CC(C)CC(C)Nc1ccccn1 e6201d1d42ec513d36d098f4198db276 [0,1,0,0,0,1|2,0,0]=4 3898 B13R1.348 CC(C)CC(C)Nc1cccnc1 682f3ae5855836c9e3f78deb250c7302 [0,1,0,0,0,1|2,0,0]=4 3899 B13R1.348 CC(C)CC(C)Nc1ccncc1 d6d12fd9923f91fe5ba2347f5dffae5d [0,1,0,0,0,1|2,0,0]=4 3900 B13R1.348 CC(C)CC(C)Oc1ccccn1 53616aafa4f4d4e2a87c50dcf789c9cb [0,1,0,0,0,1|2,0,0]=4 3901 B13R1.348 CC(C)CC(C)Oc1cccnc1 2b2af87c7f07b7c70d0802f34f82279a [0,1,0,0,0,1|2,0,0]=4 3902 B13R1.348 CC(C)CC(C)Oc1ccncc1 918eb91cab2c15e16a8f4640af7f3dfd [0,1,0,0,0,1|2,0,0]=4 3903 B13R1.348 CC(C)CN(C)Cc1ccccc1 7efbff439c225b8bbd3ff90fdf6954f3 [0,1,0,0,0,1|1,0,0]=3 3904 B13R1.348 CC(C)CN(C)Cc1ccccn1 acfefb074589b96fc71d79d978fb827d [0,1,0,0,0,1|2,0,0]=4 3905 B13R1.348 CC(C)CN(C)Cc1cccnc1 3feefca9cb6e9ed6ec1255220ecd73b9 [0,1,0,0,0,1|2,0,0]=4 3906 B13R1.348 CC(C)CN(C)Cc1ccncc1 fdaef77d6254e166fbeb2b2afabf230e [0,1,0,0,0,1|2,0,0]=4 3907 B13R1.348 CC(C)NC(C)Cc1ccccn1 659fd592ffa44d06a3f2333c31b45173 [0,1,0,0,0,1|2,0,0]=4 3908 B13R1.348 CC(C)NC(C)Cc1cccnc1 2cec11ae4d227518cc08c95a319b6466 [0,1,0,0,0,1|2,0,0]=4 3909 B13R1.348 CC(C)NC(C)Cc1ccncc1 47571d9fc724bcf21d08e4d1614282b2 [0,1,0,0,0,1|2,0,0]=4 3910 B13R1.348 CC(C)OC(C)Cc1ccccc1 2252e63beb1f94a3718b29632816b153 [0,1,0,0,0,1|1,0,0]=3 3911 B13R1.348 CC(C)OC(C)Cc1ccccn1 89ba247634c915b1308d87a05b414d13 [0,1,0,0,0,1|2,0,0]=4 3912 B13R1.348 CC(C)O[C@@H](C)Cc1ccccc1 6c0b1ecc6cc0bee8de9de4dafb9a90d4 [0,1,0,0,0,1|1,0,0]=3 3913 B13R1.348 CC(C)O[C@H](C)Cc1ccccc1 cd878f9bbdf7aae1891836954532f65f [0,1,0,0,0,1|1,0,0]=3 3914 B13R1.348 CC(CC(=O)O)Nc1ccccc1 c4dc98856a92e26f250e70f02bbad1de [0,1,0,0,0,1|1,0,1]=4 3915 B13R1.348 CC(CN(C)C)Nc1ccccc1 66b2363a047b4c3f00eab0c7704e0c33 [0,1,0,0,0,1|2,0,0]=4 3916 B13R1.348 CC(O)CC(=O)Nc1ccccn1 09bcd54c1514115391be245d0421b67a [0,1,0,0,0,1|1,0,1]=4 3917 B13R1.348 CC(O)CC(=O)Nc1cccnc1 50ee92876efb70dd2200139c3e997a73 [0,1,0,0,0,1|1,0,1]=4 3918 B13R1.348 CC(O)CC(C)Nc1ccccc1 4fccbf7a7364c4fc5b879bb7ce60f08f [0,1,0,0,0,1|0,0,0]=2 3919 B13R1.348 CC(O)CC(C)Nc1cccnc1 630bd12d7201b071c1c170c195a2ca1a [0,1,0,0,0,1|1,0,0]=3 3920 B13R1.348 CC(O)CN(C)Cc1ccccc1 9c4b00009d473743d0e40c91a74eb96c [0,1,0,0,0,1|0,0,0]=2 3921 B13R1.348 CC(O)CN(C)Cc1ccccn1 64c75f6f61cb35ed193473c04248c6e9 [0,1,0,0,0,1|1,0,0]=3 3922 B13R1.348 CC(O)CN(C)Cc1cccnc1 a7c2a054b77fa842f745a3b6b66b1be2 [0,1,0,0,0,1|1,0,0]=3 3923 B13R1.348 CC(O)CN(C)Cc1cccnn1 8f02d4089f16dbe5112d737edf4ef0f1 [0,1,0,0,0,1|2,0,0]=4 3924 B13R1.348 CC(O)CN(C)Cc1ccncc1 63a8f0b7eaf491010c9bc259df336d40 [0,1,0,0,0,1|1,0,0]=3 3925 B13R1.348 CC(O)CN(C)Cc1ccncn1 59acb5946fbc48eb4f7c34811a98d6d1 [0,1,0,0,0,1|2,0,0]=4 3926 B13R1.348 CC(O)CN(C)Cc1ccnnc1 724b3523a284a57b41ec7a5e61c84220 [0,1,0,0,0,1|2,0,0]=4 3927 B13R1.348 CC(O)CN(C)Cc1cnccn1 3eb001a456f0cc1920e7b54a5b4bb532 [0,1,0,0,0,1|2,0,0]=4 3928 B13R1.348 CC(O)CN(C)Cc1cncnc1 0cb464352c5ce22eb44fa3dea0cc0faa [0,1,0,0,0,1|2,0,0]=4 3929 B13R1.348 CC(O)CN(C)Cc1ncccn1 520cf9c7525c3c6744d20fc49516bdaa [0,1,0,0,0,1|2,0,0]=4 3930 B13R1.348 CN(C)CN(C)Cc1ccccc1 1b75020ae6e2a1c1694f7ea0d4954164 [0,1,0,0,0,1|2,0,0]=4 3931 B13R1.348 CN(CC(=O)O)Cc1ccccc1 f1801662d15885da6568ba2f9d3d5bb6 [0,1,0,0,0,1|1,0,1]=4 3932 B13R1.348 CN(Cc1ccccc1)CC(F)F 7cddd76a7d21140df036d3b4b8f5adab [0,1,0,0,0,1|2,0,0]=4 3933 B13R1.348 C[C@@H](CC(=O)O)Nc1ccccc1 9cdad3bf2e8f3e53eff429119c436576 [0,1,0,0,0,1|1,0,1]=4 3934 B13R1.348 C[C@@H](CN(C)C)Nc1ccccc1 bc6766b3546aeac82d497549c1700ec5 [0,1,0,0,0,1|2,0,0]=4 3935 B13R1.348 C[C@@H](O)CC(=O)Nc1ccccn1 84be5c463f1a41b174f6a1a96d0f46c6 [0,1,0,0,0,1|1,0,1]=4 3936 B13R1.348 C[C@@H](O)CC(=O)Nc1cccnc1 4e1154c5aea0b166ed1bb60ee7c28f67 [0,1,0,0,0,1|1,0,1]=4 3937 B13R1.348 C[C@@H](O)CN(C)Cc1ccccc1 2694449cd1cea42072e3a34f5fa5cd3f [0,1,0,0,0,1|0,0,0]=2 3938 B13R1.348 C[C@@H](O)CN(C)Cc1ccccn1 3e546b333fbd8a6a330355c70a1dafeb [0,1,0,0,0,1|1,0,0]=3 3939 B13R1.348 C[C@@H](O)CN(C)Cc1cccnc1 d5afcef2791e4101915cc7286aed28d2 [0,1,0,0,0,1|1,0,0]=3 3940 B13R1.348 C[C@@H](O)CN(C)Cc1ccncc1 75c02a2f4e62430b64161af18be1acca [0,1,0,0,0,1|1,0,0]=3 3941 B13R1.348 C[C@@H](O)CN(C)Cc1ccnnc1 4172acc66ac1c69c18b298d04c011861 [0,1,0,0,0,1|2,0,0]=4 3942 B13R1.348 C[C@@H](O)CN(C)Cc1cnccn1 d56e4edd3d2a88f439bd02733b6925f9 [0,1,0,0,0,1|2,0,0]=4 3943 B13R1.348 C[C@@H](O)CN(C)Cc1cncnc1 287b02e96a30233fbdf2da996a9a08e9 [0,1,0,0,0,1|2,0,0]=4 3944 B13R1.348 C[C@H](CC(=O)O)Nc1ccccc1 157ab40633489c7ec9d7f358ed975359 [0,1,0,0,0,1|1,0,1]=4 3945 B13R1.348 C[C@H](CN(C)C)Nc1ccccc1 bd47fa7351128ef98d51b865d15c96c6 [0,1,0,0,0,1|2,0,0]=4 3946 B13R1.348 C[C@H](O)CC(=O)Nc1ccccn1 bf914881da69f7e99643ba43f760e3f0 [0,1,0,0,0,1|1,0,1]=4 3947 B13R1.348 C[C@H](O)CC(=O)Nc1cccnc1 96043d60bb1a360b3a418c39a4922cc6 [0,1,0,0,0,1|1,0,1]=4 3948 B13R1.348 C[C@H](O)CN(C)Cc1ccccc1 6ffb63057723a6d0e84a6367b8948b24 [0,1,0,0,0,1|0,0,0]=2 3949 B13R1.348 C[C@H](O)CN(C)Cc1ccccn1 767399c33be59fda3519d030a098489c [0,1,0,0,0,1|1,0,0]=3 3950 B13R1.348 C[C@H](O)CN(C)Cc1cccnc1 0219ad66722ad8fc409fc6d491c086e9 [0,1,0,0,0,1|1,0,0]=3 3951 B13R1.348 C[C@H](O)CN(C)Cc1cccnn1 0b7983bcfbd50c92fd0e4988b540c8ab [0,1,0,0,0,1|2,0,0]=4 3952 B13R1.348 C[C@H](O)CN(C)Cc1ccncc1 f56affe763aa6f55eeb63e95b874e473 [0,1,0,0,0,1|1,0,0]=3 3953 B13R1.348 C[C@H](O)CN(C)Cc1ccncn1 cdd5add9ea2ecd9a8844c0e6b690e7f1 [0,1,0,0,0,1|2,0,0]=4 3954 B13R1.348 C[C@H](O)CN(C)Cc1ccnnc1 45e12768148a6ef05fd6c5e0a7eee3f1 [0,1,0,0,0,1|2,0,0]=4 3955 B13R1.348 C[C@H](O)CN(C)Cc1cnccn1 cf1e20eeb34d5e7b386db8136ca48004 [0,1,0,0,0,1|2,0,0]=4 3956 B13R1.348 C[C@H](O)CN(C)Cc1cncnc1 9cb9a45d482fbad1ac9073baaf80cc6a [0,1,0,0,0,1|2,0,0]=4 3957 B13R1.348 C[C@H](O)CN(C)Cc1ncccn1 c1863e3c1752379162504f806f831eb0 [0,1,0,0,0,1|2,0,0]=4 3958 B13R1.351 CC(=O)C(C)NCc1ccccc1 aee4b9fd9013acab3ce3695f5ef2f3b9 [0,1,0,0,0,1|0,0,2]=4 3959 B13R1.351 CC(=O)C(C)OCc1ccccc1 b0ca707ddcb4e41a094bc5a42ddb650a [0,1,0,0,0,1|0,0,2]=4 3960 B13R1.351 CC(=O)N(C)CCc1ccccc1 9469c367d1a70a79856a46b178f0d450 [0,1,0,0,0,1|0,0,2]=4 3961 B13R1.351 CC(C)C(=O)CNc1ccccc1 9ae4dd4e4f3cd54ccccfb10bfcd43d23 [0,1,0,0,0,1|1,0,1]=4 3962 B13R1.351 CC(C)C(C)CNc1ccccc1 31084112f543bc6b5c60aa8d2c00c60c [0,1,0,0,0,1|1,0,0]=3 3963 B13R1.351 CC(C)C(C)CNc1ccccn1 efa854a93bf821b1d10238c6ffba9f3b [0,1,0,0,0,1|2,0,0]=4 3964 B13R1.351 CC(C)C(C)CNc1cccnc1 09928d31b210857992fcb6e164dcf8e0 [0,1,0,0,0,1|2,0,0]=4 3965 B13R1.351 CC(C)C(C)CNc1ccncc1 5548111f83a0aabc9dbcb4a85e2a6c57 [0,1,0,0,0,1|2,0,0]=4 3966 B13R1.351 CC(C)C(C)COc1ccccn1 dfe559465ccb390d996200762613ac46 [0,1,0,0,0,1|2,0,0]=4 3967 B13R1.351 CC(C)C(C)COc1cccnc1 66e7e3cef3d19ebbc59bfeeaa0e43b54 [0,1,0,0,0,1|2,0,0]=4 3968 B13R1.351 CC(C)C(C)COc1ccncc1 9219b5a061c0bdba48e3fc717df745cc [0,1,0,0,0,1|2,0,0]=4 3969 B13R1.351 CC(C)C(C)NCc1ccccc1 142313a2f7d26d0887806c5be339fc3b [0,1,0,0,0,1|1,0,0]=3 3970 B13R1.351 CC(C)C(C)NCc1ccccn1 2c5e267415734e735cf63257d78e0a2e [0,1,0,0,0,1|2,0,0]=4 3971 B13R1.351 CC(C)C(C)NCc1cccnc1 04b47b7813bf2e5bf06b10156e516ce6 [0,1,0,0,0,1|2,0,0]=4 3972 B13R1.351 CC(C)C(C)NCc1ccncc1 e706770d97c5557279a4f94eaa7e4992 [0,1,0,0,0,1|2,0,0]=4 3973 B13R1.351 CC(C)C(C)OCc1ccccc1 f6ac7c8424cc7462871a98251037e6a5 [0,1,0,0,0,1|1,0,0]=3 3974 B13R1.351 CC(C)C(C)OCc1ccccn1 2328514736ded14da187b787e74f6b1a [0,1,0,0,0,1|2,0,0]=4 3975 B13R1.351 CC(C)C(C)OCc1cccnc1 0cf3c9d9df6412e332c75ac01d7e7553 [0,1,0,0,0,1|2,0,0]=4 3976 B13R1.351 CC(C)C(C)OCc1ccncc1 172ce5e301e1a8b6f4d4996197e9cd97 [0,1,0,0,0,1|2,0,0]=4 3977 B13R1.351 CC(C)C(O)CNc1ccccc1 c43af41f2de0b57accb18f837361cce6 [0,1,0,0,0,1|1,0,0]=3 3978 B13R1.351 CC(C)C(O)CNc1cccnc1 d45b506c1a503b1e018105704b0d44a8 [0,1,0,0,0,1|2,0,0]=4 3979 B13R1.351 CC(C)C(O)CNc1ccncc1 3c3655b27e0543584f105e1e7c556ec6 [0,1,0,0,0,1|2,0,0]=4 3980 B13R1.351 CC(C)N(C)CCc1ccccc1 fa69ff864129d862cbd0a4d3e3ae6df7 [0,1,0,0,0,1|1,0,0]=3 3981 B13R1.351 CC(C)N(C)CCc1ccccn1 a4630f64c671805da5b3a53830b01a82 [0,1,0,0,0,1|2,0,0]=4 3982 B13R1.351 CC(C)N(C)CCc1cccnc1 edb12f6f2f8fa487d5c1242e8487aaa0 [0,1,0,0,0,1|2,0,0]=4 3983 B13R1.351 CC(C)N(C)CCc1ccncc1 45b7a28a213ae56e71698a92a789e364 [0,1,0,0,0,1|2,0,0]=4 3984 B13R1.351 CC(C)[C@@H](C)NCc1ccccc1 a81814a7c9fae523e6253d4ea79b1a0d [0,1,0,0,0,1|1,0,0]=3 3985 B13R1.351 CC(C)[C@@H](C)NCc1ccccn1 e05fddea5eee42104086f6802a0d36f9 [0,1,0,0,0,1|2,0,0]=4 3986 B13R1.351 CC(C)[C@@H](C)NCc1cccnc1 8d95c69b1803a2ce767d02ea65c9d338 [0,1,0,0,0,1|2,0,0]=4 3987 B13R1.351 CC(C)[C@@H](C)OCc1ccccc1 cd9f97d96b89e6b31731f37cf8a6c831 [0,1,0,0,0,1|1,0,0]=3 3988 B13R1.351 CC(C)[C@@H](C)OCc1ccccn1 dfbd8c0d50cccda104d0df87d55806c9 [0,1,0,0,0,1|2,0,0]=4 3989 B13R1.351 CC(C)[C@@H](C)OCc1cccnc1 d4dcab00fa7e46dd423d6a6488049cbd [0,1,0,0,0,1|2,0,0]=4 3990 B13R1.351 CC(C)[C@H](C)NCc1ccccc1 339b2cc4ebde21423bffd826744994d1 [0,1,0,0,0,1|1,0,0]=3 3991 B13R1.351 CC(C)[C@H](C)NCc1ccccn1 7c8656b4f85b492b13ffe716913537b5 [0,1,0,0,0,1|2,0,0]=4 3992 B13R1.351 CC(C)[C@H](C)NCc1cccnc1 86db8150d81328104f71f173590381cc [0,1,0,0,0,1|2,0,0]=4 3993 B13R1.351 CC(C)[C@H](C)OCc1ccccc1 fa6bc0160f4ea230b00145d0a31dab0f [0,1,0,0,0,1|1,0,0]=3 3994 B13R1.351 CC(C)[C@H](C)OCc1ccccn1 97349a930f22962dbd4cb0034278917b [0,1,0,0,0,1|2,0,0]=4 3995 B13R1.351 CC(C)[C@H](C)OCc1cccnc1 d884849a32a5852a1224d3928f413cd9 [0,1,0,0,0,1|2,0,0]=4 3996 B13R1.351 CC(CNc1ccccc1)C(=O)O 3dc27b63797a4b52960379e71cb36442 [0,1,0,0,0,1|1,0,1]=4 3997 B13R1.351 CC(CNc1ccccc1)N(C)C b79f5040e919fbf00ef08025a8ef62e0 [0,1,0,0,0,1|2,0,0]=4 3998 B13R1.351 CC(F)C(=O)NCc1ccccc1 bffc7100d7e503c7b7b06e6d88883b73 [0,1,0,0,0,1|1,0,1]=4 3999 B13R1.351 CC(NCc1ccccc1)C(=O)O 11476306961a413fe1a2a238f81af485 [0,1,0,0,0,1|1,0,1]=4 4000 B13R1.351 CC(O)C(=O)NCc1ccccc1 ea64b32e6bfd0f8a082d2968e7b3fc9c [0,1,0,0,0,1|0,0,1]=3 4001 B13R1.351 CC(O)C(=O)NCc1ccccn1 6052f0122474eca18657b5c2b9c1e3ed [0,1,0,0,0,1|1,0,1]=4 4002 B13R1.351 CC(O)C(=O)NCc1cccnc1 196a561306487eff04711b8143918316 [0,1,0,0,0,1|1,0,1]=4 4003 B13R1.351 CC(O)C(=O)NCc1ccncc1 8afc2ae412004ec865559879a117699c [0,1,0,0,0,1|1,0,1]=4 4004 B13R1.351 CC(O)C(C)NCc1ccccc1 65d85a362199dbb80eda43c8fc3b6643 [0,1,0,0,0,1|0,0,0]=2 4005 B13R1.351 CC(O)C(C)NCc1ccccn1 aad50aa3ef04ecdead624b5c6d189a36 [0,1,0,0,0,1|1,0,0]=3 4006 B13R1.351 CC(O)C(C)NCc1cccnc1 1550eafbd2e564281961404ad8bd28f1 [0,1,0,0,0,1|1,0,0]=3 4007 B13R1.351 CC(O)C(C)NCc1cccnn1 50373d2ea7fe8e4e874b2acf71345a86 [0,1,0,0,0,1|2,0,0]=4 4008 B13R1.351 CC(O)C(C)NCc1ccncn1 c72e6f8fdcf0f90c6191f841b9634396 [0,1,0,0,0,1|2,0,0]=4 4009 B13R1.351 CC(O)C(C)NCc1cncnc1 7c3f4755350066745236c0880d76c75e [0,1,0,0,0,1|2,0,0]=4 4010 B13R1.351 CC(O)C(C)NCc1ncccn1 0bd3b237fb4c6711cc532c412e211df7 [0,1,0,0,0,1|2,0,0]=4 4011 B13R1.351 CC(OCc1ccccc1)C(=O)O d0502d867f7c961202064887e47be9f1 [0,1,0,0,0,1|1,0,1]=4 4012 B13R1.351 CC(OCc1ccccc1)C(F)F ba27b787d0a679bda341582afc22985c [0,1,0,0,0,1|2,0,0]=4 4013 B13R1.351 CC(S)C(=O)NCc1ccccc1 9f8bbd9361108737161ac8ed57cac69e [0,1,0,0,0,1|0,1,1]=4 4014 B13R1.351 CC(S)C(C)OCc1ccccc1 a2ab11d63ea9ce7d148b484fd9bfd36a [0,1,0,0,0,1|0,1,0]=3 4015 B13R1.351 CC(S)C(C)OCc1ccccn1 5a66941feba12ffd7eaf39598de8e66a [0,1,0,0,0,1|1,1,0]=4 4016 B13R1.351 CC(S)C(C)OCc1cccnc1 0792b6dd2ac2c4351388799215839f63 [0,1,0,0,0,1|1,1,0]=4 4017 B13R1.351 C[C@@H](F)C(=O)NCc1ccccc1 9c08c20355c6c5c6db152742fdf95ac9 [0,1,0,0,0,1|1,0,1]=4 4018 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)O ca85d76e84bc8a10de9905be6311207f [0,1,0,0,0,1|1,0,1]=4 4019 B13R1.351 C[C@@H](NCc1ccccc1)C(F)F 3c55e041e58d6bb58470869f1d9bc8ec [0,1,0,0,0,1|2,0,0]=4 4020 B13R1.351 C[C@@H](O)C(=O)NCc1ccccc1 e20615f745e42e5e54f78abf349a946d [0,1,0,0,0,1|0,0,1]=3 4021 B13R1.351 C[C@@H](O)C(=O)NCc1ccccn1 c73d45ffc365bdd35db63f9eebb1511c [0,1,0,0,0,1|1,0,1]=4 4022 B13R1.351 C[C@@H](O)C(=O)NCc1cccnc1 28351664c772e9804f9cd6f5f57ef8c9 [0,1,0,0,0,1|1,0,1]=4 4023 B13R1.351 C[C@@H](O)C(=O)NCc1ccncc1 1e2a4110afd885762829502fdbe89109 [0,1,0,0,0,1|1,0,1]=4 4024 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)O 1a994292d471b705dba00d31459545c2 [0,1,0,0,0,1|1,0,1]=4 4025 B13R1.351 C[C@H](F)C(=O)NCc1ccccc1 8a16dadee66e89070f45ffc182451614 [0,1,0,0,0,1|1,0,1]=4 4026 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O deadd5c87a755eb31844e7c631b6e140 [0,1,0,0,0,1|1,0,1]=4 4027 B13R1.351 C[C@H](NCc1ccccc1)C(F)F 710e38d430537b52a944f0ae86bf164d [0,1,0,0,0,1|2,0,0]=4 4028 B13R1.351 C[C@H](O)C(=O)NCc1ccccc1 ad85d6cb49b662baf7119c8d6bc9f12a [0,1,0,0,0,1|0,0,1]=3 4029 B13R1.351 C[C@H](O)C(=O)NCc1ccccn1 dfd11142e71a438fe1cb7f50da7ac7c9 [0,1,0,0,0,1|1,0,1]=4 4030 B13R1.351 C[C@H](O)C(=O)NCc1cccnc1 9f0065f37380038f48612b5c96d98230 [0,1,0,0,0,1|1,0,1]=4 4031 B13R1.351 C[C@H](O)C(=O)NCc1ccncc1 219617f570e0a2eaabb342bdfae28e64 [0,1,0,0,0,1|1,0,1]=4 4032 B13R1.351 C[C@H](OCc1ccccc1)C(=O)O 60a4714e267885c98c36be49dd428ced [0,1,0,0,0,1|1,0,1]=4 4033 B13R1.351 O=C(NCc1ccccc1)C(O)O 5230766bb275d85516282d966ca7ce4a [0,1,0,0,0,1|1,0,1]=4 4034 B13R1.351 O=C(O)C(F)NCc1ccccc1 2eef2c061d6c27028f75cbbefd37da68 [0,1,0,0,0,1|1,0,1]=4 4035 B13R1.351 O=C(O)C(O)CNc1ccccc1 3e4168511e9c7aaf40d08f5e06adedd3 [0,1,0,0,0,1|1,0,1]=4 4036 B13R1.351 O=C(O)C(O)NCc1ccccc1 43b8cd7e96453db0d2da2c5835fc2ccd [0,1,0,0,0,1|1,0,1]=4 4037 B13R1.351 O=C(O)[C@@H](O)CNc1ccccc1 24f51ede5fdb072f9d3fad34199262d8 [0,1,0,0,0,1|1,0,1]=4 4038 B13R1.351 O=C(O)[C@H](F)NCc1ccccc1 f86b55457fb01cab598836aaa352c898 [0,1,0,0,0,1|1,0,1]=4 4039 B13R1.351 O=C(O)[C@H](O)CNc1ccccc1 b725ac000d3e2daed7b457fc1d05a474 [0,1,0,0,0,1|1,0,1]=4 4040 B13R1.351 OC(CNc1ccccc1)C(F)F 71001bddbb7deb6a4845cf3ebb7ebd63 [0,1,0,0,0,1|2,0,0]=4 4041 B13R1.513 C=C(C)CCNc1ccc(cc1)Br f9b1637c6dff6d52499a8428ddc6be18 [0,1,0,0,0,1|1,0,1]=4 4042 B13R1.513 C=C(C)CCNc1ccc(cc1)C 33f4badbf7da76998540497b110f0166 [0,1,0,0,0,1|1,0,1]=4 4043 B13R1.513 C=C(C)CCNc1ccc(cc1)Cl ed66389a1d00f94ba19b0ccfa0013c7c [0,1,0,0,0,1|1,0,1]=4 4044 B13R1.513 C=C(C)CCNc1ccc(cc1)F 766e83694bb2f8eeed78572a8e341198 [0,1,0,0,0,1|1,0,1]=4 4045 B13R1.513 C=C(C)CCNc1ccc(cc1)I 58538a9119a625f381b1520eb0ed1882 [0,1,0,0,0,1|1,0,1]=4 4046 B13R1.513 C=C(C)CCNc1ccc(cc1)S e58458aa8c0c76c900ac7dc69610898a [0,1,0,0,0,1|1,0,1]=4 4047 B13R1.513 C=C(C)CCOc1ccc(cc1)Br 27b85edb1bdd61fb0e51f62a6185a80e [0,1,0,0,0,1|1,0,1]=4 4048 B13R1.513 C=C(C)CCOc1ccc(cc1)C bf45d90e626a0cf464b54e7362245b2e [0,1,0,0,0,1|1,0,1]=4 4049 B13R1.513 C=C(C)CCOc1ccc(cc1)Cl 1e7713df503494f60aa74ad72cef8de0 [0,1,0,0,0,1|1,0,1]=4 4050 B13R1.513 C=C(C)CCOc1ccc(cc1)F b6c85350ee4e74a2c6dc585bf15708f0 [0,1,0,0,0,1|1,0,1]=4 4051 B13R1.513 C=C(C)CCOc1ccc(cc1)I b62b30fb4996728b0c765746445c2acc [0,1,0,0,0,1|1,0,1]=4 4052 B13R1.513 C=C(C)CCOc1ccc(cc1)S d86dfd0847a52a0e870f72f62d0d720c [0,1,0,0,0,1|1,0,1]=4 4053 B13R1.513 C=C(C)CNCc1ccc(cc1)Br e3f4de64dc896c84d6d5e479ba8f90db [0,1,0,0,0,1|1,0,1]=4 4054 B13R1.513 C=C(C)CNCc1ccc(cc1)C d0700e651fa7164c593f818b10606b48 [0,1,0,0,0,1|1,0,1]=4 4055 B13R1.513 C=C(C)CNCc1ccc(cc1)Cl 54ea75166cd4439a79e81e3c2d16d29c [0,1,0,0,0,1|1,0,1]=4 4056 B13R1.513 C=C(C)CNCc1ccc(cc1)F 84fded8d34c13a957382c81955b0e5ca [0,1,0,0,0,1|1,0,1]=4 4057 B13R1.513 C=C(C)CNCc1ccc(cc1)I b0c7e3adeea3d27f0cef638cb6408259 [0,1,0,0,0,1|1,0,1]=4 4058 B13R1.513 C=C(C)COCc1ccc(cc1)Br b2a2f08801a3f4470486a463420bff16 [0,1,0,0,0,1|1,0,1]=4 4059 B13R1.513 C=C(C)COCc1ccc(cc1)C bbb202b7f953dce1a0d990b303538f41 [0,1,0,0,0,1|1,0,1]=4 4060 B13R1.513 C=C(C)COCc1ccc(cc1)Cl d327f5931effd5406d36f4e0f3434d4d [0,1,0,0,0,1|1,0,1]=4 4061 B13R1.513 C=C(C)COCc1ccc(cc1)F e144b33cd11870fb4aa349609c3dac95 [0,1,0,0,0,1|1,0,1]=4 4062 B13R1.513 C=C(C)COCc1ccc(cc1)I 21ab48df361188507bf6ab6c76da487d [0,1,0,0,0,1|1,0,1]=4 4063 B13R1.513 C=C(C)COCc1ccc(cc1)S 83e62279a19e9261e716bca162d874be [0,1,0,0,0,1|1,0,1]=4 4064 B13R1.513 CC(=O)CCNc1ccc(cc1)Br 9d9ed7ea90d007b9d5a7198e86e9cd55 [0,1,0,0,0,1|0,0,2]=4 4065 B13R1.513 CC(=O)CCNc1ccc(cc1)C 4970d0647583593c530891ec54e0a474 [0,1,0,0,0,1|0,0,2]=4 4066 B13R1.513 CC(=O)CCNc1ccc(cc1)Cl 3ca7190e7f3815ff39ab60e26d1a6c0d [0,1,0,0,0,1|0,0,2]=4 4067 B13R1.513 CC(=O)CCNc1ccc(cc1)F 069572370451e8511f8e9bf9e6cac995 [0,1,0,0,0,1|0,0,2]=4 4068 B13R1.513 CC(=O)CCNc1ccc(cc1)I 149e5e5071d3578bc0d73a3d7f1106b2 [0,1,0,0,0,1|0,0,2]=4 4069 B13R1.513 CC(=O)CCNc1ccc(cc1)S cf5e9a47f45ee812b9a92e98bd1936df [0,1,0,0,0,1|0,0,2]=4 4070 B13R1.513 CC(=O)CCOc1ccc(cc1)Br 509d98c608e8b963d776a680a12b2e31 [0,1,0,0,0,1|0,0,2]=4 4071 B13R1.513 CC(=O)CCOc1ccc(cc1)C 88feb9d51332d60a5a9b200ef94bff12 [0,1,0,0,0,1|0,0,2]=4 4072 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl a75fd288931f110d26f5483b0f955fff [0,1,0,0,0,1|0,0,2]=4 4073 B13R1.513 CC(=O)CCOc1ccc(cc1)F 16a007e68dd4954ee8bfa2bb51977a30 [0,1,0,0,0,1|0,0,2]=4 4074 B13R1.513 CC(=O)CCOc1ccc(cc1)I 4e3a5cf0035363516566297daa5cdf58 [0,1,0,0,0,1|0,0,2]=4 4075 B13R1.513 CC(=O)CCOc1ccc(cc1)S c8c8db7f2b65b561db24eba9531b8d32 [0,1,0,0,0,1|0,0,2]=4 4076 B13R1.513 CC(=O)CNCc1ccc(cc1)Br 7cdfa1bf93a4277e5be726d37091a047 [0,1,0,0,0,1|0,0,2]=4 4077 B13R1.513 CC(=O)CNCc1ccc(cc1)C 4bcad674817285f3c61ca2f8ad397aca [0,1,0,0,0,1|0,0,2]=4 4078 B13R1.513 CC(=O)CNCc1ccc(cc1)Cl a5905453e1426722096b500db0ab557a [0,1,0,0,0,1|0,0,2]=4 4079 B13R1.513 CC(=O)CNCc1ccc(cc1)F 0c0e0b86114aa064b7a97817fe94fe52 [0,1,0,0,0,1|0,0,2]=4 4080 B13R1.513 CC(=O)CNCc1ccc(cc1)I f4714c855e49b687e5449f6224885c5b [0,1,0,0,0,1|0,0,2]=4 4081 B13R1.513 CC(=O)COCc1ccc(cc1)Br 86b3d1e7121de26fad5caf48b465622f [0,1,0,0,0,1|0,0,2]=4 4082 B13R1.513 CC(=O)COCc1ccc(cc1)C 3012ed3bd6572487ba8b3d7176258bb7 [0,1,0,0,0,1|0,0,2]=4 4083 B13R1.513 CC(=O)COCc1ccc(cc1)Cl 95da831bc2e885dcffda43db08609d12 [0,1,0,0,0,1|0,0,2]=4 4084 B13R1.513 CC(=O)COCc1ccc(cc1)F 76af687e2accd9a42a70d4f6b51e2d1f [0,1,0,0,0,1|0,0,2]=4 4085 B13R1.513 CC(=O)COCc1ccc(cc1)I 763fe567230a0274862e3c5d37e68415 [0,1,0,0,0,1|0,0,2]=4 4086 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 2cc4881ea9242d2e44ff570bb37d2650 [0,1,0,0,0,1|0,0,2]=4 4087 B13R1.513 CC(=O)NCCc1ccc(cc1)C da725421b190aa6a16673cb3be0680d5 [0,1,0,0,0,1|0,0,2]=4 4088 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl f9a823ec8d391334b2bd601a1bc4caee [0,1,0,0,0,1|0,0,2]=4 4089 B13R1.513 CC(=O)NCCc1ccc(cc1)F ca0bc7959144760b108c788e7e580a73 [0,1,0,0,0,1|0,0,2]=4 4090 B13R1.513 CC(=O)NCCc1ccc(cc1)I bc040422debbf93a7cef01a88de4b9dc [0,1,0,0,0,1|0,0,2]=4 4091 B13R1.513 CC(=O)NCCc1ccc(cc1)O 52c317afed0f03f4a45dbc4ae1d4a51e [0,1,0,0,0,1|0,0,2]=4 4092 B13R1.513 CC(C)CCNc1ccc(=O)[nH]c1 4bd34a355812496c79ecc75e8d1ebaef [0,1,0,0,0,1|2,0,0]=4 4093 B13R1.513 CC(C)CCNc1ccc(cc1)Br b9d478e16e0c9591a48e2e778436e95a [0,1,0,0,0,1|1,0,0]=3 4094 B13R1.513 CC(C)CCNc1ccc(cc1)Cl ab1f6c20c6e339323c9b3e84cbf33cdc [0,1,0,0,0,1|1,0,0]=3 4095 B13R1.513 CC(C)CCNc1ccc(cc1)F c3a2e5864ae46f839c7ae7eda94be207 [0,1,0,0,0,1|1,0,0]=3 4096 B13R1.513 CC(C)CCNc1ccc(cc1)I c7644c05061d3be9d75a365a6aa78820 [0,1,0,0,0,1|1,0,0]=3 4097 B13R1.513 CC(C)CCNc1ccc(cc1)S 061af0a0b43a9fe8931d1dcabeb7a5fd [0,1,0,0,0,1|1,0,0]=3 4098 B13R1.513 CC(C)CCNc1ccc(cn1)Br 8f1e968871ba4621f03cc252d8dad0a0 [0,1,0,0,0,1|2,0,0]=4 4099 B13R1.513 CC(C)CCNc1ccc(cn1)Cl afb9feb9f885e27562d41057222bc3ce [0,1,0,0,0,1|2,0,0]=4 4100 B13R1.513 CC(C)CCNc1ccc(cn1)F fd67ca4b766af9b93931ec01e72676ab [0,1,0,0,0,1|2,0,0]=4 4101 B13R1.513 CC(C)CCNc1ccc(cn1)I e58526295d90798f7ec7fc4a8a234125 [0,1,0,0,0,1|2,0,0]=4 4102 B13R1.513 CC(C)CCNc1ccc(nc1)Br 3e930997ec71c6e2ebaea6e47ec7003a [0,1,0,0,0,1|2,0,0]=4 4103 B13R1.513 CC(C)CCNc1ccc(nc1)Cl b40eee24a9bc46f9cf022dac0e27002f [0,1,0,0,0,1|2,0,0]=4 4104 B13R1.513 CC(C)CCNc1ccc(nc1)F e4010456e226d40db27d4b311b6dc86c [0,1,0,0,0,1|2,0,0]=4 4105 B13R1.513 CC(C)CCNc1ccc(nc1)I 765d3c7641ddc49d870f88285a6f1acc [0,1,0,0,0,1|2,0,0]=4 4106 B13R1.513 CC(C)CCOc1ccc(cc1)Br c4342ae9547e3f12c4d4a0953284cf60 [0,1,0,0,0,1|1,0,0]=3 4107 B13R1.513 CC(C)CCOc1ccc(cc1)Cl c05c27d1b7e2e730f237104804f2df54 [0,1,0,0,0,1|1,0,0]=3 4108 B13R1.513 CC(C)CCOc1ccc(cc1)F b941fdf1e5349100fcf244fc8808675a [0,1,0,0,0,1|1,0,0]=3 4109 B13R1.513 CC(C)CCOc1ccc(cc1)I 245de7d1a15f3415b0170d894f62fb2b [0,1,0,0,0,1|1,0,0]=3 4110 B13R1.513 CC(C)CCOc1ccc(cc1)S cc19ecd3039b9a780b4d9fd52c0e771a [0,1,0,0,0,1|1,0,0]=3 4111 B13R1.513 CC(C)CCOc1ccc(cn1)Cl c8002e24bc61b2ad688416df63a58346 [0,1,0,0,0,1|2,0,0]=4 4112 B13R1.513 CC(C)CCOc1ccc(cn1)F 9e12bb2ea34294c43df4d76bd04a7822 [0,1,0,0,0,1|2,0,0]=4 4113 B13R1.513 CC(C)CCOc1ccc(cn1)I 46a90349ebc1dd788e087f2518a0df04 [0,1,0,0,0,1|2,0,0]=4 4114 B13R1.513 CC(C)CCOc1ccc(nc1)Br 47423f8e36353be12e5582804dbe6735 [0,1,0,0,0,1|2,0,0]=4 4115 B13R1.513 CC(C)CCOc1ccc(nc1)Cl 58af964cfcec1b577cdd0d0d761af65e [0,1,0,0,0,1|2,0,0]=4 4116 B13R1.513 CC(C)CCOc1ccc(nc1)F a9f2804bd9180ab3c285cd11d3a8f2c4 [0,1,0,0,0,1|2,0,0]=4 4117 B13R1.513 CC(C)CCOc1ccc(nc1)I ee2a81fd1cff7be09aa821c1fb9dd18f [0,1,0,0,0,1|2,0,0]=4 4118 B13R1.513 CC(C)CNCc1ccc(=O)[nH]c1 929e2d54536d77eb5c6ac4cd612c7357 [0,1,0,0,0,1|2,0,0]=4 4119 B13R1.513 CC(C)CNCc1ccc(cc1)Br ffbc0ba0e3da9728c8905d12325e28ad [0,1,0,0,0,1|1,0,0]=3 4120 B13R1.513 CC(C)CNCc1ccc(cc1)Cl f4fcf42389d4544dabeeb94c99838d94 [0,1,0,0,0,1|1,0,0]=3 4121 B13R1.513 CC(C)CNCc1ccc(cc1)F 3ea1377f35efa31543a2643a1fcca42d [0,1,0,0,0,1|1,0,0]=3 4122 B13R1.513 CC(C)CNCc1ccc(cc1)I ad25e97404f08826c6c3adb70d764949 [0,1,0,0,0,1|1,0,0]=3 4123 B13R1.513 CC(C)CNCc1ccc(cn1)Br cf1396fdbef16ea6de4b0242e29bb30b [0,1,0,0,0,1|2,0,0]=4 4124 B13R1.513 CC(C)CNCc1ccc(cn1)Cl 5013d4d50c75c83f63788b1acad6b408 [0,1,0,0,0,1|2,0,0]=4 4125 B13R1.513 CC(C)CNCc1ccc(cn1)F 431c2d57b78987562f4f7cab5eb8c6ad [0,1,0,0,0,1|2,0,0]=4 4126 B13R1.513 CC(C)CNCc1ccc(nc1)Br 9ff0b57919f6eee5c461eac866de52e7 [0,1,0,0,0,1|2,0,0]=4 4127 B13R1.513 CC(C)CNCc1ccc(nc1)Cl 0f4a76260f6afaa674aa60122e695fd6 [0,1,0,0,0,1|2,0,0]=4 4128 B13R1.513 CC(C)CNCc1ccc(nc1)F 036a03c919a1532e0d9e4749cab59a98 [0,1,0,0,0,1|2,0,0]=4 4129 B13R1.513 CC(C)COCc1cc[n+](cc1)[O-] f0f33d9ea3f9fdf0aca9b441b5b57815 [0,1,0,0,0,1|2,0,0]=4 4130 B13R1.513 CC(C)COCc1ccc(cc1)Br 5292a1ed3b18b3308556bceb3d791fb2 [0,1,0,0,0,1|1,0,0]=3 4131 B13R1.513 CC(C)COCc1ccc(cc1)Cl f0da682204338127387f280dbf8942bd [0,1,0,0,0,1|1,0,0]=3 4132 B13R1.513 CC(C)COCc1ccc(cc1)F 540dcbd5e2b913754559aac4ec30900c [0,1,0,0,0,1|1,0,0]=3 4133 B13R1.513 CC(C)COCc1ccc(cc1)I ca3bb0ea17020b83af103d87fe2c8226 [0,1,0,0,0,1|1,0,0]=3 4134 B13R1.513 CC(C)COCc1ccc(cc1)S faccb702cd35f180d2ab3310f670a637 [0,1,0,0,0,1|1,0,0]=3 4135 B13R1.513 CC(C)COCc1ccc(cn1)Br a83b9de7c29b92c37d4d61b1fe54fe9d [0,1,0,0,0,1|2,0,0]=4 4136 B13R1.513 CC(C)COCc1ccc(cn1)Cl f4a8a510519725c40b1dfafa76da7370 [0,1,0,0,0,1|2,0,0]=4 4137 B13R1.513 CC(C)COCc1ccc(cn1)F 78272c2f0e23f4b74b2f10e15d20643b [0,1,0,0,0,1|2,0,0]=4 4138 B13R1.513 CC(C)COCc1ccc(cn1)I 96143d9d4d22ef294a19ecb967564534 [0,1,0,0,0,1|2,0,0]=4 4139 B13R1.513 CC(C)COCc1ccc(nc1)Br 971ba4414239f2699132c5115e31de48 [0,1,0,0,0,1|2,0,0]=4 4140 B13R1.513 CC(C)COCc1ccc(nc1)Cl 4ee1f9cb6d3a1d34a9da14404c5ea5dc [0,1,0,0,0,1|2,0,0]=4 4141 B13R1.513 CC(C)COCc1ccc(nc1)F 98f6d4eafe54fb1ecd3613fcc32beeae [0,1,0,0,0,1|2,0,0]=4 4142 B13R1.513 CC(C)NCCc1ccc(cc1)Br a48e23de4df3aa87820071362adb7752 [0,1,0,0,0,1|1,0,0]=3 4143 B13R1.513 CC(C)NCCc1ccc(cc1)Cl bdce26351bc992298480ef03ec035650 [0,1,0,0,0,1|1,0,0]=3 4144 B13R1.513 CC(C)NCCc1ccc(cc1)F f334e36d76e8f18c25a81d0150102d35 [0,1,0,0,0,1|1,0,0]=3 4145 B13R1.513 CC(C)NCCc1ccc(cc1)I 40eb0326fe9e650a40c6b0fd3d6d1f49 [0,1,0,0,0,1|1,0,0]=3 4146 B13R1.513 CC(C)NCCc1ccc(nc1)Br efba4bb5b45392ca4a26c6fd2eb4fc93 [0,1,0,0,0,1|2,0,0]=4 4147 B13R1.513 CC(C)NCCc1ccc(nc1)Cl 6a44abca6cd905ded93ed69dbbe95ea5 [0,1,0,0,0,1|2,0,0]=4 4148 B13R1.513 CC(C)OCCc1ccc(cc1)Br 92a42330d270226f0b8f4626448d178b [0,1,0,0,0,1|1,0,0]=3 4149 B13R1.513 CC(C)OCCc1ccc(cc1)Cl b94c8ec303b49e24587b748aa577bb0e [0,1,0,0,0,1|1,0,0]=3 4150 B13R1.513 CC(C)OCCc1ccc(cc1)F 15d66cf2e354de75444d479316bab16c [0,1,0,0,0,1|1,0,0]=3 4151 B13R1.513 CC(C)OCCc1ccc(cc1)I ee80cb34d61e98f964db4839113a235d [0,1,0,0,0,1|1,0,0]=3 4152 B13R1.513 CC(C)OCCc1ccc(cn1)F fbcb393091cdaa537d7dc269955532ca [0,1,0,0,0,1|2,0,0]=4 4153 B13R1.513 CC(C)OCCc1ccc(nc1)Br 989048b28decf60e892d3aaff308525c [0,1,0,0,0,1|2,0,0]=4 4154 B13R1.513 CC(C)OCCc1ccc(nc1)Cl cae2a5c73884fc152d6707ba88513234 [0,1,0,0,0,1|2,0,0]=4 4155 B13R1.513 CC(C)OCCc1ccc(nc1)F 364d49128e6c7f63db0576d0db317f8c [0,1,0,0,0,1|2,0,0]=4 4156 B13R1.513 CC(C)OCNc1ccc(cc1)Br d6807ac3e07ccd6a2ebc1414238bd576 [0,1,0,0,0,1|2,0,0]=4 4157 B13R1.513 CC(C)OCNc1ccc(cc1)Cl 9c5c8f25f181d78365c51b3e121adde5 [0,1,0,0,0,1|2,0,0]=4 4158 B13R1.513 CC(C)OCNc1ccc(cc1)F 8d20ce7bb61d3205d623ccc55c6a1551 [0,1,0,0,0,1|2,0,0]=4 4159 B13R1.513 CC(C)OCNc1ccc(cc1)I d72e12b1ee3a346a374b8f0c35df5008 [0,1,0,0,0,1|2,0,0]=4 4160 B13R1.513 CC(C)OCNc1ccc(cc1)S 2c8bf3e8afe5324054559c35186b320e [0,1,0,0,0,1|2,0,0]=4 4161 B13R1.513 CC(C)OCOc1ccc(cc1)Br aab642f641b2b3b122e69b69d15befa9 [0,1,0,0,0,1|2,0,0]=4 4162 B13R1.513 CC(C)OCOc1ccc(cc1)Cl 264ce1e416d9a98317cc7ed48da385cd [0,1,0,0,0,1|2,0,0]=4 4163 B13R1.513 CC(C)OCOc1ccc(cc1)F 3a9ef7225a501e8b15685ad95be5bbef [0,1,0,0,0,1|2,0,0]=4 4164 B13R1.513 CC(C)OCOc1ccc(cc1)I 11942fe7bae5c91868fce7b07d44e303 [0,1,0,0,0,1|2,0,0]=4 4165 B13R1.513 CC(C)OCOc1ccc(cc1)S d2374fee550bbd7e45d15f5ebdbf4b97 [0,1,0,0,0,1|2,0,0]=4 4166 B13R1.513 CC(F)COCc1ccc(cc1)Br 5f508bacf1198b0073459e754b43b84d [0,1,0,0,0,1|1,0,0]=3 4167 B13R1.513 CC(F)COCc1ccc(cc1)Cl 7b7d7f12cbe8112cf9538bd1912c6583 [0,1,0,0,0,1|1,0,0]=3 4168 B13R1.513 CC(F)COCc1ccc(cc1)F 0e818147af5381c33dbb24e191f0611d [0,1,0,0,0,1|1,0,0]=3 4169 B13R1.513 CC(F)COCc1ccc(cc1)I 7c26b10bea866f7c9fe5ab3a6b4e7afd [0,1,0,0,0,1|1,0,0]=3 4170 B13R1.513 CC(F)COCc1ccc(cn1)Br d6beb6129ebe8ae2b3d4706fba643103 [0,1,0,0,0,1|2,0,0]=4 4171 B13R1.513 CC(F)COCc1ccc(cn1)Cl b9dcc5fea3c8e6e49a0fbe195c3fe34e [0,1,0,0,0,1|2,0,0]=4 4172 B13R1.513 CC(F)COCc1ccc(cn1)F 822be92c2c79d294b8cabfe475079fa8 [0,1,0,0,0,1|2,0,0]=4 4173 B13R1.513 CC(F)COCc1ccc(nc1)Br 8f1da67feae8edba33a04949fa586608 [0,1,0,0,0,1|2,0,0]=4 4174 B13R1.513 CC(F)COCc1ccc(nc1)Cl 1044cd385b01a02c6a86735922ec9194 [0,1,0,0,0,1|2,0,0]=4 4175 B13R1.513 CC(F)COCc1ccc(nc1)F dd8c0af1d53e1b67d47c3cecf8e56770 [0,1,0,0,0,1|2,0,0]=4 4176 B13R1.513 CC(O)CCNc1c[nH]c(=S)cn1 3892f90f134104b7854c7096462625d8 [0,1,0,0,0,1|2,0,0]=4 4177 B13R1.513 CC(O)CCNc1ccc(=O)[nH]c1 09ebd3c410fecfced4909e3e9887e4af [0,1,0,0,0,1|1,0,0]=3 4178 B13R1.513 CC(O)CCNc1ccc(cc1)Br 1442e47fd064eb5543d195289f3d1903 [0,1,0,0,0,1|0,0,0]=2 4179 B13R1.513 CC(O)CCNc1ccc(cc1)Cl 2dc30cde19b31ab789c1c8ccaee179b0 [0,1,0,0,0,1|0,0,0]=2 4180 B13R1.513 CC(O)CCNc1ccc(cc1)F 61b6ecdf1393e175e301982512131b7e [0,1,0,0,0,1|0,0,0]=2 4181 B13R1.513 CC(O)CCNc1ccc(cc1)I a76f9b96360d2a58239c236f579053c5 [0,1,0,0,0,1|0,0,0]=2 4182 B13R1.513 CC(O)CCNc1ccc(cc1)S 733d0e80ec30c111c98df0cd09620503 [0,1,0,0,0,1|0,0,0]=2 4183 B13R1.513 CC(O)CCNc1ccc(cn1)Br fba51313af36e838b6fac9ae620457a0 [0,1,0,0,0,1|1,0,0]=3 4184 B13R1.513 CC(O)CCNc1ccc(cn1)Cl 81ee7fbae2ad31b2b6fbf215b366a99c [0,1,0,0,0,1|1,0,0]=3 4185 B13R1.513 CC(O)CCNc1ccc(cn1)F 56b5b7eb3ac2e5e0ce86ac7096d51912 [0,1,0,0,0,1|1,0,0]=3 4186 B13R1.513 CC(O)CCNc1ccc(cn1)I 8d492bc362faf97a7ca5334dada58c26 [0,1,0,0,0,1|1,0,0]=3 4187 B13R1.513 CC(O)CCNc1ccc(nc1)Br 39a514e50ef84d4991a0b283418bb096 [0,1,0,0,0,1|1,0,0]=3 4188 B13R1.513 CC(O)CCNc1ccc(nc1)Cl 4d75abbfd06cd691d35110b0542e5360 [0,1,0,0,0,1|1,0,0]=3 4189 B13R1.513 CC(O)CCNc1ccc(nc1)F c32da58c50ca8f188437082b355389c4 [0,1,0,0,0,1|1,0,0]=3 4190 B13R1.513 CC(O)CCNc1ccc(nc1)I 476d1ce6e85b0470277c6c299730f0ef [0,1,0,0,0,1|1,0,0]=3 4191 B13R1.513 CC(O)CCNc1ccc(nn1)Br 942eb66e363448aa7c8e6f26606b4dbf [0,1,0,0,0,1|2,0,0]=4 4192 B13R1.513 CC(O)CCNc1ccc(nn1)Cl b539bcbc8376b847dba42917b83c6f3b [0,1,0,0,0,1|2,0,0]=4 4193 B13R1.513 CC(O)CCNc1ccc(nn1)F 974bf4077804a01b7669e715eb9ef692 [0,1,0,0,0,1|2,0,0]=4 4194 B13R1.513 CC(O)CCNc1ccc(nn1)I 8a5d67bc40161b4103af4541ede62e45 [0,1,0,0,0,1|2,0,0]=4 4195 B13R1.513 CC(O)CCNc1cnc(=O)[nH]c1 7379d358b24a10b5009092a99776a976 [0,1,0,0,0,1|2,0,0]=4 4196 B13R1.513 CC(O)CCNc1cnc(cn1)Br 857481dd3d7a3e9f000fa58846027fb8 [0,1,0,0,0,1|2,0,0]=4 4197 B13R1.513 CC(O)CCNc1cnc(cn1)Cl 16afe8d8079664d552239040a162926a [0,1,0,0,0,1|2,0,0]=4 4198 B13R1.513 CC(O)CCNc1cnc(cn1)I 9536e66d777dce44a26607eeb41e1047 [0,1,0,0,0,1|2,0,0]=4 4199 B13R1.513 CC(O)CCNc1cnc(nc1)Br 3986a47a39c025ddb40b091f08b01c8e [0,1,0,0,0,1|2,0,0]=4 4200 B13R1.513 CC(O)CCNc1cnc(nc1)Cl f1c5e5e09f19cf1431b494e9c556c7b2 [0,1,0,0,0,1|2,0,0]=4 4201 B13R1.513 CC(O)CCNc1cnc(nc1)I d94121f816ead10ca6142e0c498a9657 [0,1,0,0,0,1|2,0,0]=4 4202 B13R1.513 CC(O)CCNc1ncc(cn1)Br 5cda27bc63b9882bd2bd01db4001c3a2 [0,1,0,0,0,1|2,0,0]=4 4203 B13R1.513 CC(O)CCNc1ncc(cn1)Cl 2768b42ce2b2f0979194424d83d56cbb [0,1,0,0,0,1|2,0,0]=4 4204 B13R1.513 CC(O)CCNc1ncc(cn1)F a015f9a457bcaf0374ebcfe01efd030e [0,1,0,0,0,1|2,0,0]=4 4205 B13R1.513 CC(O)CCNc1ncc(cn1)I 4d18c350ab30fe9abea99f3560fce98b [0,1,0,0,0,1|2,0,0]=4 4206 B13R1.513 CC(O)CNCc1ccc(=O)[nH]c1 57cf2d5c42f47ca2c88826d87840776c [0,1,0,0,0,1|1,0,0]=3 4207 B13R1.513 CC(O)CNCc1ccc(cc1)Br 6014f2501e287750b2918f60d68b19d8 [0,1,0,0,0,1|0,0,0]=2 4208 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 45af81d8e1ac236ee5c26d9cbdbe5fa5 [0,1,0,0,0,1|0,0,0]=2 4209 B13R1.513 CC(O)CNCc1ccc(cc1)F bd60b73c7d567ebe8807120d9ac91269 [0,1,0,0,0,1|0,0,0]=2 4210 B13R1.513 CC(O)CNCc1ccc(cc1)I 6e15796e35153de1ed966d5fb1cfa05a [0,1,0,0,0,1|0,0,0]=2 4211 B13R1.513 CC(O)CNCc1ccc(cn1)Br a0f9af82825ddb0ca52a1cffc8bbda97 [0,1,0,0,0,1|1,0,0]=3 4212 B13R1.513 CC(O)CNCc1ccc(cn1)Cl 8a44950de603c82ca0a17b1b173f6644 [0,1,0,0,0,1|1,0,0]=3 4213 B13R1.513 CC(O)CNCc1ccc(cn1)F 384add95c05de3f3795858e266535251 [0,1,0,0,0,1|1,0,0]=3 4214 B13R1.513 CC(O)CNCc1ccc(nc1)Br 9475bfc1e6b157eb1ebc2e8e93f975ce [0,1,0,0,0,1|1,0,0]=3 4215 B13R1.513 CC(O)CNCc1ccc(nc1)Cl 638c04e641575c91d38519c9afef746a [0,1,0,0,0,1|1,0,0]=3 4216 B13R1.513 CC(O)CNCc1ccc(nc1)F 3bac30ba9b2801070fa3372b2394e6cf [0,1,0,0,0,1|1,0,0]=3 4217 B13R1.513 CC(O)CNCc1ccc(nn1)Cl d1165f6702ff4cf4cb8c96ed23cf14db [0,1,0,0,0,1|2,0,0]=4 4218 B13R1.513 CC(O)CNCc1cnc(cn1)Br d448fa392656888044d450aea002252c [0,1,0,0,0,1|2,0,0]=4 4219 B13R1.513 CC(O)CNCc1cnc(cn1)Cl c92eff655f206244bc14750849b88b9d [0,1,0,0,0,1|2,0,0]=4 4220 B13R1.513 CC(O)CNCc1cnc(nc1)Cl bb3b8c10f557a796f4a7d476a2cd0967 [0,1,0,0,0,1|2,0,0]=4 4221 B13R1.513 CC(O)CNCc1ncc(cn1)Br 8c46c2d61ce48dd1da4387d5d393343d [0,1,0,0,0,1|2,0,0]=4 4222 B13R1.513 CC(O)CNCc1ncc(cn1)Cl 718f1d43753eca695f71dab0960c65db [0,1,0,0,0,1|2,0,0]=4 4223 B13R1.513 CC(O)CNCc1ncc(cn1)F 9d4d529d424f441286e22d03fdfe852c [0,1,0,0,0,1|2,0,0]=4 4224 B13R1.513 CC(S)COCc1ccc(cc1)Br 4d36a0d25e6bdf21126cd5f2bf61601b [0,1,0,0,0,1|0,1,0]=3 4225 B13R1.513 CC(S)COCc1ccc(cc1)Cl dfbdc7f6dcea0d256995f8993ac74a66 [0,1,0,0,0,1|0,1,0]=3 4226 B13R1.513 CC(S)COCc1ccc(cc1)F 1c704cb404e5c7176daabcf94cce0deb [0,1,0,0,0,1|0,1,0]=3 4227 B13R1.513 CC(S)COCc1ccc(cc1)I b891d5c46729ed8d98de866894c35c26 [0,1,0,0,0,1|0,1,0]=3 4228 B13R1.513 CC(S)COCc1ccc(cn1)Br 6d46c4df007e4b64bd00a52571ac55a6 [0,1,0,0,0,1|1,1,0]=4 4229 B13R1.513 CC(S)COCc1ccc(cn1)Cl 96c3f6a58b3b25c1cd4605ec6a3db273 [0,1,0,0,0,1|1,1,0]=4 4230 B13R1.513 CC(S)COCc1ccc(cn1)F 7be52581ed371e7ca2e8b401a9c38a5e [0,1,0,0,0,1|1,1,0]=4 4231 B13R1.513 CC(S)COCc1ccc(nc1)Br 6aebd8c7650e8f458cca06dec40bbff8 [0,1,0,0,0,1|1,1,0]=4 4232 B13R1.513 CC(S)COCc1ccc(nc1)Cl ccf163be55438ea728e1ee44bcd5fbf3 [0,1,0,0,0,1|1,1,0]=4 4233 B13R1.513 CC(S)COCc1ccc(nc1)F 193b4eb460de6e4625d9dac4ed1d135a [0,1,0,0,0,1|1,1,0]=4 4234 B13R1.513 CN(C)CCNc1ccc(cc1)Br b2e0d2fa8d9706db3a17ae89997baab1 [0,1,0,0,0,1|2,0,0]=4 4235 B13R1.513 CN(C)CCNc1ccc(cc1)Cl b246e22a527f046ada18422e41285913 [0,1,0,0,0,1|2,0,0]=4 4236 B13R1.513 CN(C)CCNc1ccc(cc1)F 9377b5c17cf8117bd33d0d10b2757f10 [0,1,0,0,0,1|2,0,0]=4 4237 B13R1.513 CN(C)CCNc1ccc(cc1)I 1f76490b7d160e9630c2404801e515a4 [0,1,0,0,0,1|2,0,0]=4 4238 B13R1.513 CN(C)CCNc1ccc(cc1)S a6c12a564641aca75cddb9bbfeb2b117 [0,1,0,0,0,1|2,0,0]=4 4239 B13R1.513 CN(C)CCOc1ccc(cc1)Br 006d3f97a0605becbad9612e5865ea27 [0,1,0,0,0,1|2,0,0]=4 4240 B13R1.513 CN(C)CCOc1ccc(cc1)Cl 237e047bb8a27a8a5cf4e1b0a974a028 [0,1,0,0,0,1|2,0,0]=4 4241 B13R1.513 CN(C)CCOc1ccc(cc1)F 5bb4b79ab15ead801a8f746ffbbe99ba [0,1,0,0,0,1|2,0,0]=4 4242 B13R1.513 CN(C)CCOc1ccc(cc1)I ea42085a400ca089f6b303d7e5503965 [0,1,0,0,0,1|2,0,0]=4 4243 B13R1.513 CN(C)CCOc1ccc(cc1)S ac31e7f57b92396a980a95d596a628b7 [0,1,0,0,0,1|2,0,0]=4 4244 B13R1.513 CN(C)CNCc1ccc(cc1)Br d5f5868c64b90377c494ab7aaaeed6bf [0,1,0,0,0,1|2,0,0]=4 4245 B13R1.513 CN(C)CNCc1ccc(cc1)Cl c52607938e5a45b87ebe75d05963986b [0,1,0,0,0,1|2,0,0]=4 4246 B13R1.513 CN(C)CNCc1ccc(cc1)F b7d8fc3a0f3a6989d8cf3daafdf96d21 [0,1,0,0,0,1|2,0,0]=4 4247 B13R1.513 CN(C)CNCc1ccc(cc1)I 390b900c35bf5c5193f621b5bf0d0d22 [0,1,0,0,0,1|2,0,0]=4 4248 B13R1.513 CN(C)COCc1ccc(cc1)Br 5af75e0de68d133d2c89d6dd32901f42 [0,1,0,0,0,1|2,0,0]=4 4249 B13R1.513 CN(C)COCc1ccc(cc1)Cl b4534e7e6a25c9b61def830aa0a52a19 [0,1,0,0,0,1|2,0,0]=4 4250 B13R1.513 CN(C)COCc1ccc(cc1)F b58f014311762040121edcccace7f83c [0,1,0,0,0,1|2,0,0]=4 4251 B13R1.513 CN(C)COCc1ccc(cc1)I 001caf1f7a45380ccb7439122e9c1a27 [0,1,0,0,0,1|2,0,0]=4 4252 B13R1.513 CN(C)COCc1ccc(cc1)S 2b9d6efd58a6eeee93da25ce86fc180a [0,1,0,0,0,1|2,0,0]=4 4253 B13R1.513 CS(=O)CCNc1ccc(cc1)Br 6744613e83ff6aaf6cf3113c1af355c2 [0,1,0,0,0,1|1,0,1]=4 4254 B13R1.513 CS(=O)CCNc1ccc(cc1)Cl 1d48ec221d7f47cec436f08b910816da [0,1,0,0,0,1|1,0,1]=4 4255 B13R1.513 CS(=O)CCNc1ccc(cc1)F 3f889c91f3314ff5c16ce88c31843f96 [0,1,0,0,0,1|1,0,1]=4 4256 B13R1.513 CS(=O)CCNc1ccc(cc1)I 10150e117ecf356002db70b564c489e3 [0,1,0,0,0,1|1,0,1]=4 4257 B13R1.513 CS(=O)CCNc1ccc(cc1)S 719c87e0e998e9c343abf670ceb20388 [0,1,0,0,0,1|1,0,1]=4 4258 B13R1.513 CS(=O)CCOc1ccc(cc1)Br 95c41e774a2bd24fad80b1704ea2ce89 [0,1,0,0,0,1|1,0,1]=4 4259 B13R1.513 CS(=O)CCOc1ccc(cc1)Cl 53f60c37131cf809240b5a6bfd448557 [0,1,0,0,0,1|1,0,1]=4 4260 B13R1.513 CS(=O)CCOc1ccc(cc1)F 904c72a6a36c2458d091df004ebf0b6b [0,1,0,0,0,1|1,0,1]=4 4261 B13R1.513 CS(=O)CCOc1ccc(cc1)I 4598ba463c64ceb3ce3412f371c80822 [0,1,0,0,0,1|1,0,1]=4 4262 B13R1.513 CS(=O)CCOc1ccc(cc1)S a17b7ab53a3b36bf2b6d3fa80472cae1 [0,1,0,0,0,1|1,0,1]=4 4263 B13R1.513 C[C@@H](F)COCc1ccc(cc1)Br ab4a6d0128969159c3cb57587eb2de16 [0,1,0,0,0,1|1,0,0]=3 4264 B13R1.513 C[C@@H](F)COCc1ccc(cc1)Cl f34dffc1f8fcacb5a6f0a0048410b236 [0,1,0,0,0,1|1,0,0]=3 4265 B13R1.513 C[C@@H](F)COCc1ccc(cc1)F 782ce892e1e04b19896fe1aa34894dcd [0,1,0,0,0,1|1,0,0]=3 4266 B13R1.513 C[C@@H](F)COCc1ccc(cc1)I 4709dd820f228da437d65729804fa311 [0,1,0,0,0,1|1,0,0]=3 4267 B13R1.513 C[C@@H](F)COCc1ccc(cn1)Br 8c0f1e7497fe72cf047c925c9926dd5f [0,1,0,0,0,1|2,0,0]=4 4268 B13R1.513 C[C@@H](F)COCc1ccc(cn1)Cl f73059196256851e520781df2dc35244 [0,1,0,0,0,1|2,0,0]=4 4269 B13R1.513 C[C@@H](F)COCc1ccc(cn1)F f917f302b41986976a2fac452bc4c493 [0,1,0,0,0,1|2,0,0]=4 4270 B13R1.513 C[C@@H](F)COCc1ccc(nc1)Br 160bb13da85c94668144c8b2c1a11ba6 [0,1,0,0,0,1|2,0,0]=4 4271 B13R1.513 C[C@@H](F)COCc1ccc(nc1)Cl cc10c871128808e29ccae3816e33bf5e [0,1,0,0,0,1|2,0,0]=4 4272 B13R1.513 C[C@@H](F)COCc1ccc(nc1)F 7d3acda6907efe98ed639d01fc3d04b9 [0,1,0,0,0,1|2,0,0]=4 4273 B13R1.513 C[C@@H](O)CCNc1c[nH]c(=S)cn1 a5012d34a3fa56e5ab8df724a36de8cc [0,1,0,0,0,1|2,0,0]=4 4274 B13R1.513 C[C@@H](O)CCNc1ccc(cc1)S c7275fc0231a05c7795a14d258a546d6 [0,1,0,0,0,1|0,0,0]=2 4275 B13R1.513 C[C@@H](O)CCNc1ncc(cn1)F 40983e7cb1c5057489239fea10e129b3 [0,1,0,0,0,1|2,0,0]=4 4276 B13R1.513 C[C@@H](O)CNCc1ccc(=O)[nH]c1 36a7a2ddbd88b2569e3d0e8f6cc1ff1f [0,1,0,0,0,1|1,0,0]=3 4277 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Br 60b8b6c62e2e2aa0eb51be7df1b02616 [0,1,0,0,0,1|0,0,0]=2 4278 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Cl dbd91e287f48eea4ac9af185c4d54533 [0,1,0,0,0,1|0,0,0]=2 4279 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)F c00494c3b2da864cd2e7d87821ce8d36 [0,1,0,0,0,1|0,0,0]=2 4280 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)I fec06ec0830490f80cc803a69a1384d0 [0,1,0,0,0,1|0,0,0]=2 4281 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)Br 3e2e67a4da2574b58b6167cec19d7d1c [0,1,0,0,0,1|1,0,0]=3 4282 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)Cl 3fe1192fcb215e9965ff3f2266fb5503 [0,1,0,0,0,1|1,0,0]=3 4283 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)F c8477ac2ce9cdb8fc6c787d3c9526469 [0,1,0,0,0,1|1,0,0]=3 4284 B13R1.513 C[C@@H](O)CNCc1ccc(nc1)Br 54e113445fb3da782d7c93bfb1fab7d2 [0,1,0,0,0,1|1,0,0]=3 4285 B13R1.513 C[C@@H](O)CNCc1ccc(nc1)Cl b11f163eabb8b698b545cbb9ae9599ea [0,1,0,0,0,1|1,0,0]=3 4286 B13R1.513 C[C@@H](O)CNCc1ccc(nc1)F ed63bf09704e7c51898dbe9bc7d01076 [0,1,0,0,0,1|1,0,0]=3 4287 B13R1.513 C[C@@H](O)CNCc1ccc(nn1)Cl fcf75e7820db7840a51c94154f687089 [0,1,0,0,0,1|2,0,0]=4 4288 B13R1.513 C[C@@H](O)CNCc1cnc(cn1)Br 3556d7008a2637862178323d564e8c9c [0,1,0,0,0,1|2,0,0]=4 4289 B13R1.513 C[C@@H](O)CNCc1cnc(cn1)Cl 17b595efc7d4d29d6b4b661d90a89d60 [0,1,0,0,0,1|2,0,0]=4 4290 B13R1.513 C[C@@H](O)CNCc1cnc(nc1)Cl 4d860cc644bb67a6f3add512cc8a70dc [0,1,0,0,0,1|2,0,0]=4 4291 B13R1.513 C[C@@H](O)CNCc1ncc(cn1)Br 508882a2cfe3e3aa46223b1bb04924b8 [0,1,0,0,0,1|2,0,0]=4 4292 B13R1.513 C[C@@H](O)CNCc1ncc(cn1)Cl 5a8b73735b2b704328eb4ad40c2b5310 [0,1,0,0,0,1|2,0,0]=4 4293 B13R1.513 C[C@@H](O)CNCc1ncc(cn1)F d8359465372a6bb0cfdabf797f9a09c7 [0,1,0,0,0,1|2,0,0]=4 4294 B13R1.513 C[C@H](F)COCc1ccc(cc1)Br 3713a3ced03092cace31c97540af9c05 [0,1,0,0,0,1|1,0,0]=3 4295 B13R1.513 C[C@H](F)COCc1ccc(cc1)Cl 1bcec87017c0f95b87b1f4d9a266618a [0,1,0,0,0,1|1,0,0]=3 4296 B13R1.513 C[C@H](F)COCc1ccc(cc1)F 706ab049bab5d17f3828bca88b1ef17f [0,1,0,0,0,1|1,0,0]=3 4297 B13R1.513 C[C@H](F)COCc1ccc(cc1)I 334df28f957db9e7e1995579c14f59db [0,1,0,0,0,1|1,0,0]=3 4298 B13R1.513 C[C@H](F)COCc1ccc(cn1)Br 2c0ba8afde1fcc2f6b2003abdaa71469 [0,1,0,0,0,1|2,0,0]=4 4299 B13R1.513 C[C@H](F)COCc1ccc(cn1)Cl 23fd44ea1ae53a68258dc6837ce13e4f [0,1,0,0,0,1|2,0,0]=4 4300 B13R1.513 C[C@H](F)COCc1ccc(cn1)F 39db880d7d275f2532876ed29e68f8ba [0,1,0,0,0,1|2,0,0]=4 4301 B13R1.513 C[C@H](F)COCc1ccc(nc1)Br 5b7664a7b44f4d10df49412ab731e4ac [0,1,0,0,0,1|2,0,0]=4 4302 B13R1.513 C[C@H](F)COCc1ccc(nc1)Cl e5588e3d9bc9e53e3468af2459ca79fe [0,1,0,0,0,1|2,0,0]=4 4303 B13R1.513 C[C@H](F)COCc1ccc(nc1)F 9e007b9265e2706da0d8c3df5daa8359 [0,1,0,0,0,1|2,0,0]=4 4304 B13R1.513 C[C@H](O)CCNc1c[nH]c(=S)cn1 f46c87b61dc30112281f3cfacb63bb3c [0,1,0,0,0,1|2,0,0]=4 4305 B13R1.513 C[C@H](O)CCNc1ccc(cc1)S 0009e3240ab4172d8cc838f7ae8b0a4e [0,1,0,0,0,1|0,0,0]=2 4306 B13R1.513 C[C@H](O)CCNc1ncc(cn1)F 39974f365f000aa7256dfdbf24922e2d [0,1,0,0,0,1|2,0,0]=4 4307 B13R1.513 C[C@H](O)CNCc1ccc(=O)[nH]c1 23694026a195df96feab1e9805d6220a [0,1,0,0,0,1|1,0,0]=3 4308 B13R1.513 C[C@H](O)CNCc1ccc(cc1)Br 8b5a3e07b63f385f1253805025829f61 [0,1,0,0,0,1|0,0,0]=2 4309 B13R1.513 C[C@H](O)CNCc1ccc(cc1)Cl a807b1188b0e036b83306086b654fbf1 [0,1,0,0,0,1|0,0,0]=2 4310 B13R1.513 C[C@H](O)CNCc1ccc(cc1)F 856d877eb26ba8c25e36011c9943cd64 [0,1,0,0,0,1|0,0,0]=2 4311 B13R1.513 C[C@H](O)CNCc1ccc(cc1)I d843bf5949de18be607cd3b8d1acf729 [0,1,0,0,0,1|0,0,0]=2 4312 B13R1.513 C[C@H](O)CNCc1ccc(cn1)Br a6400e5c8296c72453c6d5d61ee7fbf1 [0,1,0,0,0,1|1,0,0]=3 4313 B13R1.513 C[C@H](O)CNCc1ccc(cn1)Cl c973a842a65e8f7efedf457856caa4db [0,1,0,0,0,1|1,0,0]=3 4314 B13R1.513 C[C@H](O)CNCc1ccc(cn1)F 49d52babb8179c0b86c7f76a6660d94b [0,1,0,0,0,1|1,0,0]=3 4315 B13R1.513 C[C@H](O)CNCc1ccc(nc1)Br 12f948a11988fe58bd2b4d1ce904051c [0,1,0,0,0,1|1,0,0]=3 4316 B13R1.513 C[C@H](O)CNCc1ccc(nc1)Cl 35ddab2ed3fe693bae671cc6074d4e41 [0,1,0,0,0,1|1,0,0]=3 4317 B13R1.513 C[C@H](O)CNCc1ccc(nc1)F 087a42c3fe4cc59a9d1bc76aba498859 [0,1,0,0,0,1|1,0,0]=3 4318 B13R1.513 C[C@H](O)CNCc1ccc(nn1)Cl 320667035874b6f4df0a60f6f6d6bac1 [0,1,0,0,0,1|2,0,0]=4 4319 B13R1.513 C[C@H](O)CNCc1cnc(cn1)Br bc876970697e017f9c6361ee09011a4a [0,1,0,0,0,1|2,0,0]=4 4320 B13R1.513 C[C@H](O)CNCc1cnc(cn1)Cl 2f20490fa0a80d362c88f5ea75dc4f56 [0,1,0,0,0,1|2,0,0]=4 4321 B13R1.513 C[C@H](O)CNCc1cnc(nc1)Cl b967cc889ad9c7339d3edf87f401d150 [0,1,0,0,0,1|2,0,0]=4 4322 B13R1.513 C[C@H](O)CNCc1ncc(cn1)Br 8de2892c64ec21530231d1f797fe247a [0,1,0,0,0,1|2,0,0]=4 4323 B13R1.513 C[C@H](O)CNCc1ncc(cn1)Cl 8877193ce6d4c6c722310808687ed1bb [0,1,0,0,0,1|2,0,0]=4 4324 B13R1.513 C[C@H](O)CNCc1ncc(cn1)F 145b1151177ecefa86aac00f128dda58 [0,1,0,0,0,1|2,0,0]=4 4325 B13R1.513 Cc1ccc(cc1)CCNC(C)C dcb33f8e3a3328245bb1e315273e2474 [0,1,0,0,0,1|1,0,0]=3 4326 B13R1.513 Cc1ccc(cc1)CCOC(C)C c40e0f5ec2a785e1448a9d4bbbda7223 [0,1,0,0,0,1|1,0,0]=3 4327 B13R1.513 Cc1ccc(cc1)CNCC(=O)O a004830896e7dfab484c538a72117632 [0,1,0,0,0,1|1,0,1]=4 4328 B13R1.513 Cc1ccc(cc1)CNCC(C)C 8007373e36ed399b3c91ab60c1eddd1e [0,1,0,0,0,1|1,0,0]=3 4329 B13R1.513 Cc1ccc(cc1)CNCC(C)O 4850723ba861dc5e09f536a03090346b [0,1,0,0,0,1|0,0,0]=2 4330 B13R1.513 Cc1ccc(cc1)CNCC(F)F c64243e1576e1d6803bfcb2c7cbeb8d4 [0,1,0,0,0,1|2,0,0]=4 4331 B13R1.513 Cc1ccc(cc1)CNCN(C)C c4b2d9b6b8a7d6299271f9c2abb42890 [0,1,0,0,0,1|2,0,0]=4 4332 B13R1.513 Cc1ccc(cc1)CNC[C@@H](C)O 7b28e33f9a7e2556c34b07317877c47d [0,1,0,0,0,1|0,0,0]=2 4333 B13R1.513 Cc1ccc(cc1)CNC[C@H](C)O f439c46b5159844a576401007fd2b3b4 [0,1,0,0,0,1|0,0,0]=2 4334 B13R1.513 Cc1ccc(cc1)COCC(=O)O 5605622eeb68658b6116d89ce68c587a [0,1,0,0,0,1|1,0,1]=4 4335 B13R1.513 Cc1ccc(cc1)COCC(C)C fef2e1b898316f09dabe51f30ed565c5 [0,1,0,0,0,1|1,0,0]=3 4336 B13R1.513 Cc1ccc(cc1)COCC(C)F aa0e37c5a5420893838d9eadb51e26d3 [0,1,0,0,0,1|1,0,0]=3 4337 B13R1.513 Cc1ccc(cc1)COCC(C)S 3fa9881d4f8749958676822017cc12ee [0,1,0,0,0,1|0,1,0]=3 4338 B13R1.513 Cc1ccc(cc1)COCC(F)F 377177b87b829ffdb2472c5eaa7c9e03 [0,1,0,0,0,1|2,0,0]=4 4339 B13R1.513 Cc1ccc(cc1)COCN(C)C 8d78d95a75bc0de1edc88c493240435b [0,1,0,0,0,1|2,0,0]=4 4340 B13R1.513 Cc1ccc(cc1)COCS(=O)O 3ca2fe698dd77cf0ae1989ed73ce48e1 [0,1,0,0,0,1|2,0,0]=4 4341 B13R1.513 Cc1ccc(cc1)COC[C@@H](C)F 4f72db0ccfb0de1aaa15e2932ddb45f6 [0,1,0,0,0,1|1,0,0]=3 4342 B13R1.513 Cc1ccc(cc1)COC[C@H](C)F 1d45633efe4ea071353d30816f23db7d [0,1,0,0,0,1|1,0,0]=3 4343 B13R1.513 Cc1ccc(cc1)NCCC(=O)O 3d83b1a84d8ce111377178485660972e [0,1,0,0,0,1|1,0,1]=4 4344 B13R1.513 Cc1ccc(cc1)NCCC(C)C f6c18c3803c1c770f7d1606f4a35adbc [0,1,0,0,0,1|1,0,0]=3 4345 B13R1.513 Cc1ccc(cc1)NCCC(C)O 162c440e82e2ad8ba1870e40632031ad [0,1,0,0,0,1|0,0,0]=2 4346 B13R1.513 Cc1ccc(cc1)NCCC(F)F d8b0ec6b2c48b8fa233b50eb0d9cac05 [0,1,0,0,0,1|2,0,0]=4 4347 B13R1.513 Cc1ccc(cc1)NCCN(C)C 7357889e48118de44053c26c3d367a00 [0,1,0,0,0,1|2,0,0]=4 4348 B13R1.513 Cc1ccc(cc1)NCCS(=O)C 8761b787f982b00c172b3dd34329bbba [0,1,0,0,0,1|1,0,1]=4 4349 B13R1.513 Cc1ccc(cc1)NCCS(=O)O 7af9cdd26e89fe38628d4b499f797890 [0,1,0,0,0,1|2,0,0]=4 4350 B13R1.513 Cc1ccc(cc1)NCC[C@@H](C)O 7ffa52480a33aa7d77fa22728757bcfd [0,1,0,0,0,1|0,0,0]=2 4351 B13R1.513 Cc1ccc(cc1)NCC[C@H](C)O 27ac2dea21e6f5dcefbf2a9361ded200 [0,1,0,0,0,1|0,0,0]=2 4352 B13R1.513 Cc1ccc(cc1)NCOC(C)C 8a66698ae9db2f34016e08328afa6535 [0,1,0,0,0,1|2,0,0]=4 4353 B13R1.513 Cc1ccc(cc1)OCCC(C)C 24d657586e73773d451964ccd9d82a09 [0,1,0,0,0,1|1,0,0]=3 4354 B13R1.513 Cc1ccc(cc1)OCCN(C)C 95736bdc8eb0fef5fa5268203e9b90d3 [0,1,0,0,0,1|2,0,0]=4 4355 B13R1.513 Cc1ccc(cc1)OCCS(=O)C 23d378a5f737f5cc08e39a3531158887 [0,1,0,0,0,1|1,0,1]=4 4356 B13R1.513 Cc1ccc(cc1)OCOC(C)C 79ca320565bb64237ff9f23f561e43fd [0,1,0,0,0,1|2,0,0]=4 4357 B13R1.513 Cc1ccc(cn1)CCNC(C)C dbed4fd6203190d16d939ed53760967c [0,1,0,0,0,1|2,0,0]=4 4358 B13R1.513 Cc1ccc(cn1)CCOC(C)C 2e84561e3293cd5d3bd4a366d3f8ceea [0,1,0,0,0,1|2,0,0]=4 4359 B13R1.513 Cc1ccc(cn1)CNCC(C)C 49bbb1f5e4651726db8e31e81c267df2 [0,1,0,0,0,1|2,0,0]=4 4360 B13R1.513 Cc1ccc(cn1)CNCC(C)O b6491d334b939fb961484dcb7e535652 [0,1,0,0,0,1|1,0,0]=3 4361 B13R1.513 Cc1ccc(cn1)CNC[C@@H](C)O dd71c2e4f577cad2929dacf1abf636af [0,1,0,0,0,1|1,0,0]=3 4362 B13R1.513 Cc1ccc(cn1)CNC[C@H](C)O 4bc2d7f42a4fab8ac1b87ca43fac2418 [0,1,0,0,0,1|1,0,0]=3 4363 B13R1.513 Cc1ccc(cn1)COCC(C)C 13f3f581cf8554d78eeffdb69b5d860d [0,1,0,0,0,1|2,0,0]=4 4364 B13R1.513 Cc1ccc(cn1)COCC(C)F 5f9a16d9e52d0af3c0f5981f4b6f2016 [0,1,0,0,0,1|2,0,0]=4 4365 B13R1.513 Cc1ccc(cn1)COCC(C)S 0ba89c0cfe080c1b538bb59fb5235b0d [0,1,0,0,0,1|1,1,0]=4 4366 B13R1.513 Cc1ccc(cn1)COC[C@@H](C)F bcd5c036c5aabaad80fdc2c9cac5d201 [0,1,0,0,0,1|2,0,0]=4 4367 B13R1.513 Cc1ccc(cn1)COC[C@H](C)F e8f303db9148faf3a90fdaa1cfe4b58c [0,1,0,0,0,1|2,0,0]=4 4368 B13R1.513 Cc1ccc(cn1)NCCC(C)C e1d8de0bde61b74f361044600ab56154 [0,1,0,0,0,1|2,0,0]=4 4369 B13R1.513 Cc1ccc(cn1)NCCC(C)O 2c739a2a060abb3d37222a42b49cd2f3 [0,1,0,0,0,1|1,0,0]=3 4370 B13R1.513 Cc1ccc(cn1)NCC[C@@H](C)O 84b5b935ed79736e7ccb0bb5d241da23 [0,1,0,0,0,1|1,0,0]=3 4371 B13R1.513 Cc1ccc(cn1)NCC[C@H](C)O 9476437f0d032b873e0bc873dfa900cb [0,1,0,0,0,1|1,0,0]=3 4372 B13R1.513 Cc1ccc(cn1)OCCC(C)C c074602a990299dd5e7a7ea847d3aed6 [0,1,0,0,0,1|2,0,0]=4 4373 B13R1.513 Cc1ccc(nc1)CCOC(C)C ebe6a28c9c93b938cf9193135c229670 [0,1,0,0,0,1|2,0,0]=4 4374 B13R1.513 Cc1ccc(nc1)CNCC(C)C 0a9767d5cd79587a391c8c52e373666b [0,1,0,0,0,1|2,0,0]=4 4375 B13R1.513 Cc1ccc(nc1)CNCC(C)O 07750fa85b0cf12b949c50e4de3c6e38 [0,1,0,0,0,1|1,0,0]=3 4376 B13R1.513 Cc1ccc(nc1)CNC[C@@H](C)O 14f473976f36516c93902eff6d86e2c1 [0,1,0,0,0,1|1,0,0]=3 4377 B13R1.513 Cc1ccc(nc1)CNC[C@H](C)O 3d66ad78fdd3d86050c4f2282dac2fad [0,1,0,0,0,1|1,0,0]=3 4378 B13R1.513 Cc1ccc(nc1)COCC(C)C 0092d6d52e863756f85726cd722ea68b [0,1,0,0,0,1|2,0,0]=4 4379 B13R1.513 Cc1ccc(nc1)COCC(C)F 553b9a97bbc1050603b68e56d0fbf8fa [0,1,0,0,0,1|2,0,0]=4 4380 B13R1.513 Cc1ccc(nc1)COCC(C)S 6f4d5d3a36660deb6673622e003d037e [0,1,0,0,0,1|1,1,0]=4 4381 B13R1.513 Cc1ccc(nc1)COC[C@@H](C)F 80bca922787a9b224cc429e5b9a8947e [0,1,0,0,0,1|2,0,0]=4 4382 B13R1.513 Cc1ccc(nc1)COC[C@H](C)F 0267868343069263bf2dde5a789b1b4e [0,1,0,0,0,1|2,0,0]=4 4383 B13R1.513 Cc1ccc(nc1)NCCC(C)C db5538cdcc27716208a4ae531ea33599 [0,1,0,0,0,1|2,0,0]=4 4384 B13R1.513 Cc1ccc(nc1)NCCC(C)O b417b978d3435de1bd310855911a11b5 [0,1,0,0,0,1|1,0,0]=3 4385 B13R1.513 Cc1ccc(nc1)OCCC(C)C a9c4b079c0a1396cd9445a30a1f308bc [0,1,0,0,0,1|2,0,0]=4 4386 B13R1.513 Cc1ccc(nn1)CNCC(C)O 51fe124f08abe606bfe1af425c2607de [0,1,0,0,0,1|2,0,0]=4 4387 B13R1.513 Cc1ccc(nn1)CNC[C@@H](C)O 2f8e516703d09fc33b280ed9b0c99154 [0,1,0,0,0,1|2,0,0]=4 4388 B13R1.513 Cc1ccc(nn1)CNC[C@H](C)O 19a1b1e358a1a0ac0a708ae705f2e033 [0,1,0,0,0,1|2,0,0]=4 4389 B13R1.513 Cc1ccc(nn1)NCCC(C)O cd9586009f542d1361fd9cb54bf82708 [0,1,0,0,0,1|2,0,0]=4 4390 B13R1.513 Cc1ccc(nn1)NCC[C@@H](C)O 1c49405002585b027ad7aded13b35320 [0,1,0,0,0,1|2,0,0]=4 4391 B13R1.513 Cc1ccc(nn1)NCC[C@H](C)O f05bfd15d59303fa87a362feebf29962 [0,1,0,0,0,1|2,0,0]=4 4392 B13R1.513 Cc1cnc(cn1)CNCC(C)O d75f0e5674c9d0248f2bafa6e313aab0 [0,1,0,0,0,1|2,0,0]=4 4393 B13R1.513 Cc1cnc(cn1)CNC[C@H](C)O 41a8bb0ecd69aaab10da2f4fa20c2cb1 [0,1,0,0,0,1|2,0,0]=4 4394 B13R1.513 Cc1cnc(cn1)NCCC(C)O 8563657ae1de0ade422831f12de2c23d [0,1,0,0,0,1|2,0,0]=4 4395 B13R1.513 Cc1cnc(nc1)CNCC(C)O 01777e0f120cbc9a2a94990c97bbe689 [0,1,0,0,0,1|2,0,0]=4 4396 B13R1.513 Cc1cnc(nc1)CNC[C@@H](C)O 00db1a70ab9fb76b00840c3b1897fe52 [0,1,0,0,0,1|2,0,0]=4 4397 B13R1.513 Cc1cnc(nc1)CNC[C@H](C)O 93ab3e050d880447385d1ba43210cbc2 [0,1,0,0,0,1|2,0,0]=4 4398 B13R1.513 Cc1cnc(nc1)NCCC(C)O 6d7069b5c919e28a7c5a56c0c911f042 [0,1,0,0,0,1|2,0,0]=4 4399 B13R1.513 Cc1ncc(cn1)CNCC(C)O 8c265a309399625ea718a0fe1b53da03 [0,1,0,0,0,1|2,0,0]=4 4400 B13R1.513 Cc1ncc(cn1)CNC[C@@H](C)O e3a5cd96e31a997b20c0abb3f55e23d1 [0,1,0,0,0,1|2,0,0]=4 4401 B13R1.513 Cc1ncc(cn1)CNC[C@H](C)O 14e7a68623d5d7fdd40b799a4187bb29 [0,1,0,0,0,1|2,0,0]=4 4402 B13R1.513 Cc1ncc(cn1)NCCC(C)O b10c3e34cdb29f88b09f00ad54b52305 [0,1,0,0,0,1|2,0,0]=4 4403 B13R1.513 FC(F)CCNc1ccc(cc1)S 0a569e427c66351011ce85507d124839 [0,1,0,0,0,1|2,0,0]=4 4404 B13R1.513 FC(F)CNCc1ccc(cc1)Br 6b7c06a8accbc130e8db5c93ad009d4b [0,1,0,0,0,1|2,0,0]=4 4405 B13R1.513 FC(F)CNCc1ccc(cc1)Cl 067b60c88847e89f7160c18e52c4078d [0,1,0,0,0,1|2,0,0]=4 4406 B13R1.513 FC(F)CNCc1ccc(cc1)I e92654c36e6bab9fcf70f2e04b66ec60 [0,1,0,0,0,1|2,0,0]=4 4407 B13R1.513 FC(F)COCc1ccc(cc1)Br 6c859892983538f49ecdbac4c160f7bb [0,1,0,0,0,1|2,0,0]=4 4408 B13R1.513 FC(F)COCc1ccc(cc1)Cl 22de692eb217c9e4252db8a4cf6ace2e [0,1,0,0,0,1|2,0,0]=4 4409 B13R1.513 FC(F)COCc1ccc(cc1)I 5aef593e62563358e2718adf9a1e465f [0,1,0,0,0,1|2,0,0]=4 4410 B13R1.513 FC(F)COCc1ccc(cc1)S c0f61d6fbe3ad7f8d3b54967d13ccd26 [0,1,0,0,0,1|2,0,0]=4 4411 B13R1.513 Fc1ccc(cc1)CNCC(F)F 488e3424f9966dc3748a02437245fe8b [0,1,0,0,0,1|2,0,0]=4 4412 B13R1.513 Fc1ccc(cc1)COCC(F)F 9324f5bf631db417be5ccd5ead2c642f [0,1,0,0,0,1|2,0,0]=4 4413 B13R1.513 O=C(O)CCNc1ccc(cc1)Br 748887e6e8fcc91d60d974a20779697e [0,1,0,0,0,1|1,0,1]=4 4414 B13R1.513 O=C(O)CCNc1ccc(cc1)Cl c9ec62df6f8c7e8af1af040ae6153b00 [0,1,0,0,0,1|1,0,1]=4 4415 B13R1.513 O=C(O)CCNc1ccc(cc1)F 4a2f682c10c82640ab272e7e6c2a8600 [0,1,0,0,0,1|1,0,1]=4 4416 B13R1.513 O=C(O)CCNc1ccc(cc1)I 18f211598f3419cd104c36445b75d95b [0,1,0,0,0,1|1,0,1]=4 4417 B13R1.513 O=C(O)CCNc1ccc(cc1)S 0c47aca2df32a2161cea9c1382a461ca [0,1,0,0,0,1|1,0,1]=4 4418 B13R1.513 O=C(O)CCOc1ccc(cc1)Br 9a064c1da7d24908c73cec67f76779cd [0,1,0,0,0,1|1,0,1]=4 4419 B13R1.513 O=C(O)CNCc1ccc(cc1)Br ccc8566cf124466390cc6c61dcda4949 [0,1,0,0,0,1|1,0,1]=4 4420 B13R1.513 O=C(O)CNCc1ccc(cc1)Cl c65e0446dcbc5b95120880b9826c0477 [0,1,0,0,0,1|1,0,1]=4 4421 B13R1.513 O=C(O)CNCc1ccc(cc1)F 86909fc1c3483b9f36bc179533c836d4 [0,1,0,0,0,1|1,0,1]=4 4422 B13R1.513 O=C(O)CNCc1ccc(cc1)I a6c35e8876930323002cac840cce0db5 [0,1,0,0,0,1|1,0,1]=4 4423 B13R1.513 O=C(O)COCc1ccc(cc1)Br 90f73b1de5f1abac695bc485319ae552 [0,1,0,0,0,1|1,0,1]=4 4424 B13R1.513 O=C(O)COCc1ccc(cc1)Cl baf26ed161507fd9e120740c40244324 [0,1,0,0,0,1|1,0,1]=4 4425 B13R1.513 O=C(O)COCc1ccc(cc1)F c74bedb19df3d0b6d6bd5a32cda226aa [0,1,0,0,0,1|1,0,1]=4 4426 B13R1.513 O=C(O)COCc1ccc(cc1)I f440337f2985a702586fa6f7e214550e [0,1,0,0,0,1|1,0,1]=4 4427 B13R1.513 O=C(O)COCc1ccc(cc1)S dcf435ea6cafc60379d421cd3a58279a [0,1,0,0,0,1|1,0,1]=4 4428 B13R1.513 O=S(O)CCNc1ccc(cc1)F 993a3cef4664925cbac89aa6af4193dc [0,1,0,0,0,1|2,0,0]=4 4429 B13R1.513 O=S(O)CCNc1ccc(cc1)S 511b51521fb29c0351ce2375c086ba69 [0,1,0,0,0,1|2,0,0]=4 4430 B13R1.513 O=S(O)COCc1ccc(cc1)Br 07666762c481193269a032212a322060 [0,1,0,0,0,1|2,0,0]=4 4431 B13R1.513 O=S(O)COCc1ccc(cc1)Cl e2b417014146dbdfeb0b5843178e4c8e [0,1,0,0,0,1|2,0,0]=4 4432 B13R1.513 O=S(O)COCc1ccc(cc1)F f8006e9fbe2f0473b0d7cec2e466d04f [0,1,0,0,0,1|2,0,0]=4 4433 B13R1.513 O=S(O)COCc1ccc(cc1)I f53b455b1e532cac3472321f4f0e7351 [0,1,0,0,0,1|2,0,0]=4 4434 B13R1.718 BrCC(Br)CNCc1ccccc1 b58b32acfda9c38f27de0959db216db5 [0,1,0,0,0,1|1,0,0]=3 4435 B13R1.718 BrCC(Br)CNCc1ccccn1 3b6bde56c0e856caf302067efb0d5871 [0,1,0,0,0,1|2,0,0]=4 4436 B13R1.718 BrCC(Br)CNCc1cccnc1 05aedb9d8ecbf862ff5726bb21e07e01 [0,1,0,0,0,1|2,0,0]=4 4437 B13R1.718 BrCC(Br)COCc1ccccc1 313bfc2d064ffc3420f240e401102d08 [0,1,0,0,0,1|1,0,0]=3 4438 B13R1.718 BrCC(Br)COCc1ccccn1 23dae8838a0363d61d3af279d9acc891 [0,1,0,0,0,1|2,0,0]=4 4439 B13R1.718 BrCC(Br)COCc1cccnc1 4629c74a382f2299f3e105b42e2a9f1b [0,1,0,0,0,1|2,0,0]=4 4440 B13R1.718 C#CC(C)NCCc1ccccc1 2c8d145f05d337c5583fb92a59a977f3 [0,1,0,0,0,1|1,0,0]=3 4441 B13R1.718 C#CC(C)NCCc1ccccn1 34ffc885e9539d4e1b1043bd5f39e18b [0,1,0,0,0,1|2,0,0]=4 4442 B13R1.718 C#CC(C)NCCc1cccnc1 3d6404e86a66a0b242cd30c6bf5baf4b [0,1,0,0,0,1|2,0,0]=4 4443 B13R1.718 C#CC(C)NCCc1ccncc1 bcb5e611097b92233724d3311848277a [0,1,0,0,0,1|2,0,0]=4 4444 B13R1.718 C#CC(C)NCSc1ccccc1 adcf8ea86e2906e454c349bc212e9d9e [0,1,0,0,0,1|2,0,0]=4 4445 B13R1.718 C#CC(C)OCCc1ccccc1 b402d4668ff8547081a9183c2915db76 [0,1,0,0,0,1|1,0,0]=3 4446 B13R1.718 C#CC(C)OCCc1ccccn1 5f2cc180b59156135739dab25b61935b [0,1,0,0,0,1|2,0,0]=4 4447 B13R1.718 C#CC(C)OCCc1cccnc1 bd79ec98e91f11a53aa78f1350fd4747 [0,1,0,0,0,1|2,0,0]=4 4448 B13R1.718 C#CC(C)OCCc1ccncc1 0755108c3294840d80169f82dc28b73b [0,1,0,0,0,1|2,0,0]=4 4449 B13R1.718 C#C[C@@H](C)NCCc1ccccc1 f689b53bc0096babd332bbdd9b580f5c [0,1,0,0,0,1|1,0,0]=3 4450 B13R1.718 C#C[C@@H](C)NCCc1ccccn1 8cdbd4194f352281c605c57d0a397498 [0,1,0,0,0,1|2,0,0]=4 4451 B13R1.718 C#C[C@@H](C)NCCc1cccnc1 36ed7c2f3fa17734b06517c045dcfaa7 [0,1,0,0,0,1|2,0,0]=4 4452 B13R1.718 C#C[C@@H](C)NCCc1ccncc1 c5bf27f79eec3c6ff6731e0e55570cc9 [0,1,0,0,0,1|2,0,0]=4 4453 B13R1.718 C#C[C@@H](C)NCSc1ccccc1 844c4dfebe60cac88995374ecbe7d4ce [0,1,0,0,0,1|2,0,0]=4 4454 B13R1.718 C#C[C@@H](C)OCCc1ccccc1 c10330c3e2c6a9ac224cf1954de7909b [0,1,0,0,0,1|1,0,0]=3 4455 B13R1.718 C#C[C@@H](C)OCCc1ccccn1 00bfb41bfffe0baf44d7d7749b0e6fba [0,1,0,0,0,1|2,0,0]=4 4456 B13R1.718 C#C[C@@H](C)OCCc1cccnc1 4001928b87afdfe4ee2b3c2b98316f00 [0,1,0,0,0,1|2,0,0]=4 4457 B13R1.718 C#C[C@@H](C)OCCc1ccncc1 686cb273223d0876d57e0b3b6e7490d9 [0,1,0,0,0,1|2,0,0]=4 4458 B13R1.718 C#C[C@H](C)NCCc1ccccc1 c2c8a94b54a28eae255c4c75946be3f5 [0,1,0,0,0,1|1,0,0]=3 4459 B13R1.718 C#C[C@H](C)NCCc1ccccn1 aef9cc8bcf582c4c34abad00b039f019 [0,1,0,0,0,1|2,0,0]=4 4460 B13R1.718 C#C[C@H](C)NCCc1cccnc1 6d49dbd43e7fd5e3b6bba4ab1ace8ba6 [0,1,0,0,0,1|2,0,0]=4 4461 B13R1.718 C#C[C@H](C)NCCc1ccncc1 b24efa1d87b06873eef512327a2b7fee [0,1,0,0,0,1|2,0,0]=4 4462 B13R1.718 C#C[C@H](C)NCSc1ccccc1 f47ba596b2b7866b894ddd71bcb14bb3 [0,1,0,0,0,1|2,0,0]=4 4463 B13R1.718 C#C[C@H](C)OCCc1ccccc1 ccd277818f91f3957e5917ac41af9fad [0,1,0,0,0,1|1,0,0]=3 4464 B13R1.718 C#C[C@H](C)OCCc1ccccn1 fa787fc17c57fa6a4ae78bc53896eb49 [0,1,0,0,0,1|2,0,0]=4 4465 B13R1.718 C#C[C@H](C)OCCc1cccnc1 b04471ae1cab3a572b76c6cd5883368f [0,1,0,0,0,1|2,0,0]=4 4466 B13R1.718 C#C[C@H](C)OCCc1ccncc1 b48fd70e964c94de7b79c47db5bd7e70 [0,1,0,0,0,1|2,0,0]=4 4467 B13R1.718 C/C(=C\I)/COCc1ccccc1 355ceb8d91a4c69510453e29a1cfa3a2 [0,1,0,0,0,1|1,0,1]=4 4468 B13R1.718 C=C(CC)CNCc1ccccc1 7b6d15ba80b42d586edb2259dfbe6885 [0,1,0,0,0,1|1,0,1]=4 4469 B13R1.718 C=C(CNCc1ccccc1)OC a6bb62f62354597296a749225c1fa97e [0,1,0,0,0,1|0,0,2]=4 4470 B13R1.718 C=C(CO)CNCc1ccccc1 aad443084a8c9078fa19f1878e96cd05 [0,1,0,0,0,1|0,0,2]=4 4471 B13R1.718 C=C(COCc1ccccc1)OC 8c4b4c5b998308002d5b388a53a71ab4 [0,1,0,0,0,1|0,0,2]=4 4472 B13R1.718 C=CC(C)COCc1ccccc1 b8b8b2053d46c3f0017ad5c27e992dc4 [0,1,0,0,0,1|1,0,0]=3 4473 B13R1.718 C=CC(C)COCc1ccccn1 6135169582364f99c98b280d1fae2026 [0,1,0,0,0,1|2,0,0]=4 4474 B13R1.718 C=CC(C)COCc1cccnc1 fe6759e987a3bf9a38d37a97d15b5522 [0,1,0,0,0,1|2,0,0]=4 4475 B13R1.718 C=CC(C)NCCc1ccccc1 85c7749c79d31c16f0650eadc1b41e4c [0,1,0,0,0,1|1,0,0]=3 4476 B13R1.718 C=CC(C)NCCc1ccccn1 37e526d124906a8ce764bf4383252db0 [0,1,0,0,0,1|2,0,0]=4 4477 B13R1.718 C=CC(C)NCCc1cccnc1 e2cbfdf74d423988a3ffbae5fb420280 [0,1,0,0,0,1|2,0,0]=4 4478 B13R1.718 C=CC(C)NCCc1ccncc1 4d8af91e55913048487e01a6218228e2 [0,1,0,0,0,1|2,0,0]=4 4479 B13R1.718 C=CC(C)NCSc1ccccc1 c78ae15e3755bd16e1ca7f9a990731e5 [0,1,0,0,0,1|2,0,0]=4 4480 B13R1.718 C=CC(C)OCCc1ccccc1 da81578e4b507de20e78dbecd775df0e [0,1,0,0,0,1|1,0,0]=3 4481 B13R1.718 C=CC(C)OCCc1ccccn1 c9ef52fbb2648eedf9ce555ed49fad25 [0,1,0,0,0,1|2,0,0]=4 4482 B13R1.718 C=CC(C)OCCc1cccnc1 5357df3421b27843a5b3b3102b13b21e [0,1,0,0,0,1|2,0,0]=4 4483 B13R1.718 C=CC(C)OCCc1ccncc1 b656921de0b5e84e47ee2fbae0a085f0 [0,1,0,0,0,1|2,0,0]=4 4484 B13R1.718 C=CC(O)CNCc1ccccc1 3b60528a0cfc8d2e11ee215e2a58af32 [0,1,0,0,0,1|0,0,1]=3 4485 B13R1.718 C=CC(O)CNCc1ccccn1 6984dc4da8d400a362833655dc43bccc [0,1,0,0,0,1|1,0,1]=4 4486 B13R1.718 C=CC(O)CNCc1cccnc1 f0f251617065da83f03ea3dd60d695bf [0,1,0,0,0,1|1,0,1]=4 4487 B13R1.718 C=C[C@H](C)OCCc1ccccc1 f517f43a0bad406910238c246a64d17e [0,1,0,0,0,1|1,0,0]=3 4488 B13R1.718 C=C[C@H](C)OCCc1ccccn1 16ba5737299318aa979749105c6b3f93 [0,1,0,0,0,1|2,0,0]=4 4489 B13R1.718 C=C[C@H](C)OCCc1cccnc1 f33e3e89915aca47fa7b77968f99b632 [0,1,0,0,0,1|2,0,0]=4 4490 B13R1.718 C=C[C@H](C)OCCc1ccncc1 a4b78e70f03812f80fc02a4db3956c75 [0,1,0,0,0,1|2,0,0]=4 4491 B13R1.718 CC(=CI)COCc1ccccc1 b966030bdc9b8b908a815cbd2cf21a28 [0,1,0,0,0,1|1,0,1]=4 4492 B13R1.718 CC(C#N)CNCc1ccccc1 4b2992bdcc2a65b08374b408fe423fce [0,1,0,0,0,1|1,0,0]=3 4493 B13R1.718 CC(C#N)CNCc1ccccn1 89f8c79fff489cd145b436d4d52c530e [0,1,0,0,0,1|2,0,0]=4 4494 B13R1.718 CC(C#N)CNCc1cccnc1 2149678299e764ed525043e149d2ef39 [0,1,0,0,0,1|2,0,0]=4 4495 B13R1.718 CC(C#N)CNCc1ccncc1 08f9296e93b3941fe756f683322f308e [0,1,0,0,0,1|2,0,0]=4 4496 B13R1.718 CC(C#N)COCc1ccccc1 dd6e89064953942042b98316280a869f [0,1,0,0,0,1|1,0,0]=3 4497 B13R1.718 CC(C#N)COCc1ccccn1 3d2eaf0a4ce4f67e4cc689cb42adf7f7 [0,1,0,0,0,1|2,0,0]=4 4498 B13R1.718 CC(C#N)COCc1cccnc1 e70a2ab36749ba7a6abdc2bd039256f1 [0,1,0,0,0,1|2,0,0]=4 4499 B13R1.718 CC(C#N)COCc1ccncc1 44872e2e8f2e628a0b26677d074f9e5a [0,1,0,0,0,1|2,0,0]=4 4500 B13R1.718 CC(C#N)NCCc1ccccc1 e419384d24d209b8092563a987296f12 [0,1,0,0,0,1|1,0,0]=3 4501 B13R1.718 CC(C#N)NCCc1ccccn1 4f6a3d14cb57089093165f75e170ae29 [0,1,0,0,0,1|2,0,0]=4 4502 B13R1.718 CC(C#N)NCCc1cccnc1 e03e17606d1d45a29e498f525c96f324 [0,1,0,0,0,1|2,0,0]=4 4503 B13R1.718 CC(C#N)NCCc1ccncc1 1f09deeb570bbf6be46967e924855e14 [0,1,0,0,0,1|2,0,0]=4 4504 B13R1.718 CC(C#N)OCCc1ccncc1 1c635454f867785f344ef27c0035654c [0,1,0,0,0,1|2,0,0]=4 4505 B13R1.718 CC(C=O)NCCc1ccccc1 369aedf3fd977678630d6ac85371f8c9 [0,1,0,0,0,1|0,0,1]=3 4506 B13R1.718 CC(C=O)NCCc1ccccn1 bb61eba4dab3d84b63c0644b0add725c [0,1,0,0,0,1|1,0,1]=4 4507 B13R1.718 CC(C=O)NCCc1cccnc1 662cc1caeb8e88b5cd6fab2008086675 [0,1,0,0,0,1|1,0,1]=4 4508 B13R1.718 CC(C=O)NCCc1ccncc1 85ba841e7e7139e02ca664d9b011f220 [0,1,0,0,0,1|1,0,1]=4 4509 B13R1.718 CC(C=O)OCCc1ccccc1 66951901da9b91faee03fbd7b536dc4f [0,1,0,0,0,1|0,0,1]=3 4510 B13R1.718 CC(C=O)OCCc1ccccn1 93345d72c247e06c9d4a1f5919b2de0c [0,1,0,0,0,1|1,0,1]=4 4511 B13R1.718 CC(C=O)OCCc1cccnc1 63b93eabe59460acfaac02bec49ba792 [0,1,0,0,0,1|1,0,1]=4 4512 B13R1.718 CC(C=O)OCCc1ccncc1 4ff3d96eba4c8a0587e6b521555f0098 [0,1,0,0,0,1|1,0,1]=4 4513 B13R1.718 CC(C=O)OCSc1ccccc1 6a1683cadd1a4f9a4551d44de3b29873 [0,1,0,0,0,1|1,0,1]=4 4514 B13R1.718 CC(CF)OCCc1ccccc1 10dacae2642b054565528321a819e915 [0,1,0,0,0,1|1,0,0]=3 4515 B13R1.718 CC(CF)OCCc1ccccn1 6e608ea6a17141565a119b65106bffa8 [0,1,0,0,0,1|2,0,0]=4 4516 B13R1.718 CC(CF)OCCc1cccnc1 6930c61c716b4629ec6702954aee7e9b [0,1,0,0,0,1|2,0,0]=4 4517 B13R1.718 CC(CF)OCCc1ccncc1 119756142afd32401152af6bf4521b37 [0,1,0,0,0,1|2,0,0]=4 4518 B13R1.718 CC(CO)CCNc1ccccc1 4d37090ae4c8c4516bf50e1daccfb4da [0,1,0,0,0,1|0,0,0]=2 4519 B13R1.718 CC(CO)CCNc1ccccn1 089ea5f0ec0e8b67707f6e1f4409a619 [0,1,0,0,0,1|1,0,0]=3 4520 B13R1.718 CC(CO)CCNc1cccnc1 a6cc281dccc3e47b54d9a517db25f6c0 [0,1,0,0,0,1|1,0,0]=3 4521 B13R1.718 CC(CO)CCNc1cccnn1 97d0855660a66e427a56fe1e566acd5d [0,1,0,0,0,1|2,0,0]=4 4522 B13R1.718 CC(CO)CCNc1ccncc1 41c2bf78bd2faeabc24b69faaf8a3c9d [0,1,0,0,0,1|1,0,0]=3 4523 B13R1.718 CC(CO)CCNc1ccncn1 e745b86022fd28d38830c958c31024d8 [0,1,0,0,0,1|2,0,0]=4 4524 B13R1.718 CC(CO)CCNc1ccnnc1 3e1fb3b4b37e6e6d634e777cb166ce49 [0,1,0,0,0,1|2,0,0]=4 4525 B13R1.718 CC(CO)CCNc1cnccn1 f529c56dba202170446a8772f8f254b3 [0,1,0,0,0,1|2,0,0]=4 4526 B13R1.718 CC(CO)CCNc1cncnc1 10a318a9df9bb2ec7e3d96ae45140721 [0,1,0,0,0,1|2,0,0]=4 4527 B13R1.718 CC(CO)CCNc1ncccn1 6fea4692075d32cfd8fd5a723e0a86b0 [0,1,0,0,0,1|2,0,0]=4 4528 B13R1.718 CC(CO)CNCc1ccccc1 a8ab15a9d308f0c4a33f134b0e8343dd [0,1,0,0,0,1|0,0,0]=2 4529 B13R1.718 CC(CO)CNCc1ccccn1 6560315a39a5c206bce3a439a8b36cd2 [0,1,0,0,0,1|1,0,0]=3 4530 B13R1.718 CC(CO)CNCc1cccnc1 144a4cbe54503f6fe95a6aace01bdb03 [0,1,0,0,0,1|1,0,0]=3 4531 B13R1.718 CC(CO)CNCc1cccnn1 403d1ac8073dfc3d4305e7b7345c58cb [0,1,0,0,0,1|2,0,0]=4 4532 B13R1.718 CC(CO)CNCc1ccncc1 d306f44fe73670872567d408176fa2a8 [0,1,0,0,0,1|1,0,0]=3 4533 B13R1.718 CC(CO)CNCc1ccncn1 987de23fd72f25b538bc34e452fb9d64 [0,1,0,0,0,1|2,0,0]=4 4534 B13R1.718 CC(CO)CNCc1ccnnc1 19f1317c84ee74b45f3ff94a52047f4e [0,1,0,0,0,1|2,0,0]=4 4535 B13R1.718 CC(CO)CNCc1cnccn1 ebe04a40bb047d18c15e044dcfbc6b4a [0,1,0,0,0,1|2,0,0]=4 4536 B13R1.718 CC(CO)CNCc1cncnc1 5fc7a45c44c0b413139364157a0881f4 [0,1,0,0,0,1|2,0,0]=4 4537 B13R1.718 CC(CO)CNCc1ncccn1 fa4013a2e8a115627a3919509b444d07 [0,1,0,0,0,1|2,0,0]=4 4538 B13R1.718 CC(CO)NCCc1ccccc1 ca980b8870daab798e4fdf7c12f222e9 [0,1,0,0,0,1|0,0,0]=2 4539 B13R1.718 CC(CO)NCCc1ccccn1 016681df2dd6b7fa7d2d6f6091d9a476 [0,1,0,0,0,1|1,0,0]=3 4540 B13R1.718 CC(CO)NCCc1cccnc1 66415843859f5efa935aff361795b6fd [0,1,0,0,0,1|1,0,0]=3 4541 B13R1.718 CC(CO)NCCc1ccncc1 6b31f55a76d9ebd1d00a42f94e0e8e2c [0,1,0,0,0,1|1,0,0]=3 4542 B13R1.718 CC(CO)NCCc1ccncn1 65188cd7b2de51d7a1e2def632ccaff8 [0,1,0,0,0,1|2,0,0]=4 4543 B13R1.718 CC(CO)NCCc1cnccn1 73d6fc96f1eb2ae273fae8a465357133 [0,1,0,0,0,1|2,0,0]=4 4544 B13R1.718 CC(CO)NCCc1ncccn1 7b51814b0fe098513330a54213fd41c2 [0,1,0,0,0,1|2,0,0]=4 4545 B13R1.718 CC(CS)OCCc1ccccc1 c835925d704a2473612a5e1bc4083289 [0,1,0,0,0,1|0,1,0]=3 4546 B13R1.718 CC(CS)OCCc1ccccn1 cf535ce640e15817fd28d6e10f92f6d7 [0,1,0,0,0,1|1,1,0]=4 4547 B13R1.718 CC(CS)OCCc1cccnc1 17f8a4a880d32e33a0e80e7cd6742282 [0,1,0,0,0,1|1,1,0]=4 4548 B13R1.718 CC(CS)OCCc1ccncc1 697470f9c08399edc49df12f87a77047 [0,1,0,0,0,1|1,1,0]=4 4549 B13R1.718 CCC(=O)CNCc1ccccc1 379e58d542b4d413818ec926fe2743ec [0,1,0,0,0,1|0,0,2]=4 4550 B13R1.718 CCC(=O)COCc1ccccc1 266396ee78f62f5a5e858c0195fee052 [0,1,0,0,0,1|0,0,2]=4 4551 B13R1.718 CCC(=O)NCCc1ccccc1 5d7fd1b17306dee08da5fe69e0aad8af [0,1,0,0,0,1|0,0,2]=4 4552 B13R1.718 CCC(C)CCNc1ccccc1 b42133b77396dfed20aa3240ac9ca29a [0,1,0,0,0,1|1,0,0]=3 4553 B13R1.718 CCC(C)CCNc1ccccn1 0d19499f049ce40b320001eda50ce47e [0,1,0,0,0,1|2,0,0]=4 4554 B13R1.718 CCC(C)CCNc1cccnc1 01ef39519abd460d72cf23c291bc26e2 [0,1,0,0,0,1|2,0,0]=4 4555 B13R1.718 CCC(C)CCNc1ccncc1 3a523442f381971c509485e440831a01 [0,1,0,0,0,1|2,0,0]=4 4556 B13R1.718 CCC(C)CCOc1ccccn1 bd11a35883ef61e8f6d1e2415310e6f3 [0,1,0,0,0,1|2,0,0]=4 4557 B13R1.718 CCC(C)CCOc1cccnc1 ed4367460491fb46c46dee5ed7230757 [0,1,0,0,0,1|2,0,0]=4 4558 B13R1.718 CCC(C)CCOc1ccncc1 310c23f83a48703aa58c066af4c44b93 [0,1,0,0,0,1|2,0,0]=4 4559 B13R1.718 CCC(C)CNCc1ccccc1 9212151e95985ff645dd6e0e56bfbd96 [0,1,0,0,0,1|1,0,0]=3 4560 B13R1.718 CCC(C)CNCc1ccccn1 24e1cda0c261324c19050c8d16a46171 [0,1,0,0,0,1|2,0,0]=4 4561 B13R1.718 CCC(C)CNCc1cccnc1 0f74b619bf6c30b422c0cd7902a59adb [0,1,0,0,0,1|2,0,0]=4 4562 B13R1.718 CCC(C)CNCc1ccncc1 131e88e99bc0c64c8ac2511df1285b83 [0,1,0,0,0,1|2,0,0]=4 4563 B13R1.718 CCC(C)COCc1ccccc1 a8db5027fb548c7a3aa4f8e3aac3f29d [0,1,0,0,0,1|1,0,0]=3 4564 B13R1.718 CCC(C)COCc1ccccn1 7b83d988cff80e11b11e235047a147c3 [0,1,0,0,0,1|2,0,0]=4 4565 B13R1.718 CCC(C)COCc1cccnc1 fe6d4d34907cd3ec66bebb4fc3bae3e9 [0,1,0,0,0,1|2,0,0]=4 4566 B13R1.718 CCC(C)COCc1ccncc1 e66edb448c616cc26f66a154df8920b0 [0,1,0,0,0,1|2,0,0]=4 4567 B13R1.718 CCC(C)NCCc1ccccc1 04fedbf0cb6009843db62b814f469f4d [0,1,0,0,0,1|1,0,0]=3 4568 B13R1.718 CCC(C)NCCc1ccccn1 fe6d040ea3832d34e25d3609e9efc0a1 [0,1,0,0,0,1|2,0,0]=4 4569 B13R1.718 CCC(C)NCCc1cccnc1 d811ad79d3d6c5c6d4bf56938672c80c [0,1,0,0,0,1|2,0,0]=4 4570 B13R1.718 CCC(C)NCCc1ccncc1 b506ba27a728915626c9aa4cc38d5704 [0,1,0,0,0,1|2,0,0]=4 4571 B13R1.718 CCC(C)OCCc1ccccc1 ebd850bb8f2f6a99345d946634614b34 [0,1,0,0,0,1|1,0,0]=3 4572 B13R1.718 CCC(C)OCCc1ccccn1 e899f44f624b8ae2a554dcfb20338a54 [0,1,0,0,0,1|2,0,0]=4 4573 B13R1.718 CCC(C)OCCc1cccnc1 c08fd956c3743d0834335d3a0a892f39 [0,1,0,0,0,1|2,0,0]=4 4574 B13R1.718 CCC(C)OCCc1ccncc1 d3708fcfb6aa0a9ede1fec5a868adbfb [0,1,0,0,0,1|2,0,0]=4 4575 B13R1.718 CCC(O)CNCc1ccccc1 5df21e5b8da54e62a8351afe56b24c4a [0,1,0,0,0,1|0,0,0]=2 4576 B13R1.718 CCC(O)CNCc1ccccn1 d127f7de937d460d83b0c4e835fc6be6 [0,1,0,0,0,1|1,0,0]=3 4577 B13R1.718 CCC(O)CNCc1cccnc1 fa13230d7f791de8096094c12ab9a7be [0,1,0,0,0,1|1,0,0]=3 4578 B13R1.718 CCC(O)CNCc1cccnn1 cb4aefa2e2b401ddb0feafe2fd74c61e [0,1,0,0,0,1|2,0,0]=4 4579 B13R1.718 CCC(O)CNCc1ccncc1 659ed5a37387812620efbb61e0898e1a [0,1,0,0,0,1|1,0,0]=3 4580 B13R1.718 CCC(O)CNCc1ccncn1 5306492d05873f43356e8172bdd345a4 [0,1,0,0,0,1|2,0,0]=4 4581 B13R1.718 CCC(O)CNCc1ccnnc1 b8bf01d873a642623119b13feaa21e88 [0,1,0,0,0,1|2,0,0]=4 4582 B13R1.718 CCC(O)CNCc1cnccn1 4600414d0a6f860a9a2890a229dcd834 [0,1,0,0,0,1|2,0,0]=4 4583 B13R1.718 CCC(O)CNCc1cncnc1 0ad5fe0568197bad2d5799ae63ee28d5 [0,1,0,0,0,1|2,0,0]=4 4584 B13R1.718 CCC(O)CNCc1ncccn1 375f17d07d987e972975c5d3570b7e86 [0,1,0,0,0,1|2,0,0]=4 4585 B13R1.718 CCN(C)CCCc1ccccc1 0fcd92cbf113da90360df3090d73dab6 [0,1,0,0,0,1|2,0,0]=4 4586 B13R1.718 CCN(C)CCOc1ccccc1 b36b1e616b4c6056ffba3ad5a2f8e9e2 [0,1,0,0,0,1|2,0,0]=4 4587 B13R1.718 CCN(C)CCSc1ccccc1 a98a0865a25951bfeff6b5260e689ee9 [0,1,0,0,0,1|2,0,0]=4 4588 B13R1.718 CC[C@@H](C)CNCc1ccccc1 3e755e1966c9036c01c574cad72da958 [0,1,0,0,0,1|1,0,0]=3 4589 B13R1.718 CC[C@@H](C)CNCc1ccccn1 8f482b4c968ad45d74783469da4625ec [0,1,0,0,0,1|2,0,0]=4 4590 B13R1.718 CC[C@@H](C)CNCc1cccnc1 11254f22f22914b59ea1c00a88413366 [0,1,0,0,0,1|2,0,0]=4 4591 B13R1.718 CC[C@@H](C)CNCc1ccncc1 51791b0e5f0c50b487dabdbead40044a [0,1,0,0,0,1|2,0,0]=4 4592 B13R1.718 CC[C@@H](C)COCc1ccccc1 3acbc56912048406996b8b9ea7a10564 [0,1,0,0,0,1|1,0,0]=3 4593 B13R1.718 CC[C@@H](C)COCc1ccccn1 618f3b9796e3c4139e4546044d36cf66 [0,1,0,0,0,1|2,0,0]=4 4594 B13R1.718 CC[C@@H](C)COCc1cccnc1 2082720fd42b4aa1edce5af9da79dea5 [0,1,0,0,0,1|2,0,0]=4 4595 B13R1.718 CC[C@@H](C)COCc1ccncc1 41b531a174290966234eea8ec43f0d04 [0,1,0,0,0,1|2,0,0]=4 4596 B13R1.718 CC[C@@H](C)NCCc1ccccc1 e9d3e12ce5c5fe10ecfef40b36bd9295 [0,1,0,0,0,1|1,0,0]=3 4597 B13R1.718 CC[C@@H](C)NCCc1ccccn1 f7ebab828ca2f6be9c3b33aa3dd6dbe7 [0,1,0,0,0,1|2,0,0]=4 4598 B13R1.718 CC[C@@H](C)NCCc1cccnc1 f3c3da2070322882317bc4767bc887bc [0,1,0,0,0,1|2,0,0]=4 4599 B13R1.718 CC[C@@H](C)NCCc1ccncc1 a2eaf66e025a64954325e257f25941ff [0,1,0,0,0,1|2,0,0]=4 4600 B13R1.718 CC[C@@H](C)OCCc1ccccc1 2f036ce5b90828a6d2f870c2a2025003 [0,1,0,0,0,1|1,0,0]=3 4601 B13R1.718 CC[C@@H](C)OCCc1ccccn1 c8dfdc4d34e2a9d7a3e1dcfc6e82b851 [0,1,0,0,0,1|2,0,0]=4 4602 B13R1.718 CC[C@@H](C)OCCc1cccnc1 41a64098193fe71415d4ac451b43fca7 [0,1,0,0,0,1|2,0,0]=4 4603 B13R1.718 CC[C@@H](C)OCCc1ccncc1 f3ce52893ae2613a1f9244fa8f44d808 [0,1,0,0,0,1|2,0,0]=4 4604 B13R1.718 CC[C@@H](O)CNCc1ccccc1 442d164a8251681b791974d837cea552 [0,1,0,0,0,1|0,0,0]=2 4605 B13R1.718 CC[C@@H](O)CNCc1ccccn1 f1c9fbda99cbc87879628833c6984590 [0,1,0,0,0,1|1,0,0]=3 4606 B13R1.718 CC[C@@H](O)CNCc1cccnc1 4990261c74598a011657339abb494d29 [0,1,0,0,0,1|1,0,0]=3 4607 B13R1.718 CC[C@@H](O)CNCc1cccnn1 579167ac99135f45d14f198aa2479439 [0,1,0,0,0,1|2,0,0]=4 4608 B13R1.718 CC[C@@H](O)CNCc1ccncn1 8607890bf0d8487a01b22e71364fd9e6 [0,1,0,0,0,1|2,0,0]=4 4609 B13R1.718 CC[C@@H](O)CNCc1cncnc1 43ded321f571b8ea6634c51c47184e84 [0,1,0,0,0,1|2,0,0]=4 4610 B13R1.718 CC[C@@H](O)CNCc1ncccn1 c0697e6bd25ad3471ba0873d1d5d9850 [0,1,0,0,0,1|2,0,0]=4 4611 B13R1.718 CC[C@H](C)CNCc1ccccc1 57f32a8258da15a9bcf0119991ef3cbb [0,1,0,0,0,1|1,0,0]=3 4612 B13R1.718 CC[C@H](C)CNCc1ccccn1 3f914e701726efd5ff6121ae17150fc4 [0,1,0,0,0,1|2,0,0]=4 4613 B13R1.718 CC[C@H](C)CNCc1cccnc1 13376d16a9a0740e92da57b6537717c2 [0,1,0,0,0,1|2,0,0]=4 4614 B13R1.718 CC[C@H](C)CNCc1ccncc1 7a94ad5037af910dd5014fec903b540b [0,1,0,0,0,1|2,0,0]=4 4615 B13R1.718 CC[C@H](C)COCc1ccccc1 3b63c6ed8446e2d55321d06d46f32904 [0,1,0,0,0,1|1,0,0]=3 4616 B13R1.718 CC[C@H](C)COCc1ccccn1 66f5981fc79bdf4b8dd51e817064c9e6 [0,1,0,0,0,1|2,0,0]=4 4617 B13R1.718 CC[C@H](C)COCc1cccnc1 04109a15eb726aa89d0dda7ba084fd90 [0,1,0,0,0,1|2,0,0]=4 4618 B13R1.718 CC[C@H](C)COCc1ccncc1 31d735532f7f405c7342d5e6e7b328b5 [0,1,0,0,0,1|2,0,0]=4 4619 B13R1.718 CC[C@H](C)NCCc1ccccc1 5bd761bea609e39e2c4848d512bd6573 [0,1,0,0,0,1|1,0,0]=3 4620 B13R1.718 CC[C@H](C)NCCc1ccccn1 a4d51fae7d9f29581ff83fc8e65c4b23 [0,1,0,0,0,1|2,0,0]=4 4621 B13R1.718 CC[C@H](C)NCCc1cccnc1 6563b6f6ef2abf876373103666f50882 [0,1,0,0,0,1|2,0,0]=4 4622 B13R1.718 CC[C@H](C)NCCc1ccncc1 210ce4c420b08f79902b74c8b0b4b94e [0,1,0,0,0,1|2,0,0]=4 4623 B13R1.718 CC[C@H](C)OCCc1ccccc1 fd47c0386d3a87c182e4a46502f572e0 [0,1,0,0,0,1|1,0,0]=3 4624 B13R1.718 CC[C@H](C)OCCc1ccccn1 fdc69678de6406a9826576be1762a1d8 [0,1,0,0,0,1|2,0,0]=4 4625 B13R1.718 CC[C@H](C)OCCc1cccnc1 80c7f12edab426452259c8834c353483 [0,1,0,0,0,1|2,0,0]=4 4626 B13R1.718 CC[C@H](C)OCCc1ccncc1 8b403596e7c5b3c9eceb3171dd160f4d [0,1,0,0,0,1|2,0,0]=4 4627 B13R1.718 CN(C=O)CCOc1ccccc1 5a9829cb6a2bf0872931c97c1243cbb5 [0,1,0,0,0,1|1,0,1]=4 4628 B13R1.718 CN(CF)CCOc1ccccc1 25b50ba66d582ebec98da6982e163322 [0,1,0,0,0,1|2,0,0]=4 4629 B13R1.718 CN(CO)C/C=C/c1ccccc1 828036e4ea0de4296ad3392772131307 [0,1,0,0,0,1|1,0,1]=4 4630 B13R1.718 CN(CO)CCCc1cccnc1 9a1871ab2e58bbfefe8f742efc62c1b1 [0,1,0,0,0,1|2,0,0]=4 4631 B13R1.718 CN(CO)CCCc1ccncc1 fa2b0d69ffeb4f0fa039154e6bc2143f [0,1,0,0,0,1|2,0,0]=4 4632 B13R1.718 CN(CO)CCOc1ccccc1 352c8a268dcb0c5ab1e6fce5e7fb0d8f [0,1,0,0,0,1|1,0,0]=3 4633 B13R1.718 CN(CO)CCSc1ccccn1 509c5327bdba09ce3c131bb8c7ff20dd [0,1,0,0,0,1|2,0,0]=4 4634 B13R1.718 CNC(=O)CCNc1ccccc1 cf273db49a64604940b5199666756b35 [0,1,0,0,0,1|0,0,2]=4 4635 B13R1.718 CNC(=O)CNCc1ccccc1 13c5aa70031d86dc84c604128f7e10a9 [0,1,0,0,0,1|0,0,2]=4 4636 B13R1.718 CNC(=O)COCc1ccccc1 f6f28fc8fe99fc848c01537d265d08ae [0,1,0,0,0,1|0,0,2]=4 4637 B13R1.718 COC(=O)CCNc1ccccc1 f9a531e654184a73e34a70c076a01e72 [0,1,0,0,0,1|0,0,2]=4 4638 B13R1.718 COC(=O)CNCc1ccccc1 432cb974df5f60a3ba0208949a9b1c17 [0,1,0,0,0,1|0,0,2]=4 4639 B13R1.718 COC(=O)COCc1ccccc1 e46d7b2f756921afd494cbaafe025c22 [0,1,0,0,0,1|0,0,2]=4 4640 B13R1.718 COC(C)CNCc1ccccc1 935d8bcd6bac3c25b8154fa2d564e57b [0,1,0,0,0,1|0,0,0]=2 4641 B13R1.718 COC(C)CNCc1ccccn1 7d324311a47f57421db02c642a1de64e [0,1,0,0,0,1|1,0,0]=3 4642 B13R1.718 COC(C)CNCc1cccnc1 3625295d9071f3d3bf3cef3098ae07b9 [0,1,0,0,0,1|1,0,0]=3 4643 B13R1.718 COC(C)CNCc1cccnn1 f04e37592cce774a75e0f2db9d6a9e4d [0,1,0,0,0,1|2,0,0]=4 4644 B13R1.718 COC(C)CNCc1ccncc1 4654427470d227918f13aeac65cd0cc2 [0,1,0,0,0,1|1,0,0]=3 4645 B13R1.718 COC(C)CNCc1ccncn1 fff9b03263d6c14dcd2615e8475250fd [0,1,0,0,0,1|2,0,0]=4 4646 B13R1.718 COC(C)CNCc1ccnnc1 b026de13674c3f36b5c64ac7562066e6 [0,1,0,0,0,1|2,0,0]=4 4647 B13R1.718 COC(C)CNCc1cnccn1 f521602c0ad26eea9960791bb3f0cb25 [0,1,0,0,0,1|2,0,0]=4 4648 B13R1.718 COC(C)CNCc1cncnc1 c7e66334adea7e9b3fb5954b30568753 [0,1,0,0,0,1|2,0,0]=4 4649 B13R1.718 COC(C)CNCc1ncccn1 42b2d4d926e025b18213abfa4f0aa7f3 [0,1,0,0,0,1|2,0,0]=4 4650 B13R1.718 COC(C)COCc1ccccc1 abc0b1f0547ce39d198869ca56fd0562 [0,1,0,0,0,1|0,0,0]=2 4651 B13R1.718 COC(C)COCc1ccccn1 9c0c3387109963140ce660d78f59fae9 [0,1,0,0,0,1|1,0,0]=3 4652 B13R1.718 COC(C)COCc1cccnc1 0630c44ba21a90c63d730eb4fe381ed9 [0,1,0,0,0,1|1,0,0]=3 4653 B13R1.718 COC(C)COCc1cccnn1 70d2d53360c2c1fdb3bb36818492fccd [0,1,0,0,0,1|2,0,0]=4 4654 B13R1.718 COC(C)COCc1ccncc1 5dbd98591a9efd679dc13d2fa5b5d76c [0,1,0,0,0,1|1,0,0]=3 4655 B13R1.718 COC(C)COCc1ccncn1 c8db68b2557d26dffed2f6321b96c734 [0,1,0,0,0,1|2,0,0]=4 4656 B13R1.718 COC(C)COCc1ccnnc1 d8ffe81d62dd80c52fd4911a0344ccf3 [0,1,0,0,0,1|2,0,0]=4 4657 B13R1.718 COC(C)COCc1cnccn1 b609b75417ad0f61cdca1a692b679b39 [0,1,0,0,0,1|2,0,0]=4 4658 B13R1.718 COC(C)COCc1cncnc1 db71e424472e456406991fc0cfb573b1 [0,1,0,0,0,1|2,0,0]=4 4659 B13R1.718 COC(C)COCc1ncccn1 2ff8a7aefda69aaa9c5d76bbddde70cf [0,1,0,0,0,1|2,0,0]=4 4660 B13R1.718 CO[C@@H](C)CNCc1ccccc1 9f07176a9fb98435253fe40059f5c78c [0,1,0,0,0,1|0,0,0]=2 4661 B13R1.718 CO[C@@H](C)CNCc1ccccn1 11d0640868b38d18ffdc6a6f8e360405 [0,1,0,0,0,1|1,0,0]=3 4662 B13R1.718 CO[C@@H](C)CNCc1cccnc1 3d99c2158495804f741e7bc9c3bb86a4 [0,1,0,0,0,1|1,0,0]=3 4663 B13R1.718 CO[C@@H](C)CNCc1cccnn1 6742299dca4fb37edc28601fd53eda0e [0,1,0,0,0,1|2,0,0]=4 4664 B13R1.718 CO[C@@H](C)CNCc1ccncc1 c7de427e2a0e3833d80dc9c005dfadae [0,1,0,0,0,1|1,0,0]=3 4665 B13R1.718 CO[C@@H](C)CNCc1ccncn1 2cdd3164062c683c1a0c0f8fb037a5c5 [0,1,0,0,0,1|2,0,0]=4 4666 B13R1.718 CO[C@@H](C)CNCc1ccnnc1 af9806351d09dcd0b724869e5a3195fd [0,1,0,0,0,1|2,0,0]=4 4667 B13R1.718 CO[C@@H](C)CNCc1cnccn1 1860a1cc126f523c42843af2a5fc3daf [0,1,0,0,0,1|2,0,0]=4 4668 B13R1.718 CO[C@@H](C)CNCc1cncnc1 181bb50165de400edfcbe323df29da3e [0,1,0,0,0,1|2,0,0]=4 4669 B13R1.718 CO[C@@H](C)CNCc1ncccn1 2578fbc1aa2028f782efd90b563dd970 [0,1,0,0,0,1|2,0,0]=4 4670 B13R1.718 CO[C@@H](C)COCc1ccccc1 88aecf7f711ca4c8fca58ebe797b8738 [0,1,0,0,0,1|0,0,0]=2 4671 B13R1.718 CO[C@@H](C)COCc1ccccn1 8a34b39242aa0ff73d3fc5dfa1b96beb [0,1,0,0,0,1|1,0,0]=3 4672 B13R1.718 CO[C@@H](C)COCc1cccnc1 2f6676a4b47d986e1bef7393133f7d8d [0,1,0,0,0,1|1,0,0]=3 4673 B13R1.718 CO[C@@H](C)COCc1cccnn1 72da3c1586b7ff175cdf66943d977790 [0,1,0,0,0,1|2,0,0]=4 4674 B13R1.718 CO[C@@H](C)COCc1ccncc1 4ca2e8412d0627979b4a77f828843408 [0,1,0,0,0,1|1,0,0]=3 4675 B13R1.718 CO[C@@H](C)COCc1ccncn1 f58daa4e20f7c3a894b1b9b37f0bdf59 [0,1,0,0,0,1|2,0,0]=4 4676 B13R1.718 CO[C@@H](C)COCc1ccnnc1 bff86846ee6a8c659f823b05455a964a [0,1,0,0,0,1|2,0,0]=4 4677 B13R1.718 CO[C@@H](C)COCc1cnccn1 7cc1a44ccfe504ddfb8d94ac0914612c [0,1,0,0,0,1|2,0,0]=4 4678 B13R1.718 CO[C@@H](C)COCc1cncnc1 ecff1369aeded3999af78f2b68b4d208 [0,1,0,0,0,1|2,0,0]=4 4679 B13R1.718 CO[C@@H](C)COCc1ncccn1 4ec7d8e94be14e19c198891e00c4896f [0,1,0,0,0,1|2,0,0]=4 4680 B13R1.718 CO[C@H](C)CNCc1ccccc1 1add30759e3e93204168617275f53841 [0,1,0,0,0,1|0,0,0]=2 4681 B13R1.718 CO[C@H](C)CNCc1ccccn1 47a882164f5933818de2ad21cc6cc181 [0,1,0,0,0,1|1,0,0]=3 4682 B13R1.718 CO[C@H](C)CNCc1cccnc1 b201eaf6c8c3b51087961414ec1191a7 [0,1,0,0,0,1|1,0,0]=3 4683 B13R1.718 CO[C@H](C)CNCc1cccnn1 b77cfb0271701c442d3c521e20517c5b [0,1,0,0,0,1|2,0,0]=4 4684 B13R1.718 CO[C@H](C)CNCc1ccncc1 fd15629a4461f313fe4b24414b8e1b7c [0,1,0,0,0,1|1,0,0]=3 4685 B13R1.718 CO[C@H](C)CNCc1ccncn1 5d362d07dfac59bf36c0951587e09e25 [0,1,0,0,0,1|2,0,0]=4 4686 B13R1.718 CO[C@H](C)CNCc1ccnnc1 0e18531f51df789352283f8d960edce9 [0,1,0,0,0,1|2,0,0]=4 4687 B13R1.718 CO[C@H](C)CNCc1cnccn1 75f937163d111b250516e4cf2f6deb1e [0,1,0,0,0,1|2,0,0]=4 4688 B13R1.718 CO[C@H](C)CNCc1cncnc1 5b2350abe5315f0089710d45edb4813a [0,1,0,0,0,1|2,0,0]=4 4689 B13R1.718 CO[C@H](C)CNCc1ncccn1 b4291fe8e70c9da97d4818f305a79024 [0,1,0,0,0,1|2,0,0]=4 4690 B13R1.718 CO[C@H](C)COCc1ccccc1 c455f4df22b5e153ceb05224bc6c1d03 [0,1,0,0,0,1|0,0,0]=2 4691 B13R1.718 CO[C@H](C)COCc1ccccn1 4e0a6a78364c66be69256e55434e3b7d [0,1,0,0,0,1|1,0,0]=3 4692 B13R1.718 CO[C@H](C)COCc1cccnc1 37955708e86efd51411e2c9f3de9b779 [0,1,0,0,0,1|1,0,0]=3 4693 B13R1.718 CO[C@H](C)COCc1cccnn1 5fc3a8700b38f14f617ad39b8c186a8f [0,1,0,0,0,1|2,0,0]=4 4694 B13R1.718 CO[C@H](C)COCc1ccncc1 23a39b811184ba695d95fed5db4eda44 [0,1,0,0,0,1|1,0,0]=3 4695 B13R1.718 CO[C@H](C)COCc1ccncn1 bfd12885f91214c8cb29bc5d1cfb9ef2 [0,1,0,0,0,1|2,0,0]=4 4696 B13R1.718 CO[C@H](C)COCc1ccnnc1 d40ae4a6b652c7941d187d68151b17b2 [0,1,0,0,0,1|2,0,0]=4 4697 B13R1.718 CO[C@H](C)COCc1cnccn1 48077019a2feba2325a2a5bdc007b20d [0,1,0,0,0,1|2,0,0]=4 4698 B13R1.718 CO[C@H](C)COCc1cncnc1 5d57cfc5951d072da8d95a4055b46568 [0,1,0,0,0,1|2,0,0]=4 4699 B13R1.718 CO[C@H](C)COCc1ncccn1 797d8dbbf42d01c1d742d53d60707ac6 [0,1,0,0,0,1|2,0,0]=4 4700 B13R1.718 C[C@@H](CO)CCNc1ccccc1 64eab2116b6261f4048d30e4ad5a6f62 [0,1,0,0,0,1|0,0,0]=2 4701 B13R1.718 C[C@@H](CO)CCNc1cccnc1 6ac516604ae5d957631eac3810c551f5 [0,1,0,0,0,1|1,0,0]=3 4702 B13R1.718 C[C@@H](CO)CCNc1cccnn1 ea6d7a11e417f33cddebde382207b06b [0,1,0,0,0,1|2,0,0]=4 4703 B13R1.718 C[C@@H](CO)CCNc1ccncc1 8efeb9b7bc004abad25b5a2f65b967c2 [0,1,0,0,0,1|1,0,0]=3 4704 B13R1.718 C[C@@H](CO)CCNc1ccncn1 10e9fd8493aa62982a02718091b0c08a [0,1,0,0,0,1|2,0,0]=4 4705 B13R1.718 C[C@@H](CO)CNCc1ccccc1 e2f2b6480afeb47c9d182f8bf342ee78 [0,1,0,0,0,1|0,0,0]=2 4706 B13R1.718 C[C@@H](CO)CNCc1ccccn1 624b5acd3d811f8a7d0711998df552f5 [0,1,0,0,0,1|1,0,0]=3 4707 B13R1.718 C[C@@H](CO)CNCc1cccnc1 0f232d5eb06bb5969e535b16689f1aec [0,1,0,0,0,1|1,0,0]=3 4708 B13R1.718 C[C@@H](CO)CNCc1cccnn1 6410b48e51aa248768c856e814fc0cd7 [0,1,0,0,0,1|2,0,0]=4 4709 B13R1.718 C[C@@H](CO)CNCc1ccncc1 19c248ec0f75056b9b10c0d2c91a5547 [0,1,0,0,0,1|1,0,0]=3 4710 B13R1.718 C[C@@H](CO)CNCc1ccncn1 b3b7b0678bd92da8c9909be0aa2a2845 [0,1,0,0,0,1|2,0,0]=4 4711 B13R1.718 C[C@@H](CO)CNCc1ccnnc1 b76bd226917ab925172e54830bd4047f [0,1,0,0,0,1|2,0,0]=4 4712 B13R1.718 C[C@@H](CO)CNCc1cnccn1 97ac979de0dd947046a5077c2cd8cc4b [0,1,0,0,0,1|2,0,0]=4 4713 B13R1.718 C[C@@H](CO)CNCc1cncnc1 0769fadcfb31b776c994b76321b57387 [0,1,0,0,0,1|2,0,0]=4 4714 B13R1.718 C[C@@H](CO)CNCc1ncccn1 65b2157300e7fea7ebd18387ce758e9f [0,1,0,0,0,1|2,0,0]=4 4715 B13R1.718 C[C@@H](CO)NCCc1ccccc1 becda43359cccf2ad88f7b4db8f3be9f [0,1,0,0,0,1|0,0,0]=2 4716 B13R1.718 C[C@@H](CO)NCCc1ccccn1 c5e8ea5ea171b001729be6671a15f573 [0,1,0,0,0,1|1,0,0]=3 4717 B13R1.718 C[C@@H](CO)NCCc1cccnc1 959e4c544713f5ced725b3787e09baec [0,1,0,0,0,1|1,0,0]=3 4718 B13R1.718 C[C@@H](CO)NCCc1ccncc1 4fbdd4730545a2fdae0a78943abc2829 [0,1,0,0,0,1|1,0,0]=3 4719 B13R1.718 C[C@@H](CO)NCCc1ccncn1 556a6fd3f7d1ab8df0e152362be7fdcc [0,1,0,0,0,1|2,0,0]=4 4720 B13R1.718 C[C@@H](CO)NCCc1cnccn1 e84ccfa1728f099cb7891e7e0f4d3d3c [0,1,0,0,0,1|2,0,0]=4 4721 B13R1.718 C[C@@H](CO)NCCc1ncccn1 a0835faeb1584612b1e59046e6b4284a [0,1,0,0,0,1|2,0,0]=4 4722 B13R1.718 C[C@H](C=O)NCCc1ccccc1 bd6dd098fe0df74c78dc8f01b3196352 [0,1,0,0,0,1|0,0,1]=3 4723 B13R1.718 C[C@H](C=O)NCCc1ccccn1 c977a8364ba24cc1d61310fcbf27fa2a [0,1,0,0,0,1|1,0,1]=4 4724 B13R1.718 C[C@H](C=O)NCCc1cccnc1 27cb005d06195dc85ecf0f3b31adf25f [0,1,0,0,0,1|1,0,1]=4 4725 B13R1.718 C[C@H](C=O)NCCc1ccncc1 f8def9fb812aec1aa063f780ad567bc6 [0,1,0,0,0,1|1,0,1]=4 4726 B13R1.718 C[C@H](C=O)OCCc1ccccc1 8c7ec29912b16ed581054220a3356151 [0,1,0,0,0,1|0,0,1]=3 4727 B13R1.718 C[C@H](C=O)OCCc1ccccn1 810a565c503d34919809d2194eb1275f [0,1,0,0,0,1|1,0,1]=4 4728 B13R1.718 C[C@H](C=O)OCCc1cccnc1 41ae59f83fad1172ea4e6735c7da8561 [0,1,0,0,0,1|1,0,1]=4 4729 B13R1.718 C[C@H](C=O)OCCc1ccncc1 18765566e65dfdc6f41a05de678644b8 [0,1,0,0,0,1|1,0,1]=4 4730 B13R1.718 C[C@H](CO)CNCc1ccccc1 92800f4bfb7229bb709a604d05a50f8b [0,1,0,0,0,1|0,0,0]=2 4731 B13R1.718 C[C@H](CO)CNCc1ccccn1 c9ad8a7651d307f1ff828516023bbe47 [0,1,0,0,0,1|1,0,0]=3 4732 B13R1.718 C[C@H](CO)CNCc1cccnc1 5a35716cbb833e23db83a34cb0e761c1 [0,1,0,0,0,1|1,0,0]=3 4733 B13R1.718 C[C@H](CO)CNCc1cccnn1 2091a433fa1859700664cda29687428f [0,1,0,0,0,1|2,0,0]=4 4734 B13R1.718 C[C@H](CO)CNCc1ccncc1 0614ee7cf304efa6ba0bda6728ef491b [0,1,0,0,0,1|1,0,0]=3 4735 B13R1.718 C[C@H](CO)CNCc1ccncn1 c4bdbb5af5da87fb9ae50556bcb8a3fb [0,1,0,0,0,1|2,0,0]=4 4736 B13R1.718 C[C@H](CO)CNCc1ccnnc1 6bed08464d16787a4ea1b50d33990d82 [0,1,0,0,0,1|2,0,0]=4 4737 B13R1.718 C[C@H](CO)CNCc1cnccn1 d930ebbaf15fa44fac2d3947c5399c33 [0,1,0,0,0,1|2,0,0]=4 4738 B13R1.718 C[C@H](CO)CNCc1cncnc1 58527c6196f0508817b9b3d9fe165660 [0,1,0,0,0,1|2,0,0]=4 4739 B13R1.718 C[C@H](CO)CNCc1ncccn1 4e36e45208f77f51d8e11d077dc09f97 [0,1,0,0,0,1|2,0,0]=4 4740 B13R1.718 C[C@H](CO)NCCc1ccccc1 2a41261301307fce936b23ca5418cc20 [0,1,0,0,0,1|0,0,0]=2 4741 B13R1.718 C[C@H](CO)NCCc1ccccn1 f1fd243df6dff79c3d86e824cd42de64 [0,1,0,0,0,1|1,0,0]=3 4742 B13R1.718 C[C@H](CO)NCCc1cccnc1 597b5bcde8acf778ebcd850be9e87531 [0,1,0,0,0,1|1,0,0]=3 4743 B13R1.718 C[C@H](CO)NCCc1ccncc1 3c1a4be16840e397d027caee72a9f740 [0,1,0,0,0,1|1,0,0]=3 4744 B13R1.718 C[C@H](CO)NCCc1ccncn1 9ded89c7e7d824d2cde957ef08f0e8bc [0,1,0,0,0,1|2,0,0]=4 4745 B13R1.718 C[C@H](CO)NCCc1cnccn1 927018b36306906d825ae8b4a6f80f2c [0,1,0,0,0,1|2,0,0]=4 4746 B13R1.718 C[C@H](CO)NCCc1ncccn1 c09fbb0ad15a00496c0336c73e74df4b [0,1,0,0,0,1|2,0,0]=4 4747 B13R1.718 C[C@H](CS)OCCc1ccccc1 f9b1b9175172eabe9502e1f20520b92a [0,1,0,0,0,1|0,1,0]=3 4748 B13R1.718 C[C@H](CS)OCCc1ccccn1 5847a5c15424f2bb93da7d12ea3178a3 [0,1,0,0,0,1|1,1,0]=4 4749 B13R1.718 C[C@H](CS)OCCc1cccnc1 a1bff0877b6727c43c13f2c0349212c8 [0,1,0,0,0,1|1,1,0]=4 4750 B13R1.718 C[C@H](CS)OCCc1ccncc1 c8ff87f1b264b2170cd354009f5a44df [0,1,0,0,0,1|1,1,0]=4 4751 B13R1.718 ClCC(Cl)COCc1ccccc1 d12322f8a7b092d05f034f37cd13991d [0,1,0,0,0,1|1,0,0]=3 4752 B13R1.718 ClCC(Cl)COCc1ccccn1 118354aaf34e67baff878c0087929895 [0,1,0,0,0,1|2,0,0]=4 4753 B13R1.718 ClCC(Cl)COCc1cccnc1 ada525cc6abfe0ebdc1529b4c8a03d1c [0,1,0,0,0,1|2,0,0]=4 4754 B13R1.718 O=C(CCNc1ccccc1)NO 8b033323d51f01c1f25698e02d1dfbe0 [0,1,0,0,0,1|1,0,1]=4 4755 B13R1.718 O=C(CF)NCCc1ccccc1 f900d87f98238c5feff53bf05fdf5016 [0,1,0,0,0,1|0,0,2]=4 4756 B13R1.718 O=C(CNCc1ccccc1)NO 6eff27a01772c4751739e0f8fc4a4bbb [0,1,0,0,0,1|1,0,1]=4 4757 B13R1.718 O=C(CO)CNCc1ccccc1 7d61b04a8751fffaf7582ce731556efd [0,1,0,0,0,1|0,0,2]=4 4758 B13R1.718 O=C(CO)NCCc1ccccc1 f13a088047fed9c1f5f150212711bedf [0,1,0,0,0,1|0,0,2]=4 4759 B13R1.718 O=C(CS)NCCc1ccccc1 8a319e6418c994c74d21a416016099d2 [0,1,0,0,0,1|0,0,2]=4 4760 B13R1.718 OC(CF)CNCc1ccccc1 29c345fed18c163df8bb2ed652691484 [0,1,0,0,0,1|0,0,0]=2 4761 B13R1.718 OC(CF)CNCc1ccccn1 5071165548b8903832e129ebff988d89 [0,1,0,0,0,1|1,0,0]=3 4762 B13R1.718 OC(CF)CNCc1cccnc1 7a1d4d98c26777a99dd9862e4e9d2f9b [0,1,0,0,0,1|1,0,0]=3 4763 B13R1.718 OC(CF)CNCc1cccnn1 1b56cbdefafc2767cb777cd6daf13754 [0,1,0,0,0,1|2,0,0]=4 4764 B13R1.718 OC(CF)CNCc1ccncc1 a2580050d19f1b68ea8541aa2e71e5ab [0,1,0,0,0,1|1,0,0]=3 4765 B13R1.718 OC(CF)CNCc1ccncn1 4a81fb04f092199874419f08eb24d368 [0,1,0,0,0,1|2,0,0]=4 4766 B13R1.718 OC(CF)CNCc1ccnnc1 8a66544794b2c7a80075c46f950231bf [0,1,0,0,0,1|2,0,0]=4 4767 B13R1.718 OC(CF)CNCc1cnccn1 3adcd2e8e88988d66ca230ed148e2e43 [0,1,0,0,0,1|2,0,0]=4 4768 B13R1.718 OC(CF)CNCc1cncnc1 1050ed4b1e4f5c0fc90dfc951ebcee78 [0,1,0,0,0,1|2,0,0]=4 4769 B13R1.718 OC(CF)CNCc1ncccn1 0af83098669cc8c09fac31a8193f6110 [0,1,0,0,0,1|2,0,0]=4 4770 B13R1.718 OCC(F)CNCc1ccccc1 244608a5191f35d15a9a09d6eefb2a7e [0,1,0,0,0,1|1,0,0]=3 4771 B13R1.718 OCC(F)CNCc1ccccn1 501dba398eacf785e9d5af5731072af2 [0,1,0,0,0,1|2,0,0]=4 4772 B13R1.718 OCC(F)CNCc1cccnc1 95ea837c8462f67297ad883ac99814fa [0,1,0,0,0,1|2,0,0]=4 4773 B13R1.718 OCC(O)CCNc1ccccc1 1c3b9de4d883af7fb997db036d207d12 [0,1,0,0,0,1|0,0,0]=2 4774 B13R1.718 OCC(O)CCNc1ccccn1 44abe0f0b0e231f28f9d15e96d5f8bc1 [0,1,0,0,0,1|1,0,0]=3 4775 B13R1.718 OCC(O)CCNc1cccnc1 0a579fadb6e0b831483e138a60260036 [0,1,0,0,0,1|1,0,0]=3 4776 B13R1.718 OCC(O)CCNc1cccnn1 3e28bc2ca57f5eda4148861af306400b [0,1,0,0,0,1|2,0,0]=4 4777 B13R1.718 OCC(O)CCNc1ccncc1 a27d09b2c2f62ea8e6368b4b49b447ce [0,1,0,0,0,1|1,0,0]=3 4778 B13R1.718 OCC(O)CCNc1ccncn1 1dbde44ddb3daae93bf8e9b4d74c700b [0,1,0,0,0,1|2,0,0]=4 4779 B13R1.718 OCC(O)CCNc1cnccn1 3fcd3e60eb39afea986c436db9d14d8b [0,1,0,0,0,1|2,0,0]=4 4780 B13R1.718 OCC(O)CNCc1ccccc1 10b7e4262107d48cf003832f5cb1c48c [0,1,0,0,0,1|0,0,0]=2 4781 B13R1.718 OCC(O)CNCc1ccccn1 7ed5048990e8918868456e0fed6394f0 [0,1,0,0,0,1|1,0,0]=3 4782 B13R1.718 OCC(O)CNCc1cccnc1 9bc997819c31ca3f7c3e93b3922c9548 [0,1,0,0,0,1|1,0,0]=3 4783 B13R1.718 OCC(O)CNCc1cccnn1 778beb9e65625f1efc09e119213e1f10 [0,1,0,0,0,1|2,0,0]=4 4784 B13R1.718 OCC(O)CNCc1ccncc1 9d36bb4d7daeb23caad01546543a8c4a [0,1,0,0,0,1|1,0,0]=3 4785 B13R1.718 OCC(O)CNCc1ccncn1 9d47d7cb6c317625edc83b5d75bb44a8 [0,1,0,0,0,1|2,0,0]=4 4786 B13R1.718 OCC(O)CNCc1ccnnc1 32e81a09bedc27da0ecbbfc1af53c864 [0,1,0,0,0,1|2,0,0]=4 4787 B13R1.718 OCC(O)CNCc1cnccn1 19e0feef17ccc0b0dbecbe0da4e5da00 [0,1,0,0,0,1|2,0,0]=4 4788 B13R1.718 OCC(O)CNCc1cncnc1 eb7653fe1fcc2bcbbc36a10dee14dd6b [0,1,0,0,0,1|2,0,0]=4 4789 B13R1.718 OCC(O)CNCc1ncccn1 94993eeede8d5d306f75c8213b21452c [0,1,0,0,0,1|2,0,0]=4 4790 B13R1.718 OCC(O)COCc1ccccc1 bd5ea9844f1ddb361d6cf950f4f789f5 [0,1,0,0,0,1|0,0,0]=2 4791 B13R1.718 OCC(O)COCc1ccccn1 90acdc4cb454f093370c1a5a9deaefd0 [0,1,0,0,0,1|1,0,0]=3 4792 B13R1.718 OCC(O)COCc1cccnc1 dd72a270b6f36f8a14044a532883496a [0,1,0,0,0,1|1,0,0]=3 4793 B13R1.718 OCC(O)COCc1cccnn1 95b8c6e65d49a91eac7162d761f8e971 [0,1,0,0,0,1|2,0,0]=4 4794 B13R1.718 OCC(O)COCc1ccncc1 99f054b23555429ac2a2f956f8b6da1a [0,1,0,0,0,1|1,0,0]=3 4795 B13R1.718 OCC(O)COCc1ccncn1 2d077385de903ef1ae586a1bee006e71 [0,1,0,0,0,1|2,0,0]=4 4796 B13R1.718 OCC(O)COCc1ccnnc1 7fe29d61174724069fd2c0531003fe03 [0,1,0,0,0,1|2,0,0]=4 4797 B13R1.718 OCC(O)COCc1cnccn1 9c5b61684b8f6bb2fd164b604c0cac14 [0,1,0,0,0,1|2,0,0]=4 4798 B13R1.718 OCC(O)COCc1cncnc1 ab18697968c39f488ba48d2aafbb15e5 [0,1,0,0,0,1|2,0,0]=4 4799 B13R1.718 OCC(O)COCc1ncccn1 4e3b44ac7c5b4ddf84b35d943302180d [0,1,0,0,0,1|2,0,0]=4 4800 B13R1.718 OC[C@@H](F)CNCc1ccccc1 332d23e9ac872b67c6e0047480e015b3 [0,1,0,0,0,1|1,0,0]=3 4801 B13R1.718 OC[C@@H](F)CNCc1ccccn1 58d0b6938aecb7c6b73447e9d8396c41 [0,1,0,0,0,1|2,0,0]=4 4802 B13R1.718 OC[C@@H](F)CNCc1cccnc1 41d59c1efced24c634e924acd080c804 [0,1,0,0,0,1|2,0,0]=4 4803 B13R1.718 OC[C@@H](O)CNCc1ccccc1 f728b5b7979ca926a75153faa67f16f6 [0,1,0,0,0,1|0,0,0]=2 4804 B13R1.718 OC[C@@H](O)CNCc1ccccn1 c87e9010487a215b42319c2250b37cc4 [0,1,0,0,0,1|1,0,0]=3 4805 B13R1.718 OC[C@@H](O)CNCc1cccnc1 4fc5e1b9ae089ec170d99b91b7be5569 [0,1,0,0,0,1|1,0,0]=3 4806 B13R1.718 OC[C@@H](O)CNCc1cccnn1 d1427dfef4022732a9e8df37c0648d8e [0,1,0,0,0,1|2,0,0]=4 4807 B13R1.718 OC[C@@H](O)CNCc1ccncc1 cdc75b80c6c62544d531da256a710d94 [0,1,0,0,0,1|1,0,0]=3 4808 B13R1.718 OC[C@@H](O)CNCc1ccncn1 0533729e0d879010d392c80f3d076463 [0,1,0,0,0,1|2,0,0]=4 4809 B13R1.718 OC[C@@H](O)CNCc1ccnnc1 88b4c58626ec6d7c63c7a1eb2b6b1ec6 [0,1,0,0,0,1|2,0,0]=4 4810 B13R1.718 OC[C@@H](O)CNCc1cnccn1 bb098af91f423972d81fe8ffe30960a6 [0,1,0,0,0,1|2,0,0]=4 4811 B13R1.718 OC[C@@H](O)CNCc1cncnc1 a55ed6aa49d0b0fe199d41d8dfecdff7 [0,1,0,0,0,1|2,0,0]=4 4812 B13R1.718 OC[C@@H](O)CNCc1ncccn1 289831abfa2c7714e22ce2fbe1abb4e5 [0,1,0,0,0,1|2,0,0]=4 4813 B13R1.718 OC[C@@H](O)COCc1ccccc1 5c80659e749ab7eada73498294e7773c [0,1,0,0,0,1|0,0,0]=2 4814 B13R1.718 OC[C@@H](O)COCc1ccccn1 968b1c3c9843f57870539fc42b4d1c12 [0,1,0,0,0,1|1,0,0]=3 4815 B13R1.718 OC[C@@H](O)COCc1cccnc1 42851599b4a87afe1ca8b273fb9911b4 [0,1,0,0,0,1|1,0,0]=3 4816 B13R1.718 OC[C@@H](O)COCc1cccnn1 b1b31d256ecfd26bbcda151dca5a0439 [0,1,0,0,0,1|2,0,0]=4 4817 B13R1.718 OC[C@@H](O)COCc1ccncc1 4e7f3ae7c0dd1681ec652831cbc2ab56 [0,1,0,0,0,1|1,0,0]=3 4818 B13R1.718 OC[C@@H](O)COCc1ccncn1 72a8e992e0aaec2da12751d9289d77bc [0,1,0,0,0,1|2,0,0]=4 4819 B13R1.718 OC[C@@H](O)COCc1ccnnc1 5e8ec9fc2cc47d688b337c0f94c2e927 [0,1,0,0,0,1|2,0,0]=4 4820 B13R1.718 OC[C@@H](O)COCc1cnccn1 d0ab469b95ed142a442914e53c6272f8 [0,1,0,0,0,1|2,0,0]=4 4821 B13R1.718 OC[C@@H](O)COCc1cncnc1 90ea119032d1dae70aa30eb5173e63dd [0,1,0,0,0,1|2,0,0]=4 4822 B13R1.718 OC[C@@H](O)COCc1ncccn1 38894f199cab16aa9a17a0462fe82544 [0,1,0,0,0,1|2,0,0]=4 4823 B13R1.718 OC[C@H](F)CNCc1ccccc1 da94ebd7bb5ca16b0c08affc7573db81 [0,1,0,0,0,1|1,0,0]=3 4824 B13R1.718 OC[C@H](F)CNCc1ccccn1 104163af92c14021b441de147081035a [0,1,0,0,0,1|2,0,0]=4 4825 B13R1.718 OC[C@H](F)CNCc1cccnc1 3362a43233625346f054ec4845bf14ac [0,1,0,0,0,1|2,0,0]=4 4826 B13R1.718 OC[C@H](O)CNCc1ccccc1 e8f6692d108ebc12a57f59d0133d16d6 [0,1,0,0,0,1|0,0,0]=2 4827 B13R1.718 OC[C@H](O)CNCc1ccccn1 57b140d96e93304db3aff81789485e44 [0,1,0,0,0,1|1,0,0]=3 4828 B13R1.718 OC[C@H](O)CNCc1cccnc1 0f0c0a96b757f04812dbdd9bdd676c9b [0,1,0,0,0,1|1,0,0]=3 4829 B13R1.718 OC[C@H](O)CNCc1cccnn1 2bd0406927942012231524d0cb1c762c [0,1,0,0,0,1|2,0,0]=4 4830 B13R1.718 OC[C@H](O)CNCc1ccncc1 a5792f79c24bd3039e0bf868a8a999d0 [0,1,0,0,0,1|1,0,0]=3 4831 B13R1.718 OC[C@H](O)CNCc1ccncn1 51ce85c2430c6fdf4f3306085087ebfa [0,1,0,0,0,1|2,0,0]=4 4832 B13R1.718 OC[C@H](O)CNCc1ccnnc1 652552c05bba9d146e77918eadec77cc [0,1,0,0,0,1|2,0,0]=4 4833 B13R1.718 OC[C@H](O)CNCc1cnccn1 dfcd533d5dfd51b1c2c5d78a63d18fac [0,1,0,0,0,1|2,0,0]=4 4834 B13R1.718 OC[C@H](O)CNCc1cncnc1 e222325932320d665e1954a4b49a9f45 [0,1,0,0,0,1|2,0,0]=4 4835 B13R1.718 OC[C@H](O)CNCc1ncccn1 e4ec24fa2c90d989d13821ced4732a47 [0,1,0,0,0,1|2,0,0]=4 4836 B13R1.718 OC[C@H](O)COCc1ccccc1 78b4838e76aaf78bf6362dc57b2a4d86 [0,1,0,0,0,1|0,0,0]=2 4837 B13R1.718 OC[C@H](O)COCc1ccccn1 57312c5c12f7b487a45cb6122c03bb0c [0,1,0,0,0,1|1,0,0]=3 4838 B13R1.718 OC[C@H](O)COCc1cccnc1 b3d0ec146ac2c45528dc454f8a8e74c6 [0,1,0,0,0,1|1,0,0]=3 4839 B13R1.718 OC[C@H](O)COCc1cccnn1 88c6c4429fac3a369ea24509274ca015 [0,1,0,0,0,1|2,0,0]=4 4840 B13R1.718 OC[C@H](O)COCc1ccncc1 e8e515f25cd010e38b4e930b2bcd3c88 [0,1,0,0,0,1|1,0,0]=3 4841 B13R1.718 OC[C@H](O)COCc1ccncn1 564d17d599e3a50fe90c8e01140bbcd4 [0,1,0,0,0,1|2,0,0]=4 4842 B13R1.718 OC[C@H](O)COCc1ccnnc1 001e9b5e5b83da11375098c974a873d0 [0,1,0,0,0,1|2,0,0]=4 4843 B13R1.718 OC[C@H](O)COCc1cnccn1 1cac1ab2a7fedea9083dd57255953adc [0,1,0,0,0,1|2,0,0]=4 4844 B13R1.718 OC[C@H](O)COCc1cncnc1 8ad69a28fc9aaedcc319e22d7269b03d [0,1,0,0,0,1|2,0,0]=4 4845 B13R1.718 OC[C@H](O)COCc1ncccn1 d8343500b920f98d80f3a4e359ac09ae [0,1,0,0,0,1|2,0,0]=4 4846 B13R1.718 SCC(S)COCc1ccccc1 88271685b7cb8bfb9d3c1fc004140dc4 [0,1,0,0,0,1|0,1,0]=3 4847 B13R1.718 SCC(S)COCc1ccccn1 b54b4c001755a00f7f6ce23be44465da [0,1,0,0,0,1|1,1,0]=4 4848 B13R1.718 SCC(S)COCc1cccnc1 cf087dc78b0390a438f20efed46cc5c4 [0,1,0,0,0,1|1,1,0]=4 4849 B13R1.3523 CC(C)(Br)COCc1ccccc1 09a2aea7670059b2ee833bdc0acefff4 [0,1,0,0,0,1|1,0,0]=3 4850 B13R1.3523 CC(C)(Br)COCc1ccccn1 de13c9782fe4890825cffadc194169ea [0,1,0,0,0,1|2,0,0]=4 4851 B13R1.3523 CC(C)(Br)COCc1cccnc1 5eadd8838c9c713f394c75c4b5204ec0 [0,1,0,0,0,1|2,0,0]=4 4852 B13R1.3523 CC(C)(C)CCNc1ccccc1 e4eb5853055cf692dd43a46b2d2d1231 [0,1,0,0,0,1|1,0,0]=3 4853 B13R1.3523 CC(C)(C)CCNc1ccccn1 4cd867408c22b55d687eb53c2130c125 [0,1,0,0,0,1|2,0,0]=4 4854 B13R1.3523 CC(C)(C)CCNc1cccnc1 6a247a8553707958027106f0045f3b09 [0,1,0,0,0,1|2,0,0]=4 4855 B13R1.3523 CC(C)(C)CCNc1ccncc1 c741332c61175b57d7843e745cc03736 [0,1,0,0,0,1|2,0,0]=4 4856 B13R1.3523 CC(C)(C)CCOc1ccccn1 b208b5936e012e4194e0f03e3c86e817 [0,1,0,0,0,1|2,0,0]=4 4857 B13R1.3523 CC(C)(C)CCOc1cccnc1 7276d74618711b4826e8414e0867c9d8 [0,1,0,0,0,1|2,0,0]=4 4858 B13R1.3523 CC(C)(C)CCOc1ccncc1 1aacd8974cf0966a542ca872be9122a0 [0,1,0,0,0,1|2,0,0]=4 4859 B13R1.3523 CC(C)(C)CNCc1ccccc1 120dce255af61d3f27a86b6df5546e6d [0,1,0,0,0,1|1,0,0]=3 4860 B13R1.3523 CC(C)(C)CNCc1ccccn1 c4805cba29de1d6693b9042fc74d05d0 [0,1,0,0,0,1|2,0,0]=4 4861 B13R1.3523 CC(C)(C)CNCc1cccnc1 1f20e612ee10468a9128f6803cdb33de [0,1,0,0,0,1|2,0,0]=4 4862 B13R1.3523 CC(C)(C)CNCc1ccncc1 6acffe25acef08fe7ef0bcaa32ea7776 [0,1,0,0,0,1|2,0,0]=4 4863 B13R1.3523 CC(C)(C)COCc1ccccc1 88c36added3761c571c82c9bcdd32e34 [0,1,0,0,0,1|1,0,0]=3 4864 B13R1.3523 CC(C)(C)COCc1ccccn1 7ff580475ef9002f26e342dfb145886c [0,1,0,0,0,1|2,0,0]=4 4865 B13R1.3523 CC(C)(C)COCc1cccnc1 70366a55ed9ee364494e469dcabac85a [0,1,0,0,0,1|2,0,0]=4 4866 B13R1.3523 CC(C)(C)COCc1ccncc1 6039ca51512d38c04d5a73033e8c327c [0,1,0,0,0,1|2,0,0]=4 4867 B13R1.3523 CC(C)(C)NCCc1ccccc1 3f7d750835adb5f58961ed6ea0ec8491 [0,1,0,0,0,1|1,0,0]=3 4868 B13R1.3523 CC(C)(C)NCCc1ccccn1 0a3eb93443b7ba9219a6e04606787e1e [0,1,0,0,0,1|2,0,0]=4 4869 B13R1.3523 CC(C)(C)NCCc1cccnc1 f11b814fe579295504e41ed4d0da0924 [0,1,0,0,0,1|2,0,0]=4 4870 B13R1.3523 CC(C)(C)NCCc1ccncc1 e66a3ed3b9e911ce8084125c90bd36f9 [0,1,0,0,0,1|2,0,0]=4 4871 B13R1.3523 CC(C)(F)CCNc1ccccc1 9ca5eb616b5c64c965352963d8743c51 [0,1,0,0,0,1|1,0,0]=3 4872 B13R1.3523 CC(C)(F)CCNc1cccnc1 289ef9c45ea35688d6416890ce526865 [0,1,0,0,0,1|2,0,0]=4 4873 B13R1.3523 CC(C)(F)CCNc1ccncc1 463b2b271d546586df4c0d3e7c089ab3 [0,1,0,0,0,1|2,0,0]=4 4874 B13R1.3523 CC(C)(F)CNCc1ccccc1 e89be8c1438a67cc2a6a0da11380728d [0,1,0,0,0,1|1,0,0]=3 4875 B13R1.3523 CC(C)(F)CNCc1ccccn1 4f2c52a604c86dfa2100268d1eb8332c [0,1,0,0,0,1|2,0,0]=4 4876 B13R1.3523 CC(C)(F)CNCc1cccnc1 ae8757f032dbddf859012eba815adfa7 [0,1,0,0,0,1|2,0,0]=4 4877 B13R1.3523 CC(C)(F)CNCc1ccncc1 039c90f7a65064c20dd0ff38a9ca3e19 [0,1,0,0,0,1|2,0,0]=4 4878 B13R1.3523 CC(C)(F)COCc1ccccc1 73208540f130f922b7ebf79f516d6005 [0,1,0,0,0,1|1,0,0]=3 4879 B13R1.3523 CC(C)(F)COCc1ccccn1 3f0e87a884a6b4c77f5b47f2309fb724 [0,1,0,0,0,1|2,0,0]=4 4880 B13R1.3523 CC(C)(F)COCc1cccnc1 7679e18848773e8c11ea211e4db62a50 [0,1,0,0,0,1|2,0,0]=4 4881 B13R1.3523 CC(C)(F)COCc1ccncc1 337baafc7d69de80e5b205cc2e2da91e [0,1,0,0,0,1|2,0,0]=4 4882 B13R1.3523 CC(C)(O)CCNc1ccccc1 c4f5ba88bd1187928d72373d155556e0 [0,1,0,0,0,1|0,0,0]=2 4883 B13R1.3523 CC(C)(O)CCNc1ccccn1 079af5d016e8429727e358ff16f33e24 [0,1,0,0,0,1|1,0,0]=3 4884 B13R1.3523 CC(C)(O)CCNc1cccnc1 500b97ac84085bb47e5be73b3ea09b6c [0,1,0,0,0,1|1,0,0]=3 4885 B13R1.3523 CC(C)(O)CCNc1cccnn1 055eb2d8e544e84cdcb5fa411a172e35 [0,1,0,0,0,1|2,0,0]=4 4886 B13R1.3523 CC(C)(O)CCNc1ccncc1 3febc68ffefb5f6bb0a183d79745ba28 [0,1,0,0,0,1|1,0,0]=3 4887 B13R1.3523 CC(C)(O)CCNc1ccncn1 2d047f69f58ff0abc468fcfb1b4fa113 [0,1,0,0,0,1|2,0,0]=4 4888 B13R1.3523 CC(C)(O)CCNc1ccnnc1 6fc38ede73c707f429285fa193afc6cd [0,1,0,0,0,1|2,0,0]=4 4889 B13R1.3523 CC(C)(O)CCNc1cnccn1 abde09bbbcdbe5b1fd5d82e1f8977b1e [0,1,0,0,0,1|2,0,0]=4 4890 B13R1.3523 CC(C)(O)CCNc1cncnc1 8950dc008adae14c47ef2a7049645d2c [0,1,0,0,0,1|2,0,0]=4 4891 B13R1.3523 CC(C)(O)CCNc1ncccn1 77330569ec0652b22be99ce59c2fade1 [0,1,0,0,0,1|2,0,0]=4 4892 B13R1.3523 CC(C)(O)CCOc1ccccn1 4c2a8627e8924908c4da06c4e02b783e [0,1,0,0,0,1|1,0,0]=3 4893 B13R1.3523 CC(C)(O)CCOc1cccnc1 e9a92ff7ff8704a6b36e437884e4f2da [0,1,0,0,0,1|1,0,0]=3 4894 B13R1.3523 CC(C)(O)CCOc1ccncc1 7a4b4f7d7739d01dad5e2f2145dab931 [0,1,0,0,0,1|1,0,0]=3 4895 B13R1.3523 CC(C)(O)CCOc1ccnnc1 f82bf4eb7cff1ddacd50746839fc2296 [0,1,0,0,0,1|2,0,0]=4 4896 B13R1.3523 CC(C)(O)CCOc1cnccn1 fb2f7648cee029910c3f89b53af137f9 [0,1,0,0,0,1|2,0,0]=4 4897 B13R1.3523 CC(C)(O)CCOc1cncnc1 cfbc75a3320b67e7435d003de9d24924 [0,1,0,0,0,1|2,0,0]=4 4898 B13R1.3523 CC(C)(O)CCOc1ncccn1 a62a61e8da63dda1c83b0bb58a766da4 [0,1,0,0,0,1|2,0,0]=4 4899 B13R1.3523 CC(C)(O)CNCc1ccccc1 ac03deab52d134fd4f2ecc3aba4f9893 [0,1,0,0,0,1|0,0,0]=2 4900 B13R1.3523 CC(C)(O)CNCc1ccccn1 f35897152b0f65dc1b7b40ae25f0932a [0,1,0,0,0,1|1,0,0]=3 4901 B13R1.3523 CC(C)(O)CNCc1cccnc1 7232a0c7410ef2be6a34f3e77a19a571 [0,1,0,0,0,1|1,0,0]=3 4902 B13R1.3523 CC(C)(O)CNCc1cccnn1 db342340d9980bd8eaaa2eeb559027c4 [0,1,0,0,0,1|2,0,0]=4 4903 B13R1.3523 CC(C)(O)CNCc1ccncc1 9f60804bd61c9f092ed7c60648fcb832 [0,1,0,0,0,1|1,0,0]=3 4904 B13R1.3523 CC(C)(O)CNCc1ccncn1 09ac9f04a455ade62411183de50ae694 [0,1,0,0,0,1|2,0,0]=4 4905 B13R1.3523 CC(C)(O)CNCc1ccnnc1 72fdc27918ad35cb37f892d2ffdc1d9b [0,1,0,0,0,1|2,0,0]=4 4906 B13R1.3523 CC(C)(O)CNCc1cnccn1 b3611a9ceae8d959631d4142a48b94bd [0,1,0,0,0,1|2,0,0]=4 4907 B13R1.3523 CC(C)(O)CNCc1cncnc1 9e971a4f2cd242b621fe1be1f17e9ad0 [0,1,0,0,0,1|2,0,0]=4 4908 B13R1.3523 CC(C)(O)CNCc1ncccn1 3305feeab06da73b1d11421e0f0b887a [0,1,0,0,0,1|2,0,0]=4 4909 B13R1.3523 CC(C)(O)COCc1ccccc1 61e7e7507275b8dcd72c7dd1f7a3ecee [0,1,0,0,0,1|0,0,0]=2 4910 B13R1.3523 CC(C)(O)COCc1ccccn1 20bec6710064573e132c08a86cbc5155 [0,1,0,0,0,1|1,0,0]=3 4911 B13R1.3523 CC(C)(O)COCc1cccnc1 495307f7413e87f05cd9d14979309670 [0,1,0,0,0,1|1,0,0]=3 4912 B13R1.3523 CC(C)(O)COCc1cccnn1 c2d0979bcda7904efebc940ec2ab20a6 [0,1,0,0,0,1|2,0,0]=4 4913 B13R1.3523 CC(C)(O)COCc1ccncc1 79337d9480f64dfb403cac71d53cf882 [0,1,0,0,0,1|1,0,0]=3 4914 B13R1.3523 CC(C)(O)COCc1ccncn1 69fea8d5a7c18a574fbe0a2753d8128f [0,1,0,0,0,1|2,0,0]=4 4915 B13R1.3523 CC(C)(O)COCc1ccnnc1 957174e107d8b4a9f2ad331a1f6b2d7a [0,1,0,0,0,1|2,0,0]=4 4916 B13R1.3523 CC(C)(O)COCc1cnccn1 e451257022e8a8e171a22f5383d08591 [0,1,0,0,0,1|2,0,0]=4 4917 B13R1.3523 CC(C)(O)COCc1cncnc1 cb28caaec35b1d20f33e2d4719413501 [0,1,0,0,0,1|2,0,0]=4 4918 B13R1.3523 CC(C)(O)COCc1ncccn1 b82c7dd93a2f4a6fb11e6c80b6f4f428 [0,1,0,0,0,1|2,0,0]=4 4919 B13R1.3523 CC(C)(S)COCc1ccccc1 149a9f519f2ca316fa0c7da7548e2256 [0,1,0,0,0,1|0,1,0]=3 4920 B13R1.3523 CC(C)(S)COCc1ccccn1 8235aab20d494630bea03733e8dde4b2 [0,1,0,0,0,1|1,1,0]=4 4921 B13R1.3523 CC(C)(S)COCc1cccnc1 573fbce7625972fe0fe0079a352ed320 [0,1,0,0,0,1|1,1,0]=4 4922 B13R1.3523 CC(F)(F)CCNc1ccccc1 59e2148c1ea7a8b812217853a2f23bf7 [0,1,0,0,0,1|1,0,0]=3 4923 B13R1.3523 CC(F)(F)CCNc1ccccn1 ce713a952589fb9653ce7d472b02d228 [0,1,0,0,0,1|2,0,0]=4 4924 B13R1.3523 CC(F)(F)CCNc1cccnc1 c7f2c90b35d1802193a8e578c002a09d [0,1,0,0,0,1|2,0,0]=4 4925 B13R1.3523 CC(F)(F)CCNc1ccncc1 a0ae8ea95a7a5d56cd15ed40af579477 [0,1,0,0,0,1|2,0,0]=4 4926 B13R1.3523 CC(F)(F)CCOc1ccccn1 a9888061d16516b214c9e917639ca78b [0,1,0,0,0,1|2,0,0]=4 4927 B13R1.3523 CC(F)(F)CCOc1cccnc1 4bae1e6af0770360fd400c98c7c974b6 [0,1,0,0,0,1|2,0,0]=4 4928 B13R1.3523 CC(F)(F)CCOc1ccncc1 fad74eca8a82577f2b9294a4e7f3109b [0,1,0,0,0,1|2,0,0]=4 4929 B13R1.3523 CC(F)(F)CNCc1ccccc1 f5d1c85105402783fee3f128e5288419 [0,1,0,0,0,1|1,0,0]=3 4930 B13R1.3523 CC(F)(F)CNCc1ccccn1 86685edba1350e1bd14c59916d61f04c [0,1,0,0,0,1|2,0,0]=4 4931 B13R1.3523 CC(F)(F)CNCc1cccnc1 6b8aa66cb6943de7a5debe9035e0e34d [0,1,0,0,0,1|2,0,0]=4 4932 B13R1.3523 CC(F)(F)CNCc1ccncc1 b1e93aaf31f5e97a7d207c780a56202a [0,1,0,0,0,1|2,0,0]=4 4933 B13R1.3523 CC(F)(F)COCc1ccccc1 c289f26370a34cda22ba40d65eb1bb90 [0,1,0,0,0,1|1,0,0]=3 4934 B13R1.3523 CC(F)(F)COCc1ccccn1 b241a16d3e52cb65e3c6077039bd9fc1 [0,1,0,0,0,1|2,0,0]=4 4935 B13R1.3523 CC(F)(F)COCc1cccnc1 e03932821f18f196e9df17cf7c08fe16 [0,1,0,0,0,1|2,0,0]=4 4936 B13R1.3523 CC(F)(F)COCc1ccncc1 272879c4b47cf127a4e2a8c60ab65baa [0,1,0,0,0,1|2,0,0]=4 4937 B13R1.3523 CS(=O)(=O)CCNc1ccccc1 e79e4a2fe7b9d2bd6fa62f30e1da335a [0,1,0,0,0,1|1,0,1]=4 4938 B13R1.3523 CS(=O)(=O)CNCc1ccccc1 c1f52c8e26be6a464d93a0144ae7b82a [0,1,0,0,0,1|1,0,1]=4 4939 B13R1.3523 FC(F)(Br)COCc1ccccc1 892281c4864153e12e9ac4f0370bd97c [0,1,0,0,0,1|2,0,0]=4 4940 B13R1.3523 FC(F)(Cl)COCc1ccccc1 5cd1b9dfc517bdccbfb39c055f799a72 [0,1,0,0,0,1|2,0,0]=4 4941 B13R1.3523 FC(F)(F)CCNc1ccccc1 4fc17c795ac56e9d53932898344c0fe8 [0,1,0,0,0,1|2,0,0]=4 4942 B13R1.3523 FC(F)(F)CNCc1ccccc1 6952cb3f4dafa065f63dd626491af1e6 [0,1,0,0,0,1|2,0,0]=4 4943 B13R1.3523 FC(F)(F)COCc1ccccc1 7eb08965c07614b4b30eebadc2cb5625 [0,1,0,0,0,1|2,0,0]=4 4944 B13R1.3523 O=S(=O)(O)CCNc1ccccc1 f6856e576d3acc586a67f80ce457faf2 [0,1,0,0,0,1|2,0,0]=4 4945 B13R1.3523 O=S(=O)(O)CNCc1ccccc1 c9e6682bbbfd65556006b4464a2494fe [0,1,0,0,0,1|2,0,0]=4 4946 B13R1.280 CC(C)CNc1cccccc1=O c6c69ad81619a4c78e56640c0914f18b [0,1,0,0,0,1|2,0,0]=4 4947 B13R1.280 CC(C)COc1cccccc1=O efbb0c211fc1c83bb20b18133fc4b5ae [0,1,0,0,0,1|2,0,0]=4 4948 B13R1.280 CC(O)CNc1cccccc1=O f1614c850f74da9c335f5a6c2380edda [0,1,0,0,0,1|1,0,0]=3 4949 B13R1.280 C[C@@H](O)CNc1cccccc1=O 1fb229ff1d55f56ce7ad6983a163c2cf [0,1,0,0,0,1|1,0,0]=3 4950 B13R1.280 C[C@H](O)CNc1cccccc1=O 6140b904073840099fc2d217b79b3594 [0,1,0,0,0,1|1,0,0]=3 4951 B13R1.3 C#Cc1ccc(cc1)CNC(C)C e6f0eddd3a5b5bbdc992e93e090dc57e [0,2,0,0,0,0|2,0,0]=4 4952 B13R1.3 C#Cc1ccc(cc1)COC(C)C 0f6668dafcb66fc1759022ebe4e861e7 [0,2,0,0,0,0|2,0,0]=4 4953 B13R1.3 C#Cc1ccc(cc1)NCC(C)C b448a80cca2cbe185fed7e54e440bca7 [0,2,0,0,0,0|2,0,0]=4 4954 B13R1.3 C#Cc1ccc(cc1)NCC(C)O 075d04c148fd390b9a42b121b9a96ca0 [0,2,0,0,0,0|1,0,0]=3 4955 B13R1.3 C#Cc1ccc(cc1)NC[C@H](C)O 4d27c190fe1a02068a9686d28b7a76c7 [0,2,0,0,0,0|1,0,0]=3 4956 B13R1.3 C#Cc1ccc(cc1)OCC(C)C f85caf3e33cf6ef4f5f3f4a05623238d [0,2,0,0,0,0|2,0,0]=4 4957 B13R1.3 C#Cc1ccc(cn1)NCC(C)O de9371f617ee9a3fc53fc65a4984debf [0,2,0,0,0,0|2,0,0]=4 4958 B13R1.3 C#Cc1ccc(cn1)NC[C@@H](C)O a2b0285bd9a6509997f2ff9f5766b5be [0,2,0,0,0,0|2,0,0]=4 4959 B13R1.3 C#Cc1ccc(cn1)NC[C@H](C)O 4253ce5fff8e9223c43c2306b76b58fa [0,2,0,0,0,0|2,0,0]=4 4960 B13R1.3 C#Cc1ccc(nc1)NCC(C)O ea66c1557722bdb3aaa5bab15ff1bd05 [0,2,0,0,0,0|2,0,0]=4 4961 B13R1.3 C#Cc1ccc(nc1)NC[C@@H](C)O fdb6884ad09a1985bf82ea65180489dd [0,2,0,0,0,0|2,0,0]=4 4962 B13R1.3 C#Cc1ccc(nc1)NC[C@H](C)O 94db2ea748a2d159c01a274d77e06c3c [0,2,0,0,0,0|2,0,0]=4 4963 B13R1.3 C=Cc1ccc(cc1)CNC(C)C 36156cd70321a67f6dce4d9b7bffeb2a [0,2,0,0,0,0|2,0,0]=4 4964 B13R1.3 C=Cc1ccc(cc1)COC(C)C 85e2bb35b140ef4f8f0a4b73296ad60d [0,2,0,0,0,0|2,0,0]=4 4965 B13R1.3 C=Cc1ccc(cc1)NCC(C)C 781e5a171ff9a20d32354270e0f893e0 [0,2,0,0,0,0|2,0,0]=4 4966 B13R1.3 C=Cc1ccc(cc1)NCC(C)O 48475e864f8b806c58394d44235ec5f9 [0,2,0,0,0,0|1,0,0]=3 4967 B13R1.3 C=Cc1ccc(cc1)NC[C@@H](C)O a4196b6fc4dcb707318418df43eab182 [0,2,0,0,0,0|1,0,0]=3 4968 B13R1.3 C=Cc1ccc(cc1)NC[C@H](C)O 2d2ae657ba5268e92234ee416a668161 [0,2,0,0,0,0|1,0,0]=3 4969 B13R1.3 C=Cc1ccc(cc1)OCC(C)C 34986f0447a1d8df589cdb05ca8dd96f [0,2,0,0,0,0|2,0,0]=4 4970 B13R1.3 C=Cc1ccc(cn1)NCC(C)O f84530f8d48563b0a54b9be85883bd02 [0,2,0,0,0,0|2,0,0]=4 4971 B13R1.3 C=Cc1ccc(cn1)NC[C@@H](C)O 4693b32d4d696d0b1e0bda49c51c8860 [0,2,0,0,0,0|2,0,0]=4 4972 B13R1.3 C=Cc1ccc(cn1)NC[C@H](C)O 6cd38a52abd325aa9a1af96d197e6a33 [0,2,0,0,0,0|2,0,0]=4 4973 B13R1.3 C=Cc1ccc(nc1)NCC(C)O c2c9b78f5d08a8ea47f2e5822c391e6f [0,2,0,0,0,0|2,0,0]=4 4974 B13R1.3 C=Cc1ccc(nc1)NC[C@@H](C)O eb295597664f2021321261045dd62246 [0,2,0,0,0,0|2,0,0]=4 4975 B13R1.3 C=Cc1ccc(nc1)NC[C@H](C)O ca33832912018210bcccbb120ec753b0 [0,2,0,0,0,0|2,0,0]=4 4976 B13R1.3 CC(C)CNc1ccc(cc1)C#N 73a3a01fb501dfd0ab27eed96db17441 [0,2,0,0,0,0|2,0,0]=4 4977 B13R1.3 CC(C)CNc1ccc(cc1)C=O 53d7bacb8b11cdad75957b6e67532b07 [0,2,0,0,0,0|2,0,0]=4 4978 B13R1.3 CC(C)CNc1ccc(cc1)CO 475a078da820895fbef270579cdd2330 [0,2,0,0,0,0|2,0,0]=4 4979 B13R1.3 CC(C)COc1ccc(cc1)C#N 4fe0bacc21bc3eb30ffa7dd21031ffa4 [0,2,0,0,0,0|2,0,0]=4 4980 B13R1.3 CC(C)COc1ccc(cc1)C=O 8198abae2efc6ea28144bbd6f6f4c2b6 [0,2,0,0,0,0|2,0,0]=4 4981 B13R1.3 CC(C)COc1ccc(cc1)N=O d4a06c8ac17441d5e97c0940348f1721 [0,2,0,0,0,0|2,0,0]=4 4982 B13R1.3 CC(C)NCc1ccc(cc1)C#N 5f1a2888ef246a0dd3ce103330e0a45e [0,2,0,0,0,0|2,0,0]=4 4983 B13R1.3 CC(C)NCc1ccc(cc1)CBr 398b1249d90b420f415abf4423ebfcd6 [0,2,0,0,0,0|2,0,0]=4 4984 B13R1.3 CC(C)NCc1ccc(cc1)CO 83fc7d492e8eb1f878b070cdf3d4efc9 [0,2,0,0,0,0|2,0,0]=4 4985 B13R1.3 CC(C)OCc1ccc(cc1)C#N 8e5521a00da548fbeeadb0403744d151 [0,2,0,0,0,0|2,0,0]=4 4986 B13R1.3 CC(C)OCc1ccc(cc1)C=O 3dc828b0457d8cfec1ad59575e96f3a7 [0,2,0,0,0,0|2,0,0]=4 4987 B13R1.3 CC(O)CNc1ccc(cc1)C#N 10383af6b3689499de9dd431322cf027 [0,2,0,0,0,0|1,0,0]=3 4988 B13R1.3 CC(O)CNc1ccc(cc1)C=O 69f54016a0f9320b809f4e403c041bb2 [0,2,0,0,0,0|1,0,0]=3 4989 B13R1.3 CC(O)CNc1ccc(cc1)CO c7438cbe6f026157f9007455221fe498 [0,2,0,0,0,0|1,0,0]=3 4990 B13R1.3 CC(O)CNc1ccc(cn1)C#N c39bbb7aa5c1c1397a3213995534db8d [0,2,0,0,0,0|2,0,0]=4 4991 B13R1.3 CC(O)CNc1ccc(cn1)C=O 5b8a6d9c3dab669b626c9c5199aff537 [0,2,0,0,0,0|2,0,0]=4 4992 B13R1.3 CC(O)CNc1ccc(cn1)CCl 235b8f59c99dc370c0943814a36fc99e [0,2,0,0,0,0|2,0,0]=4 4993 B13R1.3 CC(O)CNc1ccc(cn1)CO 1a30741a7e4efc233377446e98d9a7f9 [0,2,0,0,0,0|2,0,0]=4 4994 B13R1.3 CC(O)CNc1ccc(nc1)C#N 561c7c4075dc6122218c99954e18348f [0,2,0,0,0,0|2,0,0]=4 4995 B13R1.3 CC(O)CNc1ccc(nc1)C=O 452deb1e8700c5ad1ad40b5aa7bdbbb8 [0,2,0,0,0,0|2,0,0]=4 4996 B13R1.3 CC(O)CNc1ccc(nc1)CO 16537a437b9a82af9c0504a7458e68a2 [0,2,0,0,0,0|2,0,0]=4 4997 B13R1.3 CCc1ccc(cc1)CNC(C)C b9c2f38bc6cd20d970d94f64e93c67b1 [0,2,0,0,0,0|2,0,0]=4 4998 B13R1.3 CCc1ccc(cc1)COC(C)C 827f94870fd24c10258aa66fde5c5351 [0,2,0,0,0,0|2,0,0]=4 4999 B13R1.3 CCc1ccc(cc1)NCC(C)C e30c6bf49e3ffe79224312d78baf9dbe [0,2,0,0,0,0|2,0,0]=4 5000 B13R1.3 CCc1ccc(cc1)NCC(C)O 5c121082b45c312f16f367c15e7213c1 [0,2,0,0,0,0|1,0,0]=3 5001 B13R1.3 CCc1ccc(cc1)NC[C@H](C)O 36a988bc8fce4abe359ab411c66de960 [0,2,0,0,0,0|1,0,0]=3 5002 B13R1.3 CCc1ccc(cc1)OCC(C)C f97007c9dd123abfb4a58b8449aebe77 [0,2,0,0,0,0|2,0,0]=4 5003 B13R1.3 CCc1ccc(cn1)NCC(C)O f8ae3f2ac734fa4f619cca5eb642eab5 [0,2,0,0,0,0|2,0,0]=4 5004 B13R1.3 CCc1ccc(cn1)NC[C@@H](C)O b3b948875036727a7514248ebe8c59a0 [0,2,0,0,0,0|2,0,0]=4 5005 B13R1.3 CCc1ccc(cn1)NC[C@H](C)O 8a18bb469bff0e8e171ea82709752043 [0,2,0,0,0,0|2,0,0]=4 5006 B13R1.3 CCc1ccc(nc1)NCC(C)O 7a618fc8327c5a5e178237b5c71d4026 [0,2,0,0,0,0|2,0,0]=4 5007 B13R1.3 CCc1ccc(nc1)NC[C@H](C)O d84eee14332ef30805b544eebe159d2c [0,2,0,0,0,0|2,0,0]=4 5008 B13R1.3 COc1ccc(cc1)CNC(C)C 3fbab2f6fdf968d7c6962002435840ea [0,2,0,0,0,0|2,0,0]=4 5009 B13R1.3 COc1ccc(cc1)COC(C)C 544cb0beac466d1fe5b9a011f927534f [0,2,0,0,0,0|2,0,0]=4 5010 B13R1.3 COc1ccc(cc1)NCC(C)C 59d476837cb9437d0f607ea9cdf30362 [0,2,0,0,0,0|2,0,0]=4 5011 B13R1.3 COc1ccc(cc1)NCC(C)O dce8ae518910c8f314a95ae16fbfd582 [0,2,0,0,0,0|1,0,0]=3 5012 B13R1.3 COc1ccc(cc1)NC[C@@H](C)O 5e65c1a3c47c608fd9ff63e8a5e61da4 [0,2,0,0,0,0|1,0,0]=3 5013 B13R1.3 COc1ccc(cc1)NC[C@H](C)O 72635981a91f27c0fac816f03c0dd769 [0,2,0,0,0,0|1,0,0]=3 5014 B13R1.3 COc1ccc(cc1)OCC(C)C 702223f0df1fa37a2ba27c84ba97d5c6 [0,2,0,0,0,0|2,0,0]=4 5015 B13R1.3 COc1ccc(cn1)NCC(C)O 9b480d891dd8b05323bdb7b919f8dd69 [0,2,0,0,0,0|2,0,0]=4 5016 B13R1.3 COc1ccc(cn1)NC[C@@H](C)O 2dd69abdc0bfe0bec26b9640636fd334 [0,2,0,0,0,0|2,0,0]=4 5017 B13R1.3 COc1ccc(cn1)NC[C@H](C)O 9e519456111042fa44f9ac01726bace7 [0,2,0,0,0,0|2,0,0]=4 5018 B13R1.3 COc1ccc(nc1)NCC(C)O c8f2e89b38797414238836ecc1186b08 [0,2,0,0,0,0|2,0,0]=4 5019 B13R1.3 COc1ccc(nc1)NC[C@@H](C)O 92cf09f9b429a355f4fcaa5c43156bcb [0,2,0,0,0,0|2,0,0]=4 5020 B13R1.3 COc1ccc(nc1)NC[C@H](C)O 913651b29e3e0e7491d923adb7f8dc54 [0,2,0,0,0,0|2,0,0]=4 5021 B13R1.3 CSc1ccc(cc1)CNC(C)C 06d944333356b173a767d044193301c1 [0,2,0,0,0,0|2,0,0]=4 5022 B13R1.3 CSc1ccc(cc1)COC(C)C 3edb920351d9bedc07b37dfcc2842c1e [0,2,0,0,0,0|2,0,0]=4 5023 B13R1.3 CSc1ccc(cc1)NCC(C)C f4acb69e5e3c22ed6095ed3eea326cfc [0,2,0,0,0,0|2,0,0]=4 5024 B13R1.3 CSc1ccc(cc1)NCC(C)O e8d93933ba5916d99afb8c783ed5b150 [0,2,0,0,0,0|1,0,0]=3 5025 B13R1.3 CSc1ccc(cc1)NC[C@@H](C)O 19d5f2c32f572899f2f5f560e3458cc9 [0,2,0,0,0,0|1,0,0]=3 5026 B13R1.3 CSc1ccc(cc1)NC[C@H](C)O 46cd0ba4daa889017aec14b40c66ff28 [0,2,0,0,0,0|1,0,0]=3 5027 B13R1.3 CSc1ccc(cc1)OCC(C)C 214d475302763d1a9483c75a9a786470 [0,2,0,0,0,0|2,0,0]=4 5028 B13R1.3 CSc1ccc(cn1)NCC(C)O 5baa86b082a1cbb129856ff4d2c5a552 [0,2,0,0,0,0|2,0,0]=4 5029 B13R1.3 CSc1ccc(cn1)NC[C@@H](C)O 1106a4ff0e15faae4acb1fb070020ec6 [0,2,0,0,0,0|2,0,0]=4 5030 B13R1.3 CSc1ccc(cn1)NC[C@H](C)O cac0848f1baa0a27ef9cba809c380012 [0,2,0,0,0,0|2,0,0]=4 5031 B13R1.3 CSc1ccc(nc1)NCC(C)O c15b76f3581a40570dfc4ee7fb247ec5 [0,2,0,0,0,0|2,0,0]=4 5032 B13R1.3 CSc1ccc(nc1)NC[C@H](C)O b5676624f1df5abbb334ca52e64d5775 [0,2,0,0,0,0|2,0,0]=4 5033 B13R1.3 C[C@@H](O)CNc1ccc(cc1)C=O f7c74193d876da0824b587bf4dfa26ea [0,2,0,0,0,0|1,0,0]=3 5034 B13R1.3 C[C@@H](O)CNc1ccc(cc1)CO 5ac4b480311b32da800dddd95b36c1ce [0,2,0,0,0,0|1,0,0]=3 5035 B13R1.3 C[C@@H](O)CNc1ccc(cn1)C#N 4a77e523b5a7359b17b82043ffa9ed30 [0,2,0,0,0,0|2,0,0]=4 5036 B13R1.3 C[C@@H](O)CNc1ccc(cn1)C=O fb5517809a6d680143c0fa0b12782eff [0,2,0,0,0,0|2,0,0]=4 5037 B13R1.3 C[C@@H](O)CNc1ccc(cn1)CCl 8568256a8dfb968503007bea6ed90f39 [0,2,0,0,0,0|2,0,0]=4 5038 B13R1.3 C[C@@H](O)CNc1ccc(cn1)CO ce55e8e82fc7ddd05e4ba0f5fcf36f00 [0,2,0,0,0,0|2,0,0]=4 5039 B13R1.3 C[C@@H](O)CNc1ccc(nc1)C#N 9f934ba2ed90e8a5de6b9eefd123dd25 [0,2,0,0,0,0|2,0,0]=4 5040 B13R1.3 C[C@@H](O)CNc1ccc(nc1)C=O 8ad76e9891be8083981277d7e0c63c7d [0,2,0,0,0,0|2,0,0]=4 5041 B13R1.3 C[C@@H](O)CNc1ccc(nc1)CO 579460a9199a4010b557efac21a70f71 [0,2,0,0,0,0|2,0,0]=4 5042 B13R1.3 C[C@H](O)CNc1ccc(cc1)C#N 3dc3281e155433b4bd47977774e02192 [0,2,0,0,0,0|1,0,0]=3 5043 B13R1.3 C[C@H](O)CNc1ccc(cc1)C=O f75111789d576b9b2a297e94bf155039 [0,2,0,0,0,0|1,0,0]=3 5044 B13R1.3 C[C@H](O)CNc1ccc(cc1)CO a7fb5a420254531c29ee8e84f459ddac [0,2,0,0,0,0|1,0,0]=3 5045 B13R1.3 C[C@H](O)CNc1ccc(cn1)C#N accf58205e8e33ae2423e44da987ce07 [0,2,0,0,0,0|2,0,0]=4 5046 B13R1.3 C[C@H](O)CNc1ccc(cn1)C=O b61d90670d4a73b54ae0b400f1a2c1cd [0,2,0,0,0,0|2,0,0]=4 5047 B13R1.3 C[C@H](O)CNc1ccc(cn1)CCl 843023163053a3b96f4e88fd8990b704 [0,2,0,0,0,0|2,0,0]=4 5048 B13R1.3 C[C@H](O)CNc1ccc(cn1)CO d60fcf63a86cfde39932e44f476c3852 [0,2,0,0,0,0|2,0,0]=4 5049 B13R1.3 C[C@H](O)CNc1ccc(nc1)C#N 101cce8e7ecc67cdd6fa4357637c1188 [0,2,0,0,0,0|2,0,0]=4 5050 B13R1.3 C[C@H](O)CNc1ccc(nc1)C=O 57bcf8e895a27d0efbd565cf901abc75 [0,2,0,0,0,0|2,0,0]=4 5051 B13R1.3 C[C@H](O)CNc1ccc(nc1)CO 288136af1acd1ad39700787fa6f5add0 [0,2,0,0,0,0|2,0,0]=4 5052 B13R1.14 C#CC(C)NCc1ccc(cc1)Br 451586cd29e43741f2fba4c9cf3844bd [0,2,0,0,0,0|2,0,0]=4 5053 B13R1.14 C#CC(C)NCc1ccc(cc1)C d56965ef59dd4bbee5b95842ccb4544e [0,2,0,0,0,0|2,0,0]=4 5054 B13R1.14 C#CC(C)NCc1ccc(cc1)Cl 3c9c3eda33f37547fd994371c2426c3a [0,2,0,0,0,0|2,0,0]=4 5055 B13R1.14 C#CC(C)NCc1ccc(cc1)F a0aa99fc032784537af795a1cba75c3c [0,2,0,0,0,0|2,0,0]=4 5056 B13R1.14 C#CC(C)NCc1ccc(cc1)I 354f637f1cf01ec1b62a39e0f4af0e61 [0,2,0,0,0,0|2,0,0]=4 5057 B13R1.14 C#CC(C)OCc1ccc(cc1)Br f56e957def788883bfff2b38f4b666b1 [0,2,0,0,0,0|2,0,0]=4 5058 B13R1.14 C#CC(C)OCc1ccc(cc1)C 651095b262d782f13860642593d50165 [0,2,0,0,0,0|2,0,0]=4 5059 B13R1.14 C#CC(C)OCc1ccc(cc1)Cl 4776609bff7084921f5ef1cf9bd3d51c [0,2,0,0,0,0|2,0,0]=4 5060 B13R1.14 C#CC(C)OCc1ccc(cc1)F 5a15f5ac4f0d08c6e748b16ad193eaa0 [0,2,0,0,0,0|2,0,0]=4 5061 B13R1.14 C#CC(C)OCc1ccc(cc1)I 78b02a44cccae72b648200110205f752 [0,2,0,0,0,0|2,0,0]=4 5062 B13R1.14 C#C[C@@H](C)NCc1ccc(cc1)Br f1b141ef6b5f98873fb021512fbdc751 [0,2,0,0,0,0|2,0,0]=4 5063 B13R1.14 C#C[C@@H](C)NCc1ccc(cc1)C ced439bf8f5f52c1d50d57db740e60ce [0,2,0,0,0,0|2,0,0]=4 5064 B13R1.14 C#C[C@@H](C)NCc1ccc(cc1)Cl 0f0432d167b7f4adc3064be4f955feba [0,2,0,0,0,0|2,0,0]=4 5065 B13R1.14 C#C[C@@H](C)NCc1ccc(cc1)F de3e5f99d90a5a36b0b165f98e62ffce [0,2,0,0,0,0|2,0,0]=4 5066 B13R1.14 C#C[C@@H](C)NCc1ccc(cc1)I 1915664ed0a3d13b96af2937fa3f3444 [0,2,0,0,0,0|2,0,0]=4 5067 B13R1.14 C#C[C@@H](C)OCc1ccc(cc1)Br 9ff882cd8fbf6a81b632a9371ecea21b [0,2,0,0,0,0|2,0,0]=4 5068 B13R1.14 C#C[C@@H](C)OCc1ccc(cc1)C 86b04cb5a269aec28352c0b494705b7e [0,2,0,0,0,0|2,0,0]=4 5069 B13R1.14 C#C[C@@H](C)OCc1ccc(cc1)Cl 686c64c73b4257fbd8fc4cb1eeb061c5 [0,2,0,0,0,0|2,0,0]=4 5070 B13R1.14 C#C[C@@H](C)OCc1ccc(cc1)F 68e31392763547d4a7e82c49a3b45831 [0,2,0,0,0,0|2,0,0]=4 5071 B13R1.14 C#C[C@@H](C)OCc1ccc(cc1)I 9e1fca2aa9248dc85f12de917668f3e2 [0,2,0,0,0,0|2,0,0]=4 5072 B13R1.14 C#C[C@H](C)NCc1ccc(cc1)Br 2707cc894ad6d0bc0d33664808c85c10 [0,2,0,0,0,0|2,0,0]=4 5073 B13R1.14 C#C[C@H](C)NCc1ccc(cc1)C 5eb44289f4bf0845849ffc9cdc02fa40 [0,2,0,0,0,0|2,0,0]=4 5074 B13R1.14 C#C[C@H](C)NCc1ccc(cc1)Cl 7441baeb50c814b3f87267eaacbc1867 [0,2,0,0,0,0|2,0,0]=4 5075 B13R1.14 C#C[C@H](C)NCc1ccc(cc1)F a0ee55c00d299e02ccac53e4e5af3493 [0,2,0,0,0,0|2,0,0]=4 5076 B13R1.14 C#C[C@H](C)NCc1ccc(cc1)I 13da6a312e690356f88145c5a3bd326a [0,2,0,0,0,0|2,0,0]=4 5077 B13R1.14 C#C[C@H](C)OCc1ccc(cc1)Br 31585e4946be7e778bd142202232e23a [0,2,0,0,0,0|2,0,0]=4 5078 B13R1.14 C#C[C@H](C)OCc1ccc(cc1)C a9fa3d6df50675237dfc366ca9bf7c3e [0,2,0,0,0,0|2,0,0]=4 5079 B13R1.14 C#C[C@H](C)OCc1ccc(cc1)Cl b1e64d3e69815faedfbc91575d147e8f [0,2,0,0,0,0|2,0,0]=4 5080 B13R1.14 C#C[C@H](C)OCc1ccc(cc1)F f851644f4268f6ddc79336828835e00a [0,2,0,0,0,0|2,0,0]=4 5081 B13R1.14 C#C[C@H](C)OCc1ccc(cc1)I cfef44664933a54fc7fd360b2deadb5b [0,2,0,0,0,0|2,0,0]=4 5082 B13R1.14 C=CC(C)NCc1ccc(cc1)Br 57fbf4d089d4e6f37a7671738dafacaf [0,2,0,0,0,0|2,0,0]=4 5083 B13R1.14 C=CC(C)NCc1ccc(cc1)C 4270aa82d9a24f64c5e7eb89fb441200 [0,2,0,0,0,0|2,0,0]=4 5084 B13R1.14 C=CC(C)NCc1ccc(cc1)Cl 289959e5f34939e2d5c7bc615e07b10c [0,2,0,0,0,0|2,0,0]=4 5085 B13R1.14 C=CC(C)NCc1ccc(cc1)F 453bf983065e06690082f9790d60a740 [0,2,0,0,0,0|2,0,0]=4 5086 B13R1.14 C=CC(C)NCc1ccc(cc1)I 2460077a97630372b970be95ef5df5f3 [0,2,0,0,0,0|2,0,0]=4 5087 B13R1.14 C=CC(C)OCc1ccc(cc1)Br 99afee9d0f5e79b7a49c5e1207095eda [0,2,0,0,0,0|2,0,0]=4 5088 B13R1.14 C=CC(C)OCc1ccc(cc1)C 7c347db9c52a3100975ba6de47107f96 [0,2,0,0,0,0|2,0,0]=4 5089 B13R1.14 C=CC(C)OCc1ccc(cc1)Cl e4005c355195e66d3e2b8020c4df8f04 [0,2,0,0,0,0|2,0,0]=4 5090 B13R1.14 C=CC(C)OCc1ccc(cc1)F 91c5d9fa7eb9e934de5fdbbf8b0b077d [0,2,0,0,0,0|2,0,0]=4 5091 B13R1.14 C=CC(C)OCc1ccc(cc1)I c424a235a50fc87f5aafb8ed9c876781 [0,2,0,0,0,0|2,0,0]=4 5092 B13R1.14 C=CC(C)OCc1ccc(cc1)S 64667f7a8a0e40b527878982308f62a2 [0,2,0,0,0,0|2,0,0]=4 5093 B13R1.14 C=CC(O)CNc1ccc(cc1)C 382a20b844e1ba9c2a8c011c3e12bd6f [0,2,0,0,0,0|1,0,1]=4 5094 B13R1.14 C=CC(O)CNc1ccc(cc1)F a06547f15ade6fae1dfc5300db4f12aa [0,2,0,0,0,0|1,0,1]=4 5095 B13R1.14 C=CC(O)CNc1ccc(cc1)O 2a2955d1bb3a446b46803e83daf6fe20 [0,2,0,0,0,0|1,0,1]=4 5096 B13R1.14 C=CC(O)CNc1ccc(cc1)S cc2a71af2e0fcac09d8f425f3b43c2e7 [0,2,0,0,0,0|1,0,1]=4 5097 B13R1.14 C=C[C@H](C)OCc1ccc(cc1)Br fdf20b73bc5c505a31a82e4784a1e2df [0,2,0,0,0,0|2,0,0]=4 5098 B13R1.14 C=C[C@H](C)OCc1ccc(cc1)C 307e438fe3ad120f34cd123998a8960f [0,2,0,0,0,0|2,0,0]=4 5099 B13R1.14 C=C[C@H](C)OCc1ccc(cc1)Cl d64cc47dd0e88e71ad3d091586c331a2 [0,2,0,0,0,0|2,0,0]=4 5100 B13R1.14 C=C[C@H](C)OCc1ccc(cc1)F a727ef7815257831129eea5c3c9b7894 [0,2,0,0,0,0|2,0,0]=4 5101 B13R1.14 C=C[C@H](C)OCc1ccc(cc1)I 74e785c03b8962e831dcc1a32484d6b6 [0,2,0,0,0,0|2,0,0]=4 5102 B13R1.14 CC(C#N)CNc1ccc(cc1)Br a4380b22bcf2b461fc7af10763abd1f1 [0,2,0,0,0,0|2,0,0]=4 5103 B13R1.14 CC(C#N)CNc1ccc(cc1)Cl 0062d72dc42c130399c19d74956df621 [0,2,0,0,0,0|2,0,0]=4 5104 B13R1.14 CC(C#N)CNc1ccc(cc1)F 177d3fce87e05c83aacd5571ffed6728 [0,2,0,0,0,0|2,0,0]=4 5105 B13R1.14 CC(C#N)CNc1ccc(cc1)I c924bf828d077df8f87d29db145685fd [0,2,0,0,0,0|2,0,0]=4 5106 B13R1.14 CC(C#N)CNc1ccc(cc1)S 2982fe99806b6eee8e66b393a458d292 [0,2,0,0,0,0|2,0,0]=4 5107 B13R1.14 CC(C#N)COc1ccc(cc1)Br f761ecab4af9e4ca23bf31e84a222912 [0,2,0,0,0,0|2,0,0]=4 5108 B13R1.14 CC(C#N)COc1ccc(cc1)Cl 2f347978345117c52ded5cb28d2466b4 [0,2,0,0,0,0|2,0,0]=4 5109 B13R1.14 CC(C#N)COc1ccc(cc1)F 8dcc5a462607a714f982f0d1d2179cdd [0,2,0,0,0,0|2,0,0]=4 5110 B13R1.14 CC(C#N)COc1ccc(cc1)I 119ffef3a0d8e4d85068db9f1314b2f3 [0,2,0,0,0,0|2,0,0]=4 5111 B13R1.14 CC(C#N)COc1ccc(cc1)S d26f699fffac4680ad07a5031f73641a [0,2,0,0,0,0|2,0,0]=4 5112 B13R1.14 CC(C#N)NCc1ccc(cc1)Br b57cae260b31c0f9b10a7126cc59aac8 [0,2,0,0,0,0|2,0,0]=4 5113 B13R1.14 CC(C#N)NCc1ccc(cc1)Cl 6f42fafe3d1ffb6683f41ca70aeddecb [0,2,0,0,0,0|2,0,0]=4 5114 B13R1.14 CC(C#N)NCc1ccc(cc1)F a5f1d1cb28a72419b99d28af61caa7c0 [0,2,0,0,0,0|2,0,0]=4 5115 B13R1.14 CC(C#N)NCc1ccc(cc1)I 692fabdca577e81859638b6b8eb7f12b [0,2,0,0,0,0|2,0,0]=4 5116 B13R1.14 CC(C=O)NCc1ccc(cc1)Br d79ebfca6064805647ac638003e6537c [0,2,0,0,0,0|1,0,1]=4 5117 B13R1.14 CC(C=O)NCc1ccc(cc1)Cl 5ae9c51c5ac26d2a1eec5322e4f236b3 [0,2,0,0,0,0|1,0,1]=4 5118 B13R1.14 CC(C=O)NCc1ccc(cc1)F 36060d1a40c0ce6c17ce8f3c61e4ea84 [0,2,0,0,0,0|1,0,1]=4 5119 B13R1.14 CC(C=O)NCc1ccc(cc1)I 8e42b59df17afcca23049b46e133cfad [0,2,0,0,0,0|1,0,1]=4 5120 B13R1.14 CC(C=O)OCc1ccc(cc1)Br 252f64aa424bf641021f3af2745f6f1f [0,2,0,0,0,0|1,0,1]=4 5121 B13R1.14 CC(C=O)OCc1ccc(cc1)Cl f960f483edd0f6742930aedbc4eca365 [0,2,0,0,0,0|1,0,1]=4 5122 B13R1.14 CC(C=O)OCc1ccc(cc1)F c0158bcf511ff8c9f03c62c5ac7b9642 [0,2,0,0,0,0|1,0,1]=4 5123 B13R1.14 CC(C=O)OCc1ccc(cc1)I 4d76065ed30f7792f52d4676af3bdfc5 [0,2,0,0,0,0|1,0,1]=4 5124 B13R1.14 CC(C=O)OCc1ccc(cc1)S 6023724333d5b82c0432b5dbcbe0d51b [0,2,0,0,0,0|1,0,1]=4 5125 B13R1.14 CC(CF)OCc1ccc(cc1)Br 9e6e9f2e235a263555bf0a8f82d59a37 [0,2,0,0,0,0|2,0,0]=4 5126 B13R1.14 CC(CF)OCc1ccc(cc1)Cl 1888ba41d87f3ba9caad9939f06c87a2 [0,2,0,0,0,0|2,0,0]=4 5127 B13R1.14 CC(CF)OCc1ccc(cc1)F e198d666252e4b4a750733d316dfdbee [0,2,0,0,0,0|2,0,0]=4 5128 B13R1.14 CC(CF)OCc1ccc(cc1)I ed9e01367a648a9f04833ff2398d383e [0,2,0,0,0,0|2,0,0]=4 5129 B13R1.14 CC(CO)CNc1ccc(=O)[nH]c1 c607541ce6b85833e74259395eac29cd [0,2,0,0,0,0|2,0,0]=4 5130 B13R1.14 CC(CO)CNc1ccc(cc1)Br 00cbb7715a211e3d62087d41c8112c84 [0,2,0,0,0,0|1,0,0]=3 5131 B13R1.14 CC(CO)CNc1ccc(cc1)Cl 5a07531be19cc42055018a20817c76e6 [0,2,0,0,0,0|1,0,0]=3 5132 B13R1.14 CC(CO)CNc1ccc(cc1)F eddb2198b3b5d6f9862a8a82a5bbd398 [0,2,0,0,0,0|1,0,0]=3 5133 B13R1.14 CC(CO)CNc1ccc(cc1)I fc15793b1cdc135f845361baedbce501 [0,2,0,0,0,0|1,0,0]=3 5134 B13R1.14 CC(CO)CNc1ccc(cc1)S b33dfc8c2ed22b127b7878be05b60505 [0,2,0,0,0,0|1,0,0]=3 5135 B13R1.14 CC(CO)CNc1ccc(cn1)Br 6bcbbc4672e5dcac897604520a46e5fb [0,2,0,0,0,0|2,0,0]=4 5136 B13R1.14 CC(CO)CNc1ccc(cn1)Cl a60ee06ade51b74ccfe6cfccc7afb6cd [0,2,0,0,0,0|2,0,0]=4 5137 B13R1.14 CC(CO)CNc1ccc(cn1)F 67e7ceae8f78987b93924e3dce1efae9 [0,2,0,0,0,0|2,0,0]=4 5138 B13R1.14 CC(CO)CNc1ccc(cn1)I 3b0dd7a528d360546e0b06f35001df8c [0,2,0,0,0,0|2,0,0]=4 5139 B13R1.14 CC(CO)CNc1ccc(nc1)Br d9cf6b87b3c45c45867d224097febdac [0,2,0,0,0,0|2,0,0]=4 5140 B13R1.14 CC(CO)CNc1ccc(nc1)Cl 4a273867fd7765dfca56895100fd031d [0,2,0,0,0,0|2,0,0]=4 5141 B13R1.14 CC(CO)CNc1ccc(nc1)F c8f3efe0b49a8986cf7e66f8d9bcae6b [0,2,0,0,0,0|2,0,0]=4 5142 B13R1.14 CC(CO)CNc1ccc(nc1)I cab1d8a5eb4370b858d92c5bbf2970bc [0,2,0,0,0,0|2,0,0]=4 5143 B13R1.14 CC(CO)NCc1ccc(=O)[nH]c1 3d6de713b858ba0bfcfcb99938886b09 [0,2,0,0,0,0|2,0,0]=4 5144 B13R1.14 CC(CO)NCc1ccc(cc1)Br 22e7a86c675df40af5f1fa2c66c28ed9 [0,2,0,0,0,0|1,0,0]=3 5145 B13R1.14 CC(CO)NCc1ccc(cc1)Cl 8554d7a246628408df256d51c3574343 [0,2,0,0,0,0|1,0,0]=3 5146 B13R1.14 CC(CO)NCc1ccc(cc1)F 213a447b3f732c158e14d4759f40f5fd [0,2,0,0,0,0|1,0,0]=3 5147 B13R1.14 CC(CO)NCc1ccc(cc1)I 3522d482e44889a8be2796cf86c9a35e [0,2,0,0,0,0|1,0,0]=3 5148 B13R1.14 CC(CO)NCc1ccc(cn1)Br c3a0cb54af1ce5d666850b15126f26de [0,2,0,0,0,0|2,0,0]=4 5149 B13R1.14 CC(CO)NCc1ccc(cn1)Cl a1ae107be09f06394a9de651333a7df8 [0,2,0,0,0,0|2,0,0]=4 5150 B13R1.14 CC(CO)NCc1ccc(cn1)F f5945c215b04d59800d3714923b6e6c9 [0,2,0,0,0,0|2,0,0]=4 5151 B13R1.14 CC(CO)NCc1ccc(nc1)Br f16abcb0540f3b6b02bce941d959de2f [0,2,0,0,0,0|2,0,0]=4 5152 B13R1.14 CC(CO)NCc1ccc(nc1)Cl 3996197bb2f9f9007d07070f8d9e0431 [0,2,0,0,0,0|2,0,0]=4 5153 B13R1.14 CC(CO)NCc1ccc(nc1)F 0a18ad38574c698a08790672fc61334b [0,2,0,0,0,0|2,0,0]=4 5154 B13R1.14 CC(CS)OCc1ccc(cc1)Br 57384fcf215e3bc8d6f4795824b49438 [0,2,0,0,0,0|1,1,0]=4 5155 B13R1.14 CC(CS)OCc1ccc(cc1)Cl 2aab5473b376559848576b72e7a19ad9 [0,2,0,0,0,0|1,1,0]=4 5156 B13R1.14 CC(CS)OCc1ccc(cc1)F c44c3c06afa7bd9e0007e72ea168ffe5 [0,2,0,0,0,0|1,1,0]=4 5157 B13R1.14 CC(CS)OCc1ccc(cc1)I 582a0e694a7f4cba005c5b51dc9bbdab [0,2,0,0,0,0|1,1,0]=4 5158 B13R1.14 CCC(C)CNc1ccc(cc1)Br 3df817d747d198ce669d9f081ca82eb1 [0,2,0,0,0,0|2,0,0]=4 5159 B13R1.14 CCC(C)CNc1ccc(cc1)C 27dbbdf7a2357f4c041948b44febc0bd [0,2,0,0,0,0|2,0,0]=4 5160 B13R1.14 CCC(C)CNc1ccc(cc1)Cl efac779d21b9a928331a8c135df98e86 [0,2,0,0,0,0|2,0,0]=4 5161 B13R1.14 CCC(C)CNc1ccc(cc1)F 2947f8d87c5e310b333229f77b59193c [0,2,0,0,0,0|2,0,0]=4 5162 B13R1.14 CCC(C)CNc1ccc(cc1)I e0e757ddd7a5de19b5b1064b0661fc2f [0,2,0,0,0,0|2,0,0]=4 5163 B13R1.14 CCC(C)CNc1ccc(cc1)S 23839ee3e80641f07ac501a8dfcc1931 [0,2,0,0,0,0|2,0,0]=4 5164 B13R1.14 CCC(C)COc1ccc(cc1)Br 4e0b11ec03b805658dad52317340ff4c [0,2,0,0,0,0|2,0,0]=4 5165 B13R1.14 CCC(C)COc1ccc(cc1)C eff43219015a977fa29d00aed2620dc6 [0,2,0,0,0,0|2,0,0]=4 5166 B13R1.14 CCC(C)COc1ccc(cc1)Cl 19a9044da2753d70ab2fb0a6ce5c8729 [0,2,0,0,0,0|2,0,0]=4 5167 B13R1.14 CCC(C)COc1ccc(cc1)F 02b6c2ae66b6844e6c081a07b60da2dc [0,2,0,0,0,0|2,0,0]=4 5168 B13R1.14 CCC(C)COc1ccc(cc1)I 8214af71a40f4445bb9905b1cd7e134b [0,2,0,0,0,0|2,0,0]=4 5169 B13R1.14 CCC(C)COc1ccc(cc1)S e495f6c6e80d266083b0efaad9999766 [0,2,0,0,0,0|2,0,0]=4 5170 B13R1.14 CCC(C)NCc1ccc(cc1)Br 4abe4f89bdf03f770736d5197e7b883b [0,2,0,0,0,0|2,0,0]=4 5171 B13R1.14 CCC(C)NCc1ccc(cc1)C f0a4a7074e963254e8f2dc9718ac8faa [0,2,0,0,0,0|2,0,0]=4 5172 B13R1.14 CCC(C)NCc1ccc(cc1)Cl e9926af688e6f6abb788f4783a5448f6 [0,2,0,0,0,0|2,0,0]=4 5173 B13R1.14 CCC(C)NCc1ccc(cc1)F b97da88900d1e386f77430e387d7fd51 [0,2,0,0,0,0|2,0,0]=4 5174 B13R1.14 CCC(C)NCc1ccc(cc1)I f28ea9682d6730c55e4b6b1783bf60da [0,2,0,0,0,0|2,0,0]=4 5175 B13R1.14 CCC(C)OCc1ccc(cc1)Br c908b2ace910cbc167d0544d6712f6a4 [0,2,0,0,0,0|2,0,0]=4 5176 B13R1.14 CCC(C)OCc1ccc(cc1)C 88e39972550558e6f250df35da5c8f51 [0,2,0,0,0,0|2,0,0]=4 5177 B13R1.14 CCC(C)OCc1ccc(cc1)Cl 85bfb26d4e95965551c3bf1f664473b8 [0,2,0,0,0,0|2,0,0]=4 5178 B13R1.14 CCC(C)OCc1ccc(cc1)F 6a95bdc8f823980b54e4ce2f3815ca72 [0,2,0,0,0,0|2,0,0]=4 5179 B13R1.14 CCC(C)OCc1ccc(cc1)I 71389b9036f82c94c2cbc3112dba3565 [0,2,0,0,0,0|2,0,0]=4 5180 B13R1.14 CCC(C)OCc1ccc(cc1)S a07d1c91304f65ef652f1327ecfa1c66 [0,2,0,0,0,0|2,0,0]=4 5181 B13R1.14 CCC(O)CNc1ccc(=O)[nH]c1 142a49ed8bbdefa603c6bbd563aeaa91 [0,2,0,0,0,0|2,0,0]=4 5182 B13R1.14 CCC(O)CNc1ccc(cc1)Br 85278c2a5439604a9cc456d3fa54fa69 [0,2,0,0,0,0|1,0,0]=3 5183 B13R1.14 CCC(O)CNc1ccc(cc1)C 76ed7b0e60701492d6725bd54ecb8238 [0,2,0,0,0,0|1,0,0]=3 5184 B13R1.14 CCC(O)CNc1ccc(cc1)Cl 7dbf0f0a39916a4889bdaee77391db52 [0,2,0,0,0,0|1,0,0]=3 5185 B13R1.14 CCC(O)CNc1ccc(cc1)F 17ce13945c4af67b3135bee802662aa1 [0,2,0,0,0,0|1,0,0]=3 5186 B13R1.14 CCC(O)CNc1ccc(cc1)I 02573c0d66d226307ecada73619e29a4 [0,2,0,0,0,0|1,0,0]=3 5187 B13R1.14 CCC(O)CNc1ccc(cc1)S 191aba248fac4ace960d4e27ee515590 [0,2,0,0,0,0|1,0,0]=3 5188 B13R1.14 CCC(O)CNc1ccc(cn1)Br b3e14de92476ecf616c37b977417ed6c [0,2,0,0,0,0|2,0,0]=4 5189 B13R1.14 CCC(O)CNc1ccc(cn1)C cfb66118ebdd3ecfd279fe6010d28d3a [0,2,0,0,0,0|2,0,0]=4 5190 B13R1.14 CCC(O)CNc1ccc(cn1)Cl 7a7ede32f850153a672ee933b3070e74 [0,2,0,0,0,0|2,0,0]=4 5191 B13R1.14 CCC(O)CNc1ccc(cn1)F ed8dde4c0c914efb05ca213e2a1d42d0 [0,2,0,0,0,0|2,0,0]=4 5192 B13R1.14 CCC(O)CNc1ccc(cn1)I 689840b5f3d3c0df69413f3fd9046a2e [0,2,0,0,0,0|2,0,0]=4 5193 B13R1.14 CCC(O)CNc1ccc(nc1)C db7a01c7ec7542af656a778c53247a53 [0,2,0,0,0,0|2,0,0]=4 5194 B13R1.14 CCC(O)CNc1ccc(nc1)Cl d62b1ccbb328a15de1ea7a797d1dd186 [0,2,0,0,0,0|2,0,0]=4 5195 B13R1.14 CCC(O)CNc1ccc(nc1)F b6056cd10ef182f716270f063badaf35 [0,2,0,0,0,0|2,0,0]=4 5196 B13R1.14 CCN(C)CCc1ccc(cc1)Br d05f6660a495a52ef54d2ff5599e78af [0,2,0,0,0,0|2,0,0]=4 5197 B13R1.14 CCN(C)CCc1ccc(cc1)C 0b6f01873c3150724c0a78e8befc91d0 [0,2,0,0,0,0|2,0,0]=4 5198 B13R1.14 CCN(C)CCc1ccc(cc1)Cl bae98dc63fb1f0afe4f3048a7721e6ea [0,2,0,0,0,0|2,0,0]=4 5199 B13R1.14 CCN(C)CCc1ccc(cc1)F b56857c054326a5a7ddd7175570113cf [0,2,0,0,0,0|2,0,0]=4 5200 B13R1.14 CCN(C)CCc1ccc(cc1)I 4b664aa21606dc2fcf5c98dfa2d591a7 [0,2,0,0,0,0|2,0,0]=4 5201 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)Br b65c69c4203239d2c061c6c73df84038 [0,2,0,0,0,0|2,0,0]=4 5202 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)C e0ce160015896446d333b55ca72f47c5 [0,2,0,0,0,0|2,0,0]=4 5203 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)Cl db93f329ff79be78a2512e1dfb378481 [0,2,0,0,0,0|2,0,0]=4 5204 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)F 1edb865598afb0f6353288af25b017cd [0,2,0,0,0,0|2,0,0]=4 5205 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)I 4092e8eaf43f108a411fc6dd42a7c4d3 [0,2,0,0,0,0|2,0,0]=4 5206 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)S 31319f0c16b99e610088d2f7da9112ce [0,2,0,0,0,0|2,0,0]=4 5207 B13R1.14 CC[C@@H](C)COc1ccc(cc1)Br c49bf7a380dc299b5b22fc33cc9dfa07 [0,2,0,0,0,0|2,0,0]=4 5208 B13R1.14 CC[C@@H](C)COc1ccc(cc1)C d19941edd339c981caf752d025de86da [0,2,0,0,0,0|2,0,0]=4 5209 B13R1.14 CC[C@@H](C)COc1ccc(cc1)Cl 2f19ed7e6c2c594d2c70ac4c06f1de1b [0,2,0,0,0,0|2,0,0]=4 5210 B13R1.14 CC[C@@H](C)COc1ccc(cc1)F 52b257eeac3b8b935e7e8a9a4ff84a09 [0,2,0,0,0,0|2,0,0]=4 5211 B13R1.14 CC[C@@H](C)COc1ccc(cc1)I 0c77bb2b160ed861557fde5a43107815 [0,2,0,0,0,0|2,0,0]=4 5212 B13R1.14 CC[C@@H](C)COc1ccc(cc1)S 76d9060df38a1c8381cb06aad390fc36 [0,2,0,0,0,0|2,0,0]=4 5213 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)Br 3ff9d82fa26b0079fa42216a0a66fced [0,2,0,0,0,0|2,0,0]=4 5214 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)C 8e49a5ade28c8be4117262a4417c0700 [0,2,0,0,0,0|2,0,0]=4 5215 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)Cl dcd7b6bbbb2603492684d3d9edec7111 [0,2,0,0,0,0|2,0,0]=4 5216 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)F 03e5451e4ef53bd886bd13e2f0fc01f7 [0,2,0,0,0,0|2,0,0]=4 5217 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)I 7ebfc5866429d5e49443c4162a968451 [0,2,0,0,0,0|2,0,0]=4 5218 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)Br ab082d26ffcbc0d94f829c18539aea4f [0,2,0,0,0,0|2,0,0]=4 5219 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)C f554301de3a543cfe2e7ec6eb67b3fd5 [0,2,0,0,0,0|2,0,0]=4 5220 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)Cl 5ad21ff7f014fb224ebed22096a8f243 [0,2,0,0,0,0|2,0,0]=4 5221 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)F bda97487875bbb387e31383a434770a2 [0,2,0,0,0,0|2,0,0]=4 5222 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)I 178305fd0c396a47fed0c143f98a8164 [0,2,0,0,0,0|2,0,0]=4 5223 B13R1.14 CC[C@@H](O)CNc1ccc(cc1)C d9eb34a9bb213a62a681e5abb5a9bc9e [0,2,0,0,0,0|1,0,0]=3 5224 B13R1.14 CC[C@@H](O)CNc1ccc(cc1)S 486c3a69df85f7e30d8a19c31fe9d044 [0,2,0,0,0,0|1,0,0]=3 5225 B13R1.14 CC[C@H](C)CNc1ccc(cc1)Br d5ea2711869b7dd71b60632b70260d0a [0,2,0,0,0,0|2,0,0]=4 5226 B13R1.14 CC[C@H](C)CNc1ccc(cc1)C d5fd6fd52df8db56fa5f75fbdce7a329 [0,2,0,0,0,0|2,0,0]=4 5227 B13R1.14 CC[C@H](C)CNc1ccc(cc1)Cl 74e41806befbf399d77f87bb90a27cbc [0,2,0,0,0,0|2,0,0]=4 5228 B13R1.14 CC[C@H](C)CNc1ccc(cc1)F be19e951b98fc2955e87daf12ad1dc42 [0,2,0,0,0,0|2,0,0]=4 5229 B13R1.14 CC[C@H](C)CNc1ccc(cc1)I 84ff9e2895b7a7b8fa6ced5a2df00a20 [0,2,0,0,0,0|2,0,0]=4 5230 B13R1.14 CC[C@H](C)CNc1ccc(cc1)S 8813810fc6478e9947c0d7a3c0668d16 [0,2,0,0,0,0|2,0,0]=4 5231 B13R1.14 CC[C@H](C)COc1ccc(cc1)Br 1907f0f1b9479c6222aa8ea8ec67d438 [0,2,0,0,0,0|2,0,0]=4 5232 B13R1.14 CC[C@H](C)COc1ccc(cc1)C 770451c0c0a9f6dee7738ea72a58fef9 [0,2,0,0,0,0|2,0,0]=4 5233 B13R1.14 CC[C@H](C)COc1ccc(cc1)Cl 06232ff0850e9622a9f61667cdb5b97a [0,2,0,0,0,0|2,0,0]=4 5234 B13R1.14 CC[C@H](C)COc1ccc(cc1)F 9b0af230b94977c333dda56623c8e447 [0,2,0,0,0,0|2,0,0]=4 5235 B13R1.14 CC[C@H](C)COc1ccc(cc1)I 368fe406dedb8acec85246bf3ecff4b4 [0,2,0,0,0,0|2,0,0]=4 5236 B13R1.14 CC[C@H](C)COc1ccc(cc1)S 79c212400d92d4b3a41e19165790dcd5 [0,2,0,0,0,0|2,0,0]=4 5237 B13R1.14 CC[C@H](C)NCc1ccc(cc1)Br 50b1405d61a19588fc9b582c8506e370 [0,2,0,0,0,0|2,0,0]=4 5238 B13R1.14 CC[C@H](C)NCc1ccc(cc1)C b94b58879f72267d9f64001a24bc8656 [0,2,0,0,0,0|2,0,0]=4 5239 B13R1.14 CC[C@H](C)NCc1ccc(cc1)Cl 0ec668095e308a1b1293ad2b3d5d1b84 [0,2,0,0,0,0|2,0,0]=4 5240 B13R1.14 CC[C@H](C)NCc1ccc(cc1)F bba516c1679996d829bb5436a0ea164a [0,2,0,0,0,0|2,0,0]=4 5241 B13R1.14 CC[C@H](C)NCc1ccc(cc1)I b059fc9371ce4b03fde0e74bf63e1514 [0,2,0,0,0,0|2,0,0]=4 5242 B13R1.14 CC[C@H](C)OCc1ccc(cc1)Br e3db62d82d2b63ca8996a3ac79623212 [0,2,0,0,0,0|2,0,0]=4 5243 B13R1.14 CC[C@H](C)OCc1ccc(cc1)C 22bf190577eaa70a4e1ff49663bc4dcd [0,2,0,0,0,0|2,0,0]=4 5244 B13R1.14 CC[C@H](C)OCc1ccc(cc1)Cl 0b82856428cf3abdc9cf68a7d27ea7d1 [0,2,0,0,0,0|2,0,0]=4 5245 B13R1.14 CC[C@H](C)OCc1ccc(cc1)F 9f5f2379e2a552690a12850e384f264f [0,2,0,0,0,0|2,0,0]=4 5246 B13R1.14 CC[C@H](C)OCc1ccc(cc1)I ee6cd1ad70de386f0e5517af59e2473c [0,2,0,0,0,0|2,0,0]=4 5247 B13R1.14 CN(C=O)CCc1ccc(cc1)Br 43b6dd4dda4b8d8e9e11320a3f743516 [0,2,0,0,0,0|1,0,1]=4 5248 B13R1.14 CN(C=O)CCc1ccc(cc1)Cl 1add37dbd94dd38c492e3d9723930fe2 [0,2,0,0,0,0|1,0,1]=4 5249 B13R1.14 CN(C=O)CCc1ccc(cc1)F 28150e11e164a16dd2f4f459c1cd1619 [0,2,0,0,0,0|1,0,1]=4 5250 B13R1.14 CN(C=O)CCc1ccc(cc1)O 0def3d894aab607efed50010a64c2e31 [0,2,0,0,0,0|1,0,1]=4 5251 B13R1.14 CN(CF)CCc1ccc(cc1)Br 01bc2d008542d8a2e4e3927756f66c60 [0,2,0,0,0,0|2,0,0]=4 5252 B13R1.14 CN(CF)CCc1ccc(cc1)Cl b857580c9cf08bf0753abc7affe4cd91 [0,2,0,0,0,0|2,0,0]=4 5253 B13R1.14 CN(CF)CCc1ccc(cc1)F 7052c2977e4bba3bcab410d8eb98bb67 [0,2,0,0,0,0|2,0,0]=4 5254 B13R1.14 CN(CO)CCc1ccc(cc1)Br 8174e2fc55bb2c62774ee017d4ce1607 [0,2,0,0,0,0|1,0,0]=3 5255 B13R1.14 CN(CO)CCc1ccc(cc1)Cl e028bc39ff749bd0e1796ad056556166 [0,2,0,0,0,0|1,0,0]=3 5256 B13R1.14 CN(CO)CCc1ccc(cc1)F 4ba29b9781e113bd49733e47e1b39959 [0,2,0,0,0,0|1,0,0]=3 5257 B13R1.14 COC(C)CNc1ccc(=O)[nH]c1 f85058df78038564b558af12137b22bd [0,2,0,0,0,0|2,0,0]=4 5258 B13R1.14 COC(C)CNc1ccc(cc1)Br 6a050a91342a92da37fa0fe111d89e7a [0,2,0,0,0,0|1,0,0]=3 5259 B13R1.14 COC(C)CNc1ccc(cc1)C f15e0f686605bb4f88f783ba70d88b43 [0,2,0,0,0,0|1,0,0]=3 5260 B13R1.14 COC(C)CNc1ccc(cc1)Cl b81d23d2b4c803fe0a21dc5fdb2ba8b7 [0,2,0,0,0,0|1,0,0]=3 5261 B13R1.14 COC(C)CNc1ccc(cc1)F 14d7ee4972045a664c651ef01b833fab [0,2,0,0,0,0|1,0,0]=3 5262 B13R1.14 COC(C)CNc1ccc(cc1)I 268d4b7fd122db9448ccac07ab03aef3 [0,2,0,0,0,0|1,0,0]=3 5263 B13R1.14 COC(C)CNc1ccc(cc1)S da7c5d519a7e50835a7e1a20cdaecf4b [0,2,0,0,0,0|1,0,0]=3 5264 B13R1.14 COC(C)CNc1ccc(cn1)Br 2fa7c2303585d2d57c8e69d5a283fb2b [0,2,0,0,0,0|2,0,0]=4 5265 B13R1.14 COC(C)CNc1ccc(cn1)C eeb6c3523ecf0d9ca3f808357e3858e9 [0,2,0,0,0,0|2,0,0]=4 5266 B13R1.14 COC(C)CNc1ccc(cn1)Cl 05e5659ae19fb0c1edf72ed0eedfd3f3 [0,2,0,0,0,0|2,0,0]=4 5267 B13R1.14 COC(C)CNc1ccc(cn1)F f79a71044721035c785cc7a17c963332 [0,2,0,0,0,0|2,0,0]=4 5268 B13R1.14 COC(C)CNc1ccc(cn1)I a14ce1a1af2a8164323fec41995ae7ea [0,2,0,0,0,0|2,0,0]=4 5269 B13R1.14 COC(C)CNc1ccc(nc1)Br ffd9564a44ff8d473d2504aefbf705f1 [0,2,0,0,0,0|2,0,0]=4 5270 B13R1.14 COC(C)CNc1ccc(nc1)C b780fc7ef719418822036cbce0ffbc21 [0,2,0,0,0,0|2,0,0]=4 5271 B13R1.14 COC(C)CNc1ccc(nc1)Cl f0ab01becd06fae744537d3fd6f5d67d [0,2,0,0,0,0|2,0,0]=4 5272 B13R1.14 COC(C)CNc1ccc(nc1)F d1fe65e3103acf498ad6d8daabd4fa54 [0,2,0,0,0,0|2,0,0]=4 5273 B13R1.14 COC(C)CNc1ccc(nc1)I 71704a0c470d22e3947e5267a4427a09 [0,2,0,0,0,0|2,0,0]=4 5274 B13R1.14 COC(C)COc1ccc(cc1)Br 8daf491933479ee7af3c419f1081d4d5 [0,2,0,0,0,0|1,0,0]=3 5275 B13R1.14 COC(C)COc1ccc(cc1)C fb85d907d5a05d5b39efe283e12317a5 [0,2,0,0,0,0|1,0,0]=3 5276 B13R1.14 COC(C)COc1ccc(cc1)Cl a30c4c2e5d6f1a3530ceb8fe2024107b [0,2,0,0,0,0|1,0,0]=3 5277 B13R1.14 COC(C)COc1ccc(cc1)F ba4c9d104f620eb58de9531c9c0eaad7 [0,2,0,0,0,0|1,0,0]=3 5278 B13R1.14 COC(C)COc1ccc(cc1)I 40030c607fa06a4979d7f25e505f05e3 [0,2,0,0,0,0|1,0,0]=3 5279 B13R1.14 COC(C)COc1ccc(cc1)S cd0a51290eb7baa29b9dd582b01dfbc2 [0,2,0,0,0,0|1,0,0]=3 5280 B13R1.14 COC(C)COc1ccc(cn1)C 414d0909ac9e90d4f6a21fde4c1765a0 [0,2,0,0,0,0|2,0,0]=4 5281 B13R1.14 COC(C)COc1ccc(cn1)Cl ace8a46e3e3ff6d03bcc7571fb2b80ed [0,2,0,0,0,0|2,0,0]=4 5282 B13R1.14 COC(C)COc1ccc(cn1)F c44eee5d5b9d00fb23e7b937f51b3283 [0,2,0,0,0,0|2,0,0]=4 5283 B13R1.14 COC(C)COc1ccc(cn1)I 1222bbd6679c276b16b70280544c4407 [0,2,0,0,0,0|2,0,0]=4 5284 B13R1.14 COC(C)COc1ccc(nc1)Br 583510a1ddb595b82a816661381080d5 [0,2,0,0,0,0|2,0,0]=4 5285 B13R1.14 COC(C)COc1ccc(nc1)C dfe42751797c446f6e56e60b60ed6ce2 [0,2,0,0,0,0|2,0,0]=4 5286 B13R1.14 COC(C)COc1ccc(nc1)Cl b125c04299879147d72e05669a90cc13 [0,2,0,0,0,0|2,0,0]=4 5287 B13R1.14 COC(C)COc1ccc(nc1)F 62b41d277756a357bb192b955fb6350b [0,2,0,0,0,0|2,0,0]=4 5288 B13R1.14 COC(C)COc1ccc(nc1)I 0577663fe669816e18619c6b060864fb [0,2,0,0,0,0|2,0,0]=4 5289 B13R1.14 CO[C@@H](C)CNc1ccc(=O)[nH]c1 4b34e4bd084fa390e0702df90de29d41 [0,2,0,0,0,0|2,0,0]=4 5290 B13R1.14 CO[C@@H](C)CNc1ccc(cc1)Br 5327ab1c07e316a884f2b117889e575f [0,2,0,0,0,0|1,0,0]=3 5291 B13R1.14 CO[C@@H](C)CNc1ccc(cc1)C 2c5c86e0a66c5a69ed955e38e6fb7435 [0,2,0,0,0,0|1,0,0]=3 5292 B13R1.14 CO[C@@H](C)CNc1ccc(cc1)Cl 7d20eabfaa9d6d1a950fbc963a81568c [0,2,0,0,0,0|1,0,0]=3 5293 B13R1.14 CO[C@@H](C)CNc1ccc(cc1)F 14f55f9d9d018143c7c5cdfb918f1048 [0,2,0,0,0,0|1,0,0]=3 5294 B13R1.14 CO[C@@H](C)CNc1ccc(cc1)I d5c99bb218d75886059a58bd85289a7c [0,2,0,0,0,0|1,0,0]=3 5295 B13R1.14 CO[C@@H](C)CNc1ccc(cc1)S 2a6726117a8244b538fa85e85b722c86 [0,2,0,0,0,0|1,0,0]=3 5296 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)Br 8f8b6b1628f413ebb31f0bae54dddc67 [0,2,0,0,0,0|2,0,0]=4 5297 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)C 0e7828f4555605c82de4dcbba6816b16 [0,2,0,0,0,0|2,0,0]=4 5298 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)Cl 882c3845103a454cf49d34112b98899a [0,2,0,0,0,0|2,0,0]=4 5299 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)F ac6abcea44f89b331d24853ebed89402 [0,2,0,0,0,0|2,0,0]=4 5300 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)I 2908a18a4b8ee76584f728c33a1fefae [0,2,0,0,0,0|2,0,0]=4 5301 B13R1.14 CO[C@@H](C)CNc1ccc(nc1)Br cdf5784455d86f325c6b14677c9d0a94 [0,2,0,0,0,0|2,0,0]=4 5302 B13R1.14 CO[C@@H](C)CNc1ccc(nc1)C d7b7a833327b7528be238dc1a66b0a02 [0,2,0,0,0,0|2,0,0]=4 5303 B13R1.14 CO[C@@H](C)CNc1ccc(nc1)Cl 355d149c0a90839b0e7f5ed39fed89d1 [0,2,0,0,0,0|2,0,0]=4 5304 B13R1.14 CO[C@@H](C)CNc1ccc(nc1)F b04d59ee87530d1c3d12778ab27840a1 [0,2,0,0,0,0|2,0,0]=4 5305 B13R1.14 CO[C@@H](C)CNc1ccc(nc1)I 34653db6d68a9e0bdc1c9eb9427d0a38 [0,2,0,0,0,0|2,0,0]=4 5306 B13R1.14 CO[C@@H](C)COc1ccc(cc1)Br 352e2526f11122d4138ce66e880c193c [0,2,0,0,0,0|1,0,0]=3 5307 B13R1.14 CO[C@@H](C)COc1ccc(cc1)C 7dd16dfe8ae9c5688aaa67a46351559b [0,2,0,0,0,0|1,0,0]=3 5308 B13R1.14 CO[C@@H](C)COc1ccc(cc1)Cl a24b247012a39db9d8fbdc96ac35e518 [0,2,0,0,0,0|1,0,0]=3 5309 B13R1.14 CO[C@@H](C)COc1ccc(cc1)F a7fbf9ad54ff04c06ee8721432a31a00 [0,2,0,0,0,0|1,0,0]=3 5310 B13R1.14 CO[C@@H](C)COc1ccc(cc1)I 4068220656d825d452ea1c91a915423e [0,2,0,0,0,0|1,0,0]=3 5311 B13R1.14 CO[C@@H](C)COc1ccc(cc1)S a71abd8d84159db026a2e6e26eb39f99 [0,2,0,0,0,0|1,0,0]=3 5312 B13R1.14 CO[C@@H](C)COc1ccc(cn1)C 4661cbe9d15e974e0cb25b6ba69fb4de [0,2,0,0,0,0|2,0,0]=4 5313 B13R1.14 CO[C@@H](C)COc1ccc(cn1)Cl 7f957bbb91ede754fcfc6b3b5c06ed07 [0,2,0,0,0,0|2,0,0]=4 5314 B13R1.14 CO[C@@H](C)COc1ccc(cn1)F 933eaa64370bb4f54ce9d6cf840f4dd6 [0,2,0,0,0,0|2,0,0]=4 5315 B13R1.14 CO[C@@H](C)COc1ccc(cn1)I 22f481decc31e07f55325a6e3e69be64 [0,2,0,0,0,0|2,0,0]=4 5316 B13R1.14 CO[C@@H](C)COc1ccc(nc1)Br 85f794e6f62cee59d802ebf4f7db054c [0,2,0,0,0,0|2,0,0]=4 5317 B13R1.14 CO[C@@H](C)COc1ccc(nc1)C d71aa873793c023b72b2bc442f47a099 [0,2,0,0,0,0|2,0,0]=4 5318 B13R1.14 CO[C@@H](C)COc1ccc(nc1)Cl a295ebfd252095fb720317cbf98d43bd [0,2,0,0,0,0|2,0,0]=4 5319 B13R1.14 CO[C@@H](C)COc1ccc(nc1)F 8582d81202a0f5f8b7746530e8a96f44 [0,2,0,0,0,0|2,0,0]=4 5320 B13R1.14 CO[C@@H](C)COc1ccc(nc1)I 6b622e644c906b3c93b80738ddb345aa [0,2,0,0,0,0|2,0,0]=4 5321 B13R1.14 CO[C@H](C)CNc1ccc(=O)[nH]c1 dc06791494ff68b83312fe942f50fc4a [0,2,0,0,0,0|2,0,0]=4 5322 B13R1.14 CO[C@H](C)CNc1ccc(cc1)Br a089fd4d72b15a9056620419925a1e0b [0,2,0,0,0,0|1,0,0]=3 5323 B13R1.14 CO[C@H](C)CNc1ccc(cc1)C 32d99ebf05a66db5c7a29971de7c41ae [0,2,0,0,0,0|1,0,0]=3 5324 B13R1.14 CO[C@H](C)CNc1ccc(cc1)Cl 1e423f5c35d7466b7b5af56c97ce01a2 [0,2,0,0,0,0|1,0,0]=3 5325 B13R1.14 CO[C@H](C)CNc1ccc(cc1)F 206a74d094ef1ed74167c7e488748415 [0,2,0,0,0,0|1,0,0]=3 5326 B13R1.14 CO[C@H](C)CNc1ccc(cc1)I 9ddc619764eb44c2e1ecce69f94a3dca [0,2,0,0,0,0|1,0,0]=3 5327 B13R1.14 CO[C@H](C)CNc1ccc(cc1)S a710b17f6e8605b14d7b39a61b2ef59c [0,2,0,0,0,0|1,0,0]=3 5328 B13R1.14 CO[C@H](C)CNc1ccc(cn1)Br b718cb1cf9043b212a5cd20356df30e5 [0,2,0,0,0,0|2,0,0]=4 5329 B13R1.14 CO[C@H](C)CNc1ccc(cn1)C 7a9d34df5ddd1aa0f1b9e9b189487713 [0,2,0,0,0,0|2,0,0]=4 5330 B13R1.14 CO[C@H](C)CNc1ccc(cn1)Cl 8dbf0b5ef78c2707c9882c2a44b98532 [0,2,0,0,0,0|2,0,0]=4 5331 B13R1.14 CO[C@H](C)CNc1ccc(cn1)F a6a01754839bd9b74bd9c2b58f2ff93f [0,2,0,0,0,0|2,0,0]=4 5332 B13R1.14 CO[C@H](C)CNc1ccc(cn1)I efe0f67740b37cc17debb771084e2474 [0,2,0,0,0,0|2,0,0]=4 5333 B13R1.14 CO[C@H](C)CNc1ccc(nc1)Br 7f5f92b83fb931d4392509d886000f38 [0,2,0,0,0,0|2,0,0]=4 5334 B13R1.14 CO[C@H](C)CNc1ccc(nc1)C b313143f1c386411be264433bba9f833 [0,2,0,0,0,0|2,0,0]=4 5335 B13R1.14 CO[C@H](C)CNc1ccc(nc1)Cl 87caff78960bd8234dd91aceda49fec4 [0,2,0,0,0,0|2,0,0]=4 5336 B13R1.14 CO[C@H](C)CNc1ccc(nc1)F a7c185155bc0c383c21cde8961b196a5 [0,2,0,0,0,0|2,0,0]=4 5337 B13R1.14 CO[C@H](C)CNc1ccc(nc1)I d4fc6129870b59b865c891162d1ae941 [0,2,0,0,0,0|2,0,0]=4 5338 B13R1.14 CO[C@H](C)COc1ccc(cc1)Br 82c6ddb8d465fe74f13cf59fea42d57a [0,2,0,0,0,0|1,0,0]=3 5339 B13R1.14 CO[C@H](C)COc1ccc(cc1)C b5ac822bb549516f221fa260ad211eca [0,2,0,0,0,0|1,0,0]=3 5340 B13R1.14 CO[C@H](C)COc1ccc(cc1)Cl 0a76e9d502f0607bc755b7a1d30a842f [0,2,0,0,0,0|1,0,0]=3 5341 B13R1.14 CO[C@H](C)COc1ccc(cc1)F 3693b35c13fbe4c076a077616fd89053 [0,2,0,0,0,0|1,0,0]=3 5342 B13R1.14 CO[C@H](C)COc1ccc(cc1)I abbfc7fbf4c8e07cbc163621fb6ce56c [0,2,0,0,0,0|1,0,0]=3 5343 B13R1.14 CO[C@H](C)COc1ccc(cc1)S 657b62f68d28f59eb21cfe3a640e5132 [0,2,0,0,0,0|1,0,0]=3 5344 B13R1.14 CO[C@H](C)COc1ccc(cn1)C df8329d86344cf5453bac46ddff1b944 [0,2,0,0,0,0|2,0,0]=4 5345 B13R1.14 CO[C@H](C)COc1ccc(cn1)Cl ff0a376ec555bd4237ffd021f82ce21d [0,2,0,0,0,0|2,0,0]=4 5346 B13R1.14 CO[C@H](C)COc1ccc(cn1)F 68432c3f0993de15ced41fddac4b61a9 [0,2,0,0,0,0|2,0,0]=4 5347 B13R1.14 CO[C@H](C)COc1ccc(cn1)I 714cb27cbc336520a382cd7921654e31 [0,2,0,0,0,0|2,0,0]=4 5348 B13R1.14 CO[C@H](C)COc1ccc(nc1)Br 836b524ff64ff32cb90a318e7b0406dc [0,2,0,0,0,0|2,0,0]=4 5349 B13R1.14 CO[C@H](C)COc1ccc(nc1)C ad72bc7b692dcaf5b8c82859188e157f [0,2,0,0,0,0|2,0,0]=4 5350 B13R1.14 CO[C@H](C)COc1ccc(nc1)Cl eb729a19a7b3047d2200759d5ba5d7c6 [0,2,0,0,0,0|2,0,0]=4 5351 B13R1.14 CO[C@H](C)COc1ccc(nc1)F 7b6a47c5e89090ce5b6b0db5f21802cf [0,2,0,0,0,0|2,0,0]=4 5352 B13R1.14 CO[C@H](C)COc1ccc(nc1)I d7cac9c4078fd93e13d6673c56b76de5 [0,2,0,0,0,0|2,0,0]=4 5353 B13R1.14 C[C@@H](CO)CNc1ccc(=O)[nH]c1 1fec92ca6e767ca63d9f8c71a97d2400 [0,2,0,0,0,0|2,0,0]=4 5354 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)Br c34ae4bb2b245fc722b55d01b9e6d9b8 [0,2,0,0,0,0|1,0,0]=3 5355 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)Cl 210afbb7fd1c7055c515d38ccc4da702 [0,2,0,0,0,0|1,0,0]=3 5356 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)F 88d344053ef36fa673d01c8043ab3ea5 [0,2,0,0,0,0|1,0,0]=3 5357 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)I 74e5821659af30522f3220a11f19cb55 [0,2,0,0,0,0|1,0,0]=3 5358 B13R1.14 C[C@@H](CO)CNc1ccc(cc1)S 30071a6d702f2b364e5fc8da387f7643 [0,2,0,0,0,0|1,0,0]=3 5359 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)Br 8fb43bc6d82b3b6aa5d46a8274479427 [0,2,0,0,0,0|2,0,0]=4 5360 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)Cl 9f7dbe86b34479c090fdc735da3ef71c [0,2,0,0,0,0|2,0,0]=4 5361 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)F 4621eefd513161c63931d7af1944a3d3 [0,2,0,0,0,0|2,0,0]=4 5362 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)I 0a19fee5e1c5746c4cb11122d4552455 [0,2,0,0,0,0|2,0,0]=4 5363 B13R1.14 C[C@@H](CO)CNc1ccc(nc1)Br ee1dc5cefffa79ebe37e549f0d19b8d4 [0,2,0,0,0,0|2,0,0]=4 5364 B13R1.14 C[C@@H](CO)CNc1ccc(nc1)Cl 39da33455f31f0fa821f2b51631c1101 [0,2,0,0,0,0|2,0,0]=4 5365 B13R1.14 C[C@@H](CO)CNc1ccc(nc1)F 9508cbab6326d128d8e1b7d76e45da4f [0,2,0,0,0,0|2,0,0]=4 5366 B13R1.14 C[C@@H](CO)CNc1ccc(nc1)I ec9f554e0e36eed46eb56802137c302f [0,2,0,0,0,0|2,0,0]=4 5367 B13R1.14 C[C@@H](CO)NCc1ccc(=O)[nH]c1 a3521d30018a2c6ae0b7e26f484ffdd5 [0,2,0,0,0,0|2,0,0]=4 5368 B13R1.14 C[C@@H](CO)NCc1ccc(cc1)Br 3e0b9f35fdd704a9b032b9e102b01c89 [0,2,0,0,0,0|1,0,0]=3 5369 B13R1.14 C[C@@H](CO)NCc1ccc(cc1)Cl 335d3a0dbd1e5616146e309fd4dfee98 [0,2,0,0,0,0|1,0,0]=3 5370 B13R1.14 C[C@@H](CO)NCc1ccc(cc1)F 7963189d6c5ffc628cb8eac2c8910326 [0,2,0,0,0,0|1,0,0]=3 5371 B13R1.14 C[C@@H](CO)NCc1ccc(cc1)I 6fd12003fb0b689c44b92190e2cdae2c [0,2,0,0,0,0|1,0,0]=3 5372 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)Br 61bf0258b428b86dfab501219b225e1a [0,2,0,0,0,0|2,0,0]=4 5373 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)Cl 596e4c1f27f1c5ef351d1cb300719468 [0,2,0,0,0,0|2,0,0]=4 5374 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)F 8840506755dd0af60fccb6ae8d134123 [0,2,0,0,0,0|2,0,0]=4 5375 B13R1.14 C[C@@H](CO)NCc1ccc(nc1)Br 810bd36336c9f29f56bb1e720038e0e5 [0,2,0,0,0,0|2,0,0]=4 5376 B13R1.14 C[C@@H](CO)NCc1ccc(nc1)Cl 09a76a6dbef83f7651dfdcdd287a65af [0,2,0,0,0,0|2,0,0]=4 5377 B13R1.14 C[C@@H](CO)NCc1ccc(nc1)F 24625fab627308be1880a72ac1bf4ee6 [0,2,0,0,0,0|2,0,0]=4 5378 B13R1.14 C[C@H](C=O)NCc1ccc(cc1)Br fc10c4decea618aff5c53ec0c47f0329 [0,2,0,0,0,0|1,0,1]=4 5379 B13R1.14 C[C@H](C=O)NCc1ccc(cc1)Cl 27789f2adf570f0ff47da5618bf63e33 [0,2,0,0,0,0|1,0,1]=4 5380 B13R1.14 C[C@H](C=O)NCc1ccc(cc1)F 79af8e33f60fd9a3ec8f5c85364bfb71 [0,2,0,0,0,0|1,0,1]=4 5381 B13R1.14 C[C@H](C=O)NCc1ccc(cc1)I 9e4f3a64422130187c2d864f0d317bf5 [0,2,0,0,0,0|1,0,1]=4 5382 B13R1.14 C[C@H](C=O)OCc1ccc(cc1)Br 6c89068d4ac6e505d52508169448f2df [0,2,0,0,0,0|1,0,1]=4 5383 B13R1.14 C[C@H](C=O)OCc1ccc(cc1)Cl 9e90d59466675b4b4885e048fa7a3065 [0,2,0,0,0,0|1,0,1]=4 5384 B13R1.14 C[C@H](C=O)OCc1ccc(cc1)F cec90b5835e53155e2006f86a2b4120a [0,2,0,0,0,0|1,0,1]=4 5385 B13R1.14 C[C@H](C=O)OCc1ccc(cc1)I 597bacd7017006fa6cea6cca73d4da46 [0,2,0,0,0,0|1,0,1]=4 5386 B13R1.14 C[C@H](C=O)OCc1ccc(cc1)S 2513f70af43b6a810e13935c20688eb0 [0,2,0,0,0,0|1,0,1]=4 5387 B13R1.14 C[C@H](CO)CNc1ccc(=O)[nH]c1 c33b5af21ac271314e46ff506c98cb6d [0,2,0,0,0,0|2,0,0]=4 5388 B13R1.14 C[C@H](CO)CNc1ccc(cc1)Br ecd3d8c22fe07b6983d1f321ff733425 [0,2,0,0,0,0|1,0,0]=3 5389 B13R1.14 C[C@H](CO)CNc1ccc(cc1)Cl acdc4837c581d59960f01e32cd180d9c [0,2,0,0,0,0|1,0,0]=3 5390 B13R1.14 C[C@H](CO)CNc1ccc(cc1)F 9837efa8777fd1043ad113d97e0f40c4 [0,2,0,0,0,0|1,0,0]=3 5391 B13R1.14 C[C@H](CO)CNc1ccc(cc1)I 69038b94843b696e4fab9e1c77a62ef0 [0,2,0,0,0,0|1,0,0]=3 5392 B13R1.14 C[C@H](CO)CNc1ccc(cc1)S 9aeb2960d509592ea8dbaf37791da6e4 [0,2,0,0,0,0|1,0,0]=3 5393 B13R1.14 C[C@H](CO)CNc1ccc(cn1)Br 3559713cd8f3ed84d770bd3ff1b7e28b [0,2,0,0,0,0|2,0,0]=4 5394 B13R1.14 C[C@H](CO)CNc1ccc(cn1)Cl d433514a809a221aabcb4b4b59dd400f [0,2,0,0,0,0|2,0,0]=4 5395 B13R1.14 C[C@H](CO)CNc1ccc(cn1)F 5c0cb4ef0dfe7a3b4ea9bd71acfac557 [0,2,0,0,0,0|2,0,0]=4 5396 B13R1.14 C[C@H](CO)CNc1ccc(cn1)I 13d3c8f11d404225739efa5521706197 [0,2,0,0,0,0|2,0,0]=4 5397 B13R1.14 C[C@H](CO)CNc1ccc(nc1)Br 0108e323b1fcaee28e6596e5d96eacf9 [0,2,0,0,0,0|2,0,0]=4 5398 B13R1.14 C[C@H](CO)CNc1ccc(nc1)Cl bc7d4a5a27f3ed8643b707b1b5899d65 [0,2,0,0,0,0|2,0,0]=4 5399 B13R1.14 C[C@H](CO)CNc1ccc(nc1)F 3a2c9c35bb17315ca96648727d5fa343 [0,2,0,0,0,0|2,0,0]=4 5400 B13R1.14 C[C@H](CO)CNc1ccc(nc1)I 17ecf399b3bb6290c25199bde772aa95 [0,2,0,0,0,0|2,0,0]=4 5401 B13R1.14 C[C@H](CO)NCc1ccc(=O)[nH]c1 f4edaf982d06cdd7039d101c836fe5af [0,2,0,0,0,0|2,0,0]=4 5402 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Br b5e33c924b255b6e0c6b1808063ca504 [0,2,0,0,0,0|1,0,0]=3 5403 B13R1.14 C[C@H](CO)NCc1ccc(cc1)Cl 2dca4bd07f386ac1dec299bafce116de [0,2,0,0,0,0|1,0,0]=3 5404 B13R1.14 C[C@H](CO)NCc1ccc(cc1)F e4c820fa915ccc01628f8a5fcbc44e33 [0,2,0,0,0,0|1,0,0]=3 5405 B13R1.14 C[C@H](CO)NCc1ccc(cc1)I e52c4b0661ce08e54f9378a19e794876 [0,2,0,0,0,0|1,0,0]=3 5406 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Br 8a7a0c4fd05196bcb017715b649b30e7 [0,2,0,0,0,0|2,0,0]=4 5407 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Cl aee5fa3087a068720873a433734f70fd [0,2,0,0,0,0|2,0,0]=4 5408 B13R1.14 C[C@H](CO)NCc1ccc(cn1)F 7e6cb46552be924b65134904c29f59f3 [0,2,0,0,0,0|2,0,0]=4 5409 B13R1.14 C[C@H](CO)NCc1ccc(nc1)Br 20236cb796cc22f4166a9a7b10b5fdec [0,2,0,0,0,0|2,0,0]=4 5410 B13R1.14 C[C@H](CO)NCc1ccc(nc1)Cl f6a4753f1d00984133dcae9b276a5992 [0,2,0,0,0,0|2,0,0]=4 5411 B13R1.14 C[C@H](CO)NCc1ccc(nc1)F 16b6a0c62891780545ffeb33a16d9645 [0,2,0,0,0,0|2,0,0]=4 5412 B13R1.14 C[C@H](CS)OCc1ccc(cc1)Br 4339f88019ea6c086b3b81ee0ff447b5 [0,2,0,0,0,0|1,1,0]=4 5413 B13R1.14 C[C@H](CS)OCc1ccc(cc1)Cl d495b04650e35dbdb507dfe3e0c61632 [0,2,0,0,0,0|1,1,0]=4 5414 B13R1.14 C[C@H](CS)OCc1ccc(cc1)F 6378831a1cac5037c43b879477bf39fb [0,2,0,0,0,0|1,1,0]=4 5415 B13R1.14 C[C@H](CS)OCc1ccc(cc1)I f05dfbee4cbd0c4780fd46429fbb9a3b [0,2,0,0,0,0|1,1,0]=4 5416 B13R1.14 Cc1ccc(cc1)CCN(C)C=O 61a0c4816cb612f952482e16f3c66571 [0,2,0,0,0,0|1,0,1]=4 5417 B13R1.14 Cc1ccc(cc1)CCN(C)CF 193a11000b150dbbeb138fb4bc9cf7be [0,2,0,0,0,0|2,0,0]=4 5418 B13R1.14 Cc1ccc(cc1)CCN(C)CO 43f4946090bf0c6679769c4743ecaab5 [0,2,0,0,0,0|1,0,0]=3 5419 B13R1.14 Cc1ccc(cc1)CNC(C)C#N f858f6c653498d0c40e1f1d9e5c0e65b [0,2,0,0,0,0|2,0,0]=4 5420 B13R1.14 Cc1ccc(cc1)CNC(C)C=O 3a03fd5976a9e5cbed94e4d915bab92d [0,2,0,0,0,0|1,0,1]=4 5421 B13R1.14 Cc1ccc(cc1)CNC(C)CO 2ac2e23a96f1fac3724b147c2fea1c4c [0,2,0,0,0,0|1,0,0]=3 5422 B13R1.14 Cc1ccc(cc1)CN[C@@H](C)CO 2683162a250fd51289906af5d12bd5f4 [0,2,0,0,0,0|1,0,0]=3 5423 B13R1.14 Cc1ccc(cc1)CN[C@H](C)C=O 958800ea73cf0f30c42ac061a07111a9 [0,2,0,0,0,0|1,0,1]=4 5424 B13R1.14 Cc1ccc(cc1)CN[C@H](C)CO 6642e7d6a1a25f9811050f7e887329d2 [0,2,0,0,0,0|1,0,0]=3 5425 B13R1.14 Cc1ccc(cc1)COC(C)C=O 8b4940e2c68c3d8a001a3bba354478d5 [0,2,0,0,0,0|1,0,1]=4 5426 B13R1.14 Cc1ccc(cc1)COC(C)CF fa73f09e58d34afd4d477eed07b90779 [0,2,0,0,0,0|2,0,0]=4 5427 B13R1.14 Cc1ccc(cc1)COC(C)CS dbcb419d75defe6c18893ab782f1f1f0 [0,2,0,0,0,0|1,1,0]=4 5428 B13R1.14 Cc1ccc(cc1)CO[C@H](C)C=O 2b510ef9650f3c7dcec0d649b3aba84a [0,2,0,0,0,0|1,0,1]=4 5429 B13R1.14 Cc1ccc(cc1)CO[C@H](C)CS 8a708c0cf11ef4df765ee85c7dea70a6 [0,2,0,0,0,0|1,1,0]=4 5430 B13R1.14 Cc1ccc(cc1)NCC(Br)CBr 8f3e44497fd08025e818f83172656fab [0,2,0,0,0,0|2,0,0]=4 5431 B13R1.14 Cc1ccc(cc1)NCC(C)C#N 6d13e22156098e84988653792de4df2e [0,2,0,0,0,0|2,0,0]=4 5432 B13R1.14 Cc1ccc(cc1)NCC(C)CO c3d819e97acee10a3170c419c18b306c [0,2,0,0,0,0|1,0,0]=3 5433 B13R1.14 Cc1ccc(cc1)NCC(F)CO 8ef9ad9272c10a76d2d157eea56dab5a [0,2,0,0,0,0|2,0,0]=4 5434 B13R1.14 Cc1ccc(cc1)NCC(O)CF a7521e3b058d2a5b904f3e7f48611719 [0,2,0,0,0,0|1,0,0]=3 5435 B13R1.14 Cc1ccc(cc1)NCC(O)CO a1627edf4f3d6c5888440ef0b99713b9 [0,2,0,0,0,0|1,0,0]=3 5436 B13R1.14 Cc1ccc(cc1)NC[C@@H](C)CO e48ff431f5d3a9372420a8b447c531fb [0,2,0,0,0,0|1,0,0]=3 5437 B13R1.14 Cc1ccc(cc1)NC[C@@H](F)CO b3d62dfa318858c41c5b76e7c9d89757 [0,2,0,0,0,0|2,0,0]=4 5438 B13R1.14 Cc1ccc(cc1)NC[C@@H](O)CO 2839116ff67d3a29b945ac431eb07c39 [0,2,0,0,0,0|1,0,0]=3 5439 B13R1.14 Cc1ccc(cc1)NC[C@H](C)CO e6fd0719444d1937cf69c322b5deeab4 [0,2,0,0,0,0|1,0,0]=3 5440 B13R1.14 Cc1ccc(cc1)NC[C@H](F)CO 3134f4572eab8e69e6e52a905686860d [0,2,0,0,0,0|2,0,0]=4 5441 B13R1.14 Cc1ccc(cc1)NC[C@H](O)CO 2e6b209a9f004ee65e0c78742c3c4d5f [0,2,0,0,0,0|1,0,0]=3 5442 B13R1.14 Cc1ccc(cc1)OCC(C)C#N 9be8fe7c62cebaace9fa8e841147e462 [0,2,0,0,0,0|2,0,0]=4 5443 B13R1.14 Cc1ccc(cc1)OCC(O)CO 63ac80aa1e48d0f4ff851d35866316f9 [0,2,0,0,0,0|1,0,0]=3 5444 B13R1.14 Cc1ccc(cc1)OC[C@@H](O)CO dab883f1f75dd5b62132a5169f809025 [0,2,0,0,0,0|1,0,0]=3 5445 B13R1.14 Cc1ccc(cc1)OC[C@H](O)CO 3527a0776a1f7ea8152462274758bcfa [0,2,0,0,0,0|1,0,0]=3 5446 B13R1.14 Cc1ccc(cn1)CNC(C)CO 053b6597065b96815e36bae53425163e [0,2,0,0,0,0|2,0,0]=4 5447 B13R1.14 Cc1ccc(cn1)CN[C@@H](C)CO b04873e860e8c7facb5e280415214e10 [0,2,0,0,0,0|2,0,0]=4 5448 B13R1.14 Cc1ccc(cn1)CN[C@H](C)CO 512f3a539ba00de70f57eeca29198257 [0,2,0,0,0,0|2,0,0]=4 5449 B13R1.14 Cc1ccc(cn1)NCC(C)CO 4f84d88f9b94f3426029556be91a0208 [0,2,0,0,0,0|2,0,0]=4 5450 B13R1.14 Cc1ccc(cn1)NCC(O)CF 890de19a2ea0e8d4718717fe04353b09 [0,2,0,0,0,0|2,0,0]=4 5451 B13R1.14 Cc1ccc(cn1)NCC(O)CO 7f127a7041e39de22fba5c86c077040c [0,2,0,0,0,0|2,0,0]=4 5452 B13R1.14 Cc1ccc(cn1)NC[C@@H](C)CO e1e797acba3bba4dd99b8f316e04a30d [0,2,0,0,0,0|2,0,0]=4 5453 B13R1.14 Cc1ccc(cn1)NC[C@@H](O)CO 0390cddd763876384134e668d953852d [0,2,0,0,0,0|2,0,0]=4 5454 B13R1.14 Cc1ccc(cn1)NC[C@H](C)CO 6844942d57b665f842353389caa45f28 [0,2,0,0,0,0|2,0,0]=4 5455 B13R1.14 Cc1ccc(cn1)NC[C@H](O)CO bc43bf2a8493d72f208f2437e8a7a36c [0,2,0,0,0,0|2,0,0]=4 5456 B13R1.14 Cc1ccc(cn1)OCC(O)CO 0d22ff6de13440a3e569aab02536d972 [0,2,0,0,0,0|2,0,0]=4 5457 B13R1.14 Cc1ccc(cn1)OC[C@@H](O)CO 730d86bdaff4caa2e837eaebde219303 [0,2,0,0,0,0|2,0,0]=4 5458 B13R1.14 Cc1ccc(cn1)OC[C@H](O)CO 7726214d674001215507c244d0d0b800 [0,2,0,0,0,0|2,0,0]=4 5459 B13R1.14 Cc1ccc(nc1)CNC(C)CO 53a16a9e4fd94289d7110d570b36b42c [0,2,0,0,0,0|2,0,0]=4 5460 B13R1.14 Cc1ccc(nc1)CN[C@@H](C)CO 124441ca7c7b9e5e77c77506883d96d2 [0,2,0,0,0,0|2,0,0]=4 5461 B13R1.14 Cc1ccc(nc1)CN[C@H](C)CO c651be5b37a09595a86380cff99209a6 [0,2,0,0,0,0|2,0,0]=4 5462 B13R1.14 Cc1ccc(nc1)NCC(C)CO ace45c63ae3d3939fbd5429840cafb4f [0,2,0,0,0,0|2,0,0]=4 5463 B13R1.14 Cc1ccc(nc1)NCC(O)CF 19235d499d1c0a2780d273062a4ac0a1 [0,2,0,0,0,0|2,0,0]=4 5464 B13R1.14 Cc1ccc(nc1)NCC(O)CO fb46ac7b4ffd5e60525292a5566748db [0,2,0,0,0,0|2,0,0]=4 5465 B13R1.14 Cc1ccc(nc1)NC[C@@H](C)CO 3d96d2beb869550d809d823a0c32c6bc [0,2,0,0,0,0|2,0,0]=4 5466 B13R1.14 Cc1ccc(nc1)NC[C@@H](O)CO e2b684f5c9278cfc10fb6c1ccb695424 [0,2,0,0,0,0|2,0,0]=4 5467 B13R1.14 Cc1ccc(nc1)NC[C@H](C)CO f3db4c8b0d25fe25c3a95dde3c869cb3 [0,2,0,0,0,0|2,0,0]=4 5468 B13R1.14 Cc1ccc(nc1)NC[C@H](O)CO 2110b80132c956014e1bf7192af6e756 [0,2,0,0,0,0|2,0,0]=4 5469 B13R1.14 Cc1ccc(nc1)OCC(O)CO 6f2dd52d4137a0edda2298aec2f35416 [0,2,0,0,0,0|2,0,0]=4 5470 B13R1.14 Cc1ccc(nc1)OC[C@@H](O)CO 51ae55e092fcffcc1390a9a4147d539d [0,2,0,0,0,0|2,0,0]=4 5471 B13R1.14 Cc1ccc(nc1)OC[C@H](O)CO 191a57ba759d0a8b9f44903f9491ef21 [0,2,0,0,0,0|2,0,0]=4 5472 B13R1.14 Fc1ccc(cc1)NCC(Br)CBr 4972e01281c8429da85ec760d82719d0 [0,2,0,0,0,0|2,0,0]=4 5473 B13R1.14 O=c1ccc(c[nH]1)NCC(O)CF 0a0119377fbfeb26b0dc2f60c30877b9 [0,2,0,0,0,0|2,0,0]=4 5474 B13R1.14 O=c1ccc(c[nH]1)NCC(O)CO 10917dd9c75d81fc4437edd9cd89d32c [0,2,0,0,0,0|2,0,0]=4 5475 B13R1.14 O=c1ccc(c[nH]1)NC[C@@H](O)CO 07a43ed3a00f644c9153ee9dd6ca16fe [0,2,0,0,0,0|2,0,0]=4 5476 B13R1.14 O=c1ccc(c[nH]1)NC[C@H](O)CO 4617273484fc7aecf1178ab93ddf9f57 [0,2,0,0,0,0|2,0,0]=4 5477 B13R1.14 OC(CF)CNc1ccc(cc1)Br b441037790858fe9c145da6bf38b9f23 [0,2,0,0,0,0|1,0,0]=3 5478 B13R1.14 OC(CF)CNc1ccc(cc1)Cl dcd18e7efe7c22cc41800cfe3c92440d [0,2,0,0,0,0|1,0,0]=3 5479 B13R1.14 OC(CF)CNc1ccc(cc1)F dff1e48235ae6f702a8a633e75a30f0a [0,2,0,0,0,0|1,0,0]=3 5480 B13R1.14 OC(CF)CNc1ccc(cc1)I f66ab4835726cc577e8a582784c1741f [0,2,0,0,0,0|1,0,0]=3 5481 B13R1.14 OC(CF)CNc1ccc(cc1)S ea0641f94f21a561de212d04685cb531 [0,2,0,0,0,0|1,0,0]=3 5482 B13R1.14 OC(CF)CNc1ccc(cn1)Br da5b20a865a241ad562f42f1e6ac56fc [0,2,0,0,0,0|2,0,0]=4 5483 B13R1.14 OC(CF)CNc1ccc(cn1)Cl da097e32a91185eb641855da63729970 [0,2,0,0,0,0|2,0,0]=4 5484 B13R1.14 OC(CF)CNc1ccc(cn1)F 6990eda8018e7708eb0594b5362d519c [0,2,0,0,0,0|2,0,0]=4 5485 B13R1.14 OC(CF)CNc1ccc(cn1)I 0a52965688141a6759ac37cfede153d6 [0,2,0,0,0,0|2,0,0]=4 5486 B13R1.14 OC(CF)CNc1ccc(nc1)Br adc0ad5474d3c35768e18fbfca954107 [0,2,0,0,0,0|2,0,0]=4 5487 B13R1.14 OC(CF)CNc1ccc(nc1)Cl c6bf1645e2599c1c3bb23b0d3a30bbc2 [0,2,0,0,0,0|2,0,0]=4 5488 B13R1.14 OC(CF)CNc1ccc(nc1)F bef073f954f7820bab401393563d9ee6 [0,2,0,0,0,0|2,0,0]=4 5489 B13R1.14 OC(CF)CNc1ccc(nc1)I 89cc8b888d0b52c90880b989d027c8eb [0,2,0,0,0,0|2,0,0]=4 5490 B13R1.14 OCC(F)CNc1ccc(cc1)F 1a8f5845f4981b3482757aeb60d9b4bd [0,2,0,0,0,0|2,0,0]=4 5491 B13R1.14 OCC(F)CNc1ccc(cc1)O 01c4fc9859fedf068875b0abe5e5d276 [0,2,0,0,0,0|2,0,0]=4 5492 B13R1.14 OCC(F)CNc1ccc(cc1)S cd58cc6ec2ae0c31f87feafa32452270 [0,2,0,0,0,0|2,0,0]=4 5493 B13R1.14 OCC(O)CNc1ccc(cc1)Br f55345aea956e5e53aef5c718cdb2b68 [0,2,0,0,0,0|1,0,0]=3 5494 B13R1.14 OCC(O)CNc1ccc(cc1)Cl 2e13c143379b901efc29c3efe728aca7 [0,2,0,0,0,0|1,0,0]=3 5495 B13R1.14 OCC(O)CNc1ccc(cc1)F 8df61770d9579065f6b3c6656db2d5a4 [0,2,0,0,0,0|1,0,0]=3 5496 B13R1.14 OCC(O)CNc1ccc(cc1)I d7449dee1b734bce62875abf944f63b0 [0,2,0,0,0,0|1,0,0]=3 5497 B13R1.14 OCC(O)CNc1ccc(cc1)S 15ee66fc05eb3aeb2422207161cd9da5 [0,2,0,0,0,0|1,0,0]=3 5498 B13R1.14 OCC(O)CNc1ccc(cn1)Br 6bcc572e0dd82f1a89f202cbcda65e98 [0,2,0,0,0,0|2,0,0]=4 5499 B13R1.14 OCC(O)CNc1ccc(cn1)Cl 0ba7d729137d78c00e9ab9a3cd1bb7cd [0,2,0,0,0,0|2,0,0]=4 5500 B13R1.14 OCC(O)CNc1ccc(cn1)F 62b3f5257fc891990c362907c6262731 [0,2,0,0,0,0|2,0,0]=4 5501 B13R1.14 OCC(O)CNc1ccc(cn1)I 9fca37deefcfed29c470c4f4c25dfd3e [0,2,0,0,0,0|2,0,0]=4 5502 B13R1.14 OCC(O)CNc1ccc(nc1)Br bd5bf89f1cb106840d9facd6e0a09109 [0,2,0,0,0,0|2,0,0]=4 5503 B13R1.14 OCC(O)CNc1ccc(nc1)Cl b58168cdd1d345a7c3b6a335e9a87ebb [0,2,0,0,0,0|2,0,0]=4 5504 B13R1.14 OCC(O)CNc1ccc(nc1)F 5f992373c57a264315e6f8f4a4678a98 [0,2,0,0,0,0|2,0,0]=4 5505 B13R1.14 OCC(O)CNc1ccc(nc1)I f782f23b5ee9bb97f0c67164d41eb32c [0,2,0,0,0,0|2,0,0]=4 5506 B13R1.14 OCC(O)COc1ccc(cc1)Br eb5d0c8dc720472f88afc89370d71cc0 [0,2,0,0,0,0|1,0,0]=3 5507 B13R1.14 OCC(O)COc1ccc(cc1)Cl 445d36d805c7eeeb803c379431084898 [0,2,0,0,0,0|1,0,0]=3 5508 B13R1.14 OCC(O)COc1ccc(cc1)F b975c1632d2ebcf467c8de61cda333b5 [0,2,0,0,0,0|1,0,0]=3 5509 B13R1.14 OCC(O)COc1ccc(cc1)I 9ee68e6c317101af057cfe398a579d70 [0,2,0,0,0,0|1,0,0]=3 5510 B13R1.14 OCC(O)COc1ccc(cc1)S 7707492b782d6303a544c4aac3273339 [0,2,0,0,0,0|1,0,0]=3 5511 B13R1.14 OCC(O)COc1ccc(cn1)Cl 55a5b1c12ca93ce4b95461a06beea417 [0,2,0,0,0,0|2,0,0]=4 5512 B13R1.14 OCC(O)COc1ccc(cn1)F b7118d72c008cbee2658efbd383582de [0,2,0,0,0,0|2,0,0]=4 5513 B13R1.14 OCC(O)COc1ccc(cn1)I 9a452d0a48193f57e5957c276ebb3c9c [0,2,0,0,0,0|2,0,0]=4 5514 B13R1.14 OCC(O)COc1ccc(nc1)Br 86509f95ba681a6acf673748a335e07f [0,2,0,0,0,0|2,0,0]=4 5515 B13R1.14 OCC(O)COc1ccc(nc1)Cl 06fb4473d9986d9352bcee4b28c5df73 [0,2,0,0,0,0|2,0,0]=4 5516 B13R1.14 OCC(O)COc1ccc(nc1)F 5486dd16629b54c05fb8243f93d8bfb8 [0,2,0,0,0,0|2,0,0]=4 5517 B13R1.14 OCC(O)COc1ccc(nc1)I bfd5a723834e8ce47f2b6225ab722823 [0,2,0,0,0,0|2,0,0]=4 5518 B13R1.14 OC[C@@H](F)CNc1ccc(cc1)F 2943b4461a884cfd865ebc7886f902a2 [0,2,0,0,0,0|2,0,0]=4 5519 B13R1.14 OC[C@@H](F)CNc1ccc(cc1)O 0eb2bb8663c23b40aa8bb3006b8ef28a [0,2,0,0,0,0|2,0,0]=4 5520 B13R1.14 OC[C@@H](F)CNc1ccc(cc1)S d9cc1858688052f3823ec3d0a1f130a1 [0,2,0,0,0,0|2,0,0]=4 5521 B13R1.14 OC[C@@H](O)CNc1ccc(cc1)Br eea9729b45ad36688924f79ae745faa0 [0,2,0,0,0,0|1,0,0]=3 5522 B13R1.14 OC[C@@H](O)CNc1ccc(cc1)Cl 08f9114e9cb1a0661c8577962cd2ef6e [0,2,0,0,0,0|1,0,0]=3 5523 B13R1.14 OC[C@@H](O)CNc1ccc(cc1)F 8366ab2e5750a1604507c50e660fd599 [0,2,0,0,0,0|1,0,0]=3 5524 B13R1.14 OC[C@@H](O)CNc1ccc(cc1)I 7ecd5719c246266fc59fe371e9d03ddc [0,2,0,0,0,0|1,0,0]=3 5525 B13R1.14 OC[C@@H](O)CNc1ccc(cc1)S 4ac7d0ff5489bb89b16afa0da39d368d [0,2,0,0,0,0|1,0,0]=3 5526 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)Br 342e64a3c32d6e2b92500290b8ed02e4 [0,2,0,0,0,0|2,0,0]=4 5527 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)Cl 4a26d31b78cf708a7dd03e7293f0e790 [0,2,0,0,0,0|2,0,0]=4 5528 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)F a65898f7adbe72e780e3b6225d428d28 [0,2,0,0,0,0|2,0,0]=4 5529 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)I 42c0fd877b7f1faec5fe1624e1996608 [0,2,0,0,0,0|2,0,0]=4 5530 B13R1.14 OC[C@@H](O)CNc1ccc(nc1)Br dae86469baab81e381efc58ae64940d9 [0,2,0,0,0,0|2,0,0]=4 5531 B13R1.14 OC[C@@H](O)CNc1ccc(nc1)Cl bda931cf8263d8d6d5101ba9f905b21b [0,2,0,0,0,0|2,0,0]=4 5532 B13R1.14 OC[C@@H](O)CNc1ccc(nc1)F 7e676ce09d74589a7a5798930e6af51b [0,2,0,0,0,0|2,0,0]=4 5533 B13R1.14 OC[C@@H](O)CNc1ccc(nc1)I 277226f981951502fd8f5881b4acfa5c [0,2,0,0,0,0|2,0,0]=4 5534 B13R1.14 OC[C@@H](O)COc1ccc(cc1)Br 80af2a3bfa91bbdd80b9dfa00626dc12 [0,2,0,0,0,0|1,0,0]=3 5535 B13R1.14 OC[C@@H](O)COc1ccc(cc1)Cl 8b8acca672bc4dfb1abfc417aa8e77a2 [0,2,0,0,0,0|1,0,0]=3 5536 B13R1.14 OC[C@@H](O)COc1ccc(cc1)F 2df34d43990d21f52df60c01cdc88fae [0,2,0,0,0,0|1,0,0]=3 5537 B13R1.14 OC[C@@H](O)COc1ccc(cc1)I 935ba794cfee1193dfec4421160e90d1 [0,2,0,0,0,0|1,0,0]=3 5538 B13R1.14 OC[C@@H](O)COc1ccc(cc1)S 8a45375217b48dca905117250fcc2653 [0,2,0,0,0,0|1,0,0]=3 5539 B13R1.14 OC[C@@H](O)COc1ccc(cn1)Cl d4ecb698df396a4e37babd80e34dbdf0 [0,2,0,0,0,0|2,0,0]=4 5540 B13R1.14 OC[C@@H](O)COc1ccc(cn1)F 662760966c260370430fe4c39bbe7685 [0,2,0,0,0,0|2,0,0]=4 5541 B13R1.14 OC[C@@H](O)COc1ccc(cn1)I 7f24b27e808f8f61cc8bcbda12d44390 [0,2,0,0,0,0|2,0,0]=4 5542 B13R1.14 OC[C@@H](O)COc1ccc(nc1)Br 1004b0586c86b85d18962249dad412ee [0,2,0,0,0,0|2,0,0]=4 5543 B13R1.14 OC[C@@H](O)COc1ccc(nc1)Cl e29a69a16fc8170f0ee34bf12f2c4b38 [0,2,0,0,0,0|2,0,0]=4 5544 B13R1.14 OC[C@@H](O)COc1ccc(nc1)F 2a02fa7c9cacc1ec71ae24452c7eaecc [0,2,0,0,0,0|2,0,0]=4 5545 B13R1.14 OC[C@@H](O)COc1ccc(nc1)I f79007869af5869cfc72b67fa45fa7e2 [0,2,0,0,0,0|2,0,0]=4 5546 B13R1.14 OC[C@H](F)CNc1ccc(cc1)F 95b3bb54d98731950f6c8accf5b0ff98 [0,2,0,0,0,0|2,0,0]=4 5547 B13R1.14 OC[C@H](F)CNc1ccc(cc1)O 9222924eeeecfb5a06419eb3c42a825a [0,2,0,0,0,0|2,0,0]=4 5548 B13R1.14 OC[C@H](F)CNc1ccc(cc1)S 7401cb02e31de34e7d8fb4d755b885c6 [0,2,0,0,0,0|2,0,0]=4 5549 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Br 44246ea36b91bf2e01a05648ad69c033 [0,2,0,0,0,0|1,0,0]=3 5550 B13R1.14 OC[C@H](O)CNc1ccc(cc1)Cl 1be878d47ef97e58175eca3c1f333069 [0,2,0,0,0,0|1,0,0]=3 5551 B13R1.14 OC[C@H](O)CNc1ccc(cc1)F 80f3b8befe598087b42bc6dfedce0d9a [0,2,0,0,0,0|1,0,0]=3 5552 B13R1.14 OC[C@H](O)CNc1ccc(cc1)I 1b9b193227c363417cac5866103fd714 [0,2,0,0,0,0|1,0,0]=3 5553 B13R1.14 OC[C@H](O)CNc1ccc(cc1)S f737d66c9be813aae491dee1611ae15a [0,2,0,0,0,0|1,0,0]=3 5554 B13R1.14 OC[C@H](O)CNc1ccc(cn1)Br 2b77722e07f9ca0299cfcbc74d14cf55 [0,2,0,0,0,0|2,0,0]=4 5555 B13R1.14 OC[C@H](O)CNc1ccc(cn1)Cl f9b405ec69928b1c6cb6924e1ddfbc72 [0,2,0,0,0,0|2,0,0]=4 5556 B13R1.14 OC[C@H](O)CNc1ccc(cn1)F 90e5d71c4a3ebf7daa4b7d4b11ca23aa [0,2,0,0,0,0|2,0,0]=4 5557 B13R1.14 OC[C@H](O)CNc1ccc(cn1)I 22d21a97510c23fbcaffb23138153195 [0,2,0,0,0,0|2,0,0]=4 5558 B13R1.14 OC[C@H](O)CNc1ccc(nc1)Br 7814035d73a281a32901ab801ecb6e84 [0,2,0,0,0,0|2,0,0]=4 5559 B13R1.14 OC[C@H](O)CNc1ccc(nc1)Cl 9f49054b243952db1dc19fe36da661f1 [0,2,0,0,0,0|2,0,0]=4 5560 B13R1.14 OC[C@H](O)CNc1ccc(nc1)F 6cf36a0e6e9e0da75d56119c21a2beb6 [0,2,0,0,0,0|2,0,0]=4 5561 B13R1.14 OC[C@H](O)CNc1ccc(nc1)I cd613339a923d8720b891ee93d6ff0c1 [0,2,0,0,0,0|2,0,0]=4 5562 B13R1.14 OC[C@H](O)COc1ccc(cc1)Br c82bda2b16d1e6a63311b692c70a2f21 [0,2,0,0,0,0|1,0,0]=3 5563 B13R1.14 OC[C@H](O)COc1ccc(cc1)Cl 2907133d605f34e99a2931ebc19d99ba [0,2,0,0,0,0|1,0,0]=3 5564 B13R1.14 OC[C@H](O)COc1ccc(cc1)F 8f8a8a1f2614314fc2e4c58669c50e88 [0,2,0,0,0,0|1,0,0]=3 5565 B13R1.14 OC[C@H](O)COc1ccc(cc1)I 3a697ecf51912ec6b79a0fa1d91e8e08 [0,2,0,0,0,0|1,0,0]=3 5566 B13R1.14 OC[C@H](O)COc1ccc(cc1)S 5baec00c06249f93dcdad11d7eb894db [0,2,0,0,0,0|1,0,0]=3 5567 B13R1.14 OC[C@H](O)COc1ccc(cn1)Cl ff5451ceb6576786c566603f2c9bff93 [0,2,0,0,0,0|2,0,0]=4 5568 B13R1.14 OC[C@H](O)COc1ccc(cn1)F 632193f8d2934afd94446c761ac7bd1f [0,2,0,0,0,0|2,0,0]=4 5569 B13R1.14 OC[C@H](O)COc1ccc(cn1)I ef47f579d53f5c125135041f053d4ff3 [0,2,0,0,0,0|2,0,0]=4 5570 B13R1.14 OC[C@H](O)COc1ccc(nc1)Br 1755b4a1936f420f98b8bf757ae104b1 [0,2,0,0,0,0|2,0,0]=4 5571 B13R1.14 OC[C@H](O)COc1ccc(nc1)Cl 39693129afb4dafb013a5b2321aa41b9 [0,2,0,0,0,0|2,0,0]=4 5572 B13R1.14 OC[C@H](O)COc1ccc(nc1)F a7a5b5362da2e76d25e8a5554e9849fc [0,2,0,0,0,0|2,0,0]=4 5573 B13R1.14 OC[C@H](O)COc1ccc(nc1)I c0fe5fada4d25601da5f3c693bfd1cfe [0,2,0,0,0,0|2,0,0]=4 5574 B13R1.14 Sc1ccc(cc1)NCC(Br)CBr d058eb0c8ea91d8943e4b8bab4679bdd [0,2,0,0,0,0|2,0,0]=4 5575 B13R1.132 CC(C)CN(C)c1ccc(cc1)Br a942bcbec189b0444bc91831bc4ea05d [0,2,0,0,0,0|2,0,0]=4 5576 B13R1.132 CC(C)CN(C)c1ccc(cc1)Cl 1384edf84e0ee0ac731bef8271f179e8 [0,2,0,0,0,0|2,0,0]=4 5577 B13R1.132 CC(C)CN(C)c1ccc(cc1)F fd2b6bdd6df30522b9ae57447650a48a [0,2,0,0,0,0|2,0,0]=4 5578 B13R1.132 CC(C)CN(C)c1ccc(cc1)I 64e8de14de9394755cf8d7ee089a6868 [0,2,0,0,0,0|2,0,0]=4 5579 B13R1.132 CC(C)CN(C)c1ccc(cc1)S 471276773f44f82ad773ee20302529ff [0,2,0,0,0,0|2,0,0]=4 5580 B13R1.132 CC(C)OC(C)c1ccc(cc1)F 2b14a962c03d416b3fc36a7cc2a9e48f [0,2,0,0,0,0|2,0,0]=4 5581 B13R1.132 CC(C)OC(C)c1ccc(cc1)I 13482ebb554bebee5c9d28d578ee7fd7 [0,2,0,0,0,0|2,0,0]=4 5582 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)F b98248715112d7212028b31e8c577e05 [0,2,0,0,0,0|2,0,0]=4 5583 B13R1.132 CC(C)O[C@@H](C)c1ccc(cc1)I 8134dc705dcdfbd181332cae01a5c167 [0,2,0,0,0,0|2,0,0]=4 5584 B13R1.132 CC(C)O[C@H](C)c1ccc(cc1)F de1b161bf1fb2e5108ff544a6d18eede [0,2,0,0,0,0|2,0,0]=4 5585 B13R1.132 CC(C)O[C@H](C)c1ccc(cc1)I e1c75bf4aed86d6c513f89dcd4b032ea [0,2,0,0,0,0|2,0,0]=4 5586 B13R1.132 CC(O)CN(C)c1ccc(cc1)Br 57ddba06acec62f92e9fd857877900f4 [0,2,0,0,0,0|1,0,0]=3 5587 B13R1.132 CC(O)CN(C)c1ccc(cc1)Cl 57e82349aa9bf335f23226ebbbbd1255 [0,2,0,0,0,0|1,0,0]=3 5588 B13R1.132 CC(O)CN(C)c1ccc(cc1)F 6ba125c625572fbbf72773014136b13f [0,2,0,0,0,0|1,0,0]=3 5589 B13R1.132 CC(O)CN(C)c1ccc(cc1)I e68aafe889dece0871113a0b6b34aedd [0,2,0,0,0,0|1,0,0]=3 5590 B13R1.132 CC(O)CN(C)c1ccc(cc1)S 7f2a97152f0ff9ca827c19d85934b5fe [0,2,0,0,0,0|1,0,0]=3 5591 B13R1.132 CC(O)CN(C)c1ccc(cn1)Br 6a0fbbb85b845ab45bbf8dce18f0b88b [0,2,0,0,0,0|2,0,0]=4 5592 B13R1.132 CC(O)CN(C)c1ccc(cn1)Cl 5ef5173dde0b6ef65b2261717bf41661 [0,2,0,0,0,0|2,0,0]=4 5593 B13R1.132 CC(O)CN(C)c1ccc(cn1)F 337145b5e441445e8e9477a248e921ad [0,2,0,0,0,0|2,0,0]=4 5594 B13R1.132 CC(O)CN(C)c1ccc(cn1)I c6945cc51d0ab62e163ff843ab2a8505 [0,2,0,0,0,0|2,0,0]=4 5595 B13R1.132 CC(O)CN(C)c1ccc(nc1)Br e96c8ebf4ef9e632074f49d66abdcb76 [0,2,0,0,0,0|2,0,0]=4 5596 B13R1.132 CC(O)CN(C)c1ccc(nc1)Cl 23b87c5bea0eda6ca9a139e8faafcf37 [0,2,0,0,0,0|2,0,0]=4 5597 B13R1.132 CC(O)CN(C)c1ccc(nc1)F 3fd62c11020288841938be6b184b2b47 [0,2,0,0,0,0|2,0,0]=4 5598 B13R1.132 C[C@H](O)CN(C)c1ccc(cc1)Br df123d7490f7f9c646801c18cd3c740c [0,2,0,0,0,0|1,0,0]=3 5599 B13R1.132 C[C@H](O)CN(C)c1ccc(cc1)Cl 0199501bdd8cfd554284d7b5aec664c9 [0,2,0,0,0,0|1,0,0]=3 5600 B13R1.132 C[C@H](O)CN(C)c1ccc(cc1)F f76bf2f8c8c51f7d9d654abb3415566c [0,2,0,0,0,0|1,0,0]=3 5601 B13R1.132 C[C@H](O)CN(C)c1ccc(cc1)I 15e914d4b4af86f3b1ad78935ef9a55f [0,2,0,0,0,0|1,0,0]=3 5602 B13R1.132 C[C@H](O)CN(C)c1ccc(cc1)S aebc6217c7cf64a756ac4f9700eda8f4 [0,2,0,0,0,0|1,0,0]=3 5603 B13R1.132 C[C@H](O)CN(C)c1ccc(cn1)Br 776cf511fa4a3631c8b327c98558c52b [0,2,0,0,0,0|2,0,0]=4 5604 B13R1.132 C[C@H](O)CN(C)c1ccc(cn1)Cl 7df827a5e9baf6cfa62ee38f7b983f75 [0,2,0,0,0,0|2,0,0]=4 5605 B13R1.132 C[C@H](O)CN(C)c1ccc(cn1)F 99b3321f7d86cf4b5798ddb21b4de96c [0,2,0,0,0,0|2,0,0]=4 5606 B13R1.132 C[C@H](O)CN(C)c1ccc(cn1)I b89d35f0bb78a11dbfa71a7d74d9b07b [0,2,0,0,0,0|2,0,0]=4 5607 B13R1.132 C[C@H](O)CN(C)c1ccc(nc1)Br cbcbd7456a61c876987dbb6bf2bccfed [0,2,0,0,0,0|2,0,0]=4 5608 B13R1.132 C[C@H](O)CN(C)c1ccc(nc1)Cl 6b9093de6f684f744a2e2975192b2608 [0,2,0,0,0,0|2,0,0]=4 5609 B13R1.132 C[C@H](O)CN(C)c1ccc(nc1)F 5e3dd4e0b7045504c1d0565021bf9b95 [0,2,0,0,0,0|2,0,0]=4 5610 B13R1.132 Cc1ccc(cc1)C(C)OC(C)C ebd823f0bcb640295d64c150dde2053c [0,2,0,0,0,0|2,0,0]=4 5611 B13R1.132 Cc1ccc(cc1)N(C)CC(C)C 4873c333cb4553090a444441a0779258 [0,2,0,0,0,0|2,0,0]=4 5612 B13R1.132 Cc1ccc(cc1)N(C)CC(C)O 1e40f8cd71f71eb21f5380bc745cc153 [0,2,0,0,0,0|1,0,0]=3 5613 B13R1.132 Cc1ccc(cc1)N(C)C[C@H](C)O c2b00fb702e46f1a03ec0afb6f6e2c89 [0,2,0,0,0,0|1,0,0]=3 5614 B13R1.132 Cc1ccc(cc1)[C@@H](C)OC(C)C 10c1ef1677cca11d26da55fa99351f30 [0,2,0,0,0,0|2,0,0]=4 5615 B13R1.132 Cc1ccc(cc1)[C@H](C)OC(C)C 9f0383c814b167276cc43dc3702f38d4 [0,2,0,0,0,0|2,0,0]=4 5616 B13R1.132 Cc1ccc(cn1)N(C)CC(C)O 55f214c27c54489bc9e9d499c401c18d [0,2,0,0,0,0|2,0,0]=4 5617 B13R1.132 Cc1ccc(cn1)N(C)C[C@H](C)O f16bb621b62e27901016265d4f57dfeb [0,2,0,0,0,0|2,0,0]=4 5618 B13R1.132 Cc1ccc(nc1)N(C)CC(C)O 578f2072ef90350f752499f1a9141daa [0,2,0,0,0,0|2,0,0]=4 5619 B13R1.132 Cc1ccc(nc1)N(C)C[C@H](C)O 94c8e4ceffed4a952111381a119363dc [0,2,0,0,0,0|2,0,0]=4 5620 B13R1.133 CC(C)C(C)Nc1ccc(cc1)Br 48df6ee5ba6bea6aa9a525cd37b8cf67 [0,2,0,0,0,0|2,0,0]=4 5621 B13R1.133 CC(C)C(C)Nc1ccc(cc1)Cl 69b3bef655250a365356a23ce3f5ed98 [0,2,0,0,0,0|2,0,0]=4 5622 B13R1.133 CC(C)C(C)Nc1ccc(cc1)I d443aa6859b0ab5cc6d6b238fe4fe91c [0,2,0,0,0,0|2,0,0]=4 5623 B13R1.133 CC(C)C(C)Nc1ccc(cc1)S 243a255ff42197e79f132fb1af7761e9 [0,2,0,0,0,0|2,0,0]=4 5624 B13R1.133 CC(C)C(C)Oc1ccc(cc1)I a95f73571fc61eb7011fc83a98b33aa6 [0,2,0,0,0,0|2,0,0]=4 5625 B13R1.133 CC(C)N(C)Cc1ccc(cc1)Br 86b2b0b4a1ab44a43b638800e8927891 [0,2,0,0,0,0|2,0,0]=4 5626 B13R1.133 CC(C)N(C)Cc1ccc(cc1)Cl 101aaa2b32f36c06fa18952af3dc2687 [0,2,0,0,0,0|2,0,0]=4 5627 B13R1.133 CC(C)N(C)Cc1ccc(cc1)F cfbace6c48ee09da0edbcdb103da9bdc [0,2,0,0,0,0|2,0,0]=4 5628 B13R1.133 CC(C)N(C)Cc1ccc(cc1)I 415e889e7f47390e689c9871eef180e4 [0,2,0,0,0,0|2,0,0]=4 5629 B13R1.133 CC(C)[C@@H](C)Nc1ccc(cc1)S acfcd24b00b3ef9b48a83326eab11899 [0,2,0,0,0,0|2,0,0]=4 5630 B13R1.133 CC(C)[C@H](C)Nc1ccc(cc1)S 43c563752cde08901a3ca2594b199958 [0,2,0,0,0,0|2,0,0]=4 5631 B13R1.133 CC(O)C(=O)Nc1ccc(cc1)F 9f35c566c42a4f3231652a9bdba6aa2b [0,2,0,0,0,0|1,0,1]=4 5632 B13R1.133 CC(O)C(=O)Nc1ccc(cc1)I c2329af118f52f56c194f23414aa5661 [0,2,0,0,0,0|1,0,1]=4 5633 B13R1.133 CC(O)C(=O)Nc1ccc(cc1)O b160e33f7198bf465b37432d42b50b24 [0,2,0,0,0,0|1,0,1]=4 5634 B13R1.133 CC(O)C(=O)Nc1ccc(cc1)S 9979bbda97d486ddfeeb3af62383fbec [0,2,0,0,0,0|1,0,1]=4 5635 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)F 0c9fd1014660a590bc6955e8addd2a80 [0,2,0,0,0,0|1,0,1]=4 5636 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)I 9c4d0354bd71a8fa5d2d4aafe78853c3 [0,2,0,0,0,0|1,0,1]=4 5637 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)O c5f812803dd865692b31897d64dbe659 [0,2,0,0,0,0|1,0,1]=4 5638 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(cc1)S d0794a2cccf12cb8f60f262badaa5eb3 [0,2,0,0,0,0|1,0,1]=4 5639 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)F 70914c20fd890db4a35bed1ea3e7e12d [0,2,0,0,0,0|1,0,1]=4 5640 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)I c3f9466555d39eb7745defd6926b375a [0,2,0,0,0,0|1,0,1]=4 5641 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)O e017971e12e508e3506fedc5d086ed00 [0,2,0,0,0,0|1,0,1]=4 5642 B13R1.133 C[C@H](O)C(=O)Nc1ccc(cc1)S 42845a3372c7ef1e0ab7a8871bd6028e [0,2,0,0,0,0|1,0,1]=4 5643 B13R1.133 Cc1ccc(cc1)CN(C)C(C)C 995b96a2fbe8c9e3143e5b2aec9f46a8 [0,2,0,0,0,0|2,0,0]=4 5644 B13R1.133 Cc1ccc(cc1)NC(=O)C(C)O a98282202c08455f10ba290420bced73 [0,2,0,0,0,0|1,0,1]=4 5645 B13R1.133 Cc1ccc(cc1)NC(=O)[C@@H](C)O 5c68d357b67fac0ba61671bd107023ce [0,2,0,0,0,0|1,0,1]=4 5646 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O 1985aa7ac8075dbe9b506fb01afb1784 [0,2,0,0,0,0|1,0,1]=4 5647 B13R1.133 Cc1ccc(cc1)NC(C)C(C)C 37f1bc690b693f16698928447d986a7e [0,2,0,0,0,0|2,0,0]=4 5648 B13R1.133 Cc1ccc(cc1)OC(C)C(C)C 7cf478951a6eb2693f4eab03524b96d9 [0,2,0,0,0,0|2,0,0]=4 5649 B13R1.164 CC(C)CNc1ccc(cc1Br)Br 7be1b3d786c94fcdccb44c01d6773588 [0,2,0,0,0,0|2,0,0]=4 5650 B13R1.164 CC(C)CNc1ccc(cc1Br)Cl 18c3bb67e3733ad480f2084e4e4b7aa9 [0,2,0,0,0,0|2,0,0]=4 5651 B13R1.164 CC(C)CNc1ccc(cc1Br)F 4c17996d5f8c01368f7aa28877b83b61 [0,2,0,0,0,0|2,0,0]=4 5652 B13R1.164 CC(C)CNc1ccc(cc1Br)I 0a677ef3a0a8ba3a20078ab26917a9fa [0,2,0,0,0,0|2,0,0]=4 5653 B13R1.164 CC(C)CNc1ccc(cc1Cl)Br ab9d94217e8b42f424c4b683ae54215b [0,2,0,0,0,0|2,0,0]=4 5654 B13R1.164 CC(C)CNc1ccc(cc1Cl)Cl 0cbd0a9e1078f27073df7a1c3a95af6c [0,2,0,0,0,0|2,0,0]=4 5655 B13R1.164 CC(C)CNc1ccc(cc1Cl)F 7eec7c3acd842f31623417ae99c5e9eb [0,2,0,0,0,0|2,0,0]=4 5656 B13R1.164 CC(C)CNc1ccc(cc1Cl)I 262573afb31d24cd522a36774ff06457 [0,2,0,0,0,0|2,0,0]=4 5657 B13R1.164 CC(C)CNc1ccc(cc1F)Br d1b7116c5c370a47253e1423a9ea1736 [0,2,0,0,0,0|2,0,0]=4 5658 B13R1.164 CC(C)CNc1ccc(cc1F)Cl 9553d966a3c9c68770a801699fb80a75 [0,2,0,0,0,0|2,0,0]=4 5659 B13R1.164 CC(C)CNc1ccc(cc1F)F a71b04c18830c8087052b11247148005 [0,2,0,0,0,0|2,0,0]=4 5660 B13R1.164 CC(C)CNc1ccc(cc1F)I f625d3568c8086dfeb43e5eb5d6415c7 [0,2,0,0,0,0|2,0,0]=4 5661 B13R1.164 CC(C)CNc1ccc(cc1F)S cce0a5a88e66885dbbcaf2770bbbb83c [0,2,0,0,0,0|2,0,0]=4 5662 B13R1.164 CC(C)CNc1ccc(cc1I)Br 85f085675c6b396e744c4538ce9d72a1 [0,2,0,0,0,0|2,0,0]=4 5663 B13R1.164 CC(C)CNc1ccc(cc1I)Cl 753e1c904bb4b7b6272b61fa4610e879 [0,2,0,0,0,0|2,0,0]=4 5664 B13R1.164 CC(C)CNc1ccc(cc1I)F 30aafaa28f40e9dd0cd24058c6d96ecc [0,2,0,0,0,0|2,0,0]=4 5665 B13R1.164 CC(C)CNc1ccc(cc1I)I fca8115870c6277337af5504e0c5358b [0,2,0,0,0,0|2,0,0]=4 5666 B13R1.164 CC(C)CNc1ccc(cc1N)N fa0d97d398b8609459102c8a1f48ac47 [0,2,0,0,0,0|2,0,0]=4 5667 B13R1.164 CC(C)CNc1ccc(cc1S)Br 7e28893c30a978e0c94c0c04cfad0f2d [0,2,0,0,0,0|2,0,0]=4 5668 B13R1.164 CC(C)CNc1ccc(cc1S)Cl f088bcacb58e41378c043084a9b538b1 [0,2,0,0,0,0|2,0,0]=4 5669 B13R1.164 CC(C)CNc1ccc(cc1S)F 4be7fa095deb2519409dd33bf6b33f14 [0,2,0,0,0,0|2,0,0]=4 5670 B13R1.164 CC(C)COc1ccc(cc1Br)Br 3c2eb0f90a7e291ff003ed56de62338b [0,2,0,0,0,0|2,0,0]=4 5671 B13R1.164 CC(C)COc1ccc(cc1Br)Cl 8ccd9ead69d1f045ca9b0f363ee1bb5a [0,2,0,0,0,0|2,0,0]=4 5672 B13R1.164 CC(C)COc1ccc(cc1Br)F 1cd9e82ad6ff2929df565895bbe9b848 [0,2,0,0,0,0|2,0,0]=4 5673 B13R1.164 CC(C)COc1ccc(cc1Br)I eed1c2bc0e2f1526f95d1ea9c90c121b [0,2,0,0,0,0|2,0,0]=4 5674 B13R1.164 CC(C)COc1ccc(cc1Cl)Br dbea4d35c2583cb4139ef903a2cab309 [0,2,0,0,0,0|2,0,0]=4 5675 B13R1.164 CC(C)COc1ccc(cc1Cl)Cl 8c70daa266af6131ba3e60db44f908bb [0,2,0,0,0,0|2,0,0]=4 5676 B13R1.164 CC(C)COc1ccc(cc1Cl)F 0a379b707a51bb54beca2f5c05330b72 [0,2,0,0,0,0|2,0,0]=4 5677 B13R1.164 CC(C)COc1ccc(cc1Cl)I 82e39fe4f2d3801fa68010b2692ddd20 [0,2,0,0,0,0|2,0,0]=4 5678 B13R1.164 CC(C)COc1ccc(cc1F)Br 1f8e08adbd8334fde68fab9d83ec124e [0,2,0,0,0,0|2,0,0]=4 5679 B13R1.164 CC(C)COc1ccc(cc1F)Cl 4e82559c86b2cef362df9afb2a61c770 [0,2,0,0,0,0|2,0,0]=4 5680 B13R1.164 CC(C)COc1ccc(cc1F)F 9ab124bb7961d40e05e8eb06e107f2e0 [0,2,0,0,0,0|2,0,0]=4 5681 B13R1.164 CC(C)COc1ccc(cc1F)I 78c0ea62eb3691bc1b5eae611b9caaae [0,2,0,0,0,0|2,0,0]=4 5682 B13R1.164 CC(C)COc1ccc(cc1I)Br 75f79af841e767fa88f4438a0a4c47c6 [0,2,0,0,0,0|2,0,0]=4 5683 B13R1.164 CC(C)COc1ccc(cc1I)Cl ac8cb2fc8b943ea04ec6bc43a454c85b [0,2,0,0,0,0|2,0,0]=4 5684 B13R1.164 CC(C)COc1ccc(cc1I)F 50f529fb3e9a24d37a5d389c78bb3398 [0,2,0,0,0,0|2,0,0]=4 5685 B13R1.164 CC(C)COc1ccc(cc1I)I ef09314ec46f0a24b8dc336b4705b5a4 [0,2,0,0,0,0|2,0,0]=4 5686 B13R1.164 CC(C)NCc1ccc(cc1Cl)Br 9c7fba582be5b0c4753cc4b225bd3771 [0,2,0,0,0,0|2,0,0]=4 5687 B13R1.164 CC(C)NCc1ccc(cc1Cl)Cl 38d4f02e4559ebd8b360fb15f71487f7 [0,2,0,0,0,0|2,0,0]=4 5688 B13R1.164 CC(C)NCc1ccc(cc1Cl)F 22d755d11b768e10dd9762957eeee072 [0,2,0,0,0,0|2,0,0]=4 5689 B13R1.164 CC(C)NCc1ccc(cc1F)Br b36c2152924cc726975c38301ff4e6ad [0,2,0,0,0,0|2,0,0]=4 5690 B13R1.164 CC(C)NCc1ccc(cc1F)Cl cbf5b592dbe182d057f89e30c8530cdd [0,2,0,0,0,0|2,0,0]=4 5691 B13R1.164 CC(C)NCc1ccc(cc1F)F eb8a8edcf508bf3a57003bd184938a63 [0,2,0,0,0,0|2,0,0]=4 5692 B13R1.164 CC(C)NCc1ccc(cc1F)I 460312bd2936159701d8a06f37338a6b [0,2,0,0,0,0|2,0,0]=4 5693 B13R1.164 CC(C)NCc1ccc(cc1I)Br 8fabede87db94198b10639762f8d9dea [0,2,0,0,0,0|2,0,0]=4 5694 B13R1.164 CC(C)OCc1ccc(cc1Br)Br 591134550ead1ab83d92efc9461875bc [0,2,0,0,0,0|2,0,0]=4 5695 B13R1.164 CC(C)OCc1ccc(cc1Cl)Br 2745f261c439fa6d2a25557897835ab6 [0,2,0,0,0,0|2,0,0]=4 5696 B13R1.164 CC(C)OCc1ccc(cc1Cl)Cl ddc115cea1924d3c294b15899858c97e [0,2,0,0,0,0|2,0,0]=4 5697 B13R1.164 CC(C)OCc1ccc(cc1Cl)F 803230214d55ac808e3c96526ddb7740 [0,2,0,0,0,0|2,0,0]=4 5698 B13R1.164 CC(C)OCc1ccc(cc1Cl)I 5071e3249fef705fa18a3b8e51386209 [0,2,0,0,0,0|2,0,0]=4 5699 B13R1.164 CC(C)OCc1ccc(cc1F)Cl 0b4e6c3d12151426ca2380344aef805f [0,2,0,0,0,0|2,0,0]=4 5700 B13R1.164 CC(C)OCc1ccc(cc1F)F 2b157cd9ef49364d2128c0133eed38fc [0,2,0,0,0,0|2,0,0]=4 5701 B13R1.164 CC(C)OCc1ccc(cc1F)I 2e1acdbe0ed1dd363265ec0748f5dac9 [0,2,0,0,0,0|2,0,0]=4 5702 B13R1.164 CC(C)OCc1ccc(cc1I)Br 75e06dcd981fde69dd51b473c5cd7010 [0,2,0,0,0,0|2,0,0]=4 5703 B13R1.164 CC(C)OCc1ccc(cc1I)Cl 9152e07f16ef0e039122c77421cd5828 [0,2,0,0,0,0|2,0,0]=4 5704 B13R1.164 CC(C)OCc1ccc(cc1I)F f939f258a8cb09b39b93010b0ace9574 [0,2,0,0,0,0|2,0,0]=4 5705 B13R1.164 CC(O)CNc1ccc(=O)[nH]c1Cl fad8da07369d13320f85f9259a8a19dc [0,2,0,0,0,0|2,0,0]=4 5706 B13R1.164 CC(O)CNc1ccc([nH]c1=S)Cl 4e5c44beb22c10e3248a8eb1fa9213e8 [0,2,0,0,0,0|2,0,0]=4 5707 B13R1.164 CC(O)CNc1ccc(cc1Br)Br 537d01cba1359e9bf9d3d271a291bd23 [0,2,0,0,0,0|1,0,0]=3 5708 B13R1.164 CC(O)CNc1ccc(cc1Br)Cl 5b7421bdf64da610a68427ffeb7f21a8 [0,2,0,0,0,0|1,0,0]=3 5709 B13R1.164 CC(O)CNc1ccc(cc1Br)F 05ae38d845ef862270e79821352c78d4 [0,2,0,0,0,0|1,0,0]=3 5710 B13R1.164 CC(O)CNc1ccc(cc1Br)I 19e57b3b22ad68af3aae7f1ac9b0b02e [0,2,0,0,0,0|1,0,0]=3 5711 B13R1.164 CC(O)CNc1ccc(cc1Cl)Br ccc8ccb8fdb92031aa69552c0f9ab259 [0,2,0,0,0,0|1,0,0]=3 5712 B13R1.164 CC(O)CNc1ccc(cc1Cl)Cl 0612b3dbacf933bf85e4e4724aa9fd8d [0,2,0,0,0,0|1,0,0]=3 5713 B13R1.164 CC(O)CNc1ccc(cc1Cl)F e09c6af9c0d91daf6c340bd502c1b4fe [0,2,0,0,0,0|1,0,0]=3 5714 B13R1.164 CC(O)CNc1ccc(cc1Cl)I 4a91e8829c7f46d38df5041ed56d95f2 [0,2,0,0,0,0|1,0,0]=3 5715 B13R1.164 CC(O)CNc1ccc(cc1F)Br 44618a41e25400ae310c6777096225c6 [0,2,0,0,0,0|1,0,0]=3 5716 B13R1.164 CC(O)CNc1ccc(cc1F)Cl 9a40695715a431b48c77886fc4d23466 [0,2,0,0,0,0|1,0,0]=3 5717 B13R1.164 CC(O)CNc1ccc(cc1F)F d702727832133932137b9b0387013d68 [0,2,0,0,0,0|1,0,0]=3 5718 B13R1.164 CC(O)CNc1ccc(cc1F)I 2627c2d16841f6dd83f9e26dff990d4e [0,2,0,0,0,0|1,0,0]=3 5719 B13R1.164 CC(O)CNc1ccc(cc1F)S 02ec3b00ba6b6b3c279f35864610c93a [0,2,0,0,0,0|1,0,0]=3 5720 B13R1.164 CC(O)CNc1ccc(cc1I)Br 8c957c7e0329e5f6066a6dcd60f48b72 [0,2,0,0,0,0|1,0,0]=3 5721 B13R1.164 CC(O)CNc1ccc(cc1I)Cl 0f317cbc2b77b0a0006ed05ab5885365 [0,2,0,0,0,0|1,0,0]=3 5722 B13R1.164 CC(O)CNc1ccc(cc1I)F a2181faa4f36cd9dd5d8b68f289ccd34 [0,2,0,0,0,0|1,0,0]=3 5723 B13R1.164 CC(O)CNc1ccc(cc1I)I 56dddfba32c969821bd88b00258d8589 [0,2,0,0,0,0|1,0,0]=3 5724 B13R1.164 CC(O)CNc1ccc(cc1N)N dc934c8b453286e32b30634d072bd22d [0,2,0,0,0,0|1,0,0]=3 5725 B13R1.164 CC(O)CNc1ccc(cc1S)Br f3cc41f1ff63d4052df2286ac28dccd3 [0,2,0,0,0,0|1,0,0]=3 5726 B13R1.164 CC(O)CNc1ccc(cc1S)Cl d4a2c188c1247977e7bffc00aad9adf5 [0,2,0,0,0,0|1,0,0]=3 5727 B13R1.164 CC(O)CNc1ccc(cc1S)F 86bf444554dee5a4b6ecd61ff3283d4c [0,2,0,0,0,0|1,0,0]=3 5728 B13R1.164 CC(O)CNc1ccc(nc1Br)Br 3735a66bcf5af70914b143dbb788a798 [0,2,0,0,0,0|2,0,0]=4 5729 B13R1.164 CC(O)CNc1ccc(nc1Br)Cl 7b4af950f56ae6ea25bc15a151226476 [0,2,0,0,0,0|2,0,0]=4 5730 B13R1.164 CC(O)CNc1ccc(nc1Br)F de9393e1157647250ec08bc592af93c2 [0,2,0,0,0,0|2,0,0]=4 5731 B13R1.164 CC(O)CNc1ccc(nc1Cl)Br f30df5ca52479492a6f68f9e7cf8447e [0,2,0,0,0,0|2,0,0]=4 5732 B13R1.164 CC(O)CNc1ccc(nc1Cl)Cl edda7b97512d04c142722cf00d1b5522 [0,2,0,0,0,0|2,0,0]=4 5733 B13R1.164 CC(O)CNc1ccc(nc1Cl)F 82eae26334326fa84998f1520c590d61 [0,2,0,0,0,0|2,0,0]=4 5734 B13R1.164 CC(O)CNc1ccc(nc1Cl)I 32ddab517ed14c27f0a93f4e9c5b51e4 [0,2,0,0,0,0|2,0,0]=4 5735 B13R1.164 CC(O)CNc1ccc(nc1F)Br 992bcc0f4e690fbbf817fb00bbc1526d [0,2,0,0,0,0|2,0,0]=4 5736 B13R1.164 CC(O)CNc1ccc(nc1F)Cl 4f12ac209f5ac4e3db0d5743a0555229 [0,2,0,0,0,0|2,0,0]=4 5737 B13R1.164 CC(O)CNc1ccc(nc1F)F e147aae8094bc51077d1bd6369dac036 [0,2,0,0,0,0|2,0,0]=4 5738 B13R1.164 CC(O)CNc1ccc(nc1F)I 1be20dc7eb10acd31522c1b0ce47eb44 [0,2,0,0,0,0|2,0,0]=4 5739 B13R1.164 CC(O)CNc1ccc(nc1I)Br f3863c6e64f2a2cc8ae76f4df5887784 [0,2,0,0,0,0|2,0,0]=4 5740 B13R1.164 CC(O)CNc1ccc(nc1I)Cl 602d4801882853f490ea4fdf285fbdc6 [0,2,0,0,0,0|2,0,0]=4 5741 B13R1.164 CC(O)CNc1ccc(nc1I)F ed4b101673e0db297ba87497f644cb01 [0,2,0,0,0,0|2,0,0]=4 5742 B13R1.164 CC(O)CNc1ccc(nc1I)I cadd9ce52b92f35017beb0f9f683bbe9 [0,2,0,0,0,0|2,0,0]=4 5743 B13R1.164 CC(O)CNc1ccc(nc1N)N 1073f31d42e6b49e18a1e0283389a932 [0,2,0,0,0,0|2,0,0]=4 5744 B13R1.164 CC(O)CNc1cnc(cc1Br)Br 81a7ddfeb8d9bc6a0b1a8640a3583e81 [0,2,0,0,0,0|2,0,0]=4 5745 B13R1.164 CC(O)CNc1cnc(cc1Br)Cl 688a78c605ef9e512f5832c2533b5408 [0,2,0,0,0,0|2,0,0]=4 5746 B13R1.164 CC(O)CNc1cnc(cc1Cl)Br 19b779ae4676178fcbd556b9dd52683e [0,2,0,0,0,0|2,0,0]=4 5747 B13R1.164 CC(O)CNc1cnc(cc1Cl)Cl b0afce62bd617677123d3a25c305d601 [0,2,0,0,0,0|2,0,0]=4 5748 B13R1.164 CC(O)CNc1cnc(cc1F)Cl be07800d999577535147c76748ec99ba [0,2,0,0,0,0|2,0,0]=4 5749 B13R1.164 CC(O)CNc1cnc(cc1F)F 4f29ab623ea3d3349fe44cd8c4ad4d15 [0,2,0,0,0,0|2,0,0]=4 5750 B13R1.164 CC(O)CNc1cnc(cc1I)Br 0f3344fa93aaa126507f8e562b4d338a [0,2,0,0,0,0|2,0,0]=4 5751 B13R1.164 CC(O)CNc1cnc(cc1I)Cl 6be69478da8ab751329dcc74ffc85d5d [0,2,0,0,0,0|2,0,0]=4 5752 B13R1.164 CC(O)CNc1cnc(cc1N)N 6313b40018fb841eb6b4ae4992cacb44 [0,2,0,0,0,0|2,0,0]=4 5753 B13R1.164 CC(O)CNc1ncc(cc1Br)Br 72b5db12174f4b4c2c232627867276ed [0,2,0,0,0,0|2,0,0]=4 5754 B13R1.164 CC(O)CNc1ncc(cc1Br)Cl 068ce6e0f4c61188179f8eb95929c34b [0,2,0,0,0,0|2,0,0]=4 5755 B13R1.164 CC(O)CNc1ncc(cc1Br)F b1262059ff2a5665f4d408bf8483cffb [0,2,0,0,0,0|2,0,0]=4 5756 B13R1.164 CC(O)CNc1ncc(cc1Br)I a9a30e21d0bb856b7ca78b6cf7066c64 [0,2,0,0,0,0|2,0,0]=4 5757 B13R1.164 CC(O)CNc1ncc(cc1Cl)Br d335265d465d1502c9b21ce9dd6ad0e8 [0,2,0,0,0,0|2,0,0]=4 5758 B13R1.164 CC(O)CNc1ncc(cc1Cl)Cl ed973d5335dd1172d63b583d8f84e757 [0,2,0,0,0,0|2,0,0]=4 5759 B13R1.164 CC(O)CNc1ncc(cc1Cl)F 85cf371c31eba53eb23127963624988c [0,2,0,0,0,0|2,0,0]=4 5760 B13R1.164 CC(O)CNc1ncc(cc1Cl)I 195f764c9c5b7f43e61428bd52cdc03c [0,2,0,0,0,0|2,0,0]=4 5761 B13R1.164 CC(O)CNc1ncc(cc1F)Br e7395dbee1e31180ae6257750ab18d1b [0,2,0,0,0,0|2,0,0]=4 5762 B13R1.164 CC(O)CNc1ncc(cc1F)Cl 689e85470f8afa3dad1ff4b3d93460ea [0,2,0,0,0,0|2,0,0]=4 5763 B13R1.164 CC(O)CNc1ncc(cc1F)F ed0781733a704af316f6120295daaee2 [0,2,0,0,0,0|2,0,0]=4 5764 B13R1.164 CC(O)CNc1ncc(cc1F)I 036f2ffac2e468c0428206c6891879ec [0,2,0,0,0,0|2,0,0]=4 5765 B13R1.164 CC(O)CNc1ncc(cc1I)Br dced74c7db3ddfb469c4e585d1bceabd [0,2,0,0,0,0|2,0,0]=4 5766 B13R1.164 CC(O)CNc1ncc(cc1I)Cl b5f3bcce05e017f0a0a7d4270ae84600 [0,2,0,0,0,0|2,0,0]=4 5767 B13R1.164 CC(O)CNc1ncc(cc1I)F b348ec49acab92ecdbd062cd81d1352a [0,2,0,0,0,0|2,0,0]=4 5768 B13R1.164 CC(O)CNc1ncc(cc1I)I a6c8f63068092bc1678a6bf56a22d982 [0,2,0,0,0,0|2,0,0]=4 5769 B13R1.164 CC(O)CNc1ncc(cc1N)N b8234605f0ab5ddf75fef0c17bd8259b [0,2,0,0,0,0|2,0,0]=4 5770 B13R1.164 C[C@@H](O)CNc1ccc([nH]c1=S)Cl 1b39452b5444ef18faca717da47a413a [0,2,0,0,0,0|2,0,0]=4 5771 B13R1.164 C[C@@H](O)CNc1ccc(cc1Cl)Cl 43f325b364907b9e87836a650d951061 [0,2,0,0,0,0|1,0,0]=3 5772 B13R1.164 C[C@@H](O)CNc1ccc(cc1Cl)F 43bc0bf33d8c6030be9258ff204bdaf7 [0,2,0,0,0,0|1,0,0]=3 5773 B13R1.164 C[C@@H](O)CNc1ccc(cc1Cl)I 53f497374d352bf47bb4182e4f0e7259 [0,2,0,0,0,0|1,0,0]=3 5774 B13R1.164 C[C@@H](O)CNc1ccc(cc1F)I 6690f7a21b54a0685725a213f29fefc8 [0,2,0,0,0,0|1,0,0]=3 5775 B13R1.164 C[C@@H](O)CNc1ccc(cc1I)Br eed9f1e4c747b724dc2ce73edef40010 [0,2,0,0,0,0|1,0,0]=3 5776 B13R1.164 C[C@@H](O)CNc1ccc(cc1I)Cl c7fc6f1c4337c5c1ad4ae2da5f622f24 [0,2,0,0,0,0|1,0,0]=3 5777 B13R1.164 C[C@@H](O)CNc1ccc(cc1I)F 8c007204638d41a010f9cb827e98a3de [0,2,0,0,0,0|1,0,0]=3 5778 B13R1.164 C[C@@H](O)CNc1ccc(cc1I)I 8b2291fcd79d571a3559d0c322e0d79b [0,2,0,0,0,0|1,0,0]=3 5779 B13R1.164 C[C@@H](O)CNc1ccc(cc1N)N 7d3f25900212a870a07e15a94b196539 [0,2,0,0,0,0|1,0,0]=3 5780 B13R1.164 C[C@@H](O)CNc1ccc(nc1Br)Br 3d577faa6e294ea2146a90981eacd5a4 [0,2,0,0,0,0|2,0,0]=4 5781 B13R1.164 C[C@@H](O)CNc1ccc(nc1N)N 173827db6b2814266e71d11afaf9b86c [0,2,0,0,0,0|2,0,0]=4 5782 B13R1.164 C[C@@H](O)CNc1cnc(cc1Cl)Br 6f52f39e7f31e06cccbb277057cb4a1c [0,2,0,0,0,0|2,0,0]=4 5783 B13R1.164 C[C@@H](O)CNc1cnc(cc1N)N 3e2e41de2a1399f860dcfb05328232be [0,2,0,0,0,0|2,0,0]=4 5784 B13R1.164 C[C@@H](O)CNc1ncc(cc1Cl)I 9d54f8fdffe070325160e7554633e49c [0,2,0,0,0,0|2,0,0]=4 5785 B13R1.164 C[C@@H](O)CNc1ncc(cc1F)Br 29961e3e9e206d95dbe89548c0851287 [0,2,0,0,0,0|2,0,0]=4 5786 B13R1.164 C[C@@H](O)CNc1ncc(cc1F)Cl 9e9150c7ff14b1dc5fdc3bef2e9c2e24 [0,2,0,0,0,0|2,0,0]=4 5787 B13R1.164 C[C@@H](O)CNc1ncc(cc1F)F e5ee3f0f591a3108b55977ca1bf2e3ca [0,2,0,0,0,0|2,0,0]=4 5788 B13R1.164 C[C@@H](O)CNc1ncc(cc1F)I 1b1ae3d866a966aa71f2b5212d14251d [0,2,0,0,0,0|2,0,0]=4 5789 B13R1.164 C[C@@H](O)CNc1ncc(cc1I)Br 83051d3c4220a8070640a99336abac33 [0,2,0,0,0,0|2,0,0]=4 5790 B13R1.164 C[C@@H](O)CNc1ncc(cc1I)Cl 6144a5a2a50c0084e2665387d58fda5d [0,2,0,0,0,0|2,0,0]=4 5791 B13R1.164 C[C@@H](O)CNc1ncc(cc1I)F 85ba7811fd2986fb676b0169add233f0 [0,2,0,0,0,0|2,0,0]=4 5792 B13R1.164 C[C@@H](O)CNc1ncc(cc1I)I 5f9c5829f2cc5c68acbfefe99ac3fa01 [0,2,0,0,0,0|2,0,0]=4 5793 B13R1.164 C[C@@H](O)CNc1ncc(cc1N)N 0586e0589fcda4c213056e092afcb799 [0,2,0,0,0,0|2,0,0]=4 5794 B13R1.164 C[C@H](O)CNc1ccc(=O)[nH]c1Cl 02e3d8d2eaafe8da250718a65d74fc05 [0,2,0,0,0,0|2,0,0]=4 5795 B13R1.164 C[C@H](O)CNc1ccc([nH]c1=S)Cl 4b19bec847de08bbe44cc4b1a653715f [0,2,0,0,0,0|2,0,0]=4 5796 B13R1.164 C[C@H](O)CNc1ccc(cc1Br)Br 0cde2facd77aeeff5c2031baaacd2e80 [0,2,0,0,0,0|1,0,0]=3 5797 B13R1.164 C[C@H](O)CNc1ccc(cc1Br)Cl fe2cf06dee8ac615d0f954f02eb8d598 [0,2,0,0,0,0|1,0,0]=3 5798 B13R1.164 C[C@H](O)CNc1ccc(cc1Br)F af7f34e9b039ff11ffb5e5e8a5982608 [0,2,0,0,0,0|1,0,0]=3 5799 B13R1.164 C[C@H](O)CNc1ccc(cc1Br)I 013e2442eb2e3bf2bab8fcbc42071c31 [0,2,0,0,0,0|1,0,0]=3 5800 B13R1.164 C[C@H](O)CNc1ccc(cc1Cl)Br bf8e3fd78f673d83c0e6e68b7adbf993 [0,2,0,0,0,0|1,0,0]=3 5801 B13R1.164 C[C@H](O)CNc1ccc(cc1Cl)Cl fa0592031c1cfcca9705ad3c62beaf17 [0,2,0,0,0,0|1,0,0]=3 5802 B13R1.164 C[C@H](O)CNc1ccc(cc1Cl)F 061b797e77aca98a2d15f4ebdcbdf308 [0,2,0,0,0,0|1,0,0]=3 5803 B13R1.164 C[C@H](O)CNc1ccc(cc1Cl)I 6f311a19c7aad2d4bb5ef304039bd279 [0,2,0,0,0,0|1,0,0]=3 5804 B13R1.164 C[C@H](O)CNc1ccc(cc1F)Br 25f30e30afd6e05f25a141fb86317030 [0,2,0,0,0,0|1,0,0]=3 5805 B13R1.164 C[C@H](O)CNc1ccc(cc1F)Cl 52399708d22955b0af06762a268bdc3f [0,2,0,0,0,0|1,0,0]=3 5806 B13R1.164 C[C@H](O)CNc1ccc(cc1F)F 3512d982ca7397bbdf0bea592b94a744 [0,2,0,0,0,0|1,0,0]=3 5807 B13R1.164 C[C@H](O)CNc1ccc(cc1F)I 43d12d7e39d920338c7678676a5a72c2 [0,2,0,0,0,0|1,0,0]=3 5808 B13R1.164 C[C@H](O)CNc1ccc(cc1F)S 8a9ea9f59abb9f13d9b2b7b93ad15664 [0,2,0,0,0,0|1,0,0]=3 5809 B13R1.164 C[C@H](O)CNc1ccc(cc1I)Br 3567a3619db4f068600ba1cb252e4124 [0,2,0,0,0,0|1,0,0]=3 5810 B13R1.164 C[C@H](O)CNc1ccc(cc1I)Cl 94062b823dca5e331da566eb86cf9b6a [0,2,0,0,0,0|1,0,0]=3 5811 B13R1.164 C[C@H](O)CNc1ccc(cc1I)F bf5b5205fc7301b2c910384ff46295e0 [0,2,0,0,0,0|1,0,0]=3 5812 B13R1.164 C[C@H](O)CNc1ccc(cc1I)I 744dbd3cd3934cbb1bccdf9a0b2fbc05 [0,2,0,0,0,0|1,0,0]=3 5813 B13R1.164 C[C@H](O)CNc1ccc(cc1N)N 9dec14b19ef55e2ad6076f76d34f2553 [0,2,0,0,0,0|1,0,0]=3 5814 B13R1.164 C[C@H](O)CNc1ccc(cc1S)Br 732097c85f08d76d38d335c6cc3faf61 [0,2,0,0,0,0|1,0,0]=3 5815 B13R1.164 C[C@H](O)CNc1ccc(cc1S)Cl 0da5c7f543c1ad2fb0e99b53e415ab8c [0,2,0,0,0,0|1,0,0]=3 5816 B13R1.164 C[C@H](O)CNc1ccc(cc1S)F cf810ccc493653e64b250ecac503f8a7 [0,2,0,0,0,0|1,0,0]=3 5817 B13R1.164 C[C@H](O)CNc1ccc(nc1Br)Br ac525bee7c2a90558f6f68e1f501dfe6 [0,2,0,0,0,0|2,0,0]=4 5818 B13R1.164 C[C@H](O)CNc1ccc(nc1Br)Cl d0f04aabbb4460b0acad1bbc9b7a3d28 [0,2,0,0,0,0|2,0,0]=4 5819 B13R1.164 C[C@H](O)CNc1ccc(nc1Br)F 2d0cabd58e90e8a5f9ab0c6c9acdc522 [0,2,0,0,0,0|2,0,0]=4 5820 B13R1.164 C[C@H](O)CNc1ccc(nc1Cl)Br 199205b0fa8aea1b18fb7b7fa888abdf [0,2,0,0,0,0|2,0,0]=4 5821 B13R1.164 C[C@H](O)CNc1ccc(nc1Cl)Cl 20e5bdb13755a38c59eec68011cfd9f0 [0,2,0,0,0,0|2,0,0]=4 5822 B13R1.164 C[C@H](O)CNc1ccc(nc1Cl)F 9e93e7685f727ddaadbd87ace74a1d2d [0,2,0,0,0,0|2,0,0]=4 5823 B13R1.164 C[C@H](O)CNc1ccc(nc1Cl)I 12ce655038de77971ea956c04e176af1 [0,2,0,0,0,0|2,0,0]=4 5824 B13R1.164 C[C@H](O)CNc1ccc(nc1F)Br f1edcc959b0049a8ad3da4ebfc87ad86 [0,2,0,0,0,0|2,0,0]=4 5825 B13R1.164 C[C@H](O)CNc1ccc(nc1F)Cl 82ea5e28e953c19a006afe2e2a805314 [0,2,0,0,0,0|2,0,0]=4 5826 B13R1.164 C[C@H](O)CNc1ccc(nc1F)F e5b90e313d104e79077608db9c6d706b [0,2,0,0,0,0|2,0,0]=4 5827 B13R1.164 C[C@H](O)CNc1ccc(nc1F)I 3848af05cd91fe32336c7171fe4d57aa [0,2,0,0,0,0|2,0,0]=4 5828 B13R1.164 C[C@H](O)CNc1ccc(nc1I)Br 83ee368d9cd6f3493a534e115a33ab03 [0,2,0,0,0,0|2,0,0]=4 5829 B13R1.164 C[C@H](O)CNc1ccc(nc1I)Cl 36756a003b969bd039bf8129a2972e76 [0,2,0,0,0,0|2,0,0]=4 5830 B13R1.164 C[C@H](O)CNc1ccc(nc1I)F b3fdb9498fc2e4c5cba4601f07ed0920 [0,2,0,0,0,0|2,0,0]=4 5831 B13R1.164 C[C@H](O)CNc1ccc(nc1I)I a29c15690a896629e82348fa57956d56 [0,2,0,0,0,0|2,0,0]=4 5832 B13R1.164 C[C@H](O)CNc1ccc(nc1N)N 64e2bb84bf7be2834d7734528b75ba2f [0,2,0,0,0,0|2,0,0]=4 5833 B13R1.164 C[C@H](O)CNc1cnc(cc1Br)Br 42cde2053c4ddd343b3d3e6a9abf7c37 [0,2,0,0,0,0|2,0,0]=4 5834 B13R1.164 C[C@H](O)CNc1cnc(cc1Br)Cl d3b4a68aa1927ca591870a2c368481a0 [0,2,0,0,0,0|2,0,0]=4 5835 B13R1.164 C[C@H](O)CNc1cnc(cc1Cl)Br 428c221f7bf56237de14a2d0d35e249d [0,2,0,0,0,0|2,0,0]=4 5836 B13R1.164 C[C@H](O)CNc1cnc(cc1Cl)Cl 38a319544211c3ae92834bc9332df259 [0,2,0,0,0,0|2,0,0]=4 5837 B13R1.164 C[C@H](O)CNc1cnc(cc1F)Cl 23757d1e06d335c2ef7797a6cd33ec95 [0,2,0,0,0,0|2,0,0]=4 5838 B13R1.164 C[C@H](O)CNc1cnc(cc1F)F 89660983c61f0c0987a7ee24ec1e03e5 [0,2,0,0,0,0|2,0,0]=4 5839 B13R1.164 C[C@H](O)CNc1cnc(cc1I)Br a0fd0db9f43ebdfe7d549b570d05e1f7 [0,2,0,0,0,0|2,0,0]=4 5840 B13R1.164 C[C@H](O)CNc1cnc(cc1I)Cl b3bde005ee167e3cad34bec20674e28a [0,2,0,0,0,0|2,0,0]=4 5841 B13R1.164 C[C@H](O)CNc1cnc(cc1N)N d3eb7c29c31f065b59614e5adb66e446 [0,2,0,0,0,0|2,0,0]=4 5842 B13R1.164 C[C@H](O)CNc1ncc(cc1Br)Br 7111b716ac48966b840e36eda7b6bf78 [0,2,0,0,0,0|2,0,0]=4 5843 B13R1.164 C[C@H](O)CNc1ncc(cc1Br)Cl a8ba1de9574b06eb645c3f3089ecb551 [0,2,0,0,0,0|2,0,0]=4 5844 B13R1.164 C[C@H](O)CNc1ncc(cc1Br)F 3ad286ad154638eea05ad37417583aec [0,2,0,0,0,0|2,0,0]=4 5845 B13R1.164 C[C@H](O)CNc1ncc(cc1Br)I ce7bf54815c9e0c1c714fa856df5b785 [0,2,0,0,0,0|2,0,0]=4 5846 B13R1.164 C[C@H](O)CNc1ncc(cc1Cl)Br 7326fbbd6abe2d0ac06f67430e2c48da [0,2,0,0,0,0|2,0,0]=4 5847 B13R1.164 C[C@H](O)CNc1ncc(cc1Cl)Cl 19f48aa66a73a01ad07dee1a4a77518c [0,2,0,0,0,0|2,0,0]=4 5848 B13R1.164 C[C@H](O)CNc1ncc(cc1Cl)F 88ab6f13ab649223f99adbcbe4053691 [0,2,0,0,0,0|2,0,0]=4 5849 B13R1.164 C[C@H](O)CNc1ncc(cc1Cl)I 31f719ba0a4b77985c7547f7e2baa7ec [0,2,0,0,0,0|2,0,0]=4 5850 B13R1.164 C[C@H](O)CNc1ncc(cc1F)Br 374c0a49cf1b6e195a2fe4a35ca58889 [0,2,0,0,0,0|2,0,0]=4 5851 B13R1.164 C[C@H](O)CNc1ncc(cc1F)Cl f7b6a74889e7d8044f9030e46f0976ad [0,2,0,0,0,0|2,0,0]=4 5852 B13R1.164 C[C@H](O)CNc1ncc(cc1F)F c79b8faa6ce9582e90717998af8df9a2 [0,2,0,0,0,0|2,0,0]=4 5853 B13R1.164 C[C@H](O)CNc1ncc(cc1F)I 340e3d1b2c2f1e0ca319ee9901acf775 [0,2,0,0,0,0|2,0,0]=4 5854 B13R1.164 C[C@H](O)CNc1ncc(cc1I)Br f70c398e05a1ea5e2acdefcc57f34f04 [0,2,0,0,0,0|2,0,0]=4 5855 B13R1.164 C[C@H](O)CNc1ncc(cc1I)Cl 5bdb17c4a9d6f837333a1f4f47e1bdeb [0,2,0,0,0,0|2,0,0]=4 5856 B13R1.164 C[C@H](O)CNc1ncc(cc1I)F 8267c5ee89c2d6699473d08340e5e010 [0,2,0,0,0,0|2,0,0]=4 5857 B13R1.164 C[C@H](O)CNc1ncc(cc1I)I 2521e81c3d323971bee0f5a8d62e7a46 [0,2,0,0,0,0|2,0,0]=4 5858 B13R1.164 C[C@H](O)CNc1ncc(cc1N)N 3a72106857577cad1286630da609e2f6 [0,2,0,0,0,0|2,0,0]=4 5859 B13R1.164 Cc1cc(c(cn1)NCC(C)O)Br 20cafe23c10d586b02ad99563e0a222a [0,2,0,0,0,0|2,0,0]=4 5860 B13R1.164 Cc1cc(c(cn1)NCC(C)O)C a58be4dc026585049e6e0188e887fdc8 [0,2,0,0,0,0|2,0,0]=4 5861 B13R1.164 Cc1cc(c(cn1)NCC(C)O)Cl 06a1932ed84085ec1d849a581c008575 [0,2,0,0,0,0|2,0,0]=4 5862 B13R1.164 Cc1cc(c(cn1)NC[C@H](C)O)Br 1019a2e0ae98e9db2c3cddf7ee4004cb [0,2,0,0,0,0|2,0,0]=4 5863 B13R1.164 Cc1cc(c(cn1)NC[C@H](C)O)C 49c750b5cbc34996397d140b3dff6bdc [0,2,0,0,0,0|2,0,0]=4 5864 B13R1.164 Cc1cc(c(cn1)NC[C@H](C)O)Cl 2b73cf172054123f9345c3d6c71946b2 [0,2,0,0,0,0|2,0,0]=4 5865 B13R1.164 Cc1cc(ccc1CNC(C)C)Br fe7a68571fc8971c819ead47c8e68b8c [0,2,0,0,0,0|2,0,0]=4 5866 B13R1.164 Cc1cc(ccc1CNC(C)C)Cl 3b91144f1804199e4980b59d5b20d1dd [0,2,0,0,0,0|2,0,0]=4 5867 B13R1.164 Cc1cc(ccc1CNC(C)C)F ecb8b667636deb07862a07ed43c858e0 [0,2,0,0,0,0|2,0,0]=4 5868 B13R1.164 Cc1cc(ccc1COC(C)C)Br 2ee9af8f35577d5196f6cf263572507a [0,2,0,0,0,0|2,0,0]=4 5869 B13R1.164 Cc1cc(ccc1COC(C)C)Cl d20887331bb47e7c01426a16bf18b59c [0,2,0,0,0,0|2,0,0]=4 5870 B13R1.164 Cc1cc(ccc1COC(C)C)F b9ae6149766e8911a807269d50ab45b8 [0,2,0,0,0,0|2,0,0]=4 5871 B13R1.164 Cc1cc(ccc1COC(C)C)I 7d37ae3c2413facacb29df2558c078bf [0,2,0,0,0,0|2,0,0]=4 5872 B13R1.164 Cc1cc(ccc1NCC(C)C)Br e0e6a97fa487fcdacbaf3bb309519b02 [0,2,0,0,0,0|2,0,0]=4 5873 B13R1.164 Cc1cc(ccc1NCC(C)C)Cl c21870426802f1e9cf495eee36411804 [0,2,0,0,0,0|2,0,0]=4 5874 B13R1.164 Cc1cc(ccc1NCC(C)C)F bf6564cbe4dae811fdfb0662bbf74d3f [0,2,0,0,0,0|2,0,0]=4 5875 B13R1.164 Cc1cc(ccc1NCC(C)C)I 42fdcae7ce9d7a40fd7bcfabc5dd6748 [0,2,0,0,0,0|2,0,0]=4 5876 B13R1.164 Cc1cc(ccc1NCC(C)O)Br 40349ad53d5ce39248bf5801bb3d782e [0,2,0,0,0,0|1,0,0]=3 5877 B13R1.164 Cc1cc(ccc1NCC(C)O)Cl 86163d8b85ccb6cf51d2e1f30d8d44eb [0,2,0,0,0,0|1,0,0]=3 5878 B13R1.164 Cc1cc(ccc1NCC(C)O)F 7d4370ae62e6b9528ceb180cc4656779 [0,2,0,0,0,0|1,0,0]=3 5879 B13R1.164 Cc1cc(ccc1NCC(C)O)I c8d4f812c8883ba1ded3ecc6b9a068b8 [0,2,0,0,0,0|1,0,0]=3 5880 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)I f619fbf0d9ca9929529d9c768668ffd9 [0,2,0,0,0,0|1,0,0]=3 5881 B13R1.164 Cc1cc(ccc1NC[C@H](C)O)Br f60e1658103bac472bdbe85a93336a10 [0,2,0,0,0,0|1,0,0]=3 5882 B13R1.164 Cc1cc(ccc1NC[C@H](C)O)Cl 5762f805ae2f07a550b9aa458a4dac55 [0,2,0,0,0,0|1,0,0]=3 5883 B13R1.164 Cc1cc(ccc1NC[C@H](C)O)F 60798564a0f5d8d5dcd31beaa67f7eff [0,2,0,0,0,0|1,0,0]=3 5884 B13R1.164 Cc1cc(ccc1NC[C@H](C)O)I d9b747e6838fa96a3e888f149fba0a11 [0,2,0,0,0,0|1,0,0]=3 5885 B13R1.164 Cc1cc(ccc1OCC(C)C)Br 7239ec7de740e6404ef579f423ff2acd [0,2,0,0,0,0|2,0,0]=4 5886 B13R1.164 Cc1cc(ccc1OCC(C)C)Cl bad59fb32d1ea8e8e0ee1a2b4cb5bba2 [0,2,0,0,0,0|2,0,0]=4 5887 B13R1.164 Cc1cc(ccc1OCC(C)C)F 3d79cc1359f1a3ac40d74ec35bcdc9e7 [0,2,0,0,0,0|2,0,0]=4 5888 B13R1.164 Cc1cc(ccc1OCC(C)C)I 04a48bb8688d5bed9137e4e9e34793f3 [0,2,0,0,0,0|2,0,0]=4 5889 B13R1.164 Cc1cc(ccc1OCC(C)C)S 54759a0f53a45491fbf40eaf26196014 [0,2,0,0,0,0|2,0,0]=4 5890 B13R1.164 Cc1cc(cnc1NCC(C)O)Br 6e233da69ccfd38348b8124d6cc9c46f [0,2,0,0,0,0|2,0,0]=4 5891 B13R1.164 Cc1cc(cnc1NCC(C)O)Cl e8c43b864b84c1b0f597fd5d2cc26f64 [0,2,0,0,0,0|2,0,0]=4 5892 B13R1.164 Cc1cc(cnc1NCC(C)O)F 64ec20806df6655af39dfc9c0bc9e486 [0,2,0,0,0,0|2,0,0]=4 5893 B13R1.164 Cc1cc(cnc1NCC(C)O)I 84e8392544c2c03eef7daf5083faf7c8 [0,2,0,0,0,0|2,0,0]=4 5894 B13R1.164 Cc1cc(cnc1NC[C@@H](C)O)Br 29731bb8a17f9e179ab7e7729b3e2c30 [0,2,0,0,0,0|2,0,0]=4 5895 B13R1.164 Cc1cc(cnc1NC[C@@H](C)O)Cl fdd41f474a1d787e3bc10bf112f356b1 [0,2,0,0,0,0|2,0,0]=4 5896 B13R1.164 Cc1cc(cnc1NC[C@@H](C)O)F cf7aee2fc368decca38a5209997abb5d [0,2,0,0,0,0|2,0,0]=4 5897 B13R1.164 Cc1cc(cnc1NC[C@@H](C)O)I df774eab5a7dd3611bae5b1c92c4665e [0,2,0,0,0,0|2,0,0]=4 5898 B13R1.164 Cc1cc(cnc1NC[C@H](C)O)Br ff12733a1dd44e37a2e0e33114005d09 [0,2,0,0,0,0|2,0,0]=4 5899 B13R1.164 Cc1cc(cnc1NC[C@H](C)O)Cl 64b496d9ef7a4333d17263e84f0460cb [0,2,0,0,0,0|2,0,0]=4 5900 B13R1.164 Cc1cc(cnc1NC[C@H](C)O)F e95b0b98a19fccec5c9b1f18140c4508 [0,2,0,0,0,0|2,0,0]=4 5901 B13R1.164 Cc1cc(cnc1NC[C@H](C)O)I d36687245d36e579501155adb7a5c623 [0,2,0,0,0,0|2,0,0]=4 5902 B13R1.164 Cc1cc(ncc1NCC(C)O)Br be56b0621b53136742c322c366db9da7 [0,2,0,0,0,0|2,0,0]=4 5903 B13R1.164 Cc1cc(ncc1NCC(C)O)Cl 3171f5c4334bd6e465df1b0deb50955c [0,2,0,0,0,0|2,0,0]=4 5904 B13R1.164 Cc1cc(ncc1NCC(C)O)F d8e6e83b255d431f84e55fe76f17cf07 [0,2,0,0,0,0|2,0,0]=4 5905 B13R1.164 Cc1cc(ncc1NC[C@H](C)O)Br 4ffe8099c6f1b0d142fadce8360e1291 [0,2,0,0,0,0|2,0,0]=4 5906 B13R1.164 Cc1cc(ncc1NC[C@H](C)O)Cl 462fb5be68af541e7824ddbe8224c9f2 [0,2,0,0,0,0|2,0,0]=4 5907 B13R1.164 Cc1cc(ncc1NC[C@H](C)O)F ac583a5bd649bad036f019982be977c8 [0,2,0,0,0,0|2,0,0]=4 5908 B13R1.164 Cc1ccc(c(c1)Br)NCC(C)C 50e65c4db1302e5bb9c6a2bbff5ced31 [0,2,0,0,0,0|2,0,0]=4 5909 B13R1.164 Cc1ccc(c(c1)Br)NCC(C)O 5d13b7b9477203b60ab45ac65ec0870c [0,2,0,0,0,0|1,0,0]=3 5910 B13R1.164 Cc1ccc(c(c1)Br)NC[C@H](C)O 733a0e5b63494af3a6b5c44c116126cc [0,2,0,0,0,0|1,0,0]=3 5911 B13R1.164 Cc1ccc(c(c1)Br)OCC(C)C 8b618d3aaa5beb87daf9a30bdba418d1 [0,2,0,0,0,0|2,0,0]=4 5912 B13R1.164 Cc1ccc(c(c1)C)CNC(C)C a1ebe023d1fcfd756088c901ad5c2904 [0,2,0,0,0,0|2,0,0]=4 5913 B13R1.164 Cc1ccc(c(c1)C)COC(C)C bff0300b652b9b6ed44d0e4e4e3e998a [0,2,0,0,0,0|2,0,0]=4 5914 B13R1.164 Cc1ccc(c(c1)C)NCC(C)C def689b1c218af740e06182fc3f688b3 [0,2,0,0,0,0|2,0,0]=4 5915 B13R1.164 Cc1ccc(c(c1)C)NCC(C)O 0dc0d57074d52a94024eadb734e85a66 [0,2,0,0,0,0|1,0,0]=3 5916 B13R1.164 Cc1ccc(c(c1)C)NC[C@H](C)O 85a0b759b03a54e5998df839275ae9cc [0,2,0,0,0,0|1,0,0]=3 5917 B13R1.164 Cc1ccc(c(c1)C)OCC(C)C e68331e833d6b3c60c00dc486e5a7418 [0,2,0,0,0,0|2,0,0]=4 5918 B13R1.164 Cc1ccc(c(c1)Cl)CNC(C)C 6764b642f69335bd4c5bcab23654b192 [0,2,0,0,0,0|2,0,0]=4 5919 B13R1.164 Cc1ccc(c(c1)Cl)COC(C)C fc7e3b88f67efda8d9678207fe08c67a [0,2,0,0,0,0|2,0,0]=4 5920 B13R1.164 Cc1ccc(c(c1)Cl)NCC(C)C 8d6c672a62591ff839a20abd2fa3f03e [0,2,0,0,0,0|2,0,0]=4 5921 B13R1.164 Cc1ccc(c(c1)Cl)NCC(C)O 5daf81bae56598109f832581d08e8c98 [0,2,0,0,0,0|1,0,0]=3 5922 B13R1.164 Cc1ccc(c(c1)Cl)NC[C@H](C)O a15592c6d44028e5f497382957269241 [0,2,0,0,0,0|1,0,0]=3 5923 B13R1.164 Cc1ccc(c(c1)Cl)OCC(C)C 9d82324e0a63eaeba9beb63975dfb337 [0,2,0,0,0,0|2,0,0]=4 5924 B13R1.164 Cc1ccc(c(c1)F)NCC(C)C 58b0505ca3b16799a83d55e6e050a414 [0,2,0,0,0,0|2,0,0]=4 5925 B13R1.164 Cc1ccc(c(c1)F)NCC(C)O 62d17bbaf22a85374ccc026409144d4a [0,2,0,0,0,0|1,0,0]=3 5926 B13R1.164 Cc1ccc(c(c1)F)NC[C@H](C)O 29103758cd25db1181ebe63c8e5455bd [0,2,0,0,0,0|1,0,0]=3 5927 B13R1.164 Cc1ccc(c(c1)F)OCC(C)C 186ea6a1f1045e7b8d727fa7b6035ba9 [0,2,0,0,0,0|2,0,0]=4 5928 B13R1.164 Cc1ccc(c(c1)I)COC(C)C 4b5320994f0dff5604bdb3346b457a25 [0,2,0,0,0,0|2,0,0]=4 5929 B13R1.164 Cc1ccc(c(c1)I)NCC(C)C 56101336dec4873dbf20a4e09053a6af [0,2,0,0,0,0|2,0,0]=4 5930 B13R1.164 Cc1ccc(c(c1)I)NCC(C)O dbf44c021b3fc0740d071c18e10ad4d4 [0,2,0,0,0,0|1,0,0]=3 5931 B13R1.164 Cc1ccc(c(c1)I)NC[C@H](C)O 31743a501ad1f83f71e7b785ec462605 [0,2,0,0,0,0|1,0,0]=3 5932 B13R1.164 Cc1ccc(c(c1)I)OCC(C)C 1f81ef0305811aa3f379151cb4cd4e95 [0,2,0,0,0,0|2,0,0]=4 5933 B13R1.164 Cc1ccc(c(c1)S)NCC(C)C 0c6eab31475fa89bc7e771f381691462 [0,2,0,0,0,0|2,0,0]=4 5934 B13R1.164 Cc1ccc(c(c1)S)NCC(C)O 67a4d6f4ced3ed709b44e29e2da08e77 [0,2,0,0,0,0|1,0,0]=3 5935 B13R1.164 Cc1ccc(c(c1)S)NC[C@H](C)O 407ed0a322f3a34f01f5a2bcf71d9fd9 [0,2,0,0,0,0|1,0,0]=3 5936 B13R1.164 Cc1ccc(c(n1)Br)NCC(C)O d32fb1822df28258e5dc517346b33fde [0,2,0,0,0,0|2,0,0]=4 5937 B13R1.164 Cc1ccc(c(n1)Br)NC[C@@H](C)O a36110d30d13db3030222aef5edfbe8d [0,2,0,0,0,0|2,0,0]=4 5938 B13R1.164 Cc1ccc(c(n1)Br)NC[C@H](C)O 66569a91cf21e2cf26834ea0130a9787 [0,2,0,0,0,0|2,0,0]=4 5939 B13R1.164 Cc1ccc(c(n1)C)NCC(C)O 42e60c8ab53d98e525febe66be5255a0 [0,2,0,0,0,0|2,0,0]=4 5940 B13R1.164 Cc1ccc(c(n1)C)NC[C@H](C)O 18d9278d056da10338b59fb228626300 [0,2,0,0,0,0|2,0,0]=4 5941 B13R1.164 Cc1ccc(c(n1)Cl)NCC(C)O 0a543f8bacb6abcdaf695fc4a8765aab [0,2,0,0,0,0|2,0,0]=4 5942 B13R1.164 Cc1ccc(c(n1)Cl)NC[C@H](C)O 1c71e8ea1d5045248f0d34107d114e09 [0,2,0,0,0,0|2,0,0]=4 5943 B13R1.164 Cc1ccc(c(n1)F)NCC(C)O 8d19e37e8bb5deacfd07f9bba25f9985 [0,2,0,0,0,0|2,0,0]=4 5944 B13R1.164 Cc1ccc(c(n1)F)NC[C@H](C)O 42a7e6eb02897c886c6826193f6fa1ab [0,2,0,0,0,0|2,0,0]=4 5945 B13R1.164 Cc1ccc(c(n1)I)NCC(C)O 5092daa7d6b181a7dc909b96c11e0ea1 [0,2,0,0,0,0|2,0,0]=4 5946 B13R1.164 Cc1ccc(c(n1)I)NC[C@H](C)O 8e051b35cc2bdbdab9c3ad87baf8da0c [0,2,0,0,0,0|2,0,0]=4 5947 B13R1.164 Cc1cnc(c(c1)Br)NCC(C)O caa62d24102b6432d0481f26b4784e92 [0,2,0,0,0,0|2,0,0]=4 5948 B13R1.164 Cc1cnc(c(c1)Br)NC[C@H](C)O 364d548f0bbbbf22b51c6393ff3acdfc [0,2,0,0,0,0|2,0,0]=4 5949 B13R1.164 Cc1cnc(c(c1)C)NCC(C)O be985212861e57b5348d387c93c16c22 [0,2,0,0,0,0|2,0,0]=4 5950 B13R1.164 Cc1cnc(c(c1)C)NC[C@@H](C)O d8b1814a97baf84e21d7ee6a2de3da71 [0,2,0,0,0,0|2,0,0]=4 5951 B13R1.164 Cc1cnc(c(c1)C)NC[C@H](C)O 10592300db28f646f72e426e4aaa2ca6 [0,2,0,0,0,0|2,0,0]=4 5952 B13R1.164 Cc1cnc(c(c1)Cl)NCC(C)O 4ce1ad1e886b0d0b05783e565bab1f6d [0,2,0,0,0,0|2,0,0]=4 5953 B13R1.164 Cc1cnc(c(c1)Cl)NC[C@H](C)O 8d8bdbfcd2acafa1c9a30b6bc410fc74 [0,2,0,0,0,0|2,0,0]=4 5954 B13R1.164 Cc1cnc(c(c1)F)NCC(C)O f52ddd90ac1470676fc11c0d21e420b6 [0,2,0,0,0,0|2,0,0]=4 5955 B13R1.164 Cc1cnc(c(c1)F)NC[C@@H](C)O 20de0a522b576a9813b26fd82447a4ee [0,2,0,0,0,0|2,0,0]=4 5956 B13R1.164 Cc1cnc(c(c1)F)NC[C@H](C)O 4b3ff1650c4e35dd0505111148132fbc [0,2,0,0,0,0|2,0,0]=4 5957 B13R1.164 Cc1cnc(c(c1)I)NCC(C)O d8db21523adfe3b8fb551f09533335bd [0,2,0,0,0,0|2,0,0]=4 5958 B13R1.164 Cc1cnc(c(c1)I)NC[C@H](C)O 7d1213c6da8abdb5d3e263052dc0ba8e [0,2,0,0,0,0|2,0,0]=4 5959 B13R1.164 Cc1nc(ccc1NCC(C)O)Br 50c4928bb2c9a02bda27d7dee90ebde5 [0,2,0,0,0,0|2,0,0]=4 5960 B13R1.164 Cc1nc(ccc1NCC(C)O)Cl cc6a9941a0d2a41c8319d3741af56828 [0,2,0,0,0,0|2,0,0]=4 5961 B13R1.164 Cc1nc(ccc1NCC(C)O)F 3c71e25f029a4556cc867f483ea519ee [0,2,0,0,0,0|2,0,0]=4 5962 B13R1.164 Cc1nc(ccc1NC[C@H](C)O)Br a97c299f01736cc25861337227f53766 [0,2,0,0,0,0|2,0,0]=4 5963 B13R1.164 Cc1nc(ccc1NC[C@H](C)O)Cl 9d384dd2d294fd67cfda728098748a50 [0,2,0,0,0,0|2,0,0]=4 5964 B13R1.164 Cc1nc(ccc1NC[C@H](C)O)F c6014c455b7524cb2fc97a2ac57ce043 [0,2,0,0,0,0|2,0,0]=4 5965 B13R1.511 CC(C)CNc1ccc(c(c1)Br)Br b4ff8bbda7a586ca381fbd3e4e81d5cd [0,2,0,0,0,0|2,0,0]=4 5966 B13R1.511 CC(C)CNc1ccc(c(c1)Br)Cl a0e1dd72bc49663a8b28aa1268f0dab1 [0,2,0,0,0,0|2,0,0]=4 5967 B13R1.511 CC(C)CNc1ccc(c(c1)Br)F 113f66358e65e74f38b704d1d3decb80 [0,2,0,0,0,0|2,0,0]=4 5968 B13R1.511 CC(C)CNc1ccc(c(c1)Br)I dd96e31513de93b3b9927d20d247f277 [0,2,0,0,0,0|2,0,0]=4 5969 B13R1.511 CC(C)CNc1ccc(c(c1)Cl)Br 1474e609075875ba487379b9b8b840cc [0,2,0,0,0,0|2,0,0]=4 5970 B13R1.511 CC(C)CNc1ccc(c(c1)Cl)Cl 1fe035a7328fe5b49a8abd270f690ac5 [0,2,0,0,0,0|2,0,0]=4 5971 B13R1.511 CC(C)CNc1ccc(c(c1)Cl)F 9b927d01750c9fe6abe82f3dfba173f0 [0,2,0,0,0,0|2,0,0]=4 5972 B13R1.511 CC(C)CNc1ccc(c(c1)Cl)I c4ee2dc31c658636f96c32cfcbd1d747 [0,2,0,0,0,0|2,0,0]=4 5973 B13R1.511 CC(C)CNc1ccc(c(c1)F)Br b8779e06c528d64bf5730b84fe9643a3 [0,2,0,0,0,0|2,0,0]=4 5974 B13R1.511 CC(C)CNc1ccc(c(c1)F)Cl d1cb73851ed4f59c91a1c00bebfa9323 [0,2,0,0,0,0|2,0,0]=4 5975 B13R1.511 CC(C)CNc1ccc(c(c1)F)F 90d10472b1fce3ca4228057297fc848d [0,2,0,0,0,0|2,0,0]=4 5976 B13R1.511 CC(C)CNc1ccc(c(c1)F)I 0cc25b96a7c9c748de1eeceb1bdbd0b7 [0,2,0,0,0,0|2,0,0]=4 5977 B13R1.511 CC(C)CNc1ccc(c(c1)I)Br 18aef52cf1a3be1bf1a17b1d7fb38bf7 [0,2,0,0,0,0|2,0,0]=4 5978 B13R1.511 CC(C)CNc1ccc(c(c1)I)Cl d3b18b83f030ecc4e5fb6922e600a488 [0,2,0,0,0,0|2,0,0]=4 5979 B13R1.511 CC(C)CNc1ccc(c(c1)I)F d7f45bf608783caf770ec501096ca2d1 [0,2,0,0,0,0|2,0,0]=4 5980 B13R1.511 CC(C)CNc1ccc(c(c1)N)N 224fb8485d6cc8d5c159f5c08e86f2ec [0,2,0,0,0,0|2,0,0]=4 5981 B13R1.511 CC(C)COc1ccc(c(c1)Br)Br 15fc853a9d56a36d74b1006eca794a6c [0,2,0,0,0,0|2,0,0]=4 5982 B13R1.511 CC(C)COc1ccc(c(c1)Br)Cl bd46298bb5b208b8c232943686cc78b1 [0,2,0,0,0,0|2,0,0]=4 5983 B13R1.511 CC(C)COc1ccc(c(c1)Br)F 9e25731e2adfed1f618433a8af7d21ed [0,2,0,0,0,0|2,0,0]=4 5984 B13R1.511 CC(C)COc1ccc(c(c1)Br)I 2169f011f41557db6ba14e428bd4e2c1 [0,2,0,0,0,0|2,0,0]=4 5985 B13R1.511 CC(C)COc1ccc(c(c1)Cl)Br 56e6968dec5aae5a10039940888ee4e9 [0,2,0,0,0,0|2,0,0]=4 5986 B13R1.511 CC(C)COc1ccc(c(c1)Cl)Cl d08f1c466a3bc6c650250a49c88a28bb [0,2,0,0,0,0|2,0,0]=4 5987 B13R1.511 CC(C)COc1ccc(c(c1)Cl)F 3e48ea8837a13ce087e8f9ae4bedd148 [0,2,0,0,0,0|2,0,0]=4 5988 B13R1.511 CC(C)COc1ccc(c(c1)Cl)I 2b893883b06478df8b503faf0a2ea6e7 [0,2,0,0,0,0|2,0,0]=4 5989 B13R1.511 CC(C)COc1ccc(c(c1)F)Br 841ddabcd9b8139207e5e19a2618dfcd [0,2,0,0,0,0|2,0,0]=4 5990 B13R1.511 CC(C)COc1ccc(c(c1)F)Cl b5c8da82cdde7d1d230cb552a8baeb1e [0,2,0,0,0,0|2,0,0]=4 5991 B13R1.511 CC(C)COc1ccc(c(c1)F)F b72bf3cf768d5e31f39d3636845cb830 [0,2,0,0,0,0|2,0,0]=4 5992 B13R1.511 CC(C)COc1ccc(c(c1)F)I ae6f201c11b66bd31e1d866f9b1df577 [0,2,0,0,0,0|2,0,0]=4 5993 B13R1.511 CC(C)COc1ccc(c(c1)I)Br 492b45dab0a6fe678668f2e3dda062a9 [0,2,0,0,0,0|2,0,0]=4 5994 B13R1.511 CC(C)COc1ccc(c(c1)I)Cl 569b2d391ca8e9dc07ad57bbe9ac85b2 [0,2,0,0,0,0|2,0,0]=4 5995 B13R1.511 CC(C)COc1ccc(c(c1)I)F 2a4ec058dc514f5fcf60a03586d429fb [0,2,0,0,0,0|2,0,0]=4 5996 B13R1.511 CC(C)NCc1ccc(c(c1)Br)Cl c4b03cbaccb33789c6be4c515dfa9f62 [0,2,0,0,0,0|2,0,0]=4 5997 B13R1.511 CC(C)NCc1ccc(c(c1)Br)F f4e092ce147a29e35203f689c77a186d [0,2,0,0,0,0|2,0,0]=4 5998 B13R1.511 CC(C)NCc1ccc(c(c1)Cl)Br 81c22d575c37dfbd42435937b9bf3706 [0,2,0,0,0,0|2,0,0]=4 5999 B13R1.511 CC(C)NCc1ccc(c(c1)Cl)Cl c96788b8f0c7a0e74f80bb65ebca6621 [0,2,0,0,0,0|2,0,0]=4 6000 B13R1.511 CC(C)NCc1ccc(c(c1)Cl)F 77f1d39063d7df5cee73390a00a8fc42 [0,2,0,0,0,0|2,0,0]=4 6001 B13R1.511 CC(C)NCc1ccc(c(c1)F)Cl 3024249b23b0f7def483f7df9a24fc04 [0,2,0,0,0,0|2,0,0]=4 6002 B13R1.511 CC(C)NCc1ccc(c(c1)F)F 3594abaf08821badf5c0a1ac36d1e8c8 [0,2,0,0,0,0|2,0,0]=4 6003 B13R1.511 CC(C)NCc1ccc(c(c1)F)I f65991c2dde764a794f2e7a527707cf9 [0,2,0,0,0,0|2,0,0]=4 6004 B13R1.511 CC(C)OCc1ccc(c(c1)Br)Br 2f3f6f3f8ea2511c9af662258cb92e2b [0,2,0,0,0,0|2,0,0]=4 6005 B13R1.511 CC(C)OCc1ccc(c(c1)Br)Cl 5ea90c7567fb97dc86d211b8c5431840 [0,2,0,0,0,0|2,0,0]=4 6006 B13R1.511 CC(C)OCc1ccc(c(c1)Br)F c1ac1762cb98bbd1ac2756e8f3fe693b [0,2,0,0,0,0|2,0,0]=4 6007 B13R1.511 CC(C)OCc1ccc(c(c1)Br)I d0e58cfa59a40389aaaf745ea62ddff4 [0,2,0,0,0,0|2,0,0]=4 6008 B13R1.511 CC(C)OCc1ccc(c(c1)Cl)Cl 0559ac200d257a4174e3b3c43e7a5f36 [0,2,0,0,0,0|2,0,0]=4 6009 B13R1.511 CC(C)OCc1ccc(c(c1)Cl)F 589ffb64942f98358802b003eeabb0fc [0,2,0,0,0,0|2,0,0]=4 6010 B13R1.511 CC(C)OCc1ccc(c(c1)Cl)I e509496ff2f24e7e226794337ceb5335 [0,2,0,0,0,0|2,0,0]=4 6011 B13R1.511 CC(C)OCc1ccc(c(c1)F)Cl b57a2693d85e6f10e367cc21d0512068 [0,2,0,0,0,0|2,0,0]=4 6012 B13R1.511 CC(C)OCc1ccc(c(c1)F)F 5470b663ddbac91d2cf48f609c67fc93 [0,2,0,0,0,0|2,0,0]=4 6013 B13R1.511 CC(C)OCc1ccc(c(c1)F)I c25367b177b0de166c808c215aed455b [0,2,0,0,0,0|2,0,0]=4 6014 B13R1.511 CC(C)OCc1ccc(c(c1)I)Br 2e0ca7e9137134d632792a99e0b4baa6 [0,2,0,0,0,0|2,0,0]=4 6015 B13R1.511 CC(C)OCc1ccc(c(c1)I)Cl 8d97bf801aea46fc1e79c00b74cc7683 [0,2,0,0,0,0|2,0,0]=4 6016 B13R1.511 CC(C)OCc1ccc(c(c1)I)F e2cfaa403b91591b4254525d510d93b0 [0,2,0,0,0,0|2,0,0]=4 6017 B13R1.511 CC(O)CNc1cc(c(cn1)Br)Br 369855aa8469dae7f2f716502ec39bea [0,2,0,0,0,0|2,0,0]=4 6018 B13R1.511 CC(O)CNc1cc(c(cn1)Br)Cl 0269675c41f8861eb9db62f57c3b98aa [0,2,0,0,0,0|2,0,0]=4 6019 B13R1.511 CC(O)CNc1cc(c(cn1)Br)F 4afb36eb1c7ee987969a8918825d38a5 [0,2,0,0,0,0|2,0,0]=4 6020 B13R1.511 CC(O)CNc1cc(c(cn1)Cl)Br 94ba36faa67b91efb5a3c84ef7c91a4b [0,2,0,0,0,0|2,0,0]=4 6021 B13R1.511 CC(O)CNc1cc(c(cn1)Cl)Cl d70842310a154ee1766ad2b854a59149 [0,2,0,0,0,0|2,0,0]=4 6022 B13R1.511 CC(O)CNc1cc(c(cn1)Cl)F 795a5358f8cdef04c1c43d2f31191694 [0,2,0,0,0,0|2,0,0]=4 6023 B13R1.511 CC(O)CNc1cc(c(cn1)Cl)I e7a4376fcbc7681061db20fb744c6122 [0,2,0,0,0,0|2,0,0]=4 6024 B13R1.511 CC(O)CNc1cc(c(cn1)F)Br 32cd55e8b3a06a88a2aee0c575a9351e [0,2,0,0,0,0|2,0,0]=4 6025 B13R1.511 CC(O)CNc1cc(c(cn1)F)Cl 2e1c67a7f32985d873bfc61b8a318afc [0,2,0,0,0,0|2,0,0]=4 6026 B13R1.511 CC(O)CNc1cc(c(cn1)F)F 668aeb49dbed3f9a97d22cf74b2d2d21 [0,2,0,0,0,0|2,0,0]=4 6027 B13R1.511 CC(O)CNc1cc(c(cn1)F)I 526c10c40d14901ef13acf872b26ac62 [0,2,0,0,0,0|2,0,0]=4 6028 B13R1.511 CC(O)CNc1cc(c(cn1)I)Br 6c5301b07632c2774498e80f28fc7e29 [0,2,0,0,0,0|2,0,0]=4 6029 B13R1.511 CC(O)CNc1cc(c(cn1)I)Cl 193692549ab1633bd3346908cd241c65 [0,2,0,0,0,0|2,0,0]=4 6030 B13R1.511 CC(O)CNc1cc(c(cn1)I)F 8b96c8f98260f71356500e3e536f7c5b [0,2,0,0,0,0|2,0,0]=4 6031 B13R1.511 CC(O)CNc1cc(c(cn1)N)N 7a975d9f78b7ef6c1f8331b513c4750a [0,2,0,0,0,0|2,0,0]=4 6032 B13R1.511 CC(O)CNc1ccc(=O)n(c1)C 6f406b8088f6404534c8d92332213485 [0,2,0,0,0,0|2,0,0]=4 6033 B13R1.511 CC(O)CNc1ccc(c(c1)Br)Br a29c2d52c7e07e3ef25adc1fd718e742 [0,2,0,0,0,0|1,0,0]=3 6034 B13R1.511 CC(O)CNc1ccc(c(c1)Br)Cl a98cc38d2bfd8b9c874bb364307ae378 [0,2,0,0,0,0|1,0,0]=3 6035 B13R1.511 CC(O)CNc1ccc(c(c1)Br)F 490cc30abfb72d342e48502d21303247 [0,2,0,0,0,0|1,0,0]=3 6036 B13R1.511 CC(O)CNc1ccc(c(c1)Br)I a8df16c5d79f1e47c6502b3ac02d3ba6 [0,2,0,0,0,0|1,0,0]=3 6037 B13R1.511 CC(O)CNc1ccc(c(c1)Cl)Br e159bb0d9e1be5e7f47735bb5e10b21e [0,2,0,0,0,0|1,0,0]=3 6038 B13R1.511 CC(O)CNc1ccc(c(c1)Cl)Cl 49cda7eafa9942771b3c283f7230091d [0,2,0,0,0,0|1,0,0]=3 6039 B13R1.511 CC(O)CNc1ccc(c(c1)Cl)F 8d2c5e4de65a66b2ff7d7156280dbadd [0,2,0,0,0,0|1,0,0]=3 6040 B13R1.511 CC(O)CNc1ccc(c(c1)Cl)I 4b710172f0086d194fc80a39ce8befc8 [0,2,0,0,0,0|1,0,0]=3 6041 B13R1.511 CC(O)CNc1ccc(c(c1)F)Br 27f9c2214d315ce38bf5089c9b0a0982 [0,2,0,0,0,0|1,0,0]=3 6042 B13R1.511 CC(O)CNc1ccc(c(c1)F)Cl bd1347833802c19653d68e4aa113e921 [0,2,0,0,0,0|1,0,0]=3 6043 B13R1.511 CC(O)CNc1ccc(c(c1)F)F a28be72c6f8bc58ed218891ab7109eb0 [0,2,0,0,0,0|1,0,0]=3 6044 B13R1.511 CC(O)CNc1ccc(c(c1)F)I 9816f40c1597ee14a7c86d137c228481 [0,2,0,0,0,0|1,0,0]=3 6045 B13R1.511 CC(O)CNc1ccc(c(c1)I)Br 8db5f92655bab6ff7552682c98c475b1 [0,2,0,0,0,0|1,0,0]=3 6046 B13R1.511 CC(O)CNc1ccc(c(c1)I)Cl a29d843d51f163edb9053a33ee2a9398 [0,2,0,0,0,0|1,0,0]=3 6047 B13R1.511 CC(O)CNc1ccc(c(c1)I)F c1b883a016ff701edcf6a857a982fb64 [0,2,0,0,0,0|1,0,0]=3 6048 B13R1.511 CC(O)CNc1ccc(c(c1)N)N 197420b881ec797c11a5260f7fbad841 [0,2,0,0,0,0|1,0,0]=3 6049 B13R1.511 CC(O)CNc1ccc(c(n1)Br)Br 28f7b0fa1d0825538506d59054407453 [0,2,0,0,0,0|2,0,0]=4 6050 B13R1.511 CC(O)CNc1ccc(c(n1)Br)Cl 071ecac9810d7f8bbfe282c2e127a6ff [0,2,0,0,0,0|2,0,0]=4 6051 B13R1.511 CC(O)CNc1ccc(c(n1)Br)F 33db6491c880e6619cc31c506ecab52b [0,2,0,0,0,0|2,0,0]=4 6052 B13R1.511 CC(O)CNc1ccc(c(n1)Br)I 5904ae5b84b6ad2c6574678fc58ef05e [0,2,0,0,0,0|2,0,0]=4 6053 B13R1.511 CC(O)CNc1ccc(c(n1)Cl)Br d4104587bf881e0f9f619a22bbe96c8f [0,2,0,0,0,0|2,0,0]=4 6054 B13R1.511 CC(O)CNc1ccc(c(n1)Cl)Cl 6b550caeb8026ae0c183c9b62bf069b5 [0,2,0,0,0,0|2,0,0]=4 6055 B13R1.511 CC(O)CNc1ccc(c(n1)Cl)F 5a8bfeef52609e475d2d304c514bb6cd [0,2,0,0,0,0|2,0,0]=4 6056 B13R1.511 CC(O)CNc1ccc(c(n1)Cl)I 665def4c04d60a6dff61f65d93572721 [0,2,0,0,0,0|2,0,0]=4 6057 B13R1.511 CC(O)CNc1ccc(c(n1)F)Br 33ef85d106ad1402166272e75b53f268 [0,2,0,0,0,0|2,0,0]=4 6058 B13R1.511 CC(O)CNc1ccc(c(n1)F)Cl 5de9de010bfb6609748c94feb23d1215 [0,2,0,0,0,0|2,0,0]=4 6059 B13R1.511 CC(O)CNc1ccc(c(n1)F)F cc804fd7caa6b1452bf41ae39d4bd092 [0,2,0,0,0,0|2,0,0]=4 6060 B13R1.511 CC(O)CNc1ccc(c(n1)F)I 6adc42778a2252f0bac6b4611b95d274 [0,2,0,0,0,0|2,0,0]=4 6061 B13R1.511 CC(O)CNc1ccc(c(n1)I)Br 8ca428034d5ee77b277871506a253a74 [0,2,0,0,0,0|2,0,0]=4 6062 B13R1.511 CC(O)CNc1ccc(c(n1)I)F 2754fe26f036f2512d9dbbad553b13b3 [0,2,0,0,0,0|2,0,0]=4 6063 B13R1.511 CC(O)CNc1ccc(c(n1)N)N e25a900bee044f978fd4ee26c571351d [0,2,0,0,0,0|2,0,0]=4 6064 B13R1.511 CC(O)CNc1ccn(c(=O)c1)C 7d761b17f9b67ec34c677ceb289366b7 [0,2,0,0,0,0|2,0,0]=4 6065 B13R1.511 CC(O)CNc1cnc(c(c1)Br)Br 88ffb94a1d909b903ada8a78d623d999 [0,2,0,0,0,0|2,0,0]=4 6066 B13R1.511 CC(O)CNc1cnc(c(c1)Br)Cl b007e70e3e49e4758b5611169657be88 [0,2,0,0,0,0|2,0,0]=4 6067 B13R1.511 CC(O)CNc1cnc(c(c1)Br)F 7965ec66290738646b225fb206bce186 [0,2,0,0,0,0|2,0,0]=4 6068 B13R1.511 CC(O)CNc1cnc(c(c1)Br)I 80dc884a278848e987a9783adebec628 [0,2,0,0,0,0|2,0,0]=4 6069 B13R1.511 CC(O)CNc1cnc(c(c1)Cl)Br ce8fb45a32676c9f103052f54b40c3d6 [0,2,0,0,0,0|2,0,0]=4 6070 B13R1.511 CC(O)CNc1cnc(c(c1)Cl)Cl 9d512c4c69876a05e15e6a8ebaa406bb [0,2,0,0,0,0|2,0,0]=4 6071 B13R1.511 CC(O)CNc1cnc(c(c1)Cl)F 0007465bd09a39341bdb43940f0ba3f8 [0,2,0,0,0,0|2,0,0]=4 6072 B13R1.511 CC(O)CNc1cnc(c(c1)Cl)I 702f0e396f370b8b38ab7ae92027b545 [0,2,0,0,0,0|2,0,0]=4 6073 B13R1.511 CC(O)CNc1cnc(c(c1)F)Br 99e3809072cd1abb01a8c3edf83f4d74 [0,2,0,0,0,0|2,0,0]=4 6074 B13R1.511 CC(O)CNc1cnc(c(c1)F)Cl 66019e8a6deaf8b94def62707d1832e7 [0,2,0,0,0,0|2,0,0]=4 6075 B13R1.511 CC(O)CNc1cnc(c(c1)F)F 1599781ccb0945a1bdcdbbde80fb0679 [0,2,0,0,0,0|2,0,0]=4 6076 B13R1.511 CC(O)CNc1cnc(c(c1)F)I 80ae2c51fe2d8fa3ae6212341115a246 [0,2,0,0,0,0|2,0,0]=4 6077 B13R1.511 CC(O)CNc1cnc(c(c1)I)Br ecc3d43afd1b2a0f3b845aaadfcb4296 [0,2,0,0,0,0|2,0,0]=4 6078 B13R1.511 CC(O)CNc1cnc(c(c1)I)Cl 2426a235d61b1a9e1d175f5df089d12c [0,2,0,0,0,0|2,0,0]=4 6079 B13R1.511 CC(O)CNc1cnc(c(c1)N)N 22b52f61733c4acb29c376fc5d18c5ef [0,2,0,0,0,0|2,0,0]=4 6080 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)Br)Cl a1bd5394403b1b65f632b195043e4889 [0,2,0,0,0,0|2,0,0]=4 6081 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)Cl)Cl f75bf98e723aca427f73ee8ce26d5469 [0,2,0,0,0,0|2,0,0]=4 6082 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)Cl)F 9fc5792cdab280525f7421336d5864e4 [0,2,0,0,0,0|2,0,0]=4 6083 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)Cl)I 307067f6499da6a0dda91501e76193b9 [0,2,0,0,0,0|2,0,0]=4 6084 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)F)Cl 768a454485af5314ed9ef5c445d0785d [0,2,0,0,0,0|2,0,0]=4 6085 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)F)F 1d8ea9a66b3fad599a2804034efcced9 [0,2,0,0,0,0|2,0,0]=4 6086 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)F)I ff5facb964ed397df6a803ba48902d02 [0,2,0,0,0,0|2,0,0]=4 6087 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)I)Cl 566134e96589ba7270d43c9c330ac37b [0,2,0,0,0,0|2,0,0]=4 6088 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)I)F c37eb80e87b7d607633c6c69ef9fa3db [0,2,0,0,0,0|2,0,0]=4 6089 B13R1.511 C[C@@H](O)CNc1cc(c(cn1)N)N 527a6fb6acd40a7a0844a3a588db7055 [0,2,0,0,0,0|2,0,0]=4 6090 B13R1.511 C[C@@H](O)CNc1ccc(=O)n(c1)C 9d27a540c5853139fae45e5058577d85 [0,2,0,0,0,0|2,0,0]=4 6091 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Cl)Br 1ebd2799e5e14d6b78b51c2c74d55017 [0,2,0,0,0,0|1,0,0]=3 6092 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Cl)Cl db9ef792f3b0b8ee96e35c62199b7995 [0,2,0,0,0,0|1,0,0]=3 6093 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Cl)F 66b9f99c09c2e109152d71f258088677 [0,2,0,0,0,0|1,0,0]=3 6094 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Cl)I 562c0a799c5737cb174c70b0c113a293 [0,2,0,0,0,0|1,0,0]=3 6095 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)F)F 3f2c150f811a6ac782f764baacf28185 [0,2,0,0,0,0|1,0,0]=3 6096 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)I)Cl b28ae552da8a09ca22becbec54c5c194 [0,2,0,0,0,0|1,0,0]=3 6097 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)I)F 595670429f8af95e2874fa30bd931ef9 [0,2,0,0,0,0|1,0,0]=3 6098 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)N)N 4c54ca32ecdb3f85d4bd23e664deed52 [0,2,0,0,0,0|1,0,0]=3 6099 B13R1.511 C[C@@H](O)CNc1ccc(c(n1)Cl)Cl 917959c82f97be07b1c964cb3b14d976 [0,2,0,0,0,0|2,0,0]=4 6100 B13R1.511 C[C@@H](O)CNc1ccc(c(n1)N)N 09392c310fa9c6274f3280f7971575b8 [0,2,0,0,0,0|2,0,0]=4 6101 B13R1.511 C[C@@H](O)CNc1ccn(c(=O)c1)C db4611ab6bcb591235d8b3a34c0d7392 [0,2,0,0,0,0|2,0,0]=4 6102 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)Br)Cl 2b81d75bbd29b07d685fed7f1dd48590 [0,2,0,0,0,0|2,0,0]=4 6103 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)Br)I eefaf7699ce1a214a10befb9a3430a98 [0,2,0,0,0,0|2,0,0]=4 6104 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)Cl)Br e8da6d62cd94269333260917aa670cde [0,2,0,0,0,0|2,0,0]=4 6105 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)Cl)Cl 32c4da8b182b1dca66bd1edd2bdd65f7 [0,2,0,0,0,0|2,0,0]=4 6106 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)Cl)F 3e6a185a5b9b1031c9a62bcf3237d412 [0,2,0,0,0,0|2,0,0]=4 6107 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)F)Cl 201c00d468dc2c7dec301716347889d7 [0,2,0,0,0,0|2,0,0]=4 6108 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)F)F 0e810c41b1783af0f5df13cd86fd01cc [0,2,0,0,0,0|2,0,0]=4 6109 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)F)I e3a9f5117e28b834fe38389609a3ff20 [0,2,0,0,0,0|2,0,0]=4 6110 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)I)Cl 1aab57095f312efd00f1af2501376bda [0,2,0,0,0,0|2,0,0]=4 6111 B13R1.511 C[C@@H](O)CNc1cnc(c(c1)N)N 94e8b19b526b933de10f9dd8e9051e3a [0,2,0,0,0,0|2,0,0]=4 6112 B13R1.511 C[C@H](O)CNc1cc(c(cn1)Br)Br 486e63b99fd0248c8bbdf8ce1a7bf494 [0,2,0,0,0,0|2,0,0]=4 6113 B13R1.511 C[C@H](O)CNc1cc(c(cn1)Br)Cl af3f8e25feca6382a84de342f01692ca [0,2,0,0,0,0|2,0,0]=4 6114 B13R1.511 C[C@H](O)CNc1cc(c(cn1)Br)F 15989e23e414d96843131e5f06b839e4 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.511 C[C@H](O)CNc1cc(c(cn1)Cl)Br 2ba5aaf9a03f63746550a1c57bfbb686 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.511 C[C@H](O)CNc1cc(c(cn1)Cl)Cl f627b40bd96adbd76e5b48b0b01f9d9c [0,2,0,0,0,0|2,0,0]=4 6117 B13R1.511 C[C@H](O)CNc1cc(c(cn1)Cl)F 39534ac78c9cfae08440e085f5ea23e0 [0,2,0,0,0,0|2,0,0]=4 6118 B13R1.511 C[C@H](O)CNc1cc(c(cn1)Cl)I 828fb208df882ca357fa69bb793c9b6e [0,2,0,0,0,0|2,0,0]=4 6119 B13R1.511 C[C@H](O)CNc1cc(c(cn1)F)Br 4e1b7589ecd4e4a4d5a20cf1bfa151ff [0,2,0,0,0,0|2,0,0]=4 6120 B13R1.511 C[C@H](O)CNc1cc(c(cn1)F)Cl ad63e157f432631d52df1ce12e02ab80 [0,2,0,0,0,0|2,0,0]=4 6121 B13R1.511 C[C@H](O)CNc1cc(c(cn1)F)F 8af56016518fa7414fe62c4a8b877da0 [0,2,0,0,0,0|2,0,0]=4 6122 B13R1.511 C[C@H](O)CNc1cc(c(cn1)F)I 6ad35208048aa633b42ff787b41e36d4 [0,2,0,0,0,0|2,0,0]=4 6123 B13R1.511 C[C@H](O)CNc1cc(c(cn1)I)Br bdb7dc266f5fda2d60013d121e7e05e6 [0,2,0,0,0,0|2,0,0]=4 6124 B13R1.511 C[C@H](O)CNc1cc(c(cn1)I)Cl a6257c46bbddd69db74c0be295b9e285 [0,2,0,0,0,0|2,0,0]=4 6125 B13R1.511 C[C@H](O)CNc1cc(c(cn1)I)F a682932f0dd0528a98e0c904d9a67937 [0,2,0,0,0,0|2,0,0]=4 6126 B13R1.511 C[C@H](O)CNc1cc(c(cn1)N)N 59c59bc8af0cc0514b9b37c45a27ddf3 [0,2,0,0,0,0|2,0,0]=4 6127 B13R1.511 C[C@H](O)CNc1ccc(=O)n(c1)C 79f66b31f379a791f1ea56910f15bb21 [0,2,0,0,0,0|2,0,0]=4 6128 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Br)Br bb6b0c2a25371def18eaf5a9a50f70ad [0,2,0,0,0,0|1,0,0]=3 6129 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Br)Cl 531f57c878ec8a1f024f2297500cfa6a [0,2,0,0,0,0|1,0,0]=3 6130 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Br)F 2eeb1283a2bd6451f2e1db4787283214 [0,2,0,0,0,0|1,0,0]=3 6131 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Br)I 3b133c65899efdd4e981dc15d43a802f [0,2,0,0,0,0|1,0,0]=3 6132 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Cl)Br 3e477a31a825dc73847ad2ce60fe1ce2 [0,2,0,0,0,0|1,0,0]=3 6133 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Cl)Cl 2253e12ed96050f108c3308417bd2ad5 [0,2,0,0,0,0|1,0,0]=3 6134 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Cl)F e1cdca3cb7c60d4a235d64b2e2a26180 [0,2,0,0,0,0|1,0,0]=3 6135 B13R1.511 C[C@H](O)CNc1ccc(c(c1)Cl)I 8c7da4ffc100f758ca44bd499fe67456 [0,2,0,0,0,0|1,0,0]=3 6136 B13R1.511 C[C@H](O)CNc1ccc(c(c1)F)Br 3c0ffff05093359b6d71697172c4fe8d [0,2,0,0,0,0|1,0,0]=3 6137 B13R1.511 C[C@H](O)CNc1ccc(c(c1)F)Cl 4c3bf5217d9216eef710597eee0c455e [0,2,0,0,0,0|1,0,0]=3 6138 B13R1.511 C[C@H](O)CNc1ccc(c(c1)F)F 682e8acc0685b8d7508e2122142c35bf [0,2,0,0,0,0|1,0,0]=3 6139 B13R1.511 C[C@H](O)CNc1ccc(c(c1)F)I 6b9305c2f9f0537b8fa68855ea5f61e1 [0,2,0,0,0,0|1,0,0]=3 6140 B13R1.511 C[C@H](O)CNc1ccc(c(c1)I)Br f9b548143ac3f3bfc3b4adf3e8d0af59 [0,2,0,0,0,0|1,0,0]=3 6141 B13R1.511 C[C@H](O)CNc1ccc(c(c1)I)Cl 5859c02cbd4bb763f129a55880019c22 [0,2,0,0,0,0|1,0,0]=3 6142 B13R1.511 C[C@H](O)CNc1ccc(c(c1)I)F f76bec682aeda3bc0e073841d3a55576 [0,2,0,0,0,0|1,0,0]=3 6143 B13R1.511 C[C@H](O)CNc1ccc(c(c1)N)N f7492e667244b69999987d91c1a6d123 [0,2,0,0,0,0|1,0,0]=3 6144 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Br)Br 1c6e587ae88e271c65410575f05c4111 [0,2,0,0,0,0|2,0,0]=4 6145 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Br)Cl 28ff6569f6f26d0c829e702fb5f9e60f [0,2,0,0,0,0|2,0,0]=4 6146 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Br)F ecc6d4988ae858729fdef304d4f49fa8 [0,2,0,0,0,0|2,0,0]=4 6147 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Br)I a23c61b573ca8807d7da1976319683b7 [0,2,0,0,0,0|2,0,0]=4 6148 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Cl)Br 7115f1236a010c55caf6823416aa6efd [0,2,0,0,0,0|2,0,0]=4 6149 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Cl)Cl 951ceb4a9bac01848640d9fcde4609d1 [0,2,0,0,0,0|2,0,0]=4 6150 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Cl)F 8e275d205fa9d94fbe2389add65cc1e5 [0,2,0,0,0,0|2,0,0]=4 6151 B13R1.511 C[C@H](O)CNc1ccc(c(n1)Cl)I ceede819342c9de721d527502f89925a [0,2,0,0,0,0|2,0,0]=4 6152 B13R1.511 C[C@H](O)CNc1ccc(c(n1)F)Br 3ddb54977be1e258167bce88172df84f [0,2,0,0,0,0|2,0,0]=4 6153 B13R1.511 C[C@H](O)CNc1ccc(c(n1)F)Cl bdf598d0f274711ac4054ced93d232d0 [0,2,0,0,0,0|2,0,0]=4 6154 B13R1.511 C[C@H](O)CNc1ccc(c(n1)F)F 7bed0026ca49e181888423e208227ae7 [0,2,0,0,0,0|2,0,0]=4 6155 B13R1.511 C[C@H](O)CNc1ccc(c(n1)F)I 7ef5b8e802baf0f088cd82f1a11da190 [0,2,0,0,0,0|2,0,0]=4 6156 B13R1.511 C[C@H](O)CNc1ccc(c(n1)I)Br a3bdaa9b4597cf8c52e451e427d5d7bc [0,2,0,0,0,0|2,0,0]=4 6157 B13R1.511 C[C@H](O)CNc1ccc(c(n1)I)F f796ca53033c8bd200919d9c64577e3e [0,2,0,0,0,0|2,0,0]=4 6158 B13R1.511 C[C@H](O)CNc1ccc(c(n1)N)N ad46b115b0a79812023452b9f97230c9 [0,2,0,0,0,0|2,0,0]=4 6159 B13R1.511 C[C@H](O)CNc1ccn(c(=O)c1)C 5ea705fbbcaed5a2d3c6445487dc87ff [0,2,0,0,0,0|2,0,0]=4 6160 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Br)Br e8c1560fdf2c6b0379da07217424f89c [0,2,0,0,0,0|2,0,0]=4 6161 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Br)Cl 8bf9c529dd98371a06fd370b51f9edbf [0,2,0,0,0,0|2,0,0]=4 6162 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Br)F d4958693cd699cb958f7915e61195636 [0,2,0,0,0,0|2,0,0]=4 6163 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Br)I 518929838c42bb0da4e102cad00a5edc [0,2,0,0,0,0|2,0,0]=4 6164 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Cl)Br 2abd209edb864c610a9f7f9618fa362f [0,2,0,0,0,0|2,0,0]=4 6165 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Cl)Cl 63aa9dacec96a01589eb9601e6b2ac04 [0,2,0,0,0,0|2,0,0]=4 6166 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Cl)F 7fd91bf12add44261c34341c8e01944a [0,2,0,0,0,0|2,0,0]=4 6167 B13R1.511 C[C@H](O)CNc1cnc(c(c1)Cl)I c359bb946785eed1efa0c5a21b29cee9 [0,2,0,0,0,0|2,0,0]=4 6168 B13R1.511 C[C@H](O)CNc1cnc(c(c1)F)Br 4446475e2ea3cdd6c77004117cb7f9bd [0,2,0,0,0,0|2,0,0]=4 6169 B13R1.511 C[C@H](O)CNc1cnc(c(c1)F)Cl 634adbec7d66eede329c9c5076939ea8 [0,2,0,0,0,0|2,0,0]=4 6170 B13R1.511 C[C@H](O)CNc1cnc(c(c1)F)F c433258dba07855da2145129a390caa0 [0,2,0,0,0,0|2,0,0]=4 6171 B13R1.511 C[C@H](O)CNc1cnc(c(c1)F)I a1f7828b74a2617fd3960a7317a68ff6 [0,2,0,0,0,0|2,0,0]=4 6172 B13R1.511 C[C@H](O)CNc1cnc(c(c1)I)Br e93a2df5465f59f7ecf7034173bf9002 [0,2,0,0,0,0|2,0,0]=4 6173 B13R1.511 C[C@H](O)CNc1cnc(c(c1)I)Cl 6a6115993a9070bfcf848bae0ada6134 [0,2,0,0,0,0|2,0,0]=4 6174 B13R1.511 C[C@H](O)CNc1cnc(c(c1)N)N 9e48939ee2bef696a2d53fbc7361b236 [0,2,0,0,0,0|2,0,0]=4 6175 B13R1.511 Cc1cc(ccc1Br)COC(C)C 9d4b976426fb82613bef2f4dcdc0da56 [0,2,0,0,0,0|2,0,0]=4 6176 B13R1.511 Cc1cc(ccc1Br)NCC(C)C 444f2f8a8957eab618f5364a1f1eeb9d [0,2,0,0,0,0|2,0,0]=4 6177 B13R1.511 Cc1cc(ccc1Br)NCC(C)O 4fa12863ac721262bf591e6004b7b38c [0,2,0,0,0,0|1,0,0]=3 6178 B13R1.511 Cc1cc(ccc1Br)NC[C@H](C)O 86ab59417e56efcb828df2fe335066bf [0,2,0,0,0,0|1,0,0]=3 6179 B13R1.511 Cc1cc(ccc1Br)OCC(C)C 16b900b465d7c8824b4073aaa5f46b67 [0,2,0,0,0,0|2,0,0]=4 6180 B13R1.511 Cc1cc(ccc1Cl)COC(C)C 7d7511209b0fed321434d8be4b8a5145 [0,2,0,0,0,0|2,0,0]=4 6181 B13R1.511 Cc1cc(ccc1Cl)NCC(C)C 1bd941a0a1ceec8379a36ac44ddad1ef [0,2,0,0,0,0|2,0,0]=4 6182 B13R1.511 Cc1cc(ccc1Cl)NCC(C)O d0b1af126471a4854a65785edb953f05 [0,2,0,0,0,0|1,0,0]=3 6183 B13R1.511 Cc1cc(ccc1Cl)NC[C@@H](C)O 13913d342db63e88384e92f29f81e115 [0,2,0,0,0,0|1,0,0]=3 6184 B13R1.511 Cc1cc(ccc1Cl)NC[C@H](C)O f5f149f8f661b4a4a4d54245da2f2d56 [0,2,0,0,0,0|1,0,0]=3 6185 B13R1.511 Cc1cc(ccc1Cl)OCC(C)C ac96b0eaecca9ac3c1dc158c91c14134 [0,2,0,0,0,0|2,0,0]=4 6186 B13R1.511 Cc1cc(ccc1F)CNC(C)C 1de7b7b18fe3d12a535b922ae924af04 [0,2,0,0,0,0|2,0,0]=4 6187 B13R1.511 Cc1cc(ccc1F)COC(C)C 0f35cc2befdc85d04ad499083a06130d [0,2,0,0,0,0|2,0,0]=4 6188 B13R1.511 Cc1cc(ccc1F)NCC(C)C 684b49bc772b5299163727e2e592c86b [0,2,0,0,0,0|2,0,0]=4 6189 B13R1.511 Cc1cc(ccc1F)NCC(C)O 6e6c3acb9303993a28e37030692d5965 [0,2,0,0,0,0|1,0,0]=3 6190 B13R1.511 Cc1cc(ccc1F)NC[C@@H](C)O 6c86225e6adba04e3d0596ce8f2814f0 [0,2,0,0,0,0|1,0,0]=3 6191 B13R1.511 Cc1cc(ccc1F)NC[C@H](C)O ecfb7d92ad89aa4df5a82eacb4029de2 [0,2,0,0,0,0|1,0,0]=3 6192 B13R1.511 Cc1cc(ccc1F)OCC(C)C bbac02dbe6e520c6c99da04e76655736 [0,2,0,0,0,0|2,0,0]=4 6193 B13R1.511 Cc1cc(ccc1I)CNC(C)C b2f16890ef483c87d564791b6fcf04c3 [0,2,0,0,0,0|2,0,0]=4 6194 B13R1.511 Cc1cc(ccc1I)COC(C)C 14e2c3b09bfe5b114a2d40c90e18ddf8 [0,2,0,0,0,0|2,0,0]=4 6195 B13R1.511 Cc1cc(ccc1I)NCC(C)C 5b1d94cf98b4cb4800154532b02caa85 [0,2,0,0,0,0|2,0,0]=4 6196 B13R1.511 Cc1cc(ccc1I)NCC(C)O 71a7a7713e1d7ab85956e06dd7c98909 [0,2,0,0,0,0|1,0,0]=3 6197 B13R1.511 Cc1cc(ccc1I)NC[C@H](C)O d4200a39e254e8ac9d12db581b54fdbb [0,2,0,0,0,0|1,0,0]=3 6198 B13R1.511 Cc1cc(ccc1I)OCC(C)C 584e73ee065ef036e6bddf5e3aa71e67 [0,2,0,0,0,0|2,0,0]=4 6199 B13R1.511 Cc1cc(cnc1Br)NCC(C)O 5a52e5cde435dd85da3029c95021c741 [0,2,0,0,0,0|2,0,0]=4 6200 B13R1.511 Cc1cc(cnc1Br)NC[C@@H](C)O 67d85559ed70ecff91ff35bebda8685b [0,2,0,0,0,0|2,0,0]=4 6201 B13R1.511 Cc1cc(cnc1Br)NC[C@H](C)O 0d5facb686ce6d5fe1dd4c1ee769d625 [0,2,0,0,0,0|2,0,0]=4 6202 B13R1.511 Cc1cc(cnc1C)NCC(C)O 747506f46b642463fad29eaa1ce6f0fc [0,2,0,0,0,0|2,0,0]=4 6203 B13R1.511 Cc1cc(cnc1C)NC[C@@H](C)O 22558d2851cf679f5d29f4cd16ca5224 [0,2,0,0,0,0|2,0,0]=4 6204 B13R1.511 Cc1cc(cnc1C)NC[C@H](C)O fc5c8ac22fceeefdc78a79a84d4e6238 [0,2,0,0,0,0|2,0,0]=4 6205 B13R1.511 Cc1cc(cnc1Cl)NCC(C)O 9e7dc03a716bb79c90bb73bed5b9b580 [0,2,0,0,0,0|2,0,0]=4 6206 B13R1.511 Cc1cc(cnc1Cl)NC[C@@H](C)O 76cca5763ec6830466eb6e77c3a743e5 [0,2,0,0,0,0|2,0,0]=4 6207 B13R1.511 Cc1cc(cnc1Cl)NC[C@H](C)O f38499191ff3fa85c142152af35024ae [0,2,0,0,0,0|2,0,0]=4 6208 B13R1.511 Cc1cc(cnc1F)NCC(C)O f1fd423e7fed87ae5edf39b9d9f0c22f [0,2,0,0,0,0|2,0,0]=4 6209 B13R1.511 Cc1cc(cnc1F)NC[C@@H](C)O b2375089314c7404d936acac05682637 [0,2,0,0,0,0|2,0,0]=4 6210 B13R1.511 Cc1cc(cnc1F)NC[C@H](C)O 92dbfe5416e3903716d7e436d193c238 [0,2,0,0,0,0|2,0,0]=4 6211 B13R1.511 Cc1cc(ncc1Br)NCC(C)O 492943e3fa634cd4bdb18a5d39046f05 [0,2,0,0,0,0|2,0,0]=4 6212 B13R1.511 Cc1cc(ncc1Br)NC[C@@H](C)O e04b93f0aea86c582db870a3e04a036b [0,2,0,0,0,0|2,0,0]=4 6213 B13R1.511 Cc1cc(ncc1Br)NC[C@H](C)O 8870f408992885f70c89863f93b2a9d3 [0,2,0,0,0,0|2,0,0]=4 6214 B13R1.511 Cc1cc(ncc1Cl)NCC(C)O 3f07946389a332ffbf1a513738ab0404 [0,2,0,0,0,0|2,0,0]=4 6215 B13R1.511 Cc1cc(ncc1Cl)NC[C@H](C)O 6d880ff6c6e7a534b52f8a5394953599 [0,2,0,0,0,0|2,0,0]=4 6216 B13R1.511 Cc1cc(ncc1F)NCC(C)O a3118c4af0a95a9258367713c4bc528f [0,2,0,0,0,0|2,0,0]=4 6217 B13R1.511 Cc1cc(ncc1F)NC[C@@H](C)O 6c07404e77dc910ae45eb8395b719a2b [0,2,0,0,0,0|2,0,0]=4 6218 B13R1.511 Cc1cc(ncc1F)NC[C@H](C)O fffae4e0c0384365f538a50ad1283aaf [0,2,0,0,0,0|2,0,0]=4 6219 B13R1.511 Cc1cc(ncc1I)NCC(C)O e6e56fac2d6cd01e16f73215eb9867fb [0,2,0,0,0,0|2,0,0]=4 6220 B13R1.511 Cc1cc(ncc1I)NC[C@@H](C)O 65d59c2f4209d447a4676f9cffe9b4f0 [0,2,0,0,0,0|2,0,0]=4 6221 B13R1.511 Cc1cc(ncc1I)NC[C@H](C)O 9f5835f393673f16960910dbbf1c73e9 [0,2,0,0,0,0|2,0,0]=4 6222 B13R1.511 Cc1ccc([nH]c1=O)NCC(C)O 8766a61986ca66326078db6525e71422 [0,2,0,0,0,0|2,0,0]=4 6223 B13R1.511 Cc1ccc([nH]c1=O)NC[C@@H](C)O 4e57624b90aaa0a60c9232a04fd0e07f [0,2,0,0,0,0|2,0,0]=4 6224 B13R1.511 Cc1ccc([nH]c1=O)NC[C@H](C)O bee4ca8fef5d262ff4576138f6830e55 [0,2,0,0,0,0|2,0,0]=4 6225 B13R1.511 Cc1ccc(cc1Br)NCC(C)C fad6f7052548229c91508f08548b4b32 [0,2,0,0,0,0|2,0,0]=4 6226 B13R1.511 Cc1ccc(cc1Br)NCC(C)O 97349de41734f5cfe7a2c6d158f8ba9b [0,2,0,0,0,0|1,0,0]=3 6227 B13R1.511 Cc1ccc(cc1Br)NC[C@H](C)O d2630299960243d390faf9aaaad8003a [0,2,0,0,0,0|1,0,0]=3 6228 B13R1.511 Cc1ccc(cc1Br)OCC(C)C bd30a04f5e7b47eb11ae35be4d82e5e0 [0,2,0,0,0,0|2,0,0]=4 6229 B13R1.511 Cc1ccc(cc1C)CNC(C)C ee25a6654956b6664f0a1beb0985cd07 [0,2,0,0,0,0|2,0,0]=4 6230 B13R1.511 Cc1ccc(cc1C)COC(C)C 47ef218f4b762d559fffbbb10250fde0 [0,2,0,0,0,0|2,0,0]=4 6231 B13R1.511 Cc1ccc(cc1C)NCC(C)C e182e2535bce0621681db53b624c9e1a [0,2,0,0,0,0|2,0,0]=4 6232 B13R1.511 Cc1ccc(cc1C)NCC(C)O 70b0030334f86c9f1e7143688328eb5d [0,2,0,0,0,0|1,0,0]=3 6233 B13R1.511 Cc1ccc(cc1C)NC[C@H](C)O 30879bb236dcc44aea2fb12728564a35 [0,2,0,0,0,0|1,0,0]=3 6234 B13R1.511 Cc1ccc(cc1C)OCC(C)C c748917ae30cb8b16329e0d2afecc94b [0,2,0,0,0,0|2,0,0]=4 6235 B13R1.511 Cc1ccc(cc1Cl)CNC(C)C beb40dfbada166ba900fd8261c231c0f [0,2,0,0,0,0|2,0,0]=4 6236 B13R1.511 Cc1ccc(cc1Cl)COC(C)C 98f5f9d6c857cacc99dd554bc2b04982 [0,2,0,0,0,0|2,0,0]=4 6237 B13R1.511 Cc1ccc(cc1Cl)NCC(C)C 5241bea00252db0eabe15939f6bd5f70 [0,2,0,0,0,0|2,0,0]=4 6238 B13R1.511 Cc1ccc(cc1Cl)NCC(C)O 36888d871036db7658ce85e40aa4ab1e [0,2,0,0,0,0|1,0,0]=3 6239 B13R1.511 Cc1ccc(cc1Cl)NC[C@@H](C)O 9fd5cade89ed3685e0edd616f1bcc73e [0,2,0,0,0,0|1,0,0]=3 6240 B13R1.511 Cc1ccc(cc1Cl)NC[C@H](C)O 44a3d956df4b365a4e12174dcd9cf3d7 [0,2,0,0,0,0|1,0,0]=3 6241 B13R1.511 Cc1ccc(cc1Cl)OCC(C)C 1af00b8d2e75ca256a2a231150d7f21a [0,2,0,0,0,0|2,0,0]=4 6242 B13R1.511 Cc1ccc(cc1F)CNC(C)C 68fc027b91a8316a748a95ed4755a671 [0,2,0,0,0,0|2,0,0]=4 6243 B13R1.511 Cc1ccc(cc1F)COC(C)C 3bd12b2106f4fb85511586c4042b7fd4 [0,2,0,0,0,0|2,0,0]=4 6244 B13R1.511 Cc1ccc(cc1F)NCC(C)C 375d0769d5b148bc724dca928b8a880c [0,2,0,0,0,0|2,0,0]=4 6245 B13R1.511 Cc1ccc(cc1F)NCC(C)O a017e2b87f233c68acba197487194124 [0,2,0,0,0,0|1,0,0]=3 6246 B13R1.511 Cc1ccc(cc1F)NC[C@@H](C)O 8cd99554f5a3dc88f98e87db25348e20 [0,2,0,0,0,0|1,0,0]=3 6247 B13R1.511 Cc1ccc(cc1F)NC[C@H](C)O b01f4ee64e8a247e25c6f227a2ab7b6b [0,2,0,0,0,0|1,0,0]=3 6248 B13R1.511 Cc1ccc(cc1F)OCC(C)C bab40d49a1e7801b7593b78ff091c6e5 [0,2,0,0,0,0|2,0,0]=4 6249 B13R1.511 Cc1ccc(cc1I)COC(C)C 89ffa1657504b5af078e05ef9b136652 [0,2,0,0,0,0|2,0,0]=4 6250 B13R1.511 Cc1ccc(cc1I)NCC(C)C 548f7785908704089bd8d1fff5f66942 [0,2,0,0,0,0|2,0,0]=4 6251 B13R1.511 Cc1ccc(cc1I)NCC(C)O 3f8e8ace938e725d032169325a4ce24f [0,2,0,0,0,0|1,0,0]=3 6252 B13R1.511 Cc1ccc(cc1I)NC[C@@H](C)O 3d24950016802d37a80ad525278507d9 [0,2,0,0,0,0|1,0,0]=3 6253 B13R1.511 Cc1ccc(cc1I)NC[C@H](C)O 1ee15e2d796e12d34ba6bc28b2f5f92a [0,2,0,0,0,0|1,0,0]=3 6254 B13R1.511 Cc1ccc(cc1I)OCC(C)C 34c81a69a235474a4a0e25fefa644633 [0,2,0,0,0,0|2,0,0]=4 6255 B13R1.511 Cc1ccc(nc1Br)NCC(C)O 3332d1bc917eff309ec9b86a68622eb4 [0,2,0,0,0,0|2,0,0]=4 6256 B13R1.511 Cc1ccc(nc1Br)NC[C@H](C)O d5023cdd3b1391fe18a2b2e900a06e78 [0,2,0,0,0,0|2,0,0]=4 6257 B13R1.511 Cc1ccc(nc1C)NCC(C)O 530c8d54b902c2361f48e267d18c38e7 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.511 Cc1ccc(nc1C)NC[C@@H](C)O bf915470290e1aa6ad6640352487bb00 [0,2,0,0,0,0|2,0,0]=4 6259 B13R1.511 Cc1ccc(nc1C)NC[C@H](C)O 6ad1b582d10c2202b7fbaf2df42d0b51 [0,2,0,0,0,0|2,0,0]=4 6260 B13R1.511 Cc1ccc(nc1Cl)NCC(C)O 7e7f9ccaf28ef0d2af9d708a0a2286fc [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.511 Cc1ccc(nc1Cl)NC[C@H](C)O d52b2e452da17da9ccd83a84436067d0 [0,2,0,0,0,0|2,0,0]=4 6262 B13R1.511 Cc1ccc(nc1F)NCC(C)O 257181c8d751051930d5fb1715eaf6a4 [0,2,0,0,0,0|2,0,0]=4 6263 B13R1.511 Cc1ccc(nc1F)NC[C@@H](C)O f2a97e4e7bd91fdc7bca0eab2df0c7eb [0,2,0,0,0,0|2,0,0]=4 6264 B13R1.511 Cc1ccc(nc1F)NC[C@H](C)O e459028984bdd5e364f941350dd5a171 [0,2,0,0,0,0|2,0,0]=4 6265 B13R1.511 Cc1cnc(cc1Br)NCC(C)O 6afcf6394e84c7247959260a7940769f [0,2,0,0,0,0|2,0,0]=4 6266 B13R1.511 Cc1cnc(cc1Br)NC[C@H](C)O f84af106738242ec5bf097c21cf64cb1 [0,2,0,0,0,0|2,0,0]=4 6267 B13R1.511 Cc1cnc(cc1C)NCC(C)O 484f91d26dab5cb07fe8920b126fb7a0 [0,2,0,0,0,0|2,0,0]=4 6268 B13R1.511 Cc1cnc(cc1C)NC[C@H](C)O 67f62bee09a8ac8dcf44c2e1771fd3e6 [0,2,0,0,0,0|2,0,0]=4 6269 B13R1.511 Cc1cnc(cc1Cl)NCC(C)O 34b187bfe873cddda499b38f19a9457a [0,2,0,0,0,0|2,0,0]=4 6270 B13R1.511 Cc1cnc(cc1Cl)NC[C@@H](C)O f9923745c5ef2815079d37ab8832ae3a [0,2,0,0,0,0|2,0,0]=4 6271 B13R1.511 Cc1cnc(cc1Cl)NC[C@H](C)O 3a89b18a7ab39dffcd8f5ef14c624349 [0,2,0,0,0,0|2,0,0]=4 6272 B13R1.511 Cc1cnc(cc1F)NCC(C)O cb435485e8d6401986590c239755a137 [0,2,0,0,0,0|2,0,0]=4 6273 B13R1.511 Cc1cnc(cc1F)NC[C@@H](C)O 299e8ac22428ba2e7d2f1e570616f3f0 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.511 Cc1cnc(cc1F)NC[C@H](C)O 8f184cb9a0a320738dde8c6fba76556e [0,2,0,0,0,0|2,0,0]=4 6275 B13R1.511 Cc1cnc(cc1I)NCC(C)O 4f46a3079fbcf3528d9461804511c24e [0,2,0,0,0,0|2,0,0]=4 6276 B13R1.511 Cc1cnc(cc1I)NC[C@@H](C)O 7f08c5b613f9f6b736d4def9b26601f1 [0,2,0,0,0,0|2,0,0]=4 6277 B13R1.511 Cc1cnc(cc1I)NC[C@H](C)O 390d97c13147e3032afba6b631cb9b57 [0,2,0,0,0,0|2,0,0]=4 6278 B13R1.511 Cc1nc(ccc1Br)NCC(C)O 7a264dc697e04e00f0acd685a612236e [0,2,0,0,0,0|2,0,0]=4 6279 B13R1.511 Cc1nc(ccc1Br)NC[C@H](C)O a1c590a241f8e20f2219de1abe349585 [0,2,0,0,0,0|2,0,0]=4 6280 B13R1.511 Cc1nc(ccc1Cl)NCC(C)O 778cf8a12ecb33f5193e8562635e03a9 [0,2,0,0,0,0|2,0,0]=4 6281 B13R1.511 Cc1nc(ccc1Cl)NC[C@H](C)O 90dcb3a088a3cf038cb705a49af966ba [0,2,0,0,0,0|2,0,0]=4 6282 B13R1.511 Cc1nc(ccc1F)NCC(C)O 410ce1b8b232585c083f1bc3bb14b71a [0,2,0,0,0,0|2,0,0]=4 6283 B13R1.511 Cc1nc(ccc1F)NC[C@H](C)O e4a78a7ee79d5bea5d7151414cd3b4d5 [0,2,0,0,0,0|2,0,0]=4 6284 B13R1.511 Cc1nc(ccc1I)NCC(C)O 5de543be9bb2e126f9ea5585083ecb9b [0,2,0,0,0,0|2,0,0]=4 6285 B13R1.511 Cc1nc(ccc1I)NC[C@H](C)O 2b70fe730df27289187a856b69a9a498 [0,2,0,0,0,0|2,0,0]=4 6286 B13R1.511 Cc1ncc(cc1Br)NCC(C)O d0c63d1ddd35a2250dbe9005e49deb4c [0,2,0,0,0,0|2,0,0]=4 6287 B13R1.511 Cc1ncc(cc1Br)NC[C@@H](C)O 8ea03477c93020b7b58bfb8c17854067 [0,2,0,0,0,0|2,0,0]=4 6288 B13R1.511 Cc1ncc(cc1Br)NC[C@H](C)O 0aaa7f05e18096e297c2843034a473a9 [0,2,0,0,0,0|2,0,0]=4 6289 B13R1.511 Cc1ncc(cc1Cl)NCC(C)O 3754d74df384a268cd57247c7330c974 [0,2,0,0,0,0|2,0,0]=4 6290 B13R1.511 Cc1ncc(cc1Cl)NC[C@@H](C)O cf61542157e9254fe697c299a7a42b87 [0,2,0,0,0,0|2,0,0]=4 6291 B13R1.511 Cc1ncc(cc1Cl)NC[C@H](C)O a00ebb5053522e738ee83bad6244a39f [0,2,0,0,0,0|2,0,0]=4 6292 B13R1.511 Cc1ncc(cc1F)NCC(C)O 3bf6db9dadffde0aa34bc91b61c1467f [0,2,0,0,0,0|2,0,0]=4 6293 B13R1.511 Cc1ncc(cc1F)NC[C@@H](C)O 689eeb9c6ccfb9416fc961478ac9bb06 [0,2,0,0,0,0|2,0,0]=4 6294 B13R1.511 Cc1ncc(cc1F)NC[C@H](C)O 519b5dd104f3b92149ac112d9da52fe2 [0,2,0,0,0,0|2,0,0]=4 6295 B13R1.512 CC(C)(C)CNc1ccc(cc1)Br 67f37132cbc65738c2074ac0a5bb064d [0,2,0,0,0,0|2,0,0]=4 6296 B13R1.512 CC(C)(C)CNc1ccc(cc1)Cl 4a1fe5c51898f2e444c7a08be49fc4d8 [0,2,0,0,0,0|2,0,0]=4 6297 B13R1.512 CC(C)(C)CNc1ccc(cc1)F 2bc9d330b7d9078cff14557832bb7bb9 [0,2,0,0,0,0|2,0,0]=4 6298 B13R1.512 CC(C)(C)CNc1ccc(cc1)I 9e3c08d97e2bf8c3c57d4c3948e6a24e [0,2,0,0,0,0|2,0,0]=4 6299 B13R1.512 CC(C)(C)CNc1ccc(cc1)S 68fc800e82efca837a4bca8714de6ceb [0,2,0,0,0,0|2,0,0]=4 6300 B13R1.512 CC(C)(C)COc1ccc(cc1)Br 3e9dfec660748e843649e3261c988718 [0,2,0,0,0,0|2,0,0]=4 6301 B13R1.512 CC(C)(C)COc1ccc(cc1)Cl 3ba95802c629d071041aae304dfdad9a [0,2,0,0,0,0|2,0,0]=4 6302 B13R1.512 CC(C)(C)COc1ccc(cc1)F 8c4acf6db30935e599ea593b2c54cd0e [0,2,0,0,0,0|2,0,0]=4 6303 B13R1.512 CC(C)(C)COc1ccc(cc1)I 11896cacb532567f1df03a552b2772c6 [0,2,0,0,0,0|2,0,0]=4 6304 B13R1.512 CC(C)(C)COc1ccc(cc1)S 89ca79441f448d0518cd69f5e20d15c6 [0,2,0,0,0,0|2,0,0]=4 6305 B13R1.512 CC(C)(C)NCc1ccc(cc1)Br 5ff1227d164bcc54f649dc819c7a601f [0,2,0,0,0,0|2,0,0]=4 6306 B13R1.512 CC(C)(C)NCc1ccc(cc1)Cl f29b4dc44957851ffad7a267d7303039 [0,2,0,0,0,0|2,0,0]=4 6307 B13R1.512 CC(C)(C)NCc1ccc(cc1)F ad85f8d69f4b396da43b46954a8da971 [0,2,0,0,0,0|2,0,0]=4 6308 B13R1.512 CC(C)(C)NCc1ccc(cc1)I c4ad8bc056ef518a9bad425b48e6f123 [0,2,0,0,0,0|2,0,0]=4 6309 B13R1.512 CC(C)(F)CNc1ccc(cc1)Br f8e20fcca6ca6c8b69dce90ae646c071 [0,2,0,0,0,0|2,0,0]=4 6310 B13R1.512 CC(C)(F)CNc1ccc(cc1)Cl 5cffd3e6cad73e4f2830ce0a2bcb26b7 [0,2,0,0,0,0|2,0,0]=4 6311 B13R1.512 CC(C)(F)CNc1ccc(cc1)F 64180f1222d350a2b82ff66b776b0317 [0,2,0,0,0,0|2,0,0]=4 6312 B13R1.512 CC(C)(F)CNc1ccc(cc1)I 23192b6942c25c9af29bc770705f88df [0,2,0,0,0,0|2,0,0]=4 6313 B13R1.512 CC(C)(F)CNc1ccc(cc1)S 0ff6fb70cca899c147001dd38f387e2c [0,2,0,0,0,0|2,0,0]=4 6314 B13R1.512 CC(C)(F)COc1ccc(cc1)Br 0a78860cc8305b0c00c3a55428f076ec [0,2,0,0,0,0|2,0,0]=4 6315 B13R1.512 CC(C)(F)COc1ccc(cc1)Cl 2be0e7ed4858f6bf2e7117286191581a [0,2,0,0,0,0|2,0,0]=4 6316 B13R1.512 CC(C)(F)COc1ccc(cc1)F c39ba5a35d94529a245f57d3aee86c15 [0,2,0,0,0,0|2,0,0]=4 6317 B13R1.512 CC(C)(F)COc1ccc(cc1)I 309e3b122e54d4d79dac67c4a08bb30b [0,2,0,0,0,0|2,0,0]=4 6318 B13R1.512 CC(C)(F)COc1ccc(cc1)S 6aa59ab673de4d082b657543670425d8 [0,2,0,0,0,0|2,0,0]=4 6319 B13R1.512 CC(C)(O)CNc1ccc(=O)[nH]c1 c869c072dacc3f0c5037bc30005e7521 [0,2,0,0,0,0|2,0,0]=4 6320 B13R1.512 CC(C)(O)CNc1ccc(cc1)Br ed2ea3208035ea41b4b7589c38c225d8 [0,2,0,0,0,0|1,0,0]=3 6321 B13R1.512 CC(C)(O)CNc1ccc(cc1)Cl 863449c5485c3c5903c8a5726b58553b [0,2,0,0,0,0|1,0,0]=3 6322 B13R1.512 CC(C)(O)CNc1ccc(cc1)F e67a0bbc3c638af7559ba32baabe7e5c [0,2,0,0,0,0|1,0,0]=3 6323 B13R1.512 CC(C)(O)CNc1ccc(cc1)I ccf487aec171e33fc6dee7986f8eae20 [0,2,0,0,0,0|1,0,0]=3 6324 B13R1.512 CC(C)(O)CNc1ccc(cc1)S cd473642b9b11d4267ad329ddfe4fd07 [0,2,0,0,0,0|1,0,0]=3 6325 B13R1.512 CC(C)(O)CNc1ccc(cn1)Br 5137126c31765c812aaad49531a9cc1f [0,2,0,0,0,0|2,0,0]=4 6326 B13R1.512 CC(C)(O)CNc1ccc(cn1)Cl 1ba2c27b146fb55875b194ab49670ab1 [0,2,0,0,0,0|2,0,0]=4 6327 B13R1.512 CC(C)(O)CNc1ccc(cn1)F 7794c3203faa57333b6ce75e66adbe30 [0,2,0,0,0,0|2,0,0]=4 6328 B13R1.512 CC(C)(O)CNc1ccc(cn1)I 34d07682ff2bcca8199e0d4f5f5ba34a [0,2,0,0,0,0|2,0,0]=4 6329 B13R1.512 CC(C)(O)CNc1ccc(nc1)Br 919902aabdad6fe62646f4e628d71429 [0,2,0,0,0,0|2,0,0]=4 6330 B13R1.512 CC(C)(O)CNc1ccc(nc1)Cl 8ef00cf7e2690d3aacc4197f1e480a25 [0,2,0,0,0,0|2,0,0]=4 6331 B13R1.512 CC(C)(O)CNc1ccc(nc1)F e215bdd328c00a5db275d1fde2484d38 [0,2,0,0,0,0|2,0,0]=4 6332 B13R1.512 CC(C)(O)CNc1ccc(nc1)I 8d892898ea9dbb0e8257e41224b3957d [0,2,0,0,0,0|2,0,0]=4 6333 B13R1.512 CC(C)(O)COc1ccc(cc1)Br 568f7adfd959c7a31bb6725d42e7fd1b [0,2,0,0,0,0|1,0,0]=3 6334 B13R1.512 CC(C)(O)COc1ccc(cc1)Cl a97f5974b4624bdb7dd9d49499c6e645 [0,2,0,0,0,0|1,0,0]=3 6335 B13R1.512 CC(C)(O)COc1ccc(cc1)F 752a61d89166129e951eebf3e2b1d0a6 [0,2,0,0,0,0|1,0,0]=3 6336 B13R1.512 CC(C)(O)COc1ccc(cc1)I 8ffb8516f05c115426fbb668858963e3 [0,2,0,0,0,0|1,0,0]=3 6337 B13R1.512 CC(C)(O)COc1ccc(cc1)S 1f99babfe9c2977bb3ec5e36bea71a00 [0,2,0,0,0,0|1,0,0]=3 6338 B13R1.512 CC(C)(O)COc1ccc(cn1)Cl ee916b3db62a344fdd7c8c8226ca6e76 [0,2,0,0,0,0|2,0,0]=4 6339 B13R1.512 CC(C)(O)COc1ccc(cn1)F 9fb37128893152f2634d3d1b5911e7fb [0,2,0,0,0,0|2,0,0]=4 6340 B13R1.512 CC(C)(O)COc1ccc(cn1)I be18a7b94186289c54e12e5c434ebb0c [0,2,0,0,0,0|2,0,0]=4 6341 B13R1.512 CC(C)(O)COc1ccc(nc1)Br 46fe157e32c2657be3ac1f94fcfe8699 [0,2,0,0,0,0|2,0,0]=4 6342 B13R1.512 CC(C)(O)COc1ccc(nc1)Cl 527f060d3084bb3846cb8b236b893b64 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.512 CC(C)(O)COc1ccc(nc1)F 9ddcad1502b9feb151892dd8cc552c93 [0,2,0,0,0,0|2,0,0]=4 6344 B13R1.512 CC(C)(O)COc1ccc(nc1)I 0b85b2efd3bc31a649fc709a32da219b [0,2,0,0,0,0|2,0,0]=4 6345 B13R1.512 CC(F)(F)CNc1ccc(cc1)Br 230012aa62bfd3779fdfe5532f03c61e [0,2,0,0,0,0|2,0,0]=4 6346 B13R1.512 CC(F)(F)CNc1ccc(cc1)Cl 9316d2a6e95acc89751a18865f00e126 [0,2,0,0,0,0|2,0,0]=4 6347 B13R1.512 CC(F)(F)CNc1ccc(cc1)F cdb481fc1bf62738c9129b88c44480e7 [0,2,0,0,0,0|2,0,0]=4 6348 B13R1.512 CC(F)(F)CNc1ccc(cc1)I d921552d01ac50847abd8a8ccbe393c1 [0,2,0,0,0,0|2,0,0]=4 6349 B13R1.512 CC(F)(F)CNc1ccc(cc1)S 381b8d2edbd539a38d492ca3131d415b [0,2,0,0,0,0|2,0,0]=4 6350 B13R1.512 CC(F)(F)COc1ccc(cc1)Br 15785ff90413810c4ece3f92fa952fa5 [0,2,0,0,0,0|2,0,0]=4 6351 B13R1.512 CC(F)(F)COc1ccc(cc1)Cl d88282edff917a8e24036cbb30fc6b62 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.512 CC(F)(F)COc1ccc(cc1)F f6810a92973f20e3677eaff0f575838d [0,2,0,0,0,0|2,0,0]=4 6353 B13R1.512 CC(F)(F)COc1ccc(cc1)I dc9233383261b27fdb7fda09f77da7cf [0,2,0,0,0,0|2,0,0]=4 6354 B13R1.512 CC(F)(F)COc1ccc(cc1)S 3a611a9425ad4304b2bb18b904a47149 [0,2,0,0,0,0|2,0,0]=4 6355 B13R1.512 Cc1ccc(cc1)CNC(C)(C)C ea511df2ba7558bd641c37351e1465ea [0,2,0,0,0,0|2,0,0]=4 6356 B13R1.512 Cc1ccc(cc1)NCC(C)(C)C e794d047a3113e0972e158df3ec11b7f [0,2,0,0,0,0|2,0,0]=4 6357 B13R1.512 Cc1ccc(cc1)NCC(C)(C)F 2806f4364480f253051d0d0e1f9d6083 [0,2,0,0,0,0|2,0,0]=4 6358 B13R1.512 Cc1ccc(cc1)NCC(C)(C)O 8fff880dbd94643038974722495689c4 [0,2,0,0,0,0|1,0,0]=3 6359 B13R1.512 Cc1ccc(cc1)NCC(C)(F)F c51a12fd675d052069f39d142581e319 [0,2,0,0,0,0|2,0,0]=4 6360 B13R1.512 Cc1ccc(cc1)OCC(C)(C)C 0b353725347c520af55952e2c1ead207 [0,2,0,0,0,0|2,0,0]=4 6361 B13R1.512 Cc1ccc(cc1)OCC(C)(C)F f54228dd34a4e1011eb33a44a14d5432 [0,2,0,0,0,0|2,0,0]=4 6362 B13R1.512 Cc1ccc(cc1)OCC(C)(C)O ee9b8048c36d5a6beda69eed7fde284a [0,2,0,0,0,0|1,0,0]=3 6363 B13R1.512 Cc1ccc(cc1)OCC(C)(F)F 822c5738e43076f8c2f4603c03f4006e [0,2,0,0,0,0|2,0,0]=4 6364 B13R1.512 Cc1ccc(cn1)NCC(C)(C)O 8a1bf82da716b6b81163fad7e454b5b1 [0,2,0,0,0,0|2,0,0]=4 6365 B13R1.512 Cc1ccc(cn1)OCC(C)(C)O 4a4932bdd8337a82f168e570bd122954 [0,2,0,0,0,0|2,0,0]=4 6366 B13R1.512 Cc1ccc(nc1)NCC(C)(C)O 5194bdca627edea71209bb8f8abc365d [0,2,0,0,0,0|2,0,0]=4 6367 B13R1.512 Cc1ccc(nc1)OCC(C)(C)O 31a58b6d6b46a71fc906f1c99e419e24 [0,2,0,0,0,0|2,0,0]=4 6368 B13R1.11 C=CC(C)NC(C)c1ccccc1 79aaae47f7827e28b52622cb8fcd832e [0,2,0,0,0,0|2,0,0]=4 6369 B13R1.11 C=CC(C)N[C@@H](C)c1ccccc1 5f5f0c679946662db5947240b7c62b87 [0,2,0,0,0,0|2,0,0]=4 6370 B13R1.11 C=CC(C)N[C@H](C)c1ccccc1 2af859ac0ae15bb864ad0122306e5dc1 [0,2,0,0,0,0|2,0,0]=4 6371 B13R1.11 C=CC(C)OC(C)c1ccccc1 9d09fffdc7be60a3eed359b27fd06691 [0,2,0,0,0,0|2,0,0]=4 6372 B13R1.11 C=CC(C)O[C@@H](C)c1ccccc1 770d524bb667e83af0e777342d670dd2 [0,2,0,0,0,0|2,0,0]=4 6373 B13R1.11 C=CC(C)O[C@H](C)c1ccccc1 85b523aa995164e812a7faf46bfb2608 [0,2,0,0,0,0|2,0,0]=4 6374 B13R1.11 C=C[C@H](C)OC(C)c1ccccc1 d1dfd21d34cd444f03ec2544048e6598 [0,2,0,0,0,0|2,0,0]=4 6375 B13R1.11 C=C[C@H](C)O[C@@H](C)c1ccccc1 a6e21f6785118372d6940fd4b3de0051 [0,2,0,0,0,0|2,0,0]=4 6376 B13R1.11 C=C[C@H](C)O[C@H](C)c1ccccc1 0111f133b0d2f2ef298ab2e8a4683610 [0,2,0,0,0,0|2,0,0]=4 6377 B13R1.11 CC(C#N)CN(C)c1ccccc1 bed6ee1150ca3597478f945e30fa61ff [0,2,0,0,0,0|2,0,0]=4 6378 B13R1.11 CC(C=O)NC(C)c1ccccc1 0cce7e19d47332aa47d5146fe0f289be [0,2,0,0,0,0|1,0,1]=4 6379 B13R1.11 CC(C=O)N[C@@H](C)c1ccccc1 68e3abbc43142e486a2e80ee1abe681c [0,2,0,0,0,0|1,0,1]=4 6380 B13R1.11 CC(C=O)N[C@H](C)c1ccccc1 32815fd5edc5568f0ef1109a250eb584 [0,2,0,0,0,0|1,0,1]=4 6381 B13R1.11 CC(C=O)OC(C)c1ccccc1 4ad6644811710976fe44034865844cbb [0,2,0,0,0,0|1,0,1]=4 6382 B13R1.11 CC(C=O)O[C@@H](C)c1ccccc1 e3ce2120fac756109349f29e31d3a16e [0,2,0,0,0,0|1,0,1]=4 6383 B13R1.11 CC(C=O)O[C@H](C)c1ccccc1 4645553cdb320af33733ef4859fccc0c [0,2,0,0,0,0|1,0,1]=4 6384 B13R1.11 CC(CO)CN(C)c1ccccc1 d6b3c8ad65a7f6d9538fbfaa12babefb [0,2,0,0,0,0|1,0,0]=3 6385 B13R1.11 CC(CO)CN(C)c1ccccn1 506c4f51e759aaabda5549f83d544122 [0,2,0,0,0,0|2,0,0]=4 6386 B13R1.11 CC(CO)CN(C)c1cccnc1 b1f25f7b7946642fd3a0cf6ea815554c [0,2,0,0,0,0|2,0,0]=4 6387 B13R1.11 CC(CO)CN(C)c1ccncc1 0c4e76553157e2e702c692ee9bac0c0c [0,2,0,0,0,0|2,0,0]=4 6388 B13R1.11 CC(CO)NC(=O)c1ccccc1 df750009c3e55e45b197efd3b545a3b5 [0,2,0,0,0,0|1,0,1]=4 6389 B13R1.11 CC(CO)NC(C)c1ccccn1 963dc843d15e04a92fc3a281eb2e1d43 [0,2,0,0,0,0|2,0,0]=4 6390 B13R1.11 CC(CO)NC(C)c1cccnc1 07e36bc383c33704ee35cb9e78ce2ca7 [0,2,0,0,0,0|2,0,0]=4 6391 B13R1.11 CC(CO)NC(C)c1ccncc1 30db6daf73365ba43c8728b422d5d169 [0,2,0,0,0,0|2,0,0]=4 6392 B13R1.11 CC(CO)N[C@@H](C)c1ccccn1 4a229c34f1fd9706da678c0242250e33 [0,2,0,0,0,0|2,0,0]=4 6393 B13R1.11 CC(CO)N[C@@H](C)c1cccnc1 b797cb10faab05917b1d5e89a8661cc5 [0,2,0,0,0,0|2,0,0]=4 6394 B13R1.11 CC(CO)N[C@@H](C)c1ccncc1 e5e7b65b604de90f57580f5ad8d14df0 [0,2,0,0,0,0|2,0,0]=4 6395 B13R1.11 CC(CO)N[C@H](C)c1ccccn1 045b12f978c170c034379f00d7afaff4 [0,2,0,0,0,0|2,0,0]=4 6396 B13R1.11 CC(CO)N[C@H](C)c1cccnc1 a34610b0d5a7d9a77086149465fbced1 [0,2,0,0,0,0|2,0,0]=4 6397 B13R1.11 CC(CO)N[C@H](C)c1ccncc1 43f02e9ea7e5bbce568bdd36854682c5 [0,2,0,0,0,0|2,0,0]=4 6398 B13R1.11 CC(N[C@@H](C)CO)c1ccccn1 2f60c66e53808ce91292ba7518984f11 [0,2,0,0,0,0|2,0,0]=4 6399 B13R1.11 CC(N[C@@H](C)CO)c1cccnc1 2a973a8bb4020f0d7af4c9d254405e0e [0,2,0,0,0,0|2,0,0]=4 6400 B13R1.11 CC(N[C@@H](C)CO)c1ccncc1 b1c8652fe11afdd14368edcbcf116620 [0,2,0,0,0,0|2,0,0]=4 6401 B13R1.11 CC(N[C@H](C)C=O)c1ccccc1 43fc4147a75554200daf6d355b3d1491 [0,2,0,0,0,0|1,0,1]=4 6402 B13R1.11 CC(N[C@H](C)CO)c1ccccn1 22965acc8e9aa67970c3b1f0783bf5f7 [0,2,0,0,0,0|2,0,0]=4 6403 B13R1.11 CC(N[C@H](C)CO)c1cccnc1 a465aa4987a72fdfa71b4af0ebee3149 [0,2,0,0,0,0|2,0,0]=4 6404 B13R1.11 CC(N[C@H](C)CO)c1ccncc1 8e2041647cf7d8ca7af334e29b23eb07 [0,2,0,0,0,0|2,0,0]=4 6405 B13R1.11 CC(O[C@H](C)C=O)c1ccccc1 9fc6f9445a6c570fdf8eddfdf1aad36b [0,2,0,0,0,0|1,0,1]=4 6406 B13R1.11 CCC(C)CN(C)c1ccccc1 e6b53dde7a74db55ad58a05fdea07312 [0,2,0,0,0,0|2,0,0]=4 6407 B13R1.11 CCC(C)OC(C)c1ccccc1 23996e8320585cc0f93c0989f3fb53ed [0,2,0,0,0,0|2,0,0]=4 6408 B13R1.11 CCC(C)O[C@@H](C)c1ccccc1 a545d3c69554c273a1806cb61b834219 [0,2,0,0,0,0|2,0,0]=4 6409 B13R1.11 CCC(C)O[C@H](C)c1ccccc1 f0a1bee70840c95fe08a6ed0b3477055 [0,2,0,0,0,0|2,0,0]=4 6410 B13R1.11 CCC(O)CN(C)c1ccccc1 a4b445ea92b447b0b0e76cfd44ad0af7 [0,2,0,0,0,0|1,0,0]=3 6411 B13R1.11 CCC(O)CN(C)c1cccnc1 318d217dd3d848c4962045580c78834a [0,2,0,0,0,0|2,0,0]=4 6412 B13R1.11 CCN(C)CC(O)c1ccccc1 d45ab040335d9c291ff1d0dee78bd157 [0,2,0,0,0,0|2,0,0]=4 6413 B13R1.11 CCN(C)C[C@H](O)c1ccccc1 f912c0d939165dc0f095ac8f10acbab6 [0,2,0,0,0,0|2,0,0]=4 6414 B13R1.11 CC[C@H](C)CN(C)c1ccccc1 5ad2d6fc9d65f8f5d517bc8783d741f0 [0,2,0,0,0,0|2,0,0]=4 6415 B13R1.11 CN(C=O)CC(O)c1ccccc1 90fced2ff5c20b184a913b9c4bc05a79 [0,2,0,0,0,0|1,0,1]=4 6416 B13R1.11 CN(C=O)C[C@H](O)c1ccccc1 8ad75ee8fd38591335e54b54c0c7070f [0,2,0,0,0,0|1,0,1]=4 6417 B13R1.11 CN(CC(O)CF)c1cccnc1 49e4bd71a5a050e63835d2ae03f9e61b [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.11 CN(CC(O)CF)c1ccncc1 c10e77fff81573aaaf46067d98c31436 [0,2,0,0,0,0|2,0,0]=4 6419 B13R1.11 CN(CC(O)CO)c1ccccc1 850967a1815530cb78704864c9803fcc [0,2,0,0,0,0|1,0,0]=3 6420 B13R1.11 CN(CC(O)CO)c1cccnc1 8ac6c22f44c44baeb9ad69ef4fd43cf1 [0,2,0,0,0,0|2,0,0]=4 6421 B13R1.11 CN(CC(O)CO)c1ccncc1 a27d63e1fe14f1c355ccef1e891c87d0 [0,2,0,0,0,0|2,0,0]=4 6422 B13R1.11 CN(CF)CC(O)c1ccccc1 6044e9a09e29a14190a89ebe0cb6c0ed [0,2,0,0,0,0|2,0,0]=4 6423 B13R1.11 CN(CF)C[C@H](O)c1ccccc1 2cd27be8bf81e10e8ef14649c6ead622 [0,2,0,0,0,0|2,0,0]=4 6424 B13R1.11 CN(CO)CC(O)c1ccccc1 55c7d0f76d5ec974a482765492db178d [0,2,0,0,0,0|1,0,0]=3 6425 B13R1.11 CN(CO)CC(O)c1ccncc1 627b7aef24024cf785d3dcf3475f4b14 [0,2,0,0,0,0|2,0,0]=4 6426 B13R1.11 CN(CO)C[C@H](O)c1ccccc1 c6cc3889b9bff3c54b6be7f32b542a6f [0,2,0,0,0,0|1,0,0]=3 6427 B13R1.11 CN(C[C@@H](O)CO)c1cccnc1 7030084353ff131d23701ab325297bd2 [0,2,0,0,0,0|2,0,0]=4 6428 B13R1.11 CN(C[C@@H](O)CO)c1ccncc1 5bc005cd6326f477e1b8011552feb4f5 [0,2,0,0,0,0|2,0,0]=4 6429 B13R1.11 CN(C[C@H](O)CO)c1cccnc1 18780b590ff92fa20e394f48254af72b [0,2,0,0,0,0|2,0,0]=4 6430 B13R1.11 CN(C[C@H](O)CO)c1ccncc1 7ddbdc18794dca697a58a7341435f14d [0,2,0,0,0,0|2,0,0]=4 6431 B13R1.11 COC(C)CN(C)c1ccccc1 d616416c2702bd0786f998a85bbdf71b [0,2,0,0,0,0|1,0,0]=3 6432 B13R1.11 COC(C)CN(C)c1ccccn1 c34455aab2c9e792f9038feb2ea42876 [0,2,0,0,0,0|2,0,0]=4 6433 B13R1.11 COC(C)CN(C)c1cccnc1 edc61336c14fcc16bffa997362b0d3be [0,2,0,0,0,0|2,0,0]=4 6434 B13R1.11 COC(C)CN(C)c1ccncc1 1e7b0f6c1ffe8a66d60f6b6b67da91f4 [0,2,0,0,0,0|2,0,0]=4 6435 B13R1.11 CO[C@@H](C)CN(C)c1ccccc1 2636c0c0747c6ae31ac651ee8b8f1e50 [0,2,0,0,0,0|1,0,0]=3 6436 B13R1.11 CO[C@@H](C)CN(C)c1ccccn1 f99a02c49f556c8223c3a3c0fa472b7d [0,2,0,0,0,0|2,0,0]=4 6437 B13R1.11 CO[C@@H](C)CN(C)c1cccnc1 615949b4c1cc29ceb59b1b1cad5f11d3 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.11 CO[C@@H](C)CN(C)c1ccncc1 f4fea37e950cbd157d1b5e3327a2ad9a [0,2,0,0,0,0|2,0,0]=4 6439 B13R1.11 CO[C@H](C)CN(C)c1ccccc1 b80b3cc9c6f1adc4a460ed4bbb66e862 [0,2,0,0,0,0|1,0,0]=3 6440 B13R1.11 CO[C@H](C)CN(C)c1ccccn1 5016771b4dcce86534e8fb23122f378b [0,2,0,0,0,0|2,0,0]=4 6441 B13R1.11 CO[C@H](C)CN(C)c1cccnc1 980babea1e44e2e94e036966356d6461 [0,2,0,0,0,0|2,0,0]=4 6442 B13R1.11 CO[C@H](C)CN(C)c1ccncc1 1e1817e224ef5de66f0e250af9f06883 [0,2,0,0,0,0|2,0,0]=4 6443 B13R1.11 C[C@@H](CO)CN(C)c1ccccc1 a6c6aa35a6a366f84b5fbac7aca70dac [0,2,0,0,0,0|1,0,0]=3 6444 B13R1.11 C[C@@H](CO)CN(C)c1ccccn1 5dc116d9c5ffaf286eb576edce541c96 [0,2,0,0,0,0|2,0,0]=4 6445 B13R1.11 C[C@@H](CO)CN(C)c1cccnc1 4d792ebfd79da47a450a9fd4c58a6795 [0,2,0,0,0,0|2,0,0]=4 6446 B13R1.11 C[C@@H](CO)CN(C)c1ccncc1 4be052d52782335cf6aebfe1263d18fb [0,2,0,0,0,0|2,0,0]=4 6447 B13R1.11 C[C@@H](CO)NC(=O)c1ccccc1 5ac46a612d039f4f7153f2869e6a4af6 [0,2,0,0,0,0|1,0,1]=4 6448 B13R1.11 C[C@@H](CO)N[C@H](C)c1ccccn1 a43159b8efdee8f9ff586e3897dea16f [0,2,0,0,0,0|2,0,0]=4 6449 B13R1.11 C[C@@H](CO)N[C@H](C)c1cccnc1 699c8162538cdf2926693fdba937d61c [0,2,0,0,0,0|2,0,0]=4 6450 B13R1.11 C[C@@H](CO)N[C@H](C)c1ccncc1 046e668cf586066e65efe412a65a6bef [0,2,0,0,0,0|2,0,0]=4 6451 B13R1.11 C[C@H](C=O)N[C@@H](C)c1ccccc1 bc6fb7a7e98fddd224eae4cd3bcb23e0 [0,2,0,0,0,0|1,0,1]=4 6452 B13R1.11 C[C@H](C=O)N[C@H](C)c1ccccc1 54ab07ab3039a0ed30a0ba1bda36a4d0 [0,2,0,0,0,0|1,0,1]=4 6453 B13R1.11 C[C@H](C=O)O[C@@H](C)c1ccccc1 645e3b7ed725cbd7b3af2b8c0ab6cd34 [0,2,0,0,0,0|1,0,1]=4 6454 B13R1.11 C[C@H](C=O)O[C@H](C)c1ccccc1 a94276114d8264bc4ad2237b77ccada1 [0,2,0,0,0,0|1,0,1]=4 6455 B13R1.11 C[C@H](CO)CN(C)c1ccccc1 6db868a9ea66ff781e65efd81dca8223 [0,2,0,0,0,0|1,0,0]=3 6456 B13R1.11 C[C@H](CO)CN(C)c1ccccn1 9f2e45d3272b4ad5500949b7c98e882f [0,2,0,0,0,0|2,0,0]=4 6457 B13R1.11 C[C@H](CO)CN(C)c1cccnc1 5d017b12f18cfe91d8b79679194bcfc0 [0,2,0,0,0,0|2,0,0]=4 6458 B13R1.11 C[C@H](CO)CN(C)c1ccncc1 2d16884616c4b5c6343a7a08c74bfd9f [0,2,0,0,0,0|2,0,0]=4 6459 B13R1.11 C[C@H](CO)NC(=O)c1ccccc1 1a37ee807e2700436419a9a18680b478 [0,2,0,0,0,0|1,0,1]=4 6460 B13R1.11 C[C@H](CO)N[C@@H](C)c1ccccn1 6048e7941b2c42461e4f523bed1c041b [0,2,0,0,0,0|2,0,0]=4 6461 B13R1.11 C[C@H](CO)N[C@@H](C)c1cccnc1 f4d82f4d29ec0b05c03f2f58b67cc138 [0,2,0,0,0,0|2,0,0]=4 6462 B13R1.11 C[C@H](CO)N[C@@H](C)c1ccncc1 2e7762e3b3620b654ef340f722cc66cf [0,2,0,0,0,0|2,0,0]=4 6463 B13R1.11 C[C@H](CO)N[C@H](C)c1ccccn1 fe7d79aa50d4a4756fb1da39327d0bb2 [0,2,0,0,0,0|2,0,0]=4 6464 B13R1.11 C[C@H](CO)N[C@H](C)c1cccnc1 38919da6ac8c06556f3c2fd526b2d692 [0,2,0,0,0,0|2,0,0]=4 6465 B13R1.11 C[C@H](CO)N[C@H](C)c1ccncc1 03e6b84a4617c662ecd78c2857b498e8 [0,2,0,0,0,0|2,0,0]=4 6466 B13R1.11 C[C@H](N[C@@H](C)CO)c1ccccn1 6333bce3cff1eb923db36e801919bf69 [0,2,0,0,0,0|2,0,0]=4 6467 B13R1.11 C[C@H](N[C@@H](C)CO)c1cccnc1 a9f6b4865cd242ef062e137f18bb5e9c [0,2,0,0,0,0|2,0,0]=4 6468 B13R1.11 C[C@H](N[C@@H](C)CO)c1ccncc1 02b53af044b56f7d8bd9526f91878b87 [0,2,0,0,0,0|2,0,0]=4 6469 B13R1.15 C#CC(C)NCc1cccc(c1)Br 46be124b76e911d99ea4c0bfa73fa500 [0,2,0,0,0,0|2,0,0]=4 6470 B13R1.15 C#CC(C)NCc1cccc(c1)C 273327e836b11055fefe6a37cbbbdabf [0,2,0,0,0,0|2,0,0]=4 6471 B13R1.15 C#CC(C)NCc1cccc(c1)Cl e8366f626bb411ca80495c1609baa3e0 [0,2,0,0,0,0|2,0,0]=4 6472 B13R1.15 C#CC(C)NCc1cccc(c1)F f84c78a0c72656a168ef6c542e798093 [0,2,0,0,0,0|2,0,0]=4 6473 B13R1.15 C#CC(C)NCc1cccc(c1)I 4b7bf24de04ec6b01e8b3e20b50d3531 [0,2,0,0,0,0|2,0,0]=4 6474 B13R1.15 C#CC(C)OCc1cccc(c1)Br c50460886614a56d47711b9e4ecaa3b4 [0,2,0,0,0,0|2,0,0]=4 6475 B13R1.15 C#CC(C)OCc1cccc(c1)C 02c725c4ec0831d557ec9ff8edb1c5b2 [0,2,0,0,0,0|2,0,0]=4 6476 B13R1.15 C#CC(C)OCc1cccc(c1)Cl 09a9607b109b5c4794d8c81c9e477736 [0,2,0,0,0,0|2,0,0]=4 6477 B13R1.15 C#CC(C)OCc1cccc(c1)F e9fd78f91a6a0a0cbe67fd8a8cd3b153 [0,2,0,0,0,0|2,0,0]=4 6478 B13R1.15 C#CC(C)OCc1cccc(c1)I dff6358822a5ce224c9ff04a8c4a8b8c [0,2,0,0,0,0|2,0,0]=4 6479 B13R1.15 C#C[C@@H](C)NCc1cccc(c1)Br 117fd839c77064b9aa2ac392d98b5f69 [0,2,0,0,0,0|2,0,0]=4 6480 B13R1.15 C#C[C@@H](C)NCc1cccc(c1)C 4d3bbe5e494442e95950b17ac9896128 [0,2,0,0,0,0|2,0,0]=4 6481 B13R1.15 C#C[C@@H](C)NCc1cccc(c1)Cl 72d0f94a2f9e30d40af101aa1ece5194 [0,2,0,0,0,0|2,0,0]=4 6482 B13R1.15 C#C[C@@H](C)NCc1cccc(c1)F ff27449bda2237eb7192189d4c9518e7 [0,2,0,0,0,0|2,0,0]=4 6483 B13R1.15 C#C[C@@H](C)NCc1cccc(c1)I e54096072ef37c7c0625aae2b0b4ed0f [0,2,0,0,0,0|2,0,0]=4 6484 B13R1.15 C#C[C@@H](C)OCc1cccc(c1)Br 0f4176a57d809fdd89a29522fe1b542d [0,2,0,0,0,0|2,0,0]=4 6485 B13R1.15 C#C[C@@H](C)OCc1cccc(c1)C b4cc3df1d47349d181c1dfa418b5ee89 [0,2,0,0,0,0|2,0,0]=4 6486 B13R1.15 C#C[C@@H](C)OCc1cccc(c1)Cl 731a88cf75ea061e21a78010d69ee36b [0,2,0,0,0,0|2,0,0]=4 6487 B13R1.15 C#C[C@@H](C)OCc1cccc(c1)F 5e44327a19102ee8cde183c239459683 [0,2,0,0,0,0|2,0,0]=4 6488 B13R1.15 C#C[C@@H](C)OCc1cccc(c1)I 80439c69b127cd54d136ce68116342ff [0,2,0,0,0,0|2,0,0]=4 6489 B13R1.15 C#C[C@H](C)NCc1cccc(c1)Br 5f16e325fec0066f6f5c1afa1bfebcdb [0,2,0,0,0,0|2,0,0]=4 6490 B13R1.15 C#C[C@H](C)NCc1cccc(c1)C 27b75534691fb22a4f3c1d63220e8cfb [0,2,0,0,0,0|2,0,0]=4 6491 B13R1.15 C#C[C@H](C)NCc1cccc(c1)Cl 1b2f1ee8bd1c1a5ffa2201ab2c92ad25 [0,2,0,0,0,0|2,0,0]=4 6492 B13R1.15 C#C[C@H](C)NCc1cccc(c1)F 7d6cb4417f06741a718c842deb691f88 [0,2,0,0,0,0|2,0,0]=4 6493 B13R1.15 C#C[C@H](C)NCc1cccc(c1)I 57fa59e5c54592b029608c39a9698dc3 [0,2,0,0,0,0|2,0,0]=4 6494 B13R1.15 C#C[C@H](C)OCc1cccc(c1)Br 8df3b863a7b8540fbad8477b08ed1699 [0,2,0,0,0,0|2,0,0]=4 6495 B13R1.15 C#C[C@H](C)OCc1cccc(c1)C eb220e9b22ba520d6b9b513ecb80c207 [0,2,0,0,0,0|2,0,0]=4 6496 B13R1.15 C#C[C@H](C)OCc1cccc(c1)Cl e8ad7176448c0a12061451416626d196 [0,2,0,0,0,0|2,0,0]=4 6497 B13R1.15 C#C[C@H](C)OCc1cccc(c1)F 8c973af4671605ee65419ef96bd54ef2 [0,2,0,0,0,0|2,0,0]=4 6498 B13R1.15 C#C[C@H](C)OCc1cccc(c1)I 7283e56a5d7d35d643d83ce825ae606b [0,2,0,0,0,0|2,0,0]=4 6499 B13R1.15 C=CC(C)NCc1cccc(c1)Br 979bce57887ff03c5de10c64ad1ff6e6 [0,2,0,0,0,0|2,0,0]=4 6500 B13R1.15 C=CC(C)NCc1cccc(c1)C 2202cf4b8fb62e625a231fc10ab77ffa [0,2,0,0,0,0|2,0,0]=4 6501 B13R1.15 C=CC(C)NCc1cccc(c1)Cl c3cc38a98d920cf9b7e62eece19cdd16 [0,2,0,0,0,0|2,0,0]=4 6502 B13R1.15 C=CC(C)NCc1cccc(c1)F 2c77e67d83f66e4c3b7645734eceac12 [0,2,0,0,0,0|2,0,0]=4 6503 B13R1.15 C=CC(C)NCc1cccc(c1)I a3e34bb97d2062cab7bd1b441bec550d [0,2,0,0,0,0|2,0,0]=4 6504 B13R1.15 C=CC(C)OCc1cccc(c1)Br 67fd76f8f82f658d3e1bf8e298a9387d [0,2,0,0,0,0|2,0,0]=4 6505 B13R1.15 C=CC(C)OCc1cccc(c1)C dfca86f05031941dc90ddec9b2a2906c [0,2,0,0,0,0|2,0,0]=4 6506 B13R1.15 C=CC(C)OCc1cccc(c1)Cl 30c86df9750947b007f3dceaad593807 [0,2,0,0,0,0|2,0,0]=4 6507 B13R1.15 C=CC(C)OCc1cccc(c1)F 804728d03805d1312f029f1c830017f8 [0,2,0,0,0,0|2,0,0]=4 6508 B13R1.15 C=CC(C)OCc1cccc(c1)I f62f577090f18a0edebbe37630a699bd [0,2,0,0,0,0|2,0,0]=4 6509 B13R1.15 C=CC(O)CNc1cccc(c1)C 8106e165d665ced654fba2c3f14073fa [0,2,0,0,0,0|1,0,1]=4 6510 B13R1.15 C=CC(O)CNc1cccc(c1)F 0f3cc9c3d4d024862280fd52ed908fa4 [0,2,0,0,0,0|1,0,1]=4 6511 B13R1.15 C=CC(O)CNc1cccc(c1)O 92d12df8e9e152ffbd36499760b74ca4 [0,2,0,0,0,0|1,0,1]=4 6512 B13R1.15 C=CC(O)CNc1cccc(c1)S ad069673a2ef14c38f738ca6e51b8310 [0,2,0,0,0,0|1,0,1]=4 6513 B13R1.15 C=C[C@H](C)OCc1cccc(c1)Br 6a162d43304ed0ade4498f912a301c56 [0,2,0,0,0,0|2,0,0]=4 6514 B13R1.15 C=C[C@H](C)OCc1cccc(c1)C ce0296ece0ef4fcf1645090da8cea58c [0,2,0,0,0,0|2,0,0]=4 6515 B13R1.15 C=C[C@H](C)OCc1cccc(c1)Cl 2f151d6f57db7f810f07b56c7f4ab5bd [0,2,0,0,0,0|2,0,0]=4 6516 B13R1.15 C=C[C@H](C)OCc1cccc(c1)F 26dab6448d46d7b1a30cb5c1bd5d9e11 [0,2,0,0,0,0|2,0,0]=4 6517 B13R1.15 C=C[C@H](C)OCc1cccc(c1)I d575d943d1eebc83435e25e10c5d6fce [0,2,0,0,0,0|2,0,0]=4 6518 B13R1.15 CC(C#N)CNc1cccc(c1)Br a4cbab53d4b37905dc98755001c5b359 [0,2,0,0,0,0|2,0,0]=4 6519 B13R1.15 CC(C#N)CNc1cccc(c1)Cl b7fc554e2479012a82ef4320ee9aff26 [0,2,0,0,0,0|2,0,0]=4 6520 B13R1.15 CC(C#N)CNc1cccc(c1)F 4a8383b0d2d62ff4a4aa15fc85dd6887 [0,2,0,0,0,0|2,0,0]=4 6521 B13R1.15 CC(C#N)CNc1cccc(c1)I b80e8c1574e75ad30e21b3147131fca5 [0,2,0,0,0,0|2,0,0]=4 6522 B13R1.15 CC(C#N)COc1cccc(c1)Br 6a9b1c5a5d93c774a81fadc895d2eaec [0,2,0,0,0,0|2,0,0]=4 6523 B13R1.15 CC(C#N)COc1cccc(c1)Cl 290f9382c3ec28d642a652d11eef0302 [0,2,0,0,0,0|2,0,0]=4 6524 B13R1.15 CC(C#N)COc1cccc(c1)F 0e8b1f427c9efb27bcbe693f250c7b1c [0,2,0,0,0,0|2,0,0]=4 6525 B13R1.15 CC(C#N)COc1cccc(c1)I 4117231a23c9d73c102d2c42c08e4bd1 [0,2,0,0,0,0|2,0,0]=4 6526 B13R1.15 CC(C#N)COc1cccc(c1)S 5e35ddb937aed36b8cf3b447751b6959 [0,2,0,0,0,0|2,0,0]=4 6527 B13R1.15 CC(C#N)NCc1cccc(c1)Br c16ad6bb35a9525fcfbe49d7c2528deb [0,2,0,0,0,0|2,0,0]=4 6528 B13R1.15 CC(C#N)NCc1cccc(c1)Cl 921f285aa424e0bc9be302dda41a9e38 [0,2,0,0,0,0|2,0,0]=4 6529 B13R1.15 CC(C#N)NCc1cccc(c1)F 5a0347a48bc51eb728c3f2060ff2e47b [0,2,0,0,0,0|2,0,0]=4 6530 B13R1.15 CC(C#N)NCc1cccc(c1)I 444b65043c5042eaccc2b1657fe10131 [0,2,0,0,0,0|2,0,0]=4 6531 B13R1.15 CC(C=O)NCc1cccc(c1)Br 7387d47c8be521f90699fe14bb3ce080 [0,2,0,0,0,0|1,0,1]=4 6532 B13R1.15 CC(C=O)NCc1cccc(c1)Cl 7949032bfc06a964268cf0942d756401 [0,2,0,0,0,0|1,0,1]=4 6533 B13R1.15 CC(C=O)NCc1cccc(c1)F d5119fa02290fa128532e1f2e6755c4f [0,2,0,0,0,0|1,0,1]=4 6534 B13R1.15 CC(C=O)NCc1cccc(c1)I cc303cfe9c75cbb03b3bf6400db92960 [0,2,0,0,0,0|1,0,1]=4 6535 B13R1.15 CC(C=O)OCc1cccc(c1)Br 6ad03e7733e6b1d8a0c3194cda497cb8 [0,2,0,0,0,0|1,0,1]=4 6536 B13R1.15 CC(C=O)OCc1cccc(c1)Cl f3378245606a101f3e85251a239e6689 [0,2,0,0,0,0|1,0,1]=4 6537 B13R1.15 CC(C=O)OCc1cccc(c1)F 43ab5621f14f7f35397f2277a1c18f34 [0,2,0,0,0,0|1,0,1]=4 6538 B13R1.15 CC(C=O)OCc1cccc(c1)I 2c58eab211739dfd978013f87a31a341 [0,2,0,0,0,0|1,0,1]=4 6539 B13R1.15 CC(CF)OCc1cccc(c1)Br e4c572b0ecddc19d9a32ee3068540bbb [0,2,0,0,0,0|2,0,0]=4 6540 B13R1.15 CC(CF)OCc1cccc(c1)Cl 946e790aacbcfaf16344585a58e2c2f2 [0,2,0,0,0,0|2,0,0]=4 6541 B13R1.15 CC(CF)OCc1cccc(c1)F 1a360ec869cb36de679bf4021494596c [0,2,0,0,0,0|2,0,0]=4 6542 B13R1.15 CC(CF)OCc1cccc(c1)I 9ff421cc5f5587b731c4faa672c7ab64 [0,2,0,0,0,0|2,0,0]=4 6543 B13R1.15 CC(CO)CNc1cc(ccn1)Br 0dc1d13785f5d0df161fb7eb3d8d47ab [0,2,0,0,0,0|2,0,0]=4 6544 B13R1.15 CC(CO)CNc1cc(ccn1)Cl e632b33a0a16db0da117d4f202641415 [0,2,0,0,0,0|2,0,0]=4 6545 B13R1.15 CC(CO)CNc1cc(ccn1)F c38355a126c8e26611b6680fb1db73d2 [0,2,0,0,0,0|2,0,0]=4 6546 B13R1.15 CC(CO)CNc1cc(ccn1)I ea11cf4500f00b2c29d707345781b474 [0,2,0,0,0,0|2,0,0]=4 6547 B13R1.15 CC(CO)CNc1cc[nH]c(=S)c1 06358ec7e37b08ff40ca6c1191948aaf [0,2,0,0,0,0|2,0,0]=4 6548 B13R1.15 CC(CO)CNc1cccc(=O)[nH]1 438d8591b0ee6a4b03f0f508786c257e [0,2,0,0,0,0|2,0,0]=4 6549 B13R1.15 CC(CO)CNc1cccc(c1)Br cda5e64e39fe2ba4fe1fb9f5613d7d6f [0,2,0,0,0,0|1,0,0]=3 6550 B13R1.15 CC(CO)CNc1cccc(c1)Cl 0f27600b38e1ddc2c80f3b3b02920cdc [0,2,0,0,0,0|1,0,0]=3 6551 B13R1.15 CC(CO)CNc1cccc(c1)F 27a80e12613e71d1523c16f2fcc29ff7 [0,2,0,0,0,0|1,0,0]=3 6552 B13R1.15 CC(CO)CNc1cccc(c1)I 4e4ca65db29503f0d913311a3d895ddf [0,2,0,0,0,0|1,0,0]=3 6553 B13R1.15 CC(CO)CNc1cccc(c1)S b34d15daa22ae4affae8a42636897b9a [0,2,0,0,0,0|1,0,0]=3 6554 B13R1.15 CC(CO)CNc1cccc(n1)Br 167da3d78cf0213003fb15b6888ae692 [0,2,0,0,0,0|2,0,0]=4 6555 B13R1.15 CC(CO)CNc1cccc(n1)Cl 2cc47c608c91d749dac4a26f4bf7aa6d [0,2,0,0,0,0|2,0,0]=4 6556 B13R1.15 CC(CO)CNc1cccc(n1)F ae98320726448fe2271a0b469cc5af88 [0,2,0,0,0,0|2,0,0]=4 6557 B13R1.15 CC(CO)CNc1cccc(n1)I 0e99b463269a2e59488270b74a6d0ec9 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.15 CC(CO)CNc1ccnc(c1)Br 9aca420d28513cd1850b5c52e52e3d7c [0,2,0,0,0,0|2,0,0]=4 6559 B13R1.15 CC(CO)CNc1ccnc(c1)Cl 9dab88f33d72fff831557f777491b9d7 [0,2,0,0,0,0|2,0,0]=4 6560 B13R1.15 CC(CO)CNc1ccnc(c1)F 250db727a7e682adba0cad01c6cdc664 [0,2,0,0,0,0|2,0,0]=4 6561 B13R1.15 CC(CO)CNc1ccnc(c1)I 9e5873beb5ece1d4edc5c8b584efcddf [0,2,0,0,0,0|2,0,0]=4 6562 B13R1.15 CC(CO)CNc1cncc(c1)Br fac39f605e0baa256716b033b95de8a4 [0,2,0,0,0,0|2,0,0]=4 6563 B13R1.15 CC(CO)CNc1cncc(c1)Cl 7ed1cb8b3cdf1bf26cd07d3aeeaca627 [0,2,0,0,0,0|2,0,0]=4 6564 B13R1.15 CC(CO)CNc1cncc(c1)F 57bac76a9382dd0e91d3f73ba9f71d08 [0,2,0,0,0,0|2,0,0]=4 6565 B13R1.15 CC(CO)CNc1cncc(c1)I 140d19b6492c9d02dc4773a81f18f342 [0,2,0,0,0,0|2,0,0]=4 6566 B13R1.15 CC(CO)NCc1cc(ccn1)Br 865fabb60856bebe215cb935872003e8 [0,2,0,0,0,0|2,0,0]=4 6567 B13R1.15 CC(CO)NCc1cc(ccn1)Cl e94315260f4305814f2a545e11bd207a [0,2,0,0,0,0|2,0,0]=4 6568 B13R1.15 CC(CO)NCc1cc[nH]c(=O)c1 3176c715f0ae4ae959079892e9174b47 [0,2,0,0,0,0|2,0,0]=4 6569 B13R1.15 CC(CO)NCc1ccc[n+](c1)[O-] 3a3b63fb1a93c4922b55a47f17f8bc38 [0,2,0,0,0,0|2,0,0]=4 6570 B13R1.15 CC(CO)NCc1cccc(c1)Br 046476d86d08bc724a35c1c49c3fbb05 [0,2,0,0,0,0|1,0,0]=3 6571 B13R1.15 CC(CO)NCc1cccc(c1)Cl 3b1506bd00691bea28056136d8de6108 [0,2,0,0,0,0|1,0,0]=3 6572 B13R1.15 CC(CO)NCc1cccc(c1)F 3980f84f7761f10409bd9f437fc98f08 [0,2,0,0,0,0|1,0,0]=3 6573 B13R1.15 CC(CO)NCc1cccc(c1)I c8d87f6dd474d7f88ade8f6135b7d4e2 [0,2,0,0,0,0|1,0,0]=3 6574 B13R1.15 CC(CO)NCc1cccc(n1)Br 4e45c0df7ebf4a3d66701bc357f0ee07 [0,2,0,0,0,0|2,0,0]=4 6575 B13R1.15 CC(CO)NCc1cccc(n1)Cl a55e2fb63acf0c058a2901f9b3d95689 [0,2,0,0,0,0|2,0,0]=4 6576 B13R1.15 CC(CO)NCc1cccc(n1)F c459f3a63bd87f6c191649cec1a4fe10 [0,2,0,0,0,0|2,0,0]=4 6577 B13R1.15 CC(CO)NCc1ccnc(c1)Br 6c4c343dc00983c0bc76569ddf9518dc [0,2,0,0,0,0|2,0,0]=4 6578 B13R1.15 CC(CO)NCc1ccnc(c1)Cl 9a0340426faf45e177083a14a63d4cb9 [0,2,0,0,0,0|2,0,0]=4 6579 B13R1.15 CC(CO)NCc1ccnc(c1)F 37a4fcaec8eb058d675d1443c8c39b00 [0,2,0,0,0,0|2,0,0]=4 6580 B13R1.15 CC(CO)NCc1cncc(c1)Br e0fb576649d55ce8e0141417d8b3e1dd [0,2,0,0,0,0|2,0,0]=4 6581 B13R1.15 CC(CO)NCc1cncc(c1)Cl 73e9a77f6e8bacf12402f217bcd20e41 [0,2,0,0,0,0|2,0,0]=4 6582 B13R1.15 CC(CO)NCc1cncc(c1)F 2465fefce56a1467e7ba1589beb4964d [0,2,0,0,0,0|2,0,0]=4 6583 B13R1.15 CC(CS)OCc1cccc(c1)Br b0370fdb34c85c8ad40c8b9a85944c31 [0,2,0,0,0,0|1,1,0]=4 6584 B13R1.15 CC(CS)OCc1cccc(c1)Cl f29beb206796c7fc7868cb3aa803eaf4 [0,2,0,0,0,0|1,1,0]=4 6585 B13R1.15 CC(CS)OCc1cccc(c1)F fc44d6d7c505082e1768187459f1ca53 [0,2,0,0,0,0|1,1,0]=4 6586 B13R1.15 CC(CS)OCc1cccc(c1)I ef709da4f17567d1f31781de2cf6efac [0,2,0,0,0,0|1,1,0]=4 6587 B13R1.15 CCC(C)CNc1cccc(c1)Br c89e0b88334f41232b39525cb5d4a8aa [0,2,0,0,0,0|2,0,0]=4 6588 B13R1.15 CCC(C)CNc1cccc(c1)C da7301efe063882b034a27ce2a212575 [0,2,0,0,0,0|2,0,0]=4 6589 B13R1.15 CCC(C)CNc1cccc(c1)Cl 1d165577b7589833c52809cc52145205 [0,2,0,0,0,0|2,0,0]=4 6590 B13R1.15 CCC(C)CNc1cccc(c1)F cdc9539d3d260b8788e7ddaa69c3c386 [0,2,0,0,0,0|2,0,0]=4 6591 B13R1.15 CCC(C)CNc1cccc(c1)I 683fd95ffc1a673f51503a80dd90a008 [0,2,0,0,0,0|2,0,0]=4 6592 B13R1.15 CCC(C)CNc1cccc(c1)S b04f6d9862ae3f29024d332ee07bad53 [0,2,0,0,0,0|2,0,0]=4 6593 B13R1.15 CCC(C)COc1cccc(c1)Br fd3a871c19f35786324bfad7bf56cebe [0,2,0,0,0,0|2,0,0]=4 6594 B13R1.15 CCC(C)COc1cccc(c1)C e5cd5bf811b2b5fd04ef186ebbf9c492 [0,2,0,0,0,0|2,0,0]=4 6595 B13R1.15 CCC(C)COc1cccc(c1)Cl dd09f3e6efa2bb1cbca666bd792b5577 [0,2,0,0,0,0|2,0,0]=4 6596 B13R1.15 CCC(C)COc1cccc(c1)F 9c8cd99bcd41c34e8fe433d27d8a3891 [0,2,0,0,0,0|2,0,0]=4 6597 B13R1.15 CCC(C)COc1cccc(c1)I b6d70c33f760e1e54dbf3a6ee6a2b28e [0,2,0,0,0,0|2,0,0]=4 6598 B13R1.15 CCC(C)COc1cccc(c1)S 4fc78cc3d67b7b228fb3835228ace3b9 [0,2,0,0,0,0|2,0,0]=4 6599 B13R1.15 CCC(C)NCc1cccc(c1)Br b7c461b55ca6b583505584280087d4b7 [0,2,0,0,0,0|2,0,0]=4 6600 B13R1.15 CCC(C)NCc1cccc(c1)C ca70dcadd5661a8b1827d668f5a52e30 [0,2,0,0,0,0|2,0,0]=4 6601 B13R1.15 CCC(C)NCc1cccc(c1)Cl a5434aeb7e9c49b4844731e8f0a95be7 [0,2,0,0,0,0|2,0,0]=4 6602 B13R1.15 CCC(C)NCc1cccc(c1)F 7b025b58be34b0656490f345b605ceb0 [0,2,0,0,0,0|2,0,0]=4 6603 B13R1.15 CCC(C)NCc1cccc(c1)I 3daff5ce7c61dfce5266b93a173021e6 [0,2,0,0,0,0|2,0,0]=4 6604 B13R1.15 CCC(C)OCc1cccc(c1)Br cbd5ed07998e8fd95653091cfb0c0257 [0,2,0,0,0,0|2,0,0]=4 6605 B13R1.15 CCC(C)OCc1cccc(c1)C 251174eb7c4f92c0a92bb1803dbbb77c [0,2,0,0,0,0|2,0,0]=4 6606 B13R1.15 CCC(C)OCc1cccc(c1)Cl 2fd7c987c77cebcb64c63a0ab783a72a [0,2,0,0,0,0|2,0,0]=4 6607 B13R1.15 CCC(C)OCc1cccc(c1)F 110d551a8a6dbe449e858b7fabab179f [0,2,0,0,0,0|2,0,0]=4 6608 B13R1.15 CCC(C)OCc1cccc(c1)I bacc020725e8248c3690baca4b231d8d [0,2,0,0,0,0|2,0,0]=4 6609 B13R1.15 CCC(O)CNc1cc(ccn1)Br c080b41fa2b90b18869641938991a458 [0,2,0,0,0,0|2,0,0]=4 6610 B13R1.15 CCC(O)CNc1cc(ccn1)C 5cc3048103a7fd316e2b2201fc315966 [0,2,0,0,0,0|2,0,0]=4 6611 B13R1.15 CCC(O)CNc1cc(ccn1)Cl e3426153894a6af6fc8704def0364ce8 [0,2,0,0,0,0|2,0,0]=4 6612 B13R1.15 CCC(O)CNc1cc(ccn1)F 7ee6116a455ffa42300465a2b937c326 [0,2,0,0,0,0|2,0,0]=4 6613 B13R1.15 CCC(O)CNc1cc(ccn1)I 478993bf29d7dd15095f43257e590db4 [0,2,0,0,0,0|2,0,0]=4 6614 B13R1.15 CCC(O)CNc1cc[nH]c(=S)c1 a7a0cada384cd5c6361d392572038ddb [0,2,0,0,0,0|2,0,0]=4 6615 B13R1.15 CCC(O)CNc1cccc(c1)Br 62f5e2ed660afee868a1fb3a455e3586 [0,2,0,0,0,0|1,0,0]=3 6616 B13R1.15 CCC(O)CNc1cccc(c1)C 24103e0914c9e1eede68e6c8962eb804 [0,2,0,0,0,0|1,0,0]=3 6617 B13R1.15 CCC(O)CNc1cccc(c1)Cl a28a2d0533c65f3add3e5ad3786f5bcf [0,2,0,0,0,0|1,0,0]=3 6618 B13R1.15 CCC(O)CNc1cccc(c1)F efd9f1d32112e700ddf5b5abb47d06d5 [0,2,0,0,0,0|1,0,0]=3 6619 B13R1.15 CCC(O)CNc1cccc(c1)I 808565da50f2b37374aeca3f44722d51 [0,2,0,0,0,0|1,0,0]=3 6620 B13R1.15 CCC(O)CNc1cccc(c1)S ba536dc4bf63bfffefe32225b3071338 [0,2,0,0,0,0|1,0,0]=3 6621 B13R1.15 CCC(O)CNc1cccc(n1)Br 8542185b7ac42f2736dba7bd87b15569 [0,2,0,0,0,0|2,0,0]=4 6622 B13R1.15 CCC(O)CNc1cccc(n1)C ed9c42ba9ce783c4c6132fcef7acf588 [0,2,0,0,0,0|2,0,0]=4 6623 B13R1.15 CCC(O)CNc1cccc(n1)Cl 1c5d8851ee57a92f624ea01d35013032 [0,2,0,0,0,0|2,0,0]=4 6624 B13R1.15 CCC(O)CNc1cccc(n1)F 29e161f5116ccb63404bca19f342d010 [0,2,0,0,0,0|2,0,0]=4 6625 B13R1.15 CCC(O)CNc1cccc(n1)I f71fdae7440a12adceffd820e7e49caf [0,2,0,0,0,0|2,0,0]=4 6626 B13R1.15 CCC(O)CNc1ccnc(c1)Br 5866d23ab89065aaa894d0c6a160f652 [0,2,0,0,0,0|2,0,0]=4 6627 B13R1.15 CCC(O)CNc1ccnc(c1)C 2b9899f9d2b7b2f116997b20da1523ca [0,2,0,0,0,0|2,0,0]=4 6628 B13R1.15 CCC(O)CNc1ccnc(c1)Cl fd6833d777f6aa5d3a128f663a7cd3ac [0,2,0,0,0,0|2,0,0]=4 6629 B13R1.15 CCC(O)CNc1ccnc(c1)F ed15f05d43270f779dbee316d02298ae [0,2,0,0,0,0|2,0,0]=4 6630 B13R1.15 CCC(O)CNc1ccnc(c1)I b7a57e8422c1d0c623d8304e7428ed62 [0,2,0,0,0,0|2,0,0]=4 6631 B13R1.15 CCC(O)CNc1cncc(c1)C 5cb1dd46e0d0bf88e9a4bf4a2743d285 [0,2,0,0,0,0|2,0,0]=4 6632 B13R1.15 CCC(O)CNc1cncc(c1)Cl b3e48da03dfb6c3d4d8a7b27fd223dbf [0,2,0,0,0,0|2,0,0]=4 6633 B13R1.15 CCC(O)CNc1cncc(c1)F 0ab2687d6d09b446af00de358483fd07 [0,2,0,0,0,0|2,0,0]=4 6634 B13R1.15 CCC(O)CNc1cncc(c1)I 84a8c19ce01201d07a142963bac72b5b [0,2,0,0,0,0|2,0,0]=4 6635 B13R1.15 CCN(C)CCc1cccc(c1)Br 306252103fd3f17e538aea4452e72c82 [0,2,0,0,0,0|2,0,0]=4 6636 B13R1.15 CCN(C)CCc1cccc(c1)C 7dbd9be2f700a394aa296b727c64fc12 [0,2,0,0,0,0|2,0,0]=4 6637 B13R1.15 CCN(C)CCc1cccc(c1)Cl 7cc8eba487c78db449fa325079add7d6 [0,2,0,0,0,0|2,0,0]=4 6638 B13R1.15 CCN(C)CCc1cccc(c1)F 094f05b40559d58f88ba074870b9f125 [0,2,0,0,0,0|2,0,0]=4 6639 B13R1.15 CC[C@@H](C)CNc1cccc(c1)Br 228d3d0ccf312b07be9b3e21cef37f03 [0,2,0,0,0,0|2,0,0]=4 6640 B13R1.15 CC[C@@H](C)CNc1cccc(c1)C c0723b2e3985481e7d9b4c9b5c725550 [0,2,0,0,0,0|2,0,0]=4 6641 B13R1.15 CC[C@@H](C)CNc1cccc(c1)Cl 9088c2fba771afde59a62212a18a0397 [0,2,0,0,0,0|2,0,0]=4 6642 B13R1.15 CC[C@@H](C)CNc1cccc(c1)F 840b1f388f2d9fd3da459088c5aba8c5 [0,2,0,0,0,0|2,0,0]=4 6643 B13R1.15 CC[C@@H](C)CNc1cccc(c1)I 8d054f81697b272a1ac9539e6b00e408 [0,2,0,0,0,0|2,0,0]=4 6644 B13R1.15 CC[C@@H](C)CNc1cccc(c1)S 365e65ab685d9a923fa648185ebc2831 [0,2,0,0,0,0|2,0,0]=4 6645 B13R1.15 CC[C@@H](C)COc1cccc(c1)Br a776385868998a7c426ee9a956dda7f0 [0,2,0,0,0,0|2,0,0]=4 6646 B13R1.15 CC[C@@H](C)COc1cccc(c1)C 1d6cfb88b7c54f15ef2f072862ea0bd1 [0,2,0,0,0,0|2,0,0]=4 6647 B13R1.15 CC[C@@H](C)COc1cccc(c1)Cl 7978dc01d6ff78af1c8aa5828af1f550 [0,2,0,0,0,0|2,0,0]=4 6648 B13R1.15 CC[C@@H](C)COc1cccc(c1)F adbddbeed9c184906e9737379d5c6dd9 [0,2,0,0,0,0|2,0,0]=4 6649 B13R1.15 CC[C@@H](C)COc1cccc(c1)I 9f532a32078671fd2f17802ad18baceb [0,2,0,0,0,0|2,0,0]=4 6650 B13R1.15 CC[C@@H](C)COc1cccc(c1)S 8a17a3189123b4b75a0fda568fc4afeb [0,2,0,0,0,0|2,0,0]=4 6651 B13R1.15 CC[C@@H](C)NCc1cccc(c1)Br 8a4f7f5082da4a618683c517a00cd26d [0,2,0,0,0,0|2,0,0]=4 6652 B13R1.15 CC[C@@H](C)NCc1cccc(c1)C 39e297881f7f2803d8ae3320edd7b8c4 [0,2,0,0,0,0|2,0,0]=4 6653 B13R1.15 CC[C@@H](C)NCc1cccc(c1)Cl e95ec56d3c2bf5cd3af14c871ba12ccb [0,2,0,0,0,0|2,0,0]=4 6654 B13R1.15 CC[C@@H](C)NCc1cccc(c1)F 80630c0ae8814d6c1fcbe0ae8bf657d3 [0,2,0,0,0,0|2,0,0]=4 6655 B13R1.15 CC[C@@H](C)NCc1cccc(c1)I a0d83ac75368c1d471ef3d39276226fc [0,2,0,0,0,0|2,0,0]=4 6656 B13R1.15 CC[C@@H](C)OCc1cccc(c1)Br 53ed52da0a416746b98b97e75865ee7b [0,2,0,0,0,0|2,0,0]=4 6657 B13R1.15 CC[C@@H](C)OCc1cccc(c1)C 00f1b53ba23510fc236a810eb1b30f36 [0,2,0,0,0,0|2,0,0]=4 6658 B13R1.15 CC[C@@H](C)OCc1cccc(c1)Cl d82fd3e2127a9696ea0ff3e171c52d76 [0,2,0,0,0,0|2,0,0]=4 6659 B13R1.15 CC[C@@H](C)OCc1cccc(c1)F d52ee6f4ed2fe56a86fbcf83e1c71875 [0,2,0,0,0,0|2,0,0]=4 6660 B13R1.15 CC[C@@H](C)OCc1cccc(c1)I 1db6b2fd6befa3c9acb56ef1268a8084 [0,2,0,0,0,0|2,0,0]=4 6661 B13R1.15 CC[C@@H](O)CNc1cccc(c1)C 721e834cf76f597dedf65d1ecb40e006 [0,2,0,0,0,0|1,0,0]=3 6662 B13R1.15 CC[C@@H](O)CNc1ccnc(c1)F b5cb18c45d6e45be9fccd557e3342737 [0,2,0,0,0,0|2,0,0]=4 6663 B13R1.15 CC[C@@H](O)CNc1cncc(c1)C 4145e248c81867e7901c6c74205be22d [0,2,0,0,0,0|2,0,0]=4 6664 B13R1.15 CC[C@H](C)CNc1cccc(c1)Br 0a6b0a1a51057f1f1632387b0d67a455 [0,2,0,0,0,0|2,0,0]=4 6665 B13R1.15 CC[C@H](C)CNc1cccc(c1)C ec4dcdb3518a21259525f6410c3fb345 [0,2,0,0,0,0|2,0,0]=4 6666 B13R1.15 CC[C@H](C)CNc1cccc(c1)Cl 3d0d2bb7febd2b750a461ddcce25d9de [0,2,0,0,0,0|2,0,0]=4 6667 B13R1.15 CC[C@H](C)CNc1cccc(c1)F feb61a19fd5ea57be567b443c12307f2 [0,2,0,0,0,0|2,0,0]=4 6668 B13R1.15 CC[C@H](C)CNc1cccc(c1)I ce9569ba4b3e90b6c978e424676337df [0,2,0,0,0,0|2,0,0]=4 6669 B13R1.15 CC[C@H](C)CNc1cccc(c1)S a6b0f9ff54ac06a28c51b53023abe074 [0,2,0,0,0,0|2,0,0]=4 6670 B13R1.15 CC[C@H](C)COc1cccc(c1)Br 39acec316a367569aca56f9c01b02e34 [0,2,0,0,0,0|2,0,0]=4 6671 B13R1.15 CC[C@H](C)COc1cccc(c1)C ed9f860f7343b4b924a31b9584adb579 [0,2,0,0,0,0|2,0,0]=4 6672 B13R1.15 CC[C@H](C)COc1cccc(c1)Cl a67e48dbd503647967108b7a53c3dd2a [0,2,0,0,0,0|2,0,0]=4 6673 B13R1.15 CC[C@H](C)COc1cccc(c1)F 3033ccdc843b261b1461f1be9eb75c2d [0,2,0,0,0,0|2,0,0]=4 6674 B13R1.15 CC[C@H](C)COc1cccc(c1)I 54f654b053c6cfc7af66aefad23150c1 [0,2,0,0,0,0|2,0,0]=4 6675 B13R1.15 CC[C@H](C)COc1cccc(c1)S 0b5929681c188cb2b121633b5cd65742 [0,2,0,0,0,0|2,0,0]=4 6676 B13R1.15 CC[C@H](C)NCc1cccc(c1)Br f2280d80e856e6a8199a8994c3655741 [0,2,0,0,0,0|2,0,0]=4 6677 B13R1.15 CC[C@H](C)NCc1cccc(c1)C 4cd9319e5f3aa8dfc02c0b7cf451a158 [0,2,0,0,0,0|2,0,0]=4 6678 B13R1.15 CC[C@H](C)NCc1cccc(c1)Cl 930ff022cb73989af46c37b9c7ab522c [0,2,0,0,0,0|2,0,0]=4 6679 B13R1.15 CC[C@H](C)NCc1cccc(c1)F 7aef4ba1e8a89b4a1fa4c910a6b47493 [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.15 CC[C@H](C)NCc1cccc(c1)I 58093b818a4e2db261733ed1b4033aca [0,2,0,0,0,0|2,0,0]=4 6681 B13R1.15 CC[C@H](C)OCc1cccc(c1)Br d1adcee1429236c12967737354767f20 [0,2,0,0,0,0|2,0,0]=4 6682 B13R1.15 CC[C@H](C)OCc1cccc(c1)C f451c8bd1726bc1caa20a6708db1d21c [0,2,0,0,0,0|2,0,0]=4 6683 B13R1.15 CC[C@H](C)OCc1cccc(c1)Cl 2ea65e74282d3c5ddc9482904970a558 [0,2,0,0,0,0|2,0,0]=4 6684 B13R1.15 CC[C@H](C)OCc1cccc(c1)F b3710a4d2576129320dd17941d73c286 [0,2,0,0,0,0|2,0,0]=4 6685 B13R1.15 CC[C@H](C)OCc1cccc(c1)I d4c36aa82a2f081c00cc6aa8fd4e3841 [0,2,0,0,0,0|2,0,0]=4 6686 B13R1.15 CN(C=O)CCc1cccc(c1)Br 869cbb31de4267ae2586285f073904c7 [0,2,0,0,0,0|1,0,1]=4 6687 B13R1.15 CN(C=O)CCc1cccc(c1)Cl 57496c0fb04ee75a94c604397003ce7e [0,2,0,0,0,0|1,0,1]=4 6688 B13R1.15 CN(C=O)CCc1cccc(c1)F 2c9d7ac9822a5c2173f5a9149148313e [0,2,0,0,0,0|1,0,1]=4 6689 B13R1.15 CN(CF)CCc1cccc(c1)Br 96c9e5407f84db57a58d551543c9be72 [0,2,0,0,0,0|2,0,0]=4 6690 B13R1.15 CN(CF)CCc1cccc(c1)Cl 95c812efab39bdda4c8fb29aa673376f [0,2,0,0,0,0|2,0,0]=4 6691 B13R1.15 CN(CF)CCc1cccc(c1)F f724392b9f1df261016470ef7f2d9f99 [0,2,0,0,0,0|2,0,0]=4 6692 B13R1.15 CN(CO)CCc1cccc(c1)Br 160c67c09f0663ff9f59fb7671209f67 [0,2,0,0,0,0|1,0,0]=3 6693 B13R1.15 CN(CO)CCc1cccc(c1)Cl 758febf4a1e71f247fb1db675f39dc48 [0,2,0,0,0,0|1,0,0]=3 6694 B13R1.15 CN(CO)CCc1cccc(c1)F f038ebd582e731c723c3b5c741b3a3d9 [0,2,0,0,0,0|1,0,0]=3 6695 B13R1.15 COC(C)CNc1cc(ccn1)Br 127d0b489858bc6c1d18ac7129f54783 [0,2,0,0,0,0|2,0,0]=4 6696 B13R1.15 COC(C)CNc1cc(ccn1)C 5678109fe8a24eee44948dac3c91e479 [0,2,0,0,0,0|2,0,0]=4 6697 B13R1.15 COC(C)CNc1cc(ccn1)Cl 764dc415550e6d900d5d5745be45641d [0,2,0,0,0,0|2,0,0]=4 6698 B13R1.15 COC(C)CNc1cc(ccn1)F b5490bca58cadc70059900aa7b0def76 [0,2,0,0,0,0|2,0,0]=4 6699 B13R1.15 COC(C)CNc1cc(ccn1)I ae2d44f7c13f167460b2a1bca0a717f1 [0,2,0,0,0,0|2,0,0]=4 6700 B13R1.15 COC(C)CNc1cc[nH]c(=S)c1 82480d5d2760ea6f468a4dcd2239ec1d [0,2,0,0,0,0|2,0,0]=4 6701 B13R1.15 COC(C)CNc1cccc(c1)Br fe57b5b09d919d18dcb0a0f906a3b95d [0,2,0,0,0,0|1,0,0]=3 6702 B13R1.15 COC(C)CNc1cccc(c1)C 1e825ff0bb6a2f9fe120e5011abdfc1c [0,2,0,0,0,0|1,0,0]=3 6703 B13R1.15 COC(C)CNc1cccc(c1)Cl 9b88cb91e27bc3e7ef440ef3aa432092 [0,2,0,0,0,0|1,0,0]=3 6704 B13R1.15 COC(C)CNc1cccc(c1)F 7ecd236caead8e410d5870f4b26abd03 [0,2,0,0,0,0|1,0,0]=3 6705 B13R1.15 COC(C)CNc1cccc(c1)I fc9178be83f85e029ff94f405e169e4d [0,2,0,0,0,0|1,0,0]=3 6706 B13R1.15 COC(C)CNc1cccc(c1)S 7bba8379c1b1dfe2f791bc4ced23bde6 [0,2,0,0,0,0|1,0,0]=3 6707 B13R1.15 COC(C)CNc1cccc(n1)Br 48e2046adf37fe232b84a6a2db535e98 [0,2,0,0,0,0|2,0,0]=4 6708 B13R1.15 COC(C)CNc1cccc(n1)C 2b78d71d8d868fee94ec6c492ea6a6be [0,2,0,0,0,0|2,0,0]=4 6709 B13R1.15 COC(C)CNc1cccc(n1)Cl c8caf9aadff8e2604ce797887d8aa596 [0,2,0,0,0,0|2,0,0]=4 6710 B13R1.15 COC(C)CNc1cccc(n1)F 8b86775bcd89d6b698ebc3ef00e8a881 [0,2,0,0,0,0|2,0,0]=4 6711 B13R1.15 COC(C)CNc1cccc(n1)I 068d91b15a6f1a2ee0b5eacd53de9f76 [0,2,0,0,0,0|2,0,0]=4 6712 B13R1.15 COC(C)CNc1ccnc(c1)Br 36ab0dd51d7acab8a0d0a1da2f5b9972 [0,2,0,0,0,0|2,0,0]=4 6713 B13R1.15 COC(C)CNc1ccnc(c1)C 8d3bc69c1c39b9ee8cfbd064b36c290d [0,2,0,0,0,0|2,0,0]=4 6714 B13R1.15 COC(C)CNc1ccnc(c1)Cl 891769efa7246cf7d577394e2959fec0 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.15 COC(C)CNc1ccnc(c1)F 9ab3421abfc6ea1928892b60080559b0 [0,2,0,0,0,0|2,0,0]=4 6716 B13R1.15 COC(C)CNc1ccnc(c1)I 41950a71a5baa896a2ef27f0e6b326b0 [0,2,0,0,0,0|2,0,0]=4 6717 B13R1.15 COC(C)CNc1cncc(c1)Br d5d1150582829b58cf2c84428d95e7d6 [0,2,0,0,0,0|2,0,0]=4 6718 B13R1.15 COC(C)CNc1cncc(c1)C 5b7cebc4b72bfcf62b7887420f07513d [0,2,0,0,0,0|2,0,0]=4 6719 B13R1.15 COC(C)CNc1cncc(c1)Cl af4aff3741ac8583b0e33cef6fcf7565 [0,2,0,0,0,0|2,0,0]=4 6720 B13R1.15 COC(C)CNc1cncc(c1)F 54e45aee088d67e57827df17eb592a88 [0,2,0,0,0,0|2,0,0]=4 6721 B13R1.15 COC(C)CNc1cncc(c1)I 8a235e407ff0919e7c9659a94b4ba1d9 [0,2,0,0,0,0|2,0,0]=4 6722 B13R1.15 COC(C)COc1cc(ccn1)Br f2bc5a7c651081bf2ed3cce03b86f673 [0,2,0,0,0,0|2,0,0]=4 6723 B13R1.15 COC(C)COc1cc(ccn1)C 4c3a39d86cc3af5ee70c67f10a2c9e8f [0,2,0,0,0,0|2,0,0]=4 6724 B13R1.15 COC(C)COc1cc(ccn1)Cl a9b15f3e271c0fa897e456169502915b [0,2,0,0,0,0|2,0,0]=4 6725 B13R1.15 COC(C)COc1cc(ccn1)F 194e813f3d740a8a03131aa7c0554c45 [0,2,0,0,0,0|2,0,0]=4 6726 B13R1.15 COC(C)COc1ccc[n+](c1)[O-] d01b0d93329138a005057aa4d8634a29 [0,2,0,0,0,0|2,0,0]=4 6727 B13R1.15 COC(C)COc1cccc(=O)[nH]1 3331c709b52e4fc2e4eb736ee9a929d8 [0,2,0,0,0,0|2,0,0]=4 6728 B13R1.15 COC(C)COc1cccc(c1)Br a9f090319b0e964625c4583bf581e330 [0,2,0,0,0,0|1,0,0]=3 6729 B13R1.15 COC(C)COc1cccc(c1)C 887fb5fdd154d14b86079af1ec5ae481 [0,2,0,0,0,0|1,0,0]=3 6730 B13R1.15 COC(C)COc1cccc(c1)Cl 66438ab705815976218992989e1d15f9 [0,2,0,0,0,0|1,0,0]=3 6731 B13R1.15 COC(C)COc1cccc(c1)F 245f41cb95a3dde9d719d11051c70bf6 [0,2,0,0,0,0|1,0,0]=3 6732 B13R1.15 COC(C)COc1cccc(c1)I 68862181d13260328a55e37674ec4f0c [0,2,0,0,0,0|1,0,0]=3 6733 B13R1.15 COC(C)COc1cccc(c1)S 8d541f16c88bc49b060249a78226b463 [0,2,0,0,0,0|1,0,0]=3 6734 B13R1.15 COC(C)COc1cccc(n1)Br 2b8feecb213982716608256baff73842 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.15 COC(C)COc1cccc(n1)C 89347b6a1ad0abbd88fe97bf926c69f1 [0,2,0,0,0,0|2,0,0]=4 6736 B13R1.15 COC(C)COc1cccc(n1)F fe11595c750cb25f27506ed741c6f430 [0,2,0,0,0,0|2,0,0]=4 6737 B13R1.15 COC(C)COc1ccnc(c1)Br 3bed7649456b0e8cdcb85bb4718cf206 [0,2,0,0,0,0|2,0,0]=4 6738 B13R1.15 COC(C)COc1ccnc(c1)C af97be863d7f648f9ad79ba2bdd41b84 [0,2,0,0,0,0|2,0,0]=4 6739 B13R1.15 COC(C)COc1ccnc(c1)Cl 493d7b070dca3ce396847701b3d2d749 [0,2,0,0,0,0|2,0,0]=4 6740 B13R1.15 COC(C)COc1ccnc(c1)F a50b5954d28b8a4ed8269ae478e9c78c [0,2,0,0,0,0|2,0,0]=4 6741 B13R1.15 COC(C)COc1cncc(c1)Br 4ce67150c409a89c9165563583f032f7 [0,2,0,0,0,0|2,0,0]=4 6742 B13R1.15 COC(C)COc1cncc(c1)C 798dd97f73a516102a45c40eba74671e [0,2,0,0,0,0|2,0,0]=4 6743 B13R1.15 COC(C)COc1cncc(c1)Cl 7bbbd24ae7ba837d867ec6e216772793 [0,2,0,0,0,0|2,0,0]=4 6744 B13R1.15 COC(C)COc1cncc(c1)F 65598a0668af98385a241d0a3b635dc9 [0,2,0,0,0,0|2,0,0]=4 6745 B13R1.15 COC(C)COc1cncc(c1)I 8c9e1957aad85092a63c367f9927363c [0,2,0,0,0,0|2,0,0]=4 6746 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)Br b0118105a53f386633e668cfb374549f [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)C 8b66e4e95a2ab0a295d56faaac9edeb3 [0,2,0,0,0,0|2,0,0]=4 6748 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)Cl 7ae55d62d629d37733ccd273aea9c4ea [0,2,0,0,0,0|2,0,0]=4 6749 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)F 9aa287c17d4783fd20a9878f05732f87 [0,2,0,0,0,0|2,0,0]=4 6750 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)I 6d84a6660d725dda6a63e00958183f75 [0,2,0,0,0,0|2,0,0]=4 6751 B13R1.15 CO[C@@H](C)CNc1cc[nH]c(=S)c1 e67eaf8008c0762c7f76b763d8809a3a [0,2,0,0,0,0|2,0,0]=4 6752 B13R1.15 CO[C@@H](C)CNc1cccc(c1)Br 12fcff57c2402234bac440b0593f5ab2 [0,2,0,0,0,0|1,0,0]=3 6753 B13R1.15 CO[C@@H](C)CNc1cccc(c1)C 4975314af81a1074db8770a5b0b9b26d [0,2,0,0,0,0|1,0,0]=3 6754 B13R1.15 CO[C@@H](C)CNc1cccc(c1)Cl 52b209bbf72584a0c9ef098ec0813b9c [0,2,0,0,0,0|1,0,0]=3 6755 B13R1.15 CO[C@@H](C)CNc1cccc(c1)F 947f92d5ece27543d9ffad0b75b1cb5f [0,2,0,0,0,0|1,0,0]=3 6756 B13R1.15 CO[C@@H](C)CNc1cccc(c1)I 5e5286b22c844f9a7bdad8b6581a6cb7 [0,2,0,0,0,0|1,0,0]=3 6757 B13R1.15 CO[C@@H](C)CNc1cccc(c1)S 8ad9d6308061ad9c0f5c1c1f17b690a8 [0,2,0,0,0,0|1,0,0]=3 6758 B13R1.15 CO[C@@H](C)CNc1cccc(n1)Br 2f36cf72025405312055a449078d98c4 [0,2,0,0,0,0|2,0,0]=4 6759 B13R1.15 CO[C@@H](C)CNc1cccc(n1)C fdbdcb727b8bb9e11cdd452e5ccb8454 [0,2,0,0,0,0|2,0,0]=4 6760 B13R1.15 CO[C@@H](C)CNc1cccc(n1)Cl b3afc61c8f4afecc11df6e0f89867379 [0,2,0,0,0,0|2,0,0]=4 6761 B13R1.15 CO[C@@H](C)CNc1cccc(n1)F 0d866c8589b85a7dcdf38f7a61b2136c [0,2,0,0,0,0|2,0,0]=4 6762 B13R1.15 CO[C@@H](C)CNc1cccc(n1)I 8712f840c81cf443367366d1bf3c75cb [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.15 CO[C@@H](C)CNc1ccnc(c1)Br 544358d6622a9c9ee0ae5aff9f4dc02a [0,2,0,0,0,0|2,0,0]=4 6764 B13R1.15 CO[C@@H](C)CNc1ccnc(c1)C 0fcc8bd203dc5f30f40c8dfa10560ccd [0,2,0,0,0,0|2,0,0]=4 6765 B13R1.15 CO[C@@H](C)CNc1ccnc(c1)Cl c0d4e7ac09e60ac99e3841ef70c7e22c [0,2,0,0,0,0|2,0,0]=4 6766 B13R1.15 CO[C@@H](C)CNc1ccnc(c1)F 51b78b3bfd0d057181c78d897e3da61f [0,2,0,0,0,0|2,0,0]=4 6767 B13R1.15 CO[C@@H](C)CNc1ccnc(c1)I 24e6c93f91edeb1bc000e3b217f75f16 [0,2,0,0,0,0|2,0,0]=4 6768 B13R1.15 CO[C@@H](C)CNc1cncc(c1)Br eaa557dd3fdbcd7280529b8d746d97b7 [0,2,0,0,0,0|2,0,0]=4 6769 B13R1.15 CO[C@@H](C)CNc1cncc(c1)C 61e6ab5a9f6f26aff961540d5eef3392 [0,2,0,0,0,0|2,0,0]=4 6770 B13R1.15 CO[C@@H](C)CNc1cncc(c1)Cl 343ac2151a0365a90f9f897ee906f81a [0,2,0,0,0,0|2,0,0]=4 6771 B13R1.15 CO[C@@H](C)CNc1cncc(c1)F af24f2491afc50ce6e51042c6b167632 [0,2,0,0,0,0|2,0,0]=4 6772 B13R1.15 CO[C@@H](C)CNc1cncc(c1)I e5148dd19094771769d20686d0f3f42a [0,2,0,0,0,0|2,0,0]=4 6773 B13R1.15 CO[C@@H](C)COc1cc(ccn1)Br d1540a01040e6bec071f3a512a08ed74 [0,2,0,0,0,0|2,0,0]=4 6774 B13R1.15 CO[C@@H](C)COc1cc(ccn1)C 3277d6596e35aaf69c1829acf38b5c65 [0,2,0,0,0,0|2,0,0]=4 6775 B13R1.15 CO[C@@H](C)COc1cc(ccn1)Cl b4f3241096dccbdb12539e0aa00a5caa [0,2,0,0,0,0|2,0,0]=4 6776 B13R1.15 CO[C@@H](C)COc1cc(ccn1)F 8133915d3c1fff064ca404aa7b30f7fc [0,2,0,0,0,0|2,0,0]=4 6777 B13R1.15 CO[C@@H](C)COc1ccc[n+](c1)[O-] 093f6c0ef22d1953790871657fe96b31 [0,2,0,0,0,0|2,0,0]=4 6778 B13R1.15 CO[C@@H](C)COc1cccc(=O)[nH]1 55973066d6cb731bf85bebdf7f40288d [0,2,0,0,0,0|2,0,0]=4 6779 B13R1.15 CO[C@@H](C)COc1cccc(c1)Br f76e62a496f67dcb4e6d9357e42e9543 [0,2,0,0,0,0|1,0,0]=3 6780 B13R1.15 CO[C@@H](C)COc1cccc(c1)C 3a743e831dae03f6dc9b67b955d34e48 [0,2,0,0,0,0|1,0,0]=3 6781 B13R1.15 CO[C@@H](C)COc1cccc(c1)Cl 9d0e8b5db22c8565ff8d2ddd6df7ccd5 [0,2,0,0,0,0|1,0,0]=3 6782 B13R1.15 CO[C@@H](C)COc1cccc(c1)F cb8d3981af830017bf7391c52e9057e6 [0,2,0,0,0,0|1,0,0]=3 6783 B13R1.15 CO[C@@H](C)COc1cccc(c1)I 237d12da210c3c1697c4df8d373dc685 [0,2,0,0,0,0|1,0,0]=3 6784 B13R1.15 CO[C@@H](C)COc1cccc(c1)S 7fb348284a20631f2fb4381880c07e24 [0,2,0,0,0,0|1,0,0]=3 6785 B13R1.15 CO[C@@H](C)COc1cccc(n1)Br 783dfd1d8351f39253de196af7f8c473 [0,2,0,0,0,0|2,0,0]=4 6786 B13R1.15 CO[C@@H](C)COc1cccc(n1)C 70b03945d3efa2ebca26b247ac09ce6b [0,2,0,0,0,0|2,0,0]=4 6787 B13R1.15 CO[C@@H](C)COc1cccc(n1)F 665f3ca6e94984858ea2dc3532d85e8d [0,2,0,0,0,0|2,0,0]=4 6788 B13R1.15 CO[C@@H](C)COc1ccnc(c1)Br 5ade66b93c6b682954166578a855bff6 [0,2,0,0,0,0|2,0,0]=4 6789 B13R1.15 CO[C@@H](C)COc1ccnc(c1)C a524cc01b2d694cc31d440bc6ca0947f [0,2,0,0,0,0|2,0,0]=4 6790 B13R1.15 CO[C@@H](C)COc1ccnc(c1)Cl d34331b5c317193bdfc691e4bc93d2f8 [0,2,0,0,0,0|2,0,0]=4 6791 B13R1.15 CO[C@@H](C)COc1ccnc(c1)F 4fc1d1121a97c3a5352397b87dbb140c [0,2,0,0,0,0|2,0,0]=4 6792 B13R1.15 CO[C@@H](C)COc1cncc(c1)Br f6385e6fbf8f90685fc8d3739b17a65f [0,2,0,0,0,0|2,0,0]=4 6793 B13R1.15 CO[C@@H](C)COc1cncc(c1)C 460fe8d48f768e423b5c6606420b1384 [0,2,0,0,0,0|2,0,0]=4 6794 B13R1.15 CO[C@@H](C)COc1cncc(c1)Cl 5277fd39868e553f15fd5c30e3cd7638 [0,2,0,0,0,0|2,0,0]=4 6795 B13R1.15 CO[C@@H](C)COc1cncc(c1)F fdc82b5e8591cc57837a9175b0032440 [0,2,0,0,0,0|2,0,0]=4 6796 B13R1.15 CO[C@@H](C)COc1cncc(c1)I 5cb263fd02c9c2a35ae8700083660b39 [0,2,0,0,0,0|2,0,0]=4 6797 B13R1.15 CO[C@H](C)CNc1cc(ccn1)Br 099f3fc858bc6b4513670c8fdb61a6a5 [0,2,0,0,0,0|2,0,0]=4 6798 B13R1.15 CO[C@H](C)CNc1cc(ccn1)C 5fd130adc2b27b1ee27c1bf1f3f26a49 [0,2,0,0,0,0|2,0,0]=4 6799 B13R1.15 CO[C@H](C)CNc1cc(ccn1)Cl 17646736fc38956050d08b01e70d8703 [0,2,0,0,0,0|2,0,0]=4 6800 B13R1.15 CO[C@H](C)CNc1cc(ccn1)F da6e32238398035ae6e31545bd204229 [0,2,0,0,0,0|2,0,0]=4 6801 B13R1.15 CO[C@H](C)CNc1cc(ccn1)I a2a67e43dcfc32bed529f4fd6a7bea61 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.15 CO[C@H](C)CNc1cc[nH]c(=S)c1 58454e01d92d5bf78406f8714e6a7468 [0,2,0,0,0,0|2,0,0]=4 6803 B13R1.15 CO[C@H](C)CNc1cccc(c1)Br edf9af381354c34b65b0c9a73d799405 [0,2,0,0,0,0|1,0,0]=3 6804 B13R1.15 CO[C@H](C)CNc1cccc(c1)C ef5b963db5f7b292d116dc0e4f941c41 [0,2,0,0,0,0|1,0,0]=3 6805 B13R1.15 CO[C@H](C)CNc1cccc(c1)Cl db1c3266d7ce134fb2773f10d2e7bd3a [0,2,0,0,0,0|1,0,0]=3 6806 B13R1.15 CO[C@H](C)CNc1cccc(c1)F 7362bb7d7c2d6054df5ce2deeb653a65 [0,2,0,0,0,0|1,0,0]=3 6807 B13R1.15 CO[C@H](C)CNc1cccc(c1)I 95f86ca52444b2ed5f779c9df1cc6d36 [0,2,0,0,0,0|1,0,0]=3 6808 B13R1.15 CO[C@H](C)CNc1cccc(c1)S 28098acd21f1f09301d32024be94b9f8 [0,2,0,0,0,0|1,0,0]=3 6809 B13R1.15 CO[C@H](C)CNc1cccc(n1)Br ded1009006482eaf0dda61d46610d560 [0,2,0,0,0,0|2,0,0]=4 6810 B13R1.15 CO[C@H](C)CNc1cccc(n1)C 3aa397c34f8a2537134c4830297687a9 [0,2,0,0,0,0|2,0,0]=4 6811 B13R1.15 CO[C@H](C)CNc1cccc(n1)Cl 0d683b6210860738a2b5b9ee32920338 [0,2,0,0,0,0|2,0,0]=4 6812 B13R1.15 CO[C@H](C)CNc1cccc(n1)F a51e8599d2843ab026e1d3f682330804 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.15 CO[C@H](C)CNc1cccc(n1)I 14ea4db675c53cf89966cb0eb31702fd [0,2,0,0,0,0|2,0,0]=4 6814 B13R1.15 CO[C@H](C)CNc1ccnc(c1)Br 7e75f142a84c08ca4ab9a3662f032231 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.15 CO[C@H](C)CNc1ccnc(c1)C c673bb0b11bab7269dc52cc920fbc238 [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.15 CO[C@H](C)CNc1ccnc(c1)Cl bc2b43133b210301734d4f130d19a7e0 [0,2,0,0,0,0|2,0,0]=4 6817 B13R1.15 CO[C@H](C)CNc1ccnc(c1)F 31cf3731c962a40048cc34126f1f9cfd [0,2,0,0,0,0|2,0,0]=4 6818 B13R1.15 CO[C@H](C)CNc1ccnc(c1)I 74d3c0c2d0e065de7c96a71b62630693 [0,2,0,0,0,0|2,0,0]=4 6819 B13R1.15 CO[C@H](C)CNc1cncc(c1)Br 558b92ca8dc2966f28f01e50b8135bf1 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.15 CO[C@H](C)CNc1cncc(c1)C 82d10384e375977d516a69df8808b3e2 [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.15 CO[C@H](C)CNc1cncc(c1)Cl 2b5bd7dd3ca763c5b03d0f02b1474894 [0,2,0,0,0,0|2,0,0]=4 6822 B13R1.15 CO[C@H](C)CNc1cncc(c1)F f7fd7e2adc0ac0ae99d0151628e1882c [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.15 CO[C@H](C)CNc1cncc(c1)I 104b5d5ab5d758b6dcaf513fbad7c455 [0,2,0,0,0,0|2,0,0]=4 6824 B13R1.15 CO[C@H](C)COc1cc(ccn1)Br 02368be50416046f9a7e01dc8512adfc [0,2,0,0,0,0|2,0,0]=4 6825 B13R1.15 CO[C@H](C)COc1cc(ccn1)C 6b38d4ffd030958d69eb92d812bac41d [0,2,0,0,0,0|2,0,0]=4 6826 B13R1.15 CO[C@H](C)COc1cc(ccn1)Cl 373a0a17fcb9381604cb87aa058ba4e9 [0,2,0,0,0,0|2,0,0]=4 6827 B13R1.15 CO[C@H](C)COc1cc(ccn1)F adadb6a65d12478a80a59a2bbb491cb2 [0,2,0,0,0,0|2,0,0]=4 6828 B13R1.15 CO[C@H](C)COc1ccc[n+](c1)[O-] db01b049c8eb05dbc8b5d2d546f02008 [0,2,0,0,0,0|2,0,0]=4 6829 B13R1.15 CO[C@H](C)COc1cccc(=O)[nH]1 821138ace47bb1a9dc2bc3077b4dfc27 [0,2,0,0,0,0|2,0,0]=4 6830 B13R1.15 CO[C@H](C)COc1cccc(c1)Br 57382ca4b461c82e6975af2bb8a934fe [0,2,0,0,0,0|1,0,0]=3 6831 B13R1.15 CO[C@H](C)COc1cccc(c1)C 455a9e0dbb57a58e90670b9fa5f62466 [0,2,0,0,0,0|1,0,0]=3 6832 B13R1.15 CO[C@H](C)COc1cccc(c1)Cl efe985db807fbf4cde2f86d991561bb9 [0,2,0,0,0,0|1,0,0]=3 6833 B13R1.15 CO[C@H](C)COc1cccc(c1)F 213fb94bb7ed70797ea043f9d9c7027e [0,2,0,0,0,0|1,0,0]=3 6834 B13R1.15 CO[C@H](C)COc1cccc(c1)I 694f368942862d8818d7900bc0dc12d6 [0,2,0,0,0,0|1,0,0]=3 6835 B13R1.15 CO[C@H](C)COc1cccc(c1)S 3aea9ab374a65b9747520e3102dc071f [0,2,0,0,0,0|1,0,0]=3 6836 B13R1.15 CO[C@H](C)COc1cccc(n1)Br 92acfad4ff318cce85a720d851e6ff60 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.15 CO[C@H](C)COc1cccc(n1)C e0aced9974574acc21eab734bfaa8450 [0,2,0,0,0,0|2,0,0]=4 6838 B13R1.15 CO[C@H](C)COc1cccc(n1)F e3425d0e8ae88c6539eced026fc5db13 [0,2,0,0,0,0|2,0,0]=4 6839 B13R1.15 CO[C@H](C)COc1ccnc(c1)Br 96795d16523f6f44b7eebb8f290853ed [0,2,0,0,0,0|2,0,0]=4 6840 B13R1.15 CO[C@H](C)COc1ccnc(c1)C 99431aa1b3afd59b7ce6b0b532630479 [0,2,0,0,0,0|2,0,0]=4 6841 B13R1.15 CO[C@H](C)COc1ccnc(c1)Cl c3b9d235e17cf38058358319f88f52e0 [0,2,0,0,0,0|2,0,0]=4 6842 B13R1.15 CO[C@H](C)COc1ccnc(c1)F 0edf191313bae594e6ba499fa05893b9 [0,2,0,0,0,0|2,0,0]=4 6843 B13R1.15 CO[C@H](C)COc1cncc(c1)Br 740e90218549177f239f7beed1c67d64 [0,2,0,0,0,0|2,0,0]=4 6844 B13R1.15 CO[C@H](C)COc1cncc(c1)C 1b97bd364e2ff216ba417af7cceaa400 [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.15 CO[C@H](C)COc1cncc(c1)Cl 4b38315c669b6efebd980603291e2b21 [0,2,0,0,0,0|2,0,0]=4 6846 B13R1.15 CO[C@H](C)COc1cncc(c1)F cbbaade1496e55e23449dbf63076100b [0,2,0,0,0,0|2,0,0]=4 6847 B13R1.15 CO[C@H](C)COc1cncc(c1)I 8e52bf5272592adf6e63dd7e6298b7fb [0,2,0,0,0,0|2,0,0]=4 6848 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)Br 438a242a97a887767bbd9600a0083fc9 [0,2,0,0,0,0|2,0,0]=4 6849 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)Cl 313ae34e80c2d405242eab7185de1f2a [0,2,0,0,0,0|2,0,0]=4 6850 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)F 74b61af8a6b4a7964e7fce3a47d85c40 [0,2,0,0,0,0|2,0,0]=4 6851 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)I 6e9c4a913efd5c94338de3af92b2df7d [0,2,0,0,0,0|2,0,0]=4 6852 B13R1.15 C[C@@H](CO)CNc1cc[nH]c(=S)c1 10c778e682d54973544f7502a5f882c1 [0,2,0,0,0,0|2,0,0]=4 6853 B13R1.15 C[C@@H](CO)CNc1cccc(c1)Br f2789893b8e0414fbe589557b01351ad [0,2,0,0,0,0|1,0,0]=3 6854 B13R1.15 C[C@@H](CO)CNc1cccc(c1)Cl 9c6b3e7384f3bc582ac3422e29a60747 [0,2,0,0,0,0|1,0,0]=3 6855 B13R1.15 C[C@@H](CO)CNc1cccc(c1)F b4d5172a5d43582df64811db30975cce [0,2,0,0,0,0|1,0,0]=3 6856 B13R1.15 C[C@@H](CO)CNc1cccc(c1)I 3887533137151fd7f1cb41fad1b73efe [0,2,0,0,0,0|1,0,0]=3 6857 B13R1.15 C[C@@H](CO)CNc1cccc(c1)S 4d7dd75df7a79c4ac72ef5e72c2b24ec [0,2,0,0,0,0|1,0,0]=3 6858 B13R1.15 C[C@@H](CO)CNc1cccc(n1)Br e2b783d51e139bd7d6b52cd1e954323d [0,2,0,0,0,0|2,0,0]=4 6859 B13R1.15 C[C@@H](CO)CNc1cccc(n1)Cl 7440b1597d4b88e18371bf61004850a1 [0,2,0,0,0,0|2,0,0]=4 6860 B13R1.15 C[C@@H](CO)CNc1cccc(n1)F 0115c7a0590dc1f5aa6f362a370802ca [0,2,0,0,0,0|2,0,0]=4 6861 B13R1.15 C[C@@H](CO)CNc1cccc(n1)I 85cd5bdab7a0e2c29cc0464bd51f818c [0,2,0,0,0,0|2,0,0]=4 6862 B13R1.15 C[C@@H](CO)CNc1ccnc(c1)Br 0ace49cc390689d61b8dadb2c57078ad [0,2,0,0,0,0|2,0,0]=4 6863 B13R1.15 C[C@@H](CO)CNc1ccnc(c1)Cl 5032ebb6b2d97e475e885b2d61e2ba2a [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.15 C[C@@H](CO)CNc1ccnc(c1)F 92cb306fc60dc8d11067623a58ebe560 [0,2,0,0,0,0|2,0,0]=4 6865 B13R1.15 C[C@@H](CO)CNc1ccnc(c1)I 20757062ab6309fbbc51381c02beed0a [0,2,0,0,0,0|2,0,0]=4 6866 B13R1.15 C[C@@H](CO)CNc1cncc(c1)Br d3e1c63bbf6e622901ec7e0c2157cb11 [0,2,0,0,0,0|2,0,0]=4 6867 B13R1.15 C[C@@H](CO)CNc1cncc(c1)Cl c06fbca913f050a84fdac0aa4530ae62 [0,2,0,0,0,0|2,0,0]=4 6868 B13R1.15 C[C@@H](CO)CNc1cncc(c1)F db4b765883041fb7e55ab4966a8514e9 [0,2,0,0,0,0|2,0,0]=4 6869 B13R1.15 C[C@@H](CO)CNc1cncc(c1)I 3d91725454b99a07a765bdce5e8b688f [0,2,0,0,0,0|2,0,0]=4 6870 B13R1.15 C[C@@H](CO)NCc1cc(ccn1)Br 551bb86205eb77fd686cdd4d9cfc9005 [0,2,0,0,0,0|2,0,0]=4 6871 B13R1.15 C[C@@H](CO)NCc1cc(ccn1)Cl d00b855be4d1c4f37f85ff5be24f4ba1 [0,2,0,0,0,0|2,0,0]=4 6872 B13R1.15 C[C@@H](CO)NCc1cc[nH]c(=O)c1 e6675e31ee01039156791992e6682bee [0,2,0,0,0,0|2,0,0]=4 6873 B13R1.15 C[C@@H](CO)NCc1ccc[n+](c1)[O-] dbcfad95df424c024170a121afa9467c [0,2,0,0,0,0|2,0,0]=4 6874 B13R1.15 C[C@@H](CO)NCc1cccc(c1)Br 8461c62465f6fa5fc4eb75fad446e848 [0,2,0,0,0,0|1,0,0]=3 6875 B13R1.15 C[C@@H](CO)NCc1cccc(c1)Cl 56800286e0a3cccb869ad43fe9b593d4 [0,2,0,0,0,0|1,0,0]=3 6876 B13R1.15 C[C@@H](CO)NCc1cccc(c1)F e0afdbc8c6ea9252e1d59f3ea58e0a5b [0,2,0,0,0,0|1,0,0]=3 6877 B13R1.15 C[C@@H](CO)NCc1cccc(c1)I 228d3ce5db5299164f87278023587297 [0,2,0,0,0,0|1,0,0]=3 6878 B13R1.15 C[C@@H](CO)NCc1cccc(n1)Br d65862400aa73eb730168b9894d9696b [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.15 C[C@@H](CO)NCc1cccc(n1)Cl 9a9b059710b5557e71c4ff1125f236ab [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.15 C[C@@H](CO)NCc1cccc(n1)F 961fcd640397a5e7d8ce55c21f185fad [0,2,0,0,0,0|2,0,0]=4 6881 B13R1.15 C[C@@H](CO)NCc1ccnc(c1)Br dcfebb3ed858d652c77f31d00c63edd5 [0,2,0,0,0,0|2,0,0]=4 6882 B13R1.15 C[C@@H](CO)NCc1ccnc(c1)Cl eb6616f168815dcab1e80454126b5725 [0,2,0,0,0,0|2,0,0]=4 6883 B13R1.15 C[C@@H](CO)NCc1ccnc(c1)F 3cdf87b1adeabb1f6f882fd4df3fac3d [0,2,0,0,0,0|2,0,0]=4 6884 B13R1.15 C[C@@H](CO)NCc1cncc(c1)Br 246beb8db7bb2bc358a63eb4cbdb3466 [0,2,0,0,0,0|2,0,0]=4 6885 B13R1.15 C[C@@H](CO)NCc1cncc(c1)Cl e106d126d1669cd6b185c1a4a571196f [0,2,0,0,0,0|2,0,0]=4 6886 B13R1.15 C[C@@H](CO)NCc1cncc(c1)F ad93b90c147502875088fce476521ee4 [0,2,0,0,0,0|2,0,0]=4 6887 B13R1.15 C[C@H](C=O)NCc1cccc(c1)Br 17a95b528f1b0228d0acaaa08227c5b2 [0,2,0,0,0,0|1,0,1]=4 6888 B13R1.15 C[C@H](C=O)NCc1cccc(c1)Cl ceda91ddcd69bcd81ebb5a1acbd35ec6 [0,2,0,0,0,0|1,0,1]=4 6889 B13R1.15 C[C@H](C=O)NCc1cccc(c1)F 8784f9eb7759aa7b5c6561e6936c9f7e [0,2,0,0,0,0|1,0,1]=4 6890 B13R1.15 C[C@H](C=O)NCc1cccc(c1)I 06d9aa99f17096a9d52038e4d6aa00d8 [0,2,0,0,0,0|1,0,1]=4 6891 B13R1.15 C[C@H](C=O)OCc1cccc(c1)Br 597babf9a13c1c0d2b471c668619e536 [0,2,0,0,0,0|1,0,1]=4 6892 B13R1.15 C[C@H](C=O)OCc1cccc(c1)Cl e2c192c9e43b90e1dddf7c48ace3650e [0,2,0,0,0,0|1,0,1]=4 6893 B13R1.15 C[C@H](C=O)OCc1cccc(c1)F bd0d13987e489f2e970c873f2e0a50ec [0,2,0,0,0,0|1,0,1]=4 6894 B13R1.15 C[C@H](C=O)OCc1cccc(c1)I 69e37b445f03ac1e3da2c1eb88735839 [0,2,0,0,0,0|1,0,1]=4 6895 B13R1.15 C[C@H](CO)CNc1cc(ccn1)Br e32dd75b404f310c38c6c668924d80cb [0,2,0,0,0,0|2,0,0]=4 6896 B13R1.15 C[C@H](CO)CNc1cc(ccn1)Cl 21b4cec97fc541a8fc43b604db9e4dd1 [0,2,0,0,0,0|2,0,0]=4 6897 B13R1.15 C[C@H](CO)CNc1cc(ccn1)F b689fdbda47e5a436725f86f04352d64 [0,2,0,0,0,0|2,0,0]=4 6898 B13R1.15 C[C@H](CO)CNc1cc(ccn1)I 2a8061d71a9fed11439cfa791bfeccf6 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.15 C[C@H](CO)CNc1cc[nH]c(=S)c1 fa87bd1bd4b9b54f6886dda20342f9d2 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.15 C[C@H](CO)CNc1cccc(=O)[nH]1 005b76715cc5e4479dde97b81360dd61 [0,2,0,0,0,0|2,0,0]=4 6901 B13R1.15 C[C@H](CO)CNc1cccc(c1)Br 12728e3dae7379ba55195bdc8a8469ef [0,2,0,0,0,0|1,0,0]=3 6902 B13R1.15 C[C@H](CO)CNc1cccc(c1)Cl 486c256aee272008c74a0ea61250324b [0,2,0,0,0,0|1,0,0]=3 6903 B13R1.15 C[C@H](CO)CNc1cccc(c1)F c79da380ecb30576fbfb1021b1390ce3 [0,2,0,0,0,0|1,0,0]=3 6904 B13R1.15 C[C@H](CO)CNc1cccc(c1)I 731df43b82a6ec11318d6ef33cf0eeee [0,2,0,0,0,0|1,0,0]=3 6905 B13R1.15 C[C@H](CO)CNc1cccc(c1)S 98118b47c1700579693946a39814afb3 [0,2,0,0,0,0|1,0,0]=3 6906 B13R1.15 C[C@H](CO)CNc1cccc(n1)Br cef8b49463c8bfa6bcb0182d07f7c1d7 [0,2,0,0,0,0|2,0,0]=4 6907 B13R1.15 C[C@H](CO)CNc1cccc(n1)Cl 1f315d84be5b7ecac54574fcaeaa257b [0,2,0,0,0,0|2,0,0]=4 6908 B13R1.15 C[C@H](CO)CNc1cccc(n1)F 91e6a9e677fa4e3a58d66adb5d4240e4 [0,2,0,0,0,0|2,0,0]=4 6909 B13R1.15 C[C@H](CO)CNc1cccc(n1)I ace3df2013b50abfb4252f79e6f3b29d [0,2,0,0,0,0|2,0,0]=4 6910 B13R1.15 C[C@H](CO)CNc1ccnc(c1)Br 08c3a9425155c478d04554fead0c3643 [0,2,0,0,0,0|2,0,0]=4 6911 B13R1.15 C[C@H](CO)CNc1ccnc(c1)Cl e9733974b10867932fda6518b1df192f [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.15 C[C@H](CO)CNc1ccnc(c1)F d21e47a63db3b4b61229a7eebb841f4d [0,2,0,0,0,0|2,0,0]=4 6913 B13R1.15 C[C@H](CO)CNc1ccnc(c1)I 89c7b56b77ecbb4169fbf42a8face1bc [0,2,0,0,0,0|2,0,0]=4 6914 B13R1.15 C[C@H](CO)CNc1cncc(c1)Br 9e04c671ffc2e142d6464e09ae1b472f [0,2,0,0,0,0|2,0,0]=4 6915 B13R1.15 C[C@H](CO)CNc1cncc(c1)Cl 827548f3ef8cbc6b93f06d4127eb9e23 [0,2,0,0,0,0|2,0,0]=4 6916 B13R1.15 C[C@H](CO)CNc1cncc(c1)F b70e9f7033d5f2a316b4454d487d813e [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.15 C[C@H](CO)CNc1cncc(c1)I 0e66020a4dcb2fd1b9de49ef1564ce75 [0,2,0,0,0,0|2,0,0]=4 6918 B13R1.15 C[C@H](CO)NCc1cc(ccn1)Br 8061d66437caf0fefbb04034f312fa5e [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.15 C[C@H](CO)NCc1cc(ccn1)Cl 923b466d93e23dc5cee0c216442366ed [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.15 C[C@H](CO)NCc1cc[nH]c(=O)c1 03ef4f75fb594c3966662b3f947dbf2d [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.15 C[C@H](CO)NCc1ccc[n+](c1)[O-] e512d8e864ec183e4b33a37f34285cc0 [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.15 C[C@H](CO)NCc1cccc(c1)Br 321a0b52358d49c571519ee359aa6177 [0,2,0,0,0,0|1,0,0]=3 6923 B13R1.15 C[C@H](CO)NCc1cccc(c1)Cl 767e8c04d40366acd856797c922dcdc2 [0,2,0,0,0,0|1,0,0]=3 6924 B13R1.15 C[C@H](CO)NCc1cccc(c1)F 2ec6f0928b14782081483f7ea65a51de [0,2,0,0,0,0|1,0,0]=3 6925 B13R1.15 C[C@H](CO)NCc1cccc(c1)I 4cf64a1f908d297e19afc120603c4d54 [0,2,0,0,0,0|1,0,0]=3 6926 B13R1.15 C[C@H](CO)NCc1cccc(n1)Br 4555dca02f62b7da7dd54bae01150cee [0,2,0,0,0,0|2,0,0]=4 6927 B13R1.15 C[C@H](CO)NCc1cccc(n1)Cl 9e25d7ee2bf9d78d7604ed798075ddc4 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.15 C[C@H](CO)NCc1cccc(n1)F 9b1c4193a3a7c9c0a54de6d2efa6b70d [0,2,0,0,0,0|2,0,0]=4 6929 B13R1.15 C[C@H](CO)NCc1ccnc(c1)Br 4719f81264e0ef4ecc8bd7e8ee354074 [0,2,0,0,0,0|2,0,0]=4 6930 B13R1.15 C[C@H](CO)NCc1ccnc(c1)Cl 11fe381c5eca63b93c096f8b69d913ee [0,2,0,0,0,0|2,0,0]=4 6931 B13R1.15 C[C@H](CO)NCc1ccnc(c1)F a12cf62fd0c86c1bcd6f1e948429a662 [0,2,0,0,0,0|2,0,0]=4 6932 B13R1.15 C[C@H](CO)NCc1cncc(c1)Br 749fd9c0a549fc5efc7b52710baf7567 [0,2,0,0,0,0|2,0,0]=4 6933 B13R1.15 C[C@H](CO)NCc1cncc(c1)Cl 254a1984592b3d2d827359905190bfa5 [0,2,0,0,0,0|2,0,0]=4 6934 B13R1.15 C[C@H](CO)NCc1cncc(c1)F 36dd213218c15589a9c2ecc2e96aa018 [0,2,0,0,0,0|2,0,0]=4 6935 B13R1.15 C[C@H](CS)OCc1cccc(c1)Br 0afdc7256338e2fa8c71f277b474d5e7 [0,2,0,0,0,0|1,1,0]=4 6936 B13R1.15 C[C@H](CS)OCc1cccc(c1)Cl be1886cf9666899160f48d7c0bc8ee7b [0,2,0,0,0,0|1,1,0]=4 6937 B13R1.15 C[C@H](CS)OCc1cccc(c1)F e70c43d5fc715aadbf5435091e227c6b [0,2,0,0,0,0|1,1,0]=4 6938 B13R1.15 C[C@H](CS)OCc1cccc(c1)I bc7a15e0ffd3ca9385fd5468b0713dee [0,2,0,0,0,0|1,1,0]=4 6939 B13R1.15 Cc1cc(ccn1)CNC(C)CO e2a0f7668d4b9f71854dc5d5af79b6d6 [0,2,0,0,0,0|2,0,0]=4 6940 B13R1.15 Cc1cc(ccn1)CN[C@@H](C)CO da26b6dac2196b9f143e001b6396927f [0,2,0,0,0,0|2,0,0]=4 6941 B13R1.15 Cc1cc(ccn1)CN[C@H](C)CO 1f4736d58584da7262cd0d1c7a823027 [0,2,0,0,0,0|2,0,0]=4 6942 B13R1.15 Cc1cc(ccn1)NCC(C)CO 045fe6e924c02edbc7ccf265f54ea28a [0,2,0,0,0,0|2,0,0]=4 6943 B13R1.15 Cc1cc(ccn1)NCC(O)CF 4f9a1e1c6e0ac09b92f9de6dd7f7b33e [0,2,0,0,0,0|2,0,0]=4 6944 B13R1.15 Cc1cc(ccn1)NCC(O)CO 332acec4921fe0b254815dfebf7f58b7 [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.15 Cc1cc(ccn1)NC[C@@H](C)CO e22e28f25e8a55f7101c59e6dc6d82b7 [0,2,0,0,0,0|2,0,0]=4 6946 B13R1.15 Cc1cc(ccn1)NC[C@@H](O)CO 20a8c2c285573633eba2a8ea62755d39 [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.15 Cc1cc(ccn1)NC[C@H](C)CO 299dc6a8901975a33c68f4688aab02b6 [0,2,0,0,0,0|2,0,0]=4 6948 B13R1.15 Cc1cc(ccn1)NC[C@H](O)CO 6a75aab990408b32b6956f593343098e [0,2,0,0,0,0|2,0,0]=4 6949 B13R1.15 Cc1cc(ccn1)OCC(O)CO d280b9046c776c3593a6536211570f64 [0,2,0,0,0,0|2,0,0]=4 6950 B13R1.15 Cc1cc(ccn1)OC[C@@H](O)CO 35c94bb3e0e3c680e7e8f7f465e7fa20 [0,2,0,0,0,0|2,0,0]=4 6951 B13R1.15 Cc1cc(ccn1)OC[C@H](O)CO 97e29fdee13a954db0a13391e6b265cb [0,2,0,0,0,0|2,0,0]=4 6952 B13R1.15 Cc1cccc(c1)CCN(C)C=O 1c040eb7ffd5432d29cb5ba0d7aad588 [0,2,0,0,0,0|1,0,1]=4 6953 B13R1.15 Cc1cccc(c1)CCN(C)CF bee5dd07b533a645de47aac10c286cb1 [0,2,0,0,0,0|2,0,0]=4 6954 B13R1.15 Cc1cccc(c1)CCN(C)CO bb2049ed9e8f6a7755e1828bdaa63fae [0,2,0,0,0,0|1,0,0]=3 6955 B13R1.15 Cc1cccc(c1)CNC(C)C#N 22d2d9fa7911d8bbe2a05c2d4402a518 [0,2,0,0,0,0|2,0,0]=4 6956 B13R1.15 Cc1cccc(c1)CNC(C)C=O 41f9755cd540e05a1bac63b477a8f926 [0,2,0,0,0,0|1,0,1]=4 6957 B13R1.15 Cc1cccc(c1)CNC(C)CO 1ce78b6ed3d7b79ca902c12bb7d4d575 [0,2,0,0,0,0|1,0,0]=3 6958 B13R1.15 Cc1cccc(c1)CN[C@@H](C)CO 148ed790db27f855c992916ff759c2b3 [0,2,0,0,0,0|1,0,0]=3 6959 B13R1.15 Cc1cccc(c1)CN[C@H](C)C=O 9e1a7cff582328e77ce9fb4a91fd9e19 [0,2,0,0,0,0|1,0,1]=4 6960 B13R1.15 Cc1cccc(c1)CN[C@H](C)CO cb45f8d268f4d4eef02049dd2fb2a345 [0,2,0,0,0,0|1,0,0]=3 6961 B13R1.15 Cc1cccc(c1)COC(C)C=O 2f38fd7b8e1fea94768c709be4dbd9c8 [0,2,0,0,0,0|1,0,1]=4 6962 B13R1.15 Cc1cccc(c1)COC(C)CF ec1a66b934b9683bee2ba22a1b5573d3 [0,2,0,0,0,0|2,0,0]=4 6963 B13R1.15 Cc1cccc(c1)COC(C)CS eeb2e3efca39abd886c72ebeb5316988 [0,2,0,0,0,0|1,1,0]=4 6964 B13R1.15 Cc1cccc(c1)CO[C@H](C)C=O 090e986c6fc8cfcd20a540f9a4a380cc [0,2,0,0,0,0|1,0,1]=4 6965 B13R1.15 Cc1cccc(c1)CO[C@H](C)CS f47a109e582bb1ce99498f84143c75fd [0,2,0,0,0,0|1,1,0]=4 6966 B13R1.15 Cc1cccc(c1)NCC(Br)CBr b5ba17d6adf48d1895e34f6ef1095b3b [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.15 Cc1cccc(c1)NCC(C)C#N c8c25a0f505e117646885ac41f50edce [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.15 Cc1cccc(c1)NCC(C)CO d2f16910449449cc9185e27db58de824 [0,2,0,0,0,0|1,0,0]=3 6969 B13R1.15 Cc1cccc(c1)NCC(F)CO f3e74e92902cb635b8afea425cbe31a0 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.15 Cc1cccc(c1)NCC(O)CF 55cc4205d87805b0c6c3e8efe4868801 [0,2,0,0,0,0|1,0,0]=3 6971 B13R1.15 Cc1cccc(c1)NCC(O)CO 8759aade0abafd1716f3336d7f1514d4 [0,2,0,0,0,0|1,0,0]=3 6972 B13R1.15 Cc1cccc(c1)NC[C@@H](C)CO 14958b3687c47f61f5ba4dc9b39f39bf [0,2,0,0,0,0|1,0,0]=3 6973 B13R1.15 Cc1cccc(c1)NC[C@@H](F)CO 38bf2262bfafdeed22b5f3181b9855fd [0,2,0,0,0,0|2,0,0]=4 6974 B13R1.15 Cc1cccc(c1)NC[C@@H](O)CO 4500d8cf0159975928a554140b21a888 [0,2,0,0,0,0|1,0,0]=3 6975 B13R1.15 Cc1cccc(c1)NC[C@H](C)CO 21a1a752c93f01cb1d47076cd1335caa [0,2,0,0,0,0|1,0,0]=3 6976 B13R1.15 Cc1cccc(c1)NC[C@H](F)CO b74ba29d07f579d53e45ed0571b26e8a [0,2,0,0,0,0|2,0,0]=4 6977 B13R1.15 Cc1cccc(c1)NC[C@H](O)CO d330bae2b1cd46a980deebfe18daf67a [0,2,0,0,0,0|1,0,0]=3 6978 B13R1.15 Cc1cccc(c1)OCC(C)C#N 5575465add4c9f8166b02344ad1aa31e [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.15 Cc1cccc(c1)OCC(O)CO 0e70b2ac3407ab76a294664e593a3b59 [0,2,0,0,0,0|1,0,0]=3 6980 B13R1.15 Cc1cccc(c1)OC[C@@H](O)CO 8b69f00b8faa6a61a31e9da972e6c1a8 [0,2,0,0,0,0|1,0,0]=3 6981 B13R1.15 Cc1cccc(c1)OC[C@H](O)CO c39d988ca9d6ee154f97f4f3b5762af4 [0,2,0,0,0,0|1,0,0]=3 6982 B13R1.15 Cc1cccc(n1)CNC(C)CO e75aed75e46f211aca8e9dc0e61888a0 [0,2,0,0,0,0|2,0,0]=4 6983 B13R1.15 Cc1cccc(n1)CN[C@@H](C)CO 1a860dc7a53a5d1caffc241b41b7e7e7 [0,2,0,0,0,0|2,0,0]=4 6984 B13R1.15 Cc1cccc(n1)CN[C@H](C)CO 76ab132346132e1b7ffe981049c2bfb5 [0,2,0,0,0,0|2,0,0]=4 6985 B13R1.15 Cc1cccc(n1)NCC(C)CO 7694912547753e4b13909b80b99aaedb [0,2,0,0,0,0|2,0,0]=4 6986 B13R1.15 Cc1cccc(n1)NCC(O)CF b928050b9b9f7d6b1fcde157c7db76ed [0,2,0,0,0,0|2,0,0]=4 6987 B13R1.15 Cc1cccc(n1)NCC(O)CO 2e60a24fa3831a10a1a9cd26bad1fe89 [0,2,0,0,0,0|2,0,0]=4 6988 B13R1.15 Cc1cccc(n1)NC[C@@H](C)CO 02e87fedabc4219693b8ddee6bf9a05a [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.15 Cc1cccc(n1)NC[C@@H](O)CO 614d207676fe85113a760aa13260eda6 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.15 Cc1cccc(n1)NC[C@H](C)CO f557712994c0c34997aded1c43073e9f [0,2,0,0,0,0|2,0,0]=4 6991 B13R1.15 Cc1cccc(n1)NC[C@H](O)CO 0a994b535314e51b08e98670d3c33cfc [0,2,0,0,0,0|2,0,0]=4 6992 B13R1.15 Cc1cccc(n1)OCC(O)CO ff8004340083dbb962d115d586f6de26 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.15 Cc1cccc(n1)OC[C@@H](O)CO 956a5542a7e60a733ff51edebdcfaa77 [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.15 Cc1cccc(n1)OC[C@H](O)CO f300df76a0ee08a7212552f243bccccd [0,2,0,0,0,0|2,0,0]=4 6995 B13R1.15 Cc1ccnc(c1)CNC(C)CO 4c8bcf161e69784e8df3e7573450c0d8 [0,2,0,0,0,0|2,0,0]=4 6996 B13R1.15 Cc1ccnc(c1)CN[C@@H](C)CO 89147416a9fe600da5142533533624b3 [0,2,0,0,0,0|2,0,0]=4 6997 B13R1.15 Cc1ccnc(c1)CN[C@H](C)CO a2a437551f1162b25a8a2ac1fa23a498 [0,2,0,0,0,0|2,0,0]=4 6998 B13R1.15 Cc1ccnc(c1)NCC(C)CO d824fda0203ae061dd491baabc27853f [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.15 Cc1ccnc(c1)NCC(O)CF 5c857ac22f68bda967793040e032c475 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.15 Cc1ccnc(c1)NCC(O)CO 3cdea546f941a55e7eea6519c121322d [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.15 Cc1ccnc(c1)NC[C@@H](C)CO 4ce383dfc6f9eda68cb29397324bf727 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.15 Cc1ccnc(c1)NC[C@@H](O)CO 30f705773a9c227c4783dd5931387b63 [0,2,0,0,0,0|2,0,0]=4 7003 B13R1.15 Cc1ccnc(c1)NC[C@H](C)CO 8a834ebeed00b8b4ff43285069b63cc4 [0,2,0,0,0,0|2,0,0]=4 7004 B13R1.15 Cc1ccnc(c1)NC[C@H](O)CO 4b95a85050262a76bf9784665c906ca3 [0,2,0,0,0,0|2,0,0]=4 7005 B13R1.15 Cc1ccnc(c1)OCC(O)CO 5120bb1f24e1bd5431fa8f29a155b838 [0,2,0,0,0,0|2,0,0]=4 7006 B13R1.15 Cc1ccnc(c1)OC[C@@H](O)CO 7db89bc5d9fdb7e66e19d4d5589130e7 [0,2,0,0,0,0|2,0,0]=4 7007 B13R1.15 Cc1ccnc(c1)OC[C@H](O)CO 0832d1c4fb740824424d912912eca1e8 [0,2,0,0,0,0|2,0,0]=4 7008 B13R1.15 Cc1cncc(c1)CNC(C)CO 40d911df557ce75f2e8ef456a2cb19a1 [0,2,0,0,0,0|2,0,0]=4 7009 B13R1.15 Cc1cncc(c1)CN[C@@H](C)CO 1bd5b9ec0d4015d3ddf94c0d4ea4dd81 [0,2,0,0,0,0|2,0,0]=4 7010 B13R1.15 Cc1cncc(c1)CN[C@H](C)CO 4db7969f76bc348c2ea4f478e36010fb [0,2,0,0,0,0|2,0,0]=4 7011 B13R1.15 Cc1cncc(c1)NCC(C)CO f5c196a7884de820f5dce819e707fbf1 [0,2,0,0,0,0|2,0,0]=4 7012 B13R1.15 Cc1cncc(c1)NCC(O)CF 7e269cf8e9f4e771f8c0c094af4032cb [0,2,0,0,0,0|2,0,0]=4 7013 B13R1.15 Cc1cncc(c1)NCC(O)CO 3b979d000683232901dd2eb2bcac260e [0,2,0,0,0,0|2,0,0]=4 7014 B13R1.15 Cc1cncc(c1)NC[C@@H](C)CO 747a8ea0b997be49b5ece4689a0556dc [0,2,0,0,0,0|2,0,0]=4 7015 B13R1.15 Cc1cncc(c1)NC[C@@H](O)CO 280845d3511e2c5525939744e7b0b7d8 [0,2,0,0,0,0|2,0,0]=4 7016 B13R1.15 Cc1cncc(c1)NC[C@H](C)CO fbda526516357867f094b1cddf4fdcae [0,2,0,0,0,0|2,0,0]=4 7017 B13R1.15 Cc1cncc(c1)NC[C@H](O)CO 6e975778d7b4ee02280a5092cb36a130 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.15 Cc1cncc(c1)OCC(O)CO 3ccef4e5cb9104db7933314d788fd1d4 [0,2,0,0,0,0|2,0,0]=4 7019 B13R1.15 Cc1cncc(c1)OC[C@@H](O)CO ba42f202cbd17e161bf97d75e5374328 [0,2,0,0,0,0|2,0,0]=4 7020 B13R1.15 Cc1cncc(c1)OC[C@H](O)CO d3ebfecd397c818a468b5d808c951b67 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.15 Fc1cccc(c1)NCC(Br)CBr dfac3517cf79f58803189dfa2fff9f52 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.15 O=c1cc(cc[nH]1)NCC(O)CO c8d3a089fd61b382b1b723aec1668244 [0,2,0,0,0,0|2,0,0]=4 7023 B13R1.15 O=c1cc(cc[nH]1)NC[C@@H](O)CO 9ccc8a171e4e634703b0fd66bb05a3a3 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.15 O=c1cc(cc[nH]1)NC[C@H](O)CO a85f47bda6dca74972e4bc412f961364 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.15 O=c1cccc([nH]1)NCC(O)CO 60d2a434461f844626286bf8d873e0fc [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.15 O=c1cccc([nH]1)NC[C@@H](O)CO a937ea7a6aaeef1d3a8113f02bc19df1 [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.15 O=c1cccc([nH]1)NC[C@H](O)CO 970d7964af113952f11aeb707aadc747 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.15 OC(CF)CNc1cc(ccn1)Br 4c1ab4b602b37ca1669c14ffde492a2e [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.15 OC(CF)CNc1cc(ccn1)Cl 2c585f687153e77ed7eae6fb6ec51e92 [0,2,0,0,0,0|2,0,0]=4 7030 B13R1.15 OC(CF)CNc1cc(ccn1)F 4d485f178b44ce5c2c8d23110ce7fa35 [0,2,0,0,0,0|2,0,0]=4 7031 B13R1.15 OC(CF)CNc1cc(ccn1)I d0e5a7e5beb6cb94dd9830d9f7bf6524 [0,2,0,0,0,0|2,0,0]=4 7032 B13R1.15 OC(CF)CNc1cc[nH]c(=S)c1 fe5cd912f1119978df50b05724ab69bf [0,2,0,0,0,0|2,0,0]=4 7033 B13R1.15 OC(CF)CNc1cccc(c1)Br 144e2c7e034bd6323fe2db74f2249bf8 [0,2,0,0,0,0|1,0,0]=3 7034 B13R1.15 OC(CF)CNc1cccc(c1)Cl 403d3af95aaad8c54bd799355171ea36 [0,2,0,0,0,0|1,0,0]=3 7035 B13R1.15 OC(CF)CNc1cccc(c1)F c9b4b1817dc492baf448e2c4ef08fb92 [0,2,0,0,0,0|1,0,0]=3 7036 B13R1.15 OC(CF)CNc1cccc(c1)I 04c436320db4267c1aad39d3c9f3478d [0,2,0,0,0,0|1,0,0]=3 7037 B13R1.15 OC(CF)CNc1cccc(c1)S 105956897e252fa7d45f7c9f4f954289 [0,2,0,0,0,0|1,0,0]=3 7038 B13R1.15 OC(CF)CNc1cccc(n1)Br 0c74f8232c6cf700848aee4d13e5a7df [0,2,0,0,0,0|2,0,0]=4 7039 B13R1.15 OC(CF)CNc1cccc(n1)Cl 17b88a661774defbb44aeceeaa465a30 [0,2,0,0,0,0|2,0,0]=4 7040 B13R1.15 OC(CF)CNc1cccc(n1)F 3534c544af97525953407f86d7b99ae2 [0,2,0,0,0,0|2,0,0]=4 7041 B13R1.15 OC(CF)CNc1cccc(n1)I 209636ba11f4875eae5611e1ddcab77b [0,2,0,0,0,0|2,0,0]=4 7042 B13R1.15 OC(CF)CNc1ccnc(c1)Br a3a04fa3ef39f1c68c09e89425e72025 [0,2,0,0,0,0|2,0,0]=4 7043 B13R1.15 OC(CF)CNc1ccnc(c1)Cl 8fff68330fe765cf5e4fd8bf21332ae4 [0,2,0,0,0,0|2,0,0]=4 7044 B13R1.15 OC(CF)CNc1ccnc(c1)F 92220f452fe51c9f0bf47cf43ef51fa4 [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.15 OC(CF)CNc1ccnc(c1)I 4f8102e5b439861a45b21c6d6142d767 [0,2,0,0,0,0|2,0,0]=4 7046 B13R1.15 OC(CF)CNc1cncc(c1)Br 9bfaf3b85bf8264597e51c925afbb68b [0,2,0,0,0,0|2,0,0]=4 7047 B13R1.15 OC(CF)CNc1cncc(c1)Cl d6844130e4f9eb913e6fce9636571c34 [0,2,0,0,0,0|2,0,0]=4 7048 B13R1.15 OC(CF)CNc1cncc(c1)F 183ffe46a9a661b4a96dfb1b9d5b167a [0,2,0,0,0,0|2,0,0]=4 7049 B13R1.15 OC(CF)CNc1cncc(c1)I ca6defdb5c295da5759ae2932041a7cc [0,2,0,0,0,0|2,0,0]=4 7050 B13R1.15 OCC(F)CNc1cccc(c1)F 6d55fd24035ba9b3e7aea089ec4b21a0 [0,2,0,0,0,0|2,0,0]=4 7051 B13R1.15 OCC(F)CNc1cccc(c1)O d4dc7fc5bcdaa266dcd905bf853a94e7 [0,2,0,0,0,0|2,0,0]=4 7052 B13R1.15 OCC(F)CNc1cccc(c1)S a80177a53260375e4e10ebc7baf4a596 [0,2,0,0,0,0|2,0,0]=4 7053 B13R1.15 OCC(O)CNc1cc(ccn1)Br 660e41f2401c80d1a09f4244488b05f3 [0,2,0,0,0,0|2,0,0]=4 7054 B13R1.15 OCC(O)CNc1cc(ccn1)Cl f63c0ae3af69ca3630f933a851083513 [0,2,0,0,0,0|2,0,0]=4 7055 B13R1.15 OCC(O)CNc1cc(ccn1)F 3a9de3b95503a882d0f3af9a7acc6a8c [0,2,0,0,0,0|2,0,0]=4 7056 B13R1.15 OCC(O)CNc1cc(ccn1)I d2195caaa96a3b5ad3ab62168468f300 [0,2,0,0,0,0|2,0,0]=4 7057 B13R1.15 OCC(O)CNc1cc[nH]c(=S)c1 0deb40d578f61bb311f54a26e65b5d13 [0,2,0,0,0,0|2,0,0]=4 7058 B13R1.15 OCC(O)CNc1cccc(c1)Br 6f242b3487b31aa688c77128ae8c6605 [0,2,0,0,0,0|1,0,0]=3 7059 B13R1.15 OCC(O)CNc1cccc(c1)Cl 98d1b74d875da6533798e980c83b5001 [0,2,0,0,0,0|1,0,0]=3 7060 B13R1.15 OCC(O)CNc1cccc(c1)F 242fcf718677ea3440f3ea281ebe33e9 [0,2,0,0,0,0|1,0,0]=3 7061 B13R1.15 OCC(O)CNc1cccc(c1)I 29582f127b7bcfff28957b13db2cbb13 [0,2,0,0,0,0|1,0,0]=3 7062 B13R1.15 OCC(O)CNc1cccc(c1)S 21a717100e497ba2d8a1df776474a3b0 [0,2,0,0,0,0|1,0,0]=3 7063 B13R1.15 OCC(O)CNc1cccc(n1)Br cfa18695b5a11a8c0bebe5a786a837c1 [0,2,0,0,0,0|2,0,0]=4 7064 B13R1.15 OCC(O)CNc1cccc(n1)Cl 99f51946d9008c2445891c086309b983 [0,2,0,0,0,0|2,0,0]=4 7065 B13R1.15 OCC(O)CNc1cccc(n1)F efd90d93a8b302e1eb5d6eccd6f52457 [0,2,0,0,0,0|2,0,0]=4 7066 B13R1.15 OCC(O)CNc1cccc(n1)I 89c795967a5e35af5083070cb40abbaa [0,2,0,0,0,0|2,0,0]=4 7067 B13R1.15 OCC(O)CNc1ccnc(c1)Br 6806468656dd144fc472f2d34d576b23 [0,2,0,0,0,0|2,0,0]=4 7068 B13R1.15 OCC(O)CNc1ccnc(c1)Cl b5fe52e796cca285639aa954dd66bdc6 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.15 OCC(O)CNc1ccnc(c1)F d3dcd48897b9971a8c7e66e3441e6119 [0,2,0,0,0,0|2,0,0]=4 7070 B13R1.15 OCC(O)CNc1ccnc(c1)I f49106dd0879413b67bfe17a1bcd5515 [0,2,0,0,0,0|2,0,0]=4 7071 B13R1.15 OCC(O)CNc1cncc(c1)Br ffb90b73b3fe2d7d0a97c633d936ee80 [0,2,0,0,0,0|2,0,0]=4 7072 B13R1.15 OCC(O)CNc1cncc(c1)Cl 3883b55f836170de24ccc9667e4b16cc [0,2,0,0,0,0|2,0,0]=4 7073 B13R1.15 OCC(O)CNc1cncc(c1)F 4e0f6c2ee5f65b987f005c7ac2017328 [0,2,0,0,0,0|2,0,0]=4 7074 B13R1.15 OCC(O)CNc1cncc(c1)I 1145854a79866a481c1131d3333ccfab [0,2,0,0,0,0|2,0,0]=4 7075 B13R1.15 OCC(O)COc1cc(ccn1)Br 8ada5a4dff96eaae94592c209ca09596 [0,2,0,0,0,0|2,0,0]=4 7076 B13R1.15 OCC(O)COc1cc(ccn1)Cl d658613620544fd4844dab7571fcb5b3 [0,2,0,0,0,0|2,0,0]=4 7077 B13R1.15 OCC(O)COc1cc(ccn1)F aeccd9a69e2e5bf196f06375a848ae3e [0,2,0,0,0,0|2,0,0]=4 7078 B13R1.15 OCC(O)COc1cccc(c1)Br 307e8a1e94bb106c69ab1f7983449979 [0,2,0,0,0,0|1,0,0]=3 7079 B13R1.15 OCC(O)COc1cccc(c1)Cl c7d65097bdc17a74c0ceea8729b68ce9 [0,2,0,0,0,0|1,0,0]=3 7080 B13R1.15 OCC(O)COc1cccc(c1)F 9e4e117fde75df9f32efa06b95439632 [0,2,0,0,0,0|1,0,0]=3 7081 B13R1.15 OCC(O)COc1cccc(c1)I 5dbe977ce56e6ca058abb14343325ba8 [0,2,0,0,0,0|1,0,0]=3 7082 B13R1.15 OCC(O)COc1cccc(c1)S 11cf682fa5efc8b3d91f9d6bcc2d178b [0,2,0,0,0,0|1,0,0]=3 7083 B13R1.15 OCC(O)COc1cccc(n1)Br 2f866c0260269e8071834cc28bf13517 [0,2,0,0,0,0|2,0,0]=4 7084 B13R1.15 OCC(O)COc1cccc(n1)F 5d6b8ffe8452c1461f17c9ed35521540 [0,2,0,0,0,0|2,0,0]=4 7085 B13R1.15 OCC(O)COc1ccnc(c1)Br 8dc8636a9a3a668187242cb3e71054d1 [0,2,0,0,0,0|2,0,0]=4 7086 B13R1.15 OCC(O)COc1ccnc(c1)Cl 6a45d9a05db7616a580f4dc5feb5adfa [0,2,0,0,0,0|2,0,0]=4 7087 B13R1.15 OCC(O)COc1ccnc(c1)F b1921c2662bc616a56514944f9103902 [0,2,0,0,0,0|2,0,0]=4 7088 B13R1.15 OCC(O)COc1cncc(c1)Cl 349ae15ac1f618ac67b54de94e5e2d94 [0,2,0,0,0,0|2,0,0]=4 7089 B13R1.15 OCC(O)COc1cncc(c1)F ed18c26a2bd01ce525c9cdffd4fb23f1 [0,2,0,0,0,0|2,0,0]=4 7090 B13R1.15 OCC(O)COc1cncc(c1)I 863aad2101609d92b87ba88546529175 [0,2,0,0,0,0|2,0,0]=4 7091 B13R1.15 OC[C@@H](F)CNc1cccc(c1)F e9102f12706a6953822c5a14a7676d0f [0,2,0,0,0,0|2,0,0]=4 7092 B13R1.15 OC[C@@H](F)CNc1cccc(c1)O 96c0de28e9a0b9bb594dd06fcce82ce5 [0,2,0,0,0,0|2,0,0]=4 7093 B13R1.15 OC[C@@H](F)CNc1cccc(c1)S ad2a0d3e689b423143014bf12015951d [0,2,0,0,0,0|2,0,0]=4 7094 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)Br debee4031cb47464748550bcdc498e55 [0,2,0,0,0,0|2,0,0]=4 7095 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)Cl 40a6443cfbbfa55fb38a218ad67f2ac8 [0,2,0,0,0,0|2,0,0]=4 7096 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)F ab928eb8aed87f3f6103f40b4edae2d1 [0,2,0,0,0,0|2,0,0]=4 7097 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)I 4d5c32d88ce7b88a5d4825263371d4ff [0,2,0,0,0,0|2,0,0]=4 7098 B13R1.15 OC[C@@H](O)CNc1cc[nH]c(=S)c1 384bdc7fbf189df1f03bd3d0fba476e2 [0,2,0,0,0,0|2,0,0]=4 7099 B13R1.15 OC[C@@H](O)CNc1cccc(c1)Br eccf45cac30de2c077c2ecdac9babfd3 [0,2,0,0,0,0|1,0,0]=3 7100 B13R1.15 OC[C@@H](O)CNc1cccc(c1)Cl 1856ce217536eba297f335f52705327e [0,2,0,0,0,0|1,0,0]=3 7101 B13R1.15 OC[C@@H](O)CNc1cccc(c1)F f875a697f3f52878fdead7b08a793c8d [0,2,0,0,0,0|1,0,0]=3 7102 B13R1.15 OC[C@@H](O)CNc1cccc(c1)I 64245780b0e81a944a6317966588daf6 [0,2,0,0,0,0|1,0,0]=3 7103 B13R1.15 OC[C@@H](O)CNc1cccc(c1)S 89ea48c474d342fccdb43cf889dfab4e [0,2,0,0,0,0|1,0,0]=3 7104 B13R1.15 OC[C@@H](O)CNc1cccc(n1)Br 8e40b2e3d2281391c098b46a918ccf4d [0,2,0,0,0,0|2,0,0]=4 7105 B13R1.15 OC[C@@H](O)CNc1cccc(n1)Cl 22548fcf83c9f8734c1979514710b99d [0,2,0,0,0,0|2,0,0]=4 7106 B13R1.15 OC[C@@H](O)CNc1cccc(n1)F d01f6a7705a98255e34d5a172e4ba722 [0,2,0,0,0,0|2,0,0]=4 7107 B13R1.15 OC[C@@H](O)CNc1cccc(n1)I bc6a373b79be32ee1835c2b4a80fb345 [0,2,0,0,0,0|2,0,0]=4 7108 B13R1.15 OC[C@@H](O)CNc1ccnc(c1)Br f0814e1ff58ec55670836b0aa9ac7687 [0,2,0,0,0,0|2,0,0]=4 7109 B13R1.15 OC[C@@H](O)CNc1ccnc(c1)Cl a9078e875895fb0f27f6c8d67bec0ae3 [0,2,0,0,0,0|2,0,0]=4 7110 B13R1.15 OC[C@@H](O)CNc1ccnc(c1)F 53d10bca14408f433d01c387b51c6984 [0,2,0,0,0,0|2,0,0]=4 7111 B13R1.15 OC[C@@H](O)CNc1ccnc(c1)I 512d9031915a29c3b912325e2e0f6944 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.15 OC[C@@H](O)CNc1cncc(c1)Br 16c19db0358262e3bf4c02888108de3c [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.15 OC[C@@H](O)CNc1cncc(c1)Cl 5eb997d9ed8d33081aa3efe57abaae6c [0,2,0,0,0,0|2,0,0]=4 7114 B13R1.15 OC[C@@H](O)CNc1cncc(c1)F 293f84027133fe6f74df7ddf33e5452b [0,2,0,0,0,0|2,0,0]=4 7115 B13R1.15 OC[C@@H](O)CNc1cncc(c1)I df8ab959225274d31c32aea6c42035cc [0,2,0,0,0,0|2,0,0]=4 7116 B13R1.15 OC[C@@H](O)COc1cc(ccn1)Br df6bd37581ffd0027c0356938dcf68e1 [0,2,0,0,0,0|2,0,0]=4 7117 B13R1.15 OC[C@@H](O)COc1cc(ccn1)Cl cce6ee6c156c7f01eb6994edff4e5fb5 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.15 OC[C@@H](O)COc1cc(ccn1)F 14b5dbdfe6c578ea7fc0490208ef96a7 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.15 OC[C@@H](O)COc1cccc(c1)Br 038c886c1a43f04e5b1f187edf942d51 [0,2,0,0,0,0|1,0,0]=3 7120 B13R1.15 OC[C@@H](O)COc1cccc(c1)Cl fc634bbac95999bd82fad5d704da6fa2 [0,2,0,0,0,0|1,0,0]=3 7121 B13R1.15 OC[C@@H](O)COc1cccc(c1)F 8cccd3acde8bf58d3d73450c36a54d15 [0,2,0,0,0,0|1,0,0]=3 7122 B13R1.15 OC[C@@H](O)COc1cccc(c1)I 66312cf062017b2c7465aa5ef9c66457 [0,2,0,0,0,0|1,0,0]=3 7123 B13R1.15 OC[C@@H](O)COc1cccc(c1)S bd8bb22788db649430cbfc97077a9f35 [0,2,0,0,0,0|1,0,0]=3 7124 B13R1.15 OC[C@@H](O)COc1cccc(n1)Br 03a02a80a70b13cf81ae364fa2241e3f [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.15 OC[C@@H](O)COc1cccc(n1)F dbea553f6746e870a406bfb92ddc772f [0,2,0,0,0,0|2,0,0]=4 7126 B13R1.15 OC[C@@H](O)COc1ccnc(c1)Br 1e728171c27c86e034b9e43004d09fb0 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.15 OC[C@@H](O)COc1ccnc(c1)Cl fbba4d4e1c638b145681467d62bc20ac [0,2,0,0,0,0|2,0,0]=4 7128 B13R1.15 OC[C@@H](O)COc1ccnc(c1)F 30457c7dfa05ed0d1a245a5bf67dd873 [0,2,0,0,0,0|2,0,0]=4 7129 B13R1.15 OC[C@@H](O)COc1cncc(c1)Cl c584d453281a7c38c787233c303a04e1 [0,2,0,0,0,0|2,0,0]=4 7130 B13R1.15 OC[C@@H](O)COc1cncc(c1)F ed5f3e7c55d32629325e510fd0adcdee [0,2,0,0,0,0|2,0,0]=4 7131 B13R1.15 OC[C@@H](O)COc1cncc(c1)I 37e9570d11d5376513be9b9094f6f43e [0,2,0,0,0,0|2,0,0]=4 7132 B13R1.15 OC[C@H](F)CNc1cccc(c1)F 687e79d7f09f9b8adf4b445d867c77d6 [0,2,0,0,0,0|2,0,0]=4 7133 B13R1.15 OC[C@H](F)CNc1cccc(c1)O 8880eb5b4c71e5e9072227d890dae2ff [0,2,0,0,0,0|2,0,0]=4 7134 B13R1.15 OC[C@H](F)CNc1cccc(c1)S 7508be362c21322fa8bca33f7fdc12f6 [0,2,0,0,0,0|2,0,0]=4 7135 B13R1.15 OC[C@H](O)CNc1cc(ccn1)Br ccb44a6f2c5643580c49dccc223dff4c [0,2,0,0,0,0|2,0,0]=4 7136 B13R1.15 OC[C@H](O)CNc1cc(ccn1)Cl 6b7cab3da85a678d6d537a14fb485f09 [0,2,0,0,0,0|2,0,0]=4 7137 B13R1.15 OC[C@H](O)CNc1cc(ccn1)F 24d8bbc0088efef989d522c54a160ee6 [0,2,0,0,0,0|2,0,0]=4 7138 B13R1.15 OC[C@H](O)CNc1cc(ccn1)I 57930453a20fce01c70812eaf285ce39 [0,2,0,0,0,0|2,0,0]=4 7139 B13R1.15 OC[C@H](O)CNc1cc[nH]c(=S)c1 d6bd5311bd49ec621cf062dbc0c1efe0 [0,2,0,0,0,0|2,0,0]=4 7140 B13R1.15 OC[C@H](O)CNc1cccc(c1)Br 22c518a5cb87b0061e04038cf7ac88aa [0,2,0,0,0,0|1,0,0]=3 7141 B13R1.15 OC[C@H](O)CNc1cccc(c1)Cl ddf9d7eb3235bacc15ff593bc48c0865 [0,2,0,0,0,0|1,0,0]=3 7142 B13R1.15 OC[C@H](O)CNc1cccc(c1)F c9afab307d5bd074357dc382151767e1 [0,2,0,0,0,0|1,0,0]=3 7143 B13R1.15 OC[C@H](O)CNc1cccc(c1)I 0e815fa66179f02e3628b832eaf65500 [0,2,0,0,0,0|1,0,0]=3 7144 B13R1.15 OC[C@H](O)CNc1cccc(c1)S a0475c338fbfe02e2acb2bcd1b05e5bd [0,2,0,0,0,0|1,0,0]=3 7145 B13R1.15 OC[C@H](O)CNc1cccc(n1)Br 8b2e802c9d5c124a6dd8d7284e922c8d [0,2,0,0,0,0|2,0,0]=4 7146 B13R1.15 OC[C@H](O)CNc1cccc(n1)Cl 6876303cb78da9ce948c8ba84688f60f [0,2,0,0,0,0|2,0,0]=4 7147 B13R1.15 OC[C@H](O)CNc1cccc(n1)F 5711e20913e7c1d7c261f17082593447 [0,2,0,0,0,0|2,0,0]=4 7148 B13R1.15 OC[C@H](O)CNc1cccc(n1)I de58dc6df8546b53f2bbb178efe1ba95 [0,2,0,0,0,0|2,0,0]=4 7149 B13R1.15 OC[C@H](O)CNc1ccnc(c1)Br b73704ece4a5928e02f345628932428a [0,2,0,0,0,0|2,0,0]=4 7150 B13R1.15 OC[C@H](O)CNc1ccnc(c1)Cl 92de12bc626f3cc4c0333248bacfcf18 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.15 OC[C@H](O)CNc1ccnc(c1)F acb2c508c432a1ef1bbd372d430aa98b [0,2,0,0,0,0|2,0,0]=4 7152 B13R1.15 OC[C@H](O)CNc1ccnc(c1)I 8871d18fcf0c0818b8cffa6505bba632 [0,2,0,0,0,0|2,0,0]=4 7153 B13R1.15 OC[C@H](O)CNc1cncc(c1)Br 49cc11a891f0c849c7fe8b4356165729 [0,2,0,0,0,0|2,0,0]=4 7154 B13R1.15 OC[C@H](O)CNc1cncc(c1)Cl 2bddfff6b9a32d9657b35240cfe7bd12 [0,2,0,0,0,0|2,0,0]=4 7155 B13R1.15 OC[C@H](O)CNc1cncc(c1)F 7c50cd913458dcf60a0572871f3f3435 [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.15 OC[C@H](O)CNc1cncc(c1)I 598a532bd0179f693e702c3b95ac06fb [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.15 OC[C@H](O)COc1cc(ccn1)Br 623891393fd0142afa089f8a32ef70b4 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.15 OC[C@H](O)COc1cc(ccn1)Cl 9f755c328b596014fdb35d0c6fa7fb4d [0,2,0,0,0,0|2,0,0]=4 7159 B13R1.15 OC[C@H](O)COc1cc(ccn1)F 0add908f36c857c70cb6fab8b6cfc160 [0,2,0,0,0,0|2,0,0]=4 7160 B13R1.15 OC[C@H](O)COc1cccc(c1)Br 6bd314401f4f9856793d6564f8c66449 [0,2,0,0,0,0|1,0,0]=3 7161 B13R1.15 OC[C@H](O)COc1cccc(c1)Cl 68425b93004c0e86fcc2130349e89462 [0,2,0,0,0,0|1,0,0]=3 7162 B13R1.15 OC[C@H](O)COc1cccc(c1)F 97954bb985d04a0b8d93a6804d46d6c6 [0,2,0,0,0,0|1,0,0]=3 7163 B13R1.15 OC[C@H](O)COc1cccc(c1)I 38e7ea8ec6e5f9b3b06080b18a80596b [0,2,0,0,0,0|1,0,0]=3 7164 B13R1.15 OC[C@H](O)COc1cccc(c1)S 7dff2228bedfaee4af481b6d686534de [0,2,0,0,0,0|1,0,0]=3 7165 B13R1.15 OC[C@H](O)COc1cccc(n1)Br b7e2a59b1fc40ea9a9125ab7dea7f9b5 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.15 OC[C@H](O)COc1cccc(n1)F 65340798b39fef9a40cda4edeb7078da [0,2,0,0,0,0|2,0,0]=4 7167 B13R1.15 OC[C@H](O)COc1ccnc(c1)Br 978b1f93fb6e4397413ea0594c80545a [0,2,0,0,0,0|2,0,0]=4 7168 B13R1.15 OC[C@H](O)COc1ccnc(c1)Cl 624f80650c1bb6fd7355fde9fd783f0c [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.15 OC[C@H](O)COc1ccnc(c1)F 78b3fba72fde580d7c6b712ed96b36fa [0,2,0,0,0,0|2,0,0]=4 7170 B13R1.15 OC[C@H](O)COc1cncc(c1)Cl 842464abbde644d89cb545ee9d38dd52 [0,2,0,0,0,0|2,0,0]=4 7171 B13R1.15 OC[C@H](O)COc1cncc(c1)F ca78767ce1e37614a18df03fc538be2b [0,2,0,0,0,0|2,0,0]=4 7172 B13R1.15 OC[C@H](O)COc1cncc(c1)I 976c387f15f687454aaafa6cb5fe396f [0,2,0,0,0,0|2,0,0]=4 7173 B13R1.15 Sc1cccc(c1)NCC(Br)CBr 3d480b61a273a88a0ac746a35494bba1 [0,2,0,0,0,0|2,0,0]=4 7174 B13R1.15 [O-][n+]1cccc(c1)OCC(O)CO eccae6327fb0576583d60faa178edbea [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.15 [O-][n+]1cccc(c1)OC[C@@H](O)CO be7ebf93df7b9eec37d35ecb405b557c [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.15 [O-][n+]1cccc(c1)OC[C@H](O)CO 3825e36bda34ff715a1ebee46a071448 [0,2,0,0,0,0|2,0,0]=4 7177 B13R1.42 C#CCC(C)OCc1ccccc1 87e1f5be78cc6b5f9357a2c4c8e68c1c [0,2,0,0,0,0|2,0,0]=4 7178 B13R1.42 C#CCN(C)CCc1ccccc1 eee59183f04633b9feade53e582fa207 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.42 C/C=C/C(C)OCc1ccccc1 c0df3343d05cb0346b99d6dc75eec6e2 [0,2,0,0,0,0|2,0,0]=4 7180 B13R1.42 C=CCC(C)CNc1ccccc1 51489e75596453ce56ce34a4a2bdd65b [0,2,0,0,0,0|2,0,0]=4 7181 B13R1.42 C=CCC(C)OCc1ccccc1 2d3cf03808e1c94d175430914870d8d5 [0,2,0,0,0,0|2,0,0]=4 7182 B13R1.42 C=CCC(O)CNc1ccccc1 9e0b870442713e60bc1e0b217927dda1 [0,2,0,0,0,0|1,0,0]=3 7183 B13R1.42 C=CCC(O)CNc1ccccn1 30e6ff4ff8cedefa69fc3d36967bcf83 [0,2,0,0,0,0|2,0,0]=4 7184 B13R1.42 C=CCC(O)CNc1cccnc1 f5f1c3270499506d4d12a14d03f72ace [0,2,0,0,0,0|2,0,0]=4 7185 B13R1.42 C=CCC(O)CNc1ccncc1 ee6b446aa675c3a6eacebe3b2d2a987a [0,2,0,0,0,0|2,0,0]=4 7186 B13R1.42 C=CCN(C)CCc1ccccc1 e3a976f7e1831649e9d77b225b1ffc7b [0,2,0,0,0,0|2,0,0]=4 7187 B13R1.42 C=CC[C@@H](C)OCc1ccccc1 13456c6ad6b10061e37560137720764d [0,2,0,0,0,0|2,0,0]=4 7188 B13R1.42 C=CC[C@H](C)OCc1ccccc1 f380247baa60496234eede3319a99f4c [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.42 CC#CC(C)OCc1ccccc1 5f9658e59dc28dcda538895c59689c79 [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.42 CC(CC#N)NCc1ccccc1 8fc7a6046c4b75e3b9dcff3dc71b417a [0,2,0,0,0,0|2,0,0]=4 7191 B13R1.42 CC(CC#N)OCc1ccccc1 f7e39773b16a04fd938abd3ccc58366f [0,2,0,0,0,0|2,0,0]=4 7192 B13R1.42 CC(CCO)CNc1ccccc1 1cbf2b82d6cb29848f970040e61bb301 [0,2,0,0,0,0|1,0,0]=3 7193 B13R1.42 CC(CCO)CNc1cccnc1 eda0a2195092aee6f033e5e985464cfb [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.42 CC(CCO)CNc1ccncc1 2964ea1fa36ed3b2794e96ca28e8e62c [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.42 CC(CCO)NCc1ccccc1 2d704fb14f90482b2a98956731d04e1c [0,2,0,0,0,0|1,0,0]=3 7196 B13R1.42 CC(CCO)NCc1ccccn1 abf48fb665ce2ad89b750447079ee5b5 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.42 CC(CCO)NCc1cccnc1 edfea8aa4a9667db3c396279c25bbc6d [0,2,0,0,0,0|2,0,0]=4 7198 B13R1.42 CC(CCO)NCc1ccncc1 efffad2ea6a882d94607f6bb735163da [0,2,0,0,0,0|2,0,0]=4 7199 B13R1.42 CC(CCc1ccccc1)NC#N 4fd42473f135ef90c8c043d8407dd69d [0,2,0,0,0,0|1,0,0]=3 7200 B13R1.42 CC(CCc1ccccc1)NC=O bdfe3150024f27d0ff01706315909ccf [0,2,0,0,0,0|0,0,1]=3 7201 B13R1.42 CC(CCc1ccccc1)NCF a42e5b5f91b83e44d4ea6cb075865f9a [0,2,0,0,0,0|1,0,0]=3 7202 B13R1.42 CC(CCc1ccccc1)NCO 573731d8365bcd386dcb0a75723b31f9 [0,2,0,0,0,0|0,0,0]=2 7203 B13R1.42 CC(CCc1ccccc1)OCF b817527da136da6614558b4fdf8a884a [0,2,0,0,0,0|0,0,0]=2 7204 B13R1.42 CC(CCc1ccncc1)OCF aeb843b5fb91b5dc10738cdf75103549 [0,2,0,0,0,0|1,0,0]=3 7205 B13R1.42 CC(COc1ccccc1)NC#N 8b462afe0dd04975795cbd9b0348a504 [0,2,0,0,0,0|2,0,0]=4 7206 B13R1.42 CC(COc1ccccc1)NC=O e3f203de0876716b8e27471010dad93c [0,2,0,0,0,0|1,0,1]=4 7207 B13R1.42 CC(COc1ccccc1)NCF 9aa5220a44864567ebfa3daa01cf4a55 [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.42 CC(COc1ccccc1)NCO a7f9c133fb184909aa86f334d53fc9f7 [0,2,0,0,0,0|1,0,0]=3 7209 B13R1.42 CC(COc1ccccc1)OCF 733d88747cd50c7fd35d010481846585 [0,2,0,0,0,0|1,0,0]=3 7210 B13R1.42 CC=CC(C)OCc1ccccc1 ea94e54106856a108ec09f1a3f6b9d4e [0,2,0,0,0,0|2,0,0]=4 7211 B13R1.42 CCCC(C)CNc1ccccc1 aceca67b9a8fe005c5366aac5e0a66b6 [0,2,0,0,0,0|2,0,0]=4 7212 B13R1.42 CCCC(C)NCc1ccccc1 53154217c268f5d0598e4e12f7d298bb [0,2,0,0,0,0|2,0,0]=4 7213 B13R1.42 CCCC(C)OCc1ccccc1 62e10e03a43d42ba7fb192a9435404e6 [0,2,0,0,0,0|2,0,0]=4 7214 B13R1.42 CCCC(O)CNc1ccccc1 220474775c6cbfc6d80aa13b0113711a [0,2,0,0,0,0|1,0,0]=3 7215 B13R1.42 CCCC(O)CNc1cccnc1 baf3d4e36ec25a42a269af9b16328b4c [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.42 CCCC(O)CNc1ccncc1 897c97268b6b29513597479630ef8bf7 [0,2,0,0,0,0|2,0,0]=4 7217 B13R1.42 CCCN(C)CCc1ccccc1 a41beb51cc343624f1c890785f4bdd38 [0,2,0,0,0,0|2,0,0]=4 7218 B13R1.42 CCC[C@@H](C)OCc1ccccc1 db98b5f2c49d1e3ddf209846b4784b59 [0,2,0,0,0,0|2,0,0]=4 7219 B13R1.42 CCC[C@H](C)NCc1ccccc1 d8804a42c825fa4b5c431612e37bfcee [0,2,0,0,0,0|2,0,0]=4 7220 B13R1.42 CCC[C@H](C)OCc1ccccc1 8c3ca82fcc39937ab59845512a9cd17f [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.42 CCNC(C)CCc1ccccc1 3a85d48c04505575d5467bc0bd9af811 [0,2,0,0,0,0|1,0,0]=3 7222 B13R1.42 CCNC(C)COc1ccccc1 c3f5b985c1454f438bd9b054f4063300 [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.42 CCN[C@@H](C)CCc1ccccc1 25cc2dcf1297b4ba66d4746337c79bd1 [0,2,0,0,0,0|1,0,0]=3 7224 B13R1.42 CCN[C@H](C)CCc1ccccc1 77d995264aa903f3deaa67a682fcce7b [0,2,0,0,0,0|1,0,0]=3 7225 B13R1.42 CCOC(C)C#Cc1ccccc1 b6586e94a2a277ff2b6c7a1513f6e444 [0,2,0,0,0,0|0,0,2]=4 7226 B13R1.42 CCOC(C)CCc1ccccc1 23579034bfebccfffc6e55cea5f13e11 [0,2,0,0,0,0|0,0,0]=2 7227 B13R1.42 CCOC(C)CCc1ccncc1 37b6523f4f90b117462d88265ecf78ea [0,2,0,0,0,0|1,0,0]=3 7228 B13R1.42 CCOC(C)CNc1ccccc1 25fb120a0da31a70bf05e55af475fa7e [0,2,0,0,0,0|1,0,0]=3 7229 B13R1.42 CCOC(C)CNc1ccccn1 375c8e5ae5f4da551c655f4a49d77b1e [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.42 CCOC(C)CNc1cccnc1 1ef0a1d1bbabba28118f2fd94731c2b8 [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.42 CCOC(C)CNc1ccncc1 c3465d9a4d5a878cf1f671b62978bd73 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.42 CCOC(C)COc1ccccc1 adadaa14ae1f0e2b1b62d0cb1c6d50e0 [0,2,0,0,0,0|1,0,0]=3 7233 B13R1.42 CCO[C@@H](C)/C=C/c1ccccc1 6622bcb008aa2be147e5c2e5c90d9017 [0,2,0,0,0,0|0,0,2]=4 7234 B13R1.42 CCO[C@@H](C)CCc1ccccc1 b70a0a77f96b996d192896970f07f491 [0,2,0,0,0,0|0,0,0]=2 7235 B13R1.42 CCO[C@H](C)/C=C/c1ccccc1 76a57581c4cc19118b10835e3b874458 [0,2,0,0,0,0|0,0,2]=4 7236 B13R1.42 CCO[C@H](C)CCc1ccccc1 825f854f5bf562ec2e457866b3a4856f [0,2,0,0,0,0|0,0,0]=2 7237 B13R1.42 CN(CC#N)CCc1ccccc1 fd5f8532536f4fe062678e26044496c1 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.42 CN(CC=O)CCc1ccccc1 41bbf4a6bcb8e065d52edf61eb677740 [0,2,0,0,0,0|1,0,1]=4 7239 B13R1.42 CN(CCF)CCc1ccccc1 1781394fa8b0991b0b61fe822c9dd8d3 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.42 CN(CCO)CCc1ccccc1 4c669cc510b57787c8bc9fcbecf75376 [0,2,0,0,0,0|1,0,0]=3 7241 B13R1.42 CN(CCO)CCc1ccccn1 151354c1cac05e71f825dfc42a6dd998 [0,2,0,0,0,0|2,0,0]=4 7242 B13R1.42 CN(CCO)CCc1cccnc1 0d0d5bbae9e923fcd28bc0946c8a9260 [0,2,0,0,0,0|2,0,0]=4 7243 B13R1.42 CN(CCO)CCc1ccncc1 20f566599d36546e7b25000efa420215 [0,2,0,0,0,0|2,0,0]=4 7244 B13R1.42 CN(CCS)CCc1ccccc1 d45b47e6351da8dae4096dc30623fdf0 [0,2,0,0,0,0|1,1,0]=4 7245 B13R1.42 COCC(C)NCc1ccccc1 ab1fcc440d4cc521099d3de2f29d455a [0,2,0,0,0,0|1,0,0]=3 7246 B13R1.42 COCC(C)NCc1ccccn1 fbba32a546af650e758347c492f87417 [0,2,0,0,0,0|2,0,0]=4 7247 B13R1.42 COCC(C)NCc1cccnc1 ec1595a50fb8d97857af4416ceeb6e32 [0,2,0,0,0,0|2,0,0]=4 7248 B13R1.42 COCC(C)NCc1ccncc1 ac3c06115abe6f3766fb4136013d908f [0,2,0,0,0,0|2,0,0]=4 7249 B13R1.42 COCC(C)OCc1ccccc1 11e0f0e823324ee028f381824ac985a0 [0,2,0,0,0,0|1,0,0]=3 7250 B13R1.42 COCC(C)OCc1ccccn1 474b94ea61fc08cf4221858761693ac2 [0,2,0,0,0,0|2,0,0]=4 7251 B13R1.42 COCC(C)OCc1cccnc1 d1e78e71e9f51b4b1bd3dbb5ae395841 [0,2,0,0,0,0|2,0,0]=4 7252 B13R1.42 COCC(C)OCc1ccncc1 dfae1dbb2b5681019ceb5acc2b8d99da [0,2,0,0,0,0|2,0,0]=4 7253 B13R1.42 COCC(O)CNc1ccccc1 f022b89d713d4034f5740dbcffca3d88 [0,2,0,0,0,0|1,0,0]=3 7254 B13R1.42 COCC(O)CNc1ccccn1 d1e2e48f5e319919afbbe404e8d1bec4 [0,2,0,0,0,0|2,0,0]=4 7255 B13R1.42 COCC(O)CNc1cccnc1 96b85a73eaf0a5dca8cd931a2e15ebf8 [0,2,0,0,0,0|2,0,0]=4 7256 B13R1.42 COCC(O)CNc1ccncc1 920d5b1b61d02b73657aae19508c81c9 [0,2,0,0,0,0|2,0,0]=4 7257 B13R1.42 COCN(C)CCc1ccccc1 e7d3165b0b61bc462d79ae1576fa1ba9 [0,2,0,0,0,0|1,0,0]=3 7258 B13R1.42 COCN(C)CCc1ccccn1 33b281c25bc5b136c758322ee97fa4aa [0,2,0,0,0,0|2,0,0]=4 7259 B13R1.42 COCN(C)CCc1cccnc1 705f32602fc6ff6e7ed48bb8c14a71f7 [0,2,0,0,0,0|2,0,0]=4 7260 B13R1.42 COCN(C)CCc1ccncc1 a1d8cd2571d681345b46a3901e0fc33b [0,2,0,0,0,0|2,0,0]=4 7261 B13R1.42 COC[C@@H](C)NCc1ccccc1 466a3931c5e490fb14677f149f8080c5 [0,2,0,0,0,0|1,0,0]=3 7262 B13R1.42 COC[C@@H](C)NCc1ccccn1 390011a03833c1d95593dffb83a8c05f [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.42 COC[C@@H](C)NCc1cccnc1 7cd7e1fa782a8882a54f4e01f7ca6915 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.42 COC[C@@H](C)OCc1ccccc1 51036b1f3c77dbee4e5edd16b8bd6bcb [0,2,0,0,0,0|1,0,0]=3 7265 B13R1.42 COC[C@@H](C)OCc1ccccn1 3734745c1fd39c4070ed933316bf0752 [0,2,0,0,0,0|2,0,0]=4 7266 B13R1.42 COC[C@@H](C)OCc1cccnc1 5543d573d5dd05f20aa1df573bfb699b [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.42 COC[C@@H](O)CNc1ccccc1 f1b8b05560bc328fdc4c555a83140a6f [0,2,0,0,0,0|1,0,0]=3 7268 B13R1.42 COC[C@@H](O)CNc1cccnc1 cbab1bac48cd696f543be97839b55705 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.42 COC[C@@H](O)CNc1ccncc1 403f9ec22fedb2fce5d19140a72b9d1c [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.42 COC[C@H](C)NCc1ccccc1 32f825cd017921b7836d59b7e65fd97a [0,2,0,0,0,0|1,0,0]=3 7271 B13R1.42 COC[C@H](C)NCc1ccccn1 fb24f8a64ec9cf1d71f0715db427cbfe [0,2,0,0,0,0|2,0,0]=4 7272 B13R1.42 COC[C@H](C)NCc1cccnc1 baa3905acf3e4c2e3349708966637e04 [0,2,0,0,0,0|2,0,0]=4 7273 B13R1.42 COC[C@H](C)OCc1ccccc1 0e493f712feabde7b5d70b60c172f1a2 [0,2,0,0,0,0|1,0,0]=3 7274 B13R1.42 COC[C@H](C)OCc1ccccn1 a0c87ae3f9ce2d0266f8cf9bddbad11b [0,2,0,0,0,0|2,0,0]=4 7275 B13R1.42 COC[C@H](C)OCc1cccnc1 fe6edc7b496f5c494f4eb9e6907d3a21 [0,2,0,0,0,0|2,0,0]=4 7276 B13R1.42 CSCC(C)OCc1ccccc1 c5047fc77e770d5b5eb9f1fcd10f510e [0,2,0,0,0,0|1,1,0]=4 7277 B13R1.42 CSCN(C)CCc1ccccc1 9944bfe9badd870ea5b4a03d98255fd2 [0,2,0,0,0,0|1,1,0]=4 7278 B13R1.42 C[C@@H](/C=C/c1ccccc1)OCF 5bb9274d9fd62319c9df3036f8ac4daa [0,2,0,0,0,0|0,0,2]=4 7279 B13R1.42 C[C@@H](CC#N)OCc1ccccc1 be24e4f36e686ae691993f20b2046013 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.42 C[C@@H](CCO)NCc1ccccc1 bc3866dbf49e39f228cb674cbc1bec8b [0,2,0,0,0,0|1,0,0]=3 7281 B13R1.42 C[C@@H](CCO)NCc1ccccn1 709c790ae075267f9ebb731e9c9319ac [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.42 C[C@@H](CCO)NCc1cccnc1 9b064c5ba1620cf6559e78ca676aa5f0 [0,2,0,0,0,0|2,0,0]=4 7283 B13R1.42 C[C@@H](CCc1ccccc1)NC=O 019d3cf6722d587584026af48c02abcf [0,2,0,0,0,0|0,0,1]=3 7284 B13R1.42 C[C@@H](CCc1ccccc1)NCF 141464051b59054dc947b79a37fab287 [0,2,0,0,0,0|1,0,0]=3 7285 B13R1.42 C[C@@H](CCc1ccccc1)NCO 3759c1278ce61f38b6db3ceb186b0f09 [0,2,0,0,0,0|0,0,0]=2 7286 B13R1.42 C[C@@H](CCc1ccccc1)OCF 2d7573a53a25a898551f872deb413ea5 [0,2,0,0,0,0|0,0,0]=2 7287 B13R1.42 C[C@H](/C=C/c1ccccc1)OCF fb71d3304119d1abfd98add8da0493a5 [0,2,0,0,0,0|0,0,2]=4 7288 B13R1.42 C[C@H](CC#N)OCc1ccccc1 862b4d2a5dd7e9fd25f039263754f779 [0,2,0,0,0,0|2,0,0]=4 7289 B13R1.42 C[C@H](CCO)NCc1ccccc1 8b0dda9ac626523e27cea0e3830dbd74 [0,2,0,0,0,0|1,0,0]=3 7290 B13R1.42 C[C@H](CCO)NCc1ccccn1 ab0361bf5768167e6335736fcf2caf20 [0,2,0,0,0,0|2,0,0]=4 7291 B13R1.42 C[C@H](CCO)NCc1cccnc1 ca1baa55ef3f651ee0c0c9443b6e38f9 [0,2,0,0,0,0|2,0,0]=4 7292 B13R1.42 C[C@H](CCc1ccccc1)NC=O 32ce1a5bf478c1a289ccb73f2582c14a [0,2,0,0,0,0|0,0,1]=3 7293 B13R1.42 C[C@H](CCc1ccccc1)NCF 4e263f3ce53cc0768d172f1bde7fa992 [0,2,0,0,0,0|1,0,0]=3 7294 B13R1.42 C[C@H](CCc1ccccc1)NCO 2e4b0b7de21d868ecf19e6198b53feec [0,2,0,0,0,0|0,0,0]=2 7295 B13R1.42 C[C@H](CCc1ccccc1)OCF e1ee46cdd9db3dc0e9789b0183a6b30c [0,2,0,0,0,0|0,0,0]=2 7296 B13R1.42 N#CCC(O)CNc1ccccc1 529e51e05c0dda125cc4be8166f8151d [0,2,0,0,0,0|1,0,0]=3 7297 B13R1.42 N#CCC(O)CNc1ccccn1 5cc9eb3b0a3aeb8e76d00b96afd9e61f [0,2,0,0,0,0|2,0,0]=4 7298 B13R1.42 N#CCC(O)CNc1cccnc1 bebf162c3e2770d2af89a519b3ca4d51 [0,2,0,0,0,0|2,0,0]=4 7299 B13R1.42 N#CCC(O)CNc1ccncc1 2cfbec77678613dbadb857eb7aa75cc3 [0,2,0,0,0,0|2,0,0]=4 7300 B13R1.42 N#CC[C@@H](O)CNc1ccccc1 8744b63be96f0bf81fff22330a7a2862 [0,2,0,0,0,0|1,0,0]=3 7301 B13R1.42 N#CC[C@@H](O)CNc1ccccn1 b514b230deea1fdce5f17b86f299c871 [0,2,0,0,0,0|2,0,0]=4 7302 B13R1.42 N#CC[C@@H](O)CNc1cccnc1 587a8b432f885f5058662b0f74189e34 [0,2,0,0,0,0|2,0,0]=4 7303 B13R1.42 N#CC[C@@H](O)CNc1ccncc1 bbe0758a16ed63a82dc5ab9032b3cf77 [0,2,0,0,0,0|2,0,0]=4 7304 B13R1.42 N#CC[C@H](O)CNc1ccccc1 d91316a76c8fd2463357b1b080036859 [0,2,0,0,0,0|1,0,0]=3 7305 B13R1.42 N#CC[C@H](O)CNc1ccccn1 d7a053b63efa998abab06027f1254e87 [0,2,0,0,0,0|2,0,0]=4 7306 B13R1.42 N#CC[C@H](O)CNc1cccnc1 90c36d1dbf6a9ed62b80c3fff27a3dd2 [0,2,0,0,0,0|2,0,0]=4 7307 B13R1.42 N#CC[C@H](O)CNc1ccncc1 3133e493a197b04b5c26519d2c2b77c7 [0,2,0,0,0,0|2,0,0]=4 7308 B13R1.42 OCC[C@H](O)CNc1cccnc1 f531c4091080853fc22067364ae43192 [0,2,0,0,0,0|2,0,0]=4 7309 B13R1.42 OCC[C@H](O)COc1ccccn1 74d0d5ffbe4d5e0e6988767159b72fa9 [0,2,0,0,0,0|2,0,0]=4 7310 B13R1.42 OCC[C@H](O)COc1cccnc1 bac688a84ecd018979b53b7e2ce33215 [0,2,0,0,0,0|2,0,0]=4 7311 B13R1.42 OCC[C@H](O)COc1ccncc1 b8252dbf625fe88a5ca7851b8b2e44c2 [0,2,0,0,0,0|2,0,0]=4 7312 B13R1.135 C=CC(C)N(C)Cc1ccccc1 17ebf121add7bcd6ae56fecfc7dd299d [0,2,0,0,0,0|2,0,0]=4 7313 B13R1.135 CC(C=O)N(C)Cc1ccccc1 325d9a447c32b77a036f3c22da750d68 [0,2,0,0,0,0|1,0,1]=4 7314 B13R1.135 CC(CO)N(C)Cc1ccccc1 b2040d31f4919def57cebe2f3b9bcf51 [0,2,0,0,0,0|1,0,0]=3 7315 B13R1.135 CC(CO)N(C)Cc1ccccn1 3c9fdef3b4a421e310540f6452a44290 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.135 CC(CO)N(C)Cc1cccnc1 0a53afdc5ab48deb8aa8d9c1061693fb [0,2,0,0,0,0|2,0,0]=4 7317 B13R1.135 CC(CO)N(C)Cc1ccncc1 2d61c3dc52ebef32b55726d41c6c4db6 [0,2,0,0,0,0|2,0,0]=4 7318 B13R1.135 CC(Cc1ccccn1)N(C)CO 1bac6048c7537564e8f18bba48e0962a [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.135 CC(Cc1cccnc1)N(C)CO 24581cba4f64d54115131f082e0abc43 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.135 CCC(C)C(C)Nc1ccccc1 73b2cd226841b6348e2e0f4edcd68945 [0,2,0,0,0,0|2,0,0]=4 7321 B13R1.135 CCC(C)N(C)Cc1ccccc1 e234f9a3b43c51cdfa21362e0b953970 [0,2,0,0,0,0|2,0,0]=4 7322 B13R1.135 C[C@@H](CO)N(C)Cc1ccccc1 7445e9b044c2ec7fd2309346654ec286 [0,2,0,0,0,0|1,0,0]=3 7323 B13R1.135 C[C@@H](CO)N(C)Cc1ccccn1 4f46919fb1dc121d4c3f6db1ac4a4c0d [0,2,0,0,0,0|2,0,0]=4 7324 B13R1.135 C[C@@H](CO)N(C)Cc1cccnc1 115775c66924a05cbfa999f2bffcd12c [0,2,0,0,0,0|2,0,0]=4 7325 B13R1.135 C[C@@H](CO)N(C)Cc1ccncc1 967bfa5a54a0ddec10fac5ddfcad4483 [0,2,0,0,0,0|2,0,0]=4 7326 B13R1.135 C[C@H](C=O)N(C)Cc1ccccc1 23515ed6644365727457d018c71a7421 [0,2,0,0,0,0|1,0,1]=4 7327 B13R1.135 C[C@H](CO)N(C)Cc1ccccc1 1735f5f3edda1be34df094fd556d944d [0,2,0,0,0,0|1,0,0]=3 7328 B13R1.135 C[C@H](CO)N(C)Cc1ccccn1 dedda2496208f8fc493dd027a35bd72d [0,2,0,0,0,0|2,0,0]=4 7329 B13R1.135 C[C@H](CO)N(C)Cc1cccnc1 bb5103f43b2d514bbd3860b9f96aced0 [0,2,0,0,0,0|2,0,0]=4 7330 B13R1.135 C[C@H](CO)N(C)Cc1ccncc1 610327b955dbc1f9d324290378b9abfc [0,2,0,0,0,0|2,0,0]=4 7331 B13R1.135 O=C(Nc1ccccc1)C(O)CO 608e03483de4659e84178324357941d7 [0,2,0,0,0,0|1,0,1]=4 7332 B13R1.135 O=C(Nc1ccccc1)[C@@H](O)CO 09ea772159278f1ac774b86fc38166d8 [0,2,0,0,0,0|1,0,1]=4 7333 B13R1.254 C#CC(C)(C)NCc1ccccc1 64d2fa634fe924fd4589ffc2874c5753 [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.254 CC(C)(C#N)CNc1ccccc1 929fcfa02d3659e3f4a3ac28d31aa50a [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.254 CC(C)(C#N)NCc1ccccc1 83efd1f474618be3ed67e80860226a43 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.254 CC(C)(CF)CNc1ccccc1 08e543bbe83104b4ddf7bb04441934a3 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.254 CC(C)(CF)NCc1ccccc1 c69f3949aaaed78f67d0fa1e10da8037 [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.254 CC(C)(CO)CNc1ccccc1 f8b3f5cf042ed0c0c420963fa1f3f799 [0,2,0,0,0,0|1,0,0]=3 7339 B13R1.254 CC(C)(CO)CNc1ccccn1 7fd2d9778ca68c2e4df0e5685dc71a97 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.254 CC(C)(CO)CNc1cccnc1 aa61686ba3b242f076a66f19a5783ecb [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.254 CC(C)(CO)CNc1ccncc1 0c142c1be55973d004ce6fcf0d1bf050 [0,2,0,0,0,0|2,0,0]=4 7342 B13R1.254 CC(C)(CO)NCc1ccccc1 c0308e124e3e09217037785baaabc17b [0,2,0,0,0,0|1,0,0]=3 7343 B13R1.254 CC(C)(CO)NCc1ccccn1 af01aceb25337d8503159bb791929e4a [0,2,0,0,0,0|2,0,0]=4 7344 B13R1.254 CC(C)(CO)NCc1cccnc1 133c7b0c3adcb7eb2a3bfefeb673f146 [0,2,0,0,0,0|2,0,0]=4 7345 B13R1.254 CCC(C)(C)CNc1ccccc1 57e0f7745801d3a9ef93112da52879cc [0,2,0,0,0,0|2,0,0]=4 7346 B13R1.254 CCC(C)(C)NCc1ccccc1 c23d315dd1142156bcb929792b807c12 [0,2,0,0,0,0|2,0,0]=4 7347 B13R1.254 CCC(C)(O)CNc1ccccc1 eaddb3dcda08b71b2b3c74b7dd85d191 [0,2,0,0,0,0|1,0,0]=3 7348 B13R1.254 CCC(C)(O)CNc1cccnc1 94a5bc7dcef62b5b3bab4c4ecc0ecab8 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.254 COC(C)(C)CNc1ccccc1 bf18a157d235c1e92fc015cbd2312534 [0,2,0,0,0,0|1,0,0]=3 7350 B13R1.254 COC(C)(C)CNc1ccccn1 672a9d3657b832bdc11a2067ffee941d [0,2,0,0,0,0|2,0,0]=4 7351 B13R1.254 COC(C)(C)CNc1cccnc1 68b90a30b209fdeb1e972b2a7215cf4b [0,2,0,0,0,0|2,0,0]=4 7352 B13R1.254 COC(C)(C)CNc1ccncc1 1badf74ac1c0f1d48a37e910cc60a797 [0,2,0,0,0,0|2,0,0]=4 7353 B13R1.254 COC(C)(C)COc1ccccn1 2d19e2a010622e2d24586b08dc483a61 [0,2,0,0,0,0|2,0,0]=4 7354 B13R1.254 COC(C)(C)COc1cccnc1 301dd95b1aceeb42b990dd01e74bbb79 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.254 COC(C)(C)COc1ccncc1 cd6712d701e8f876c9f9e30c30b763fb [0,2,0,0,0,0|2,0,0]=4 7356 B13R1.254 OCC(F)(F)CNc1ccccc1 0554925beb504fc5eab8ed1153523ac0 [0,2,0,0,0,0|2,0,0]=4 7357 B13R1.417 BrCC(CBr)OCc1ccccc1 1b38195fd8528ff11955f4f799bc5ec3 [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.417 C#CC(CC)OCc1ccccc1 fe34c6cb1fd7685cae88a1aa1b127906 [0,2,0,0,0,0|2,0,0]=4 7359 B13R1.417 C=CC(CC)OCc1ccccc1 fe5beb69f4e8eaca615527027702b7a0 [0,2,0,0,0,0|2,0,0]=4 7360 B13R1.417 C=C[C@@H](CO)NCc1ccccc1 f27e0dd6d5530ac0e95c20b4894b02c2 [0,2,0,0,0,0|1,0,1]=4 7361 B13R1.417 CCC(C#N)OCc1ccccc1 8ae92adfb29fdb17f15d645f3cb4e7b3 [0,2,0,0,0,0|2,0,0]=4 7362 B13R1.417 CCC(C=O)NCc1ccccc1 f6845985d015a5d539738c58cc946136 [0,2,0,0,0,0|1,0,1]=4 7363 B13R1.417 CCC(C=O)OCc1ccccc1 7e42f954680b0457c90fa3b9a0110dd2 [0,2,0,0,0,0|1,0,1]=4 7364 B13R1.417 CCC(CC)CNc1ccccc1 74bcf58314d6623796f9ccdf533641c4 [0,2,0,0,0,0|2,0,0]=4 7365 B13R1.417 CCC(CC)NCc1ccccc1 d33e44be019531a76e706befeb4676ba [0,2,0,0,0,0|2,0,0]=4 7366 B13R1.417 CCC(CC)OCc1ccccc1 f6f2f0325d2e972c2d5203c22b72617f [0,2,0,0,0,0|2,0,0]=4 7367 B13R1.417 CCC(CO)CNc1ccccc1 8d3946142dcc7cb6f0ee8416f963ee9b [0,2,0,0,0,0|1,0,0]=3 7368 B13R1.417 CCC(CO)CNc1ccccn1 d0c7e69a15c07331eac1bf55862bc734 [0,2,0,0,0,0|2,0,0]=4 7369 B13R1.417 CCC(CO)CNc1cccnc1 b235f641a28ae50dd5efd16852ed8819 [0,2,0,0,0,0|2,0,0]=4 7370 B13R1.417 CCC(CO)CNc1ccncc1 9b91f36708ce4033366e041a437106ba [0,2,0,0,0,0|2,0,0]=4 7371 B13R1.417 CCC(CO)NCc1ccccc1 4118611d5798d6436f95bebc393d2001 [0,2,0,0,0,0|1,0,0]=3 7372 B13R1.417 CCC(CO)NCc1ccccn1 54e94bbc8817dd47610a121294f76d79 [0,2,0,0,0,0|2,0,0]=4 7373 B13R1.417 CCC(CO)NCc1cccnc1 87daf970df1f11e16aa28490016d21b2 [0,2,0,0,0,0|2,0,0]=4 7374 B13R1.417 CCC(CO)NCc1ccncc1 da93c861066a753bd470bb2817bdb78d [0,2,0,0,0,0|2,0,0]=4 7375 B13R1.417 CCN(C=O)CCc1ccccc1 4ec660b185cec5e17670f6a60b5e65af [0,2,0,0,0,0|1,0,1]=4 7376 B13R1.417 CC[C@@H](CO)NCc1ccccc1 e086dd22d9e656a2441c3cffc093f266 [0,2,0,0,0,0|1,0,0]=3 7377 B13R1.417 CC[C@@H](CO)NCc1ccccn1 908d41bd3c16389196c38ee0329caadc [0,2,0,0,0,0|2,0,0]=4 7378 B13R1.417 CC[C@@H](CO)NCc1cccnc1 8ec657ab910ad03507a7eb3171616733 [0,2,0,0,0,0|2,0,0]=4 7379 B13R1.417 CC[C@H](CO)NCc1ccccc1 43a5086c23ee0a5039b6e92e77253605 [0,2,0,0,0,0|1,0,0]=3 7380 B13R1.417 CC[C@H](CO)NCc1ccccn1 6ddc6bc17a0c1ca66d888b4adf2c31f0 [0,2,0,0,0,0|2,0,0]=4 7381 B13R1.417 CC[C@H](CO)NCc1cccnc1 c715ba63f36a6b9ffded74d3624397c6 [0,2,0,0,0,0|2,0,0]=4 7382 B13R1.417 COC(CNc1ccccc1)OC 91b7154c3c67b4dd9ea38a718aacd035 [0,2,0,0,0,0|1,0,0]=3 7383 B13R1.417 COC(CNc1ccccn1)OC 5f9249e6661326ac7147fa202df30911 [0,2,0,0,0,0|2,0,0]=4 7384 B13R1.417 COC(CNc1cccnc1)OC 0e73c094feedf212b45252e1cb13d3f7 [0,2,0,0,0,0|2,0,0]=4 7385 B13R1.417 COC(CNc1ccncc1)OC e5bd2820da226d7fa6810d1769fe9ab5 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.417 COC(COc1ccccn1)OC b9bc763a9e580496a1ed3fd48d2cb940 [0,2,0,0,0,0|2,0,0]=4 7387 B13R1.417 COC(COc1cccnc1)OC 34934926f91a76e30e53f9d3d0f0f8e9 [0,2,0,0,0,0|2,0,0]=4 7388 B13R1.417 COC(COc1ccncc1)OC 9abf2a9ffc1aa61d850ab853d1ea4f9a [0,2,0,0,0,0|2,0,0]=4 7389 B13R1.417 CO[C@@H](CO)CNc1ccccc1 6349790bbcee1e2b7f121249b31683b8 [0,2,0,0,0,0|1,0,0]=3 7390 B13R1.417 CO[C@@H](CO)CNc1ccccn1 ca712f510d0f2accbf7223c410d5e426 [0,2,0,0,0,0|2,0,0]=4 7391 B13R1.417 CO[C@@H](CO)CNc1cccnc1 bb0f101e5322bb5c80e106413e418974 [0,2,0,0,0,0|2,0,0]=4 7392 B13R1.417 CO[C@@H](CO)CNc1ccncc1 d9d119110b73014a1f84a2d74d588eea [0,2,0,0,0,0|2,0,0]=4 7393 B13R1.417 ClCC(CBr)OCc1ccccc1 c0bad9be9c8ff7e98778209b4269fd29 [0,2,0,0,0,0|2,0,0]=4 7394 B13R1.417 ClCC(CCl)OCc1ccccc1 a3a3f7c048da61ff4a869340b382f037 [0,2,0,0,0,0|2,0,0]=4 7395 B13R1.417 ClC[C@@H](CI)OCc1ccccc1 5db731b75f94620247a6c7cc5e4913ab [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.417 ClC[C@H](CI)OCc1ccccc1 9c14931d9ddf81ca350991161510329f [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.417 FCC(CF)OCc1ccccc1 35e0c683e0537d3e468e4ba1e15422cd [0,2,0,0,0,0|2,0,0]=4 7398 B13R1.417 OCC(CO)CNc1ccccc1 9812978662beae5c3eca0888fbf9753c [0,2,0,0,0,0|1,0,0]=3 7399 B13R1.417 OCC(CO)CNc1ccccn1 59f81bf24cb8ea87b0fb130e105d56f0 [0,2,0,0,0,0|2,0,0]=4 7400 B13R1.417 OCC(CO)CNc1cccnc1 782d5d3a62b97255b44aee42c47d412e [0,2,0,0,0,0|2,0,0]=4 7401 B13R1.417 OCC(CO)CNc1ccncc1 f12bb656ebb36ec9f7f29b7ba8b05dd0 [0,2,0,0,0,0|2,0,0]=4 7402 B13R1.417 OCC(CO)NCc1ccccc1 c31c2a235adf271b98176fc48a870b8f [0,2,0,0,0,0|1,0,0]=3 7403 B13R1.417 OCC(CO)NCc1ccccn1 362396a9c6ed1d3d88523122a0ae2ced [0,2,0,0,0,0|2,0,0]=4 7404 B13R1.417 OCC(CO)NCc1cccnc1 ffefd293a4ded6814b279310ae9ab866 [0,2,0,0,0,0|2,0,0]=4 7405 B13R1.417 OCC(CO)NCc1ccncc1 5d37a2464793020fb4af581d5593c0c1 [0,2,0,0,0,0|2,0,0]=4 7406 B13R1.417 OCC(CO)OCc1ccccc1 f866196de214b42ddffcb60775444a7a [0,2,0,0,0,0|1,0,0]=3 7407 B13R1.417 OCC(CO)OCc1ccccn1 044e7987af0d6cab292564e1a45ef887 [0,2,0,0,0,0|2,0,0]=4 7408 B13R1.417 OCC(CO)OCc1cccnc1 26ad306203a978d8b7394c05dbbc8e21 [0,2,0,0,0,0|2,0,0]=4 7409 B13R1.417 OCC(CO)OCc1ccncc1 20c36bbd5f4199a08814bd42641477f6 [0,2,0,0,0,0|2,0,0]=4 7410 B13R1.528 C#CC(C)NCc1ccccc1Br cb31256fbe0ec4e7a11fa97d7949e3d5 [0,2,0,0,0,0|2,0,0]=4 7411 B13R1.528 C#CC(C)NCc1ccccc1C ec9bb29029027bfa114334f69d695d2a [0,2,0,0,0,0|2,0,0]=4 7412 B13R1.528 C#CC(C)NCc1ccccc1Cl 08a28804ad89ed461ccfbee07320d53b [0,2,0,0,0,0|2,0,0]=4 7413 B13R1.528 C#CC(C)NCc1ccccc1F de6837e9241dbadbf4693d2061ee4c9d [0,2,0,0,0,0|2,0,0]=4 7414 B13R1.528 C#CC(C)NCc1ccccc1I 887f3076a101087b179bb52fd99339c3 [0,2,0,0,0,0|2,0,0]=4 7415 B13R1.528 C#CC(C)OCc1ccccc1Cl 072427e6378fae1023d5d59182405c4f [0,2,0,0,0,0|2,0,0]=4 7416 B13R1.528 C#CC(C)OCc1ccccc1F eb7334a5a7b6a2f7bd65cb6245ed0474 [0,2,0,0,0,0|2,0,0]=4 7417 B13R1.528 C#CC(C)OCc1ccccc1I 7cebdd2d4bf8df8c4322084deff481af [0,2,0,0,0,0|2,0,0]=4 7418 B13R1.528 C#C[C@@H](C)NCc1ccccc1Br fa8d890cb9ba9e5789cea20c434ad628 [0,2,0,0,0,0|2,0,0]=4 7419 B13R1.528 C#C[C@@H](C)NCc1ccccc1C facbe01951a0fa2b4e7496862b5d8bdc [0,2,0,0,0,0|2,0,0]=4 7420 B13R1.528 C#C[C@@H](C)NCc1ccccc1Cl 9059cf3596bc40d77a30b71077da191b [0,2,0,0,0,0|2,0,0]=4 7421 B13R1.528 C#C[C@@H](C)NCc1ccccc1F 9d37844d25b360289bbe79c13d8f6df8 [0,2,0,0,0,0|2,0,0]=4 7422 B13R1.528 C#C[C@@H](C)NCc1ccccc1I 4d907aa219bcbd0d7ba9c3bd0499fe94 [0,2,0,0,0,0|2,0,0]=4 7423 B13R1.528 C#C[C@@H](C)OCc1ccccc1Cl a4005cd16c93f925f647f04c9b42a97e [0,2,0,0,0,0|2,0,0]=4 7424 B13R1.528 C#C[C@@H](C)OCc1ccccc1F 1d6cb31af691b92d3204f56b8a77cbb4 [0,2,0,0,0,0|2,0,0]=4 7425 B13R1.528 C#C[C@@H](C)OCc1ccccc1I b4cea53f43da7efcfe2fa6510cb47177 [0,2,0,0,0,0|2,0,0]=4 7426 B13R1.528 C#C[C@H](C)NCc1ccccc1Br ebd1689e11bade3ce1e9c77419ee1485 [0,2,0,0,0,0|2,0,0]=4 7427 B13R1.528 C#C[C@H](C)NCc1ccccc1C 955062667c0088fa4e7b0a28ecaeb732 [0,2,0,0,0,0|2,0,0]=4 7428 B13R1.528 C#C[C@H](C)NCc1ccccc1Cl 836052f831fb5ee3d3f3a79acdb1bd5f [0,2,0,0,0,0|2,0,0]=4 7429 B13R1.528 C#C[C@H](C)NCc1ccccc1F efcb657bc5032fee892291c57aabbfb4 [0,2,0,0,0,0|2,0,0]=4 7430 B13R1.528 C#C[C@H](C)NCc1ccccc1I ceba4ec5e7b0883fb067cf6e752ec517 [0,2,0,0,0,0|2,0,0]=4 7431 B13R1.528 C#C[C@H](C)OCc1ccccc1Cl 131cf1531ad58df23ac26e0298e7546f [0,2,0,0,0,0|2,0,0]=4 7432 B13R1.528 C#C[C@H](C)OCc1ccccc1F 28d328caac6a359f52da5b9c66edf0a5 [0,2,0,0,0,0|2,0,0]=4 7433 B13R1.528 C#C[C@H](C)OCc1ccccc1I 559deec0129f19295ffaa87b2bb2f20f [0,2,0,0,0,0|2,0,0]=4 7434 B13R1.528 C=CC(C)NCc1ccccc1Br 86b60a935ca2143dbdbe0974e70b3049 [0,2,0,0,0,0|2,0,0]=4 7435 B13R1.528 C=CC(C)NCc1ccccc1C 76ae0ce021817df5c427a6c3204b2af1 [0,2,0,0,0,0|2,0,0]=4 7436 B13R1.528 C=CC(C)NCc1ccccc1Cl b64bbd3969bf5aede474222b66d41bde [0,2,0,0,0,0|2,0,0]=4 7437 B13R1.528 C=CC(C)NCc1ccccc1F d8e1b10b785c6935981d732d3a34dccf [0,2,0,0,0,0|2,0,0]=4 7438 B13R1.528 C=CC(C)NCc1ccccc1I 7124ed641ec93c3e5d1a910b549cd082 [0,2,0,0,0,0|2,0,0]=4 7439 B13R1.528 C=CC(C)OCc1ccccc1C 321609cefd0f3800379a63e4e1405021 [0,2,0,0,0,0|2,0,0]=4 7440 B13R1.528 C=CC(C)OCc1ccccc1Cl b04ee458e029134d4cac1a7b28c2630c [0,2,0,0,0,0|2,0,0]=4 7441 B13R1.528 C=CC(C)OCc1ccccc1F df29f84b6e99f9f8f3641c736bf90410 [0,2,0,0,0,0|2,0,0]=4 7442 B13R1.528 C=CC(C)OCc1ccccc1I dc8431dcdc31511e6e663cd3e97aa39d [0,2,0,0,0,0|2,0,0]=4 7443 B13R1.528 C=CC(C)OCc1ccccc1S 93130f1b6af2b0584936badb5ddc5962 [0,2,0,0,0,0|2,0,0]=4 7444 B13R1.528 C=CC(O)CNc1ccccc1C f08732da6d678113ef55bed157694f3a [0,2,0,0,0,0|1,0,1]=4 7445 B13R1.528 C=CC(O)CNc1ccccc1F 8c002934a186d33aec13bf6242fd72ab [0,2,0,0,0,0|1,0,1]=4 7446 B13R1.528 C=CC(O)CNc1ccccc1S 508b4f66f2b85f5abe505fe881e40d55 [0,2,0,0,0,0|1,0,1]=4 7447 B13R1.528 C=C[C@H](C)OCc1ccccc1C 1b2baa088ee72cd4662bae4e1e8659e3 [0,2,0,0,0,0|2,0,0]=4 7448 B13R1.528 C=C[C@H](C)OCc1ccccc1Cl 11c40292e6b07e6858eadc114036390e [0,2,0,0,0,0|2,0,0]=4 7449 B13R1.528 C=C[C@H](C)OCc1ccccc1F 9023b023baaaa8078bb3d71f692c08a2 [0,2,0,0,0,0|2,0,0]=4 7450 B13R1.528 C=C[C@H](C)OCc1ccccc1I f5b21d47d11504aea209892709dffb4d [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.528 CC(C#N)CNc1ccccc1I e80f2c36ca3b7995e34d9bc70a05d694 [0,2,0,0,0,0|2,0,0]=4 7452 B13R1.528 CC(C#N)COc1ccccc1Cl 4f2fc138965b433a40d6ba858fa911db [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.528 CC(C#N)COc1ccccc1I 13468fe10f7395f4dece76a2e456ebc1 [0,2,0,0,0,0|2,0,0]=4 7454 B13R1.528 CC(C#N)NCc1ccccc1Br 66ef32c408cd5528f83af7ef5dfc20e3 [0,2,0,0,0,0|2,0,0]=4 7455 B13R1.528 CC(C#N)NCc1ccccc1Cl 4e9e90fa1fb8893f73016fc45cd8c157 [0,2,0,0,0,0|2,0,0]=4 7456 B13R1.528 CC(C#N)NCc1ccccc1F 69f231535ead5e52201e91c30f14dadd [0,2,0,0,0,0|2,0,0]=4 7457 B13R1.528 CC(C#N)NCc1ccccc1I beb7ac07e63052ab646aa3738831717a [0,2,0,0,0,0|2,0,0]=4 7458 B13R1.528 CC(C=O)NCc1ccccc1Br b9e847abb240188253b75a3b6a4c10b1 [0,2,0,0,0,0|1,0,1]=4 7459 B13R1.528 CC(C=O)NCc1ccccc1Cl d1560e45abe0080a95ac96745a472eb1 [0,2,0,0,0,0|1,0,1]=4 7460 B13R1.528 CC(C=O)NCc1ccccc1F cf6efe50d67eab67d2989a627caa2f64 [0,2,0,0,0,0|1,0,1]=4 7461 B13R1.528 CC(C=O)NCc1ccccc1I 6f9b9cd7591e5b5100fb40eae77f9b88 [0,2,0,0,0,0|1,0,1]=4 7462 B13R1.528 CC(C=O)OCc1ccccc1Cl e51ce74d5a3e35ed3a84da392957d348 [0,2,0,0,0,0|1,0,1]=4 7463 B13R1.528 CC(C=O)OCc1ccccc1F e26121536853319e853f3fc517f6d62e [0,2,0,0,0,0|1,0,1]=4 7464 B13R1.528 CC(C=O)OCc1ccccc1I 416dd777b8b5adcee19ca91a275a7952 [0,2,0,0,0,0|1,0,1]=4 7465 B13R1.528 CC(C=O)OCc1ccccc1S 18992e463999e1623e954ad1ee6206d2 [0,2,0,0,0,0|1,0,1]=4 7466 B13R1.528 CC(CF)OCc1ccccc1Cl cc481467db462d2ec66c00aaa9ab87c9 [0,2,0,0,0,0|2,0,0]=4 7467 B13R1.528 CC(CF)OCc1ccccc1F 95cf589166c0b2dac94c106840db3803 [0,2,0,0,0,0|2,0,0]=4 7468 B13R1.528 CC(CF)OCc1ccccc1I 16bf047dfaf4bb3d27c831cc8d18efb9 [0,2,0,0,0,0|2,0,0]=4 7469 B13R1.528 CC(CO)CNc1c[nH]ccc1=O 6621fd25a0d4e5432bd6b594875770aa [0,2,0,0,0,0|2,0,0]=4 7470 B13R1.528 CC(CO)CNc1ccc[nH]c1=S ae41f2d851282f0ec66522076159beaf [0,2,0,0,0,0|2,0,0]=4 7471 B13R1.528 CC(CO)CNc1cccc[n+]1[O-] 4e2012082b57d3ed1fcad6621ec64cbc [0,2,0,0,0,0|2,0,0]=4 7472 B13R1.528 CC(CO)CNc1ccccc1Br 5183f3dd8037b09965bba605113db494 [0,2,0,0,0,0|1,0,0]=3 7473 B13R1.528 CC(CO)CNc1ccccc1Cl 04041f2bc037643d607047fcb0618a66 [0,2,0,0,0,0|1,0,0]=3 7474 B13R1.528 CC(CO)CNc1ccccc1F ac8544206854abcce03fcf7bd4b428d0 [0,2,0,0,0,0|1,0,0]=3 7475 B13R1.528 CC(CO)CNc1ccccc1I ccdc9fccd6e4ad79f2a966beb20bc87f [0,2,0,0,0,0|1,0,0]=3 7476 B13R1.528 CC(CO)CNc1ccccc1S b3442b4e6f43140b83a7875b1153a3c9 [0,2,0,0,0,0|1,0,0]=3 7477 B13R1.528 CC(CO)CNc1cccnc1Br 3095bf5f92f53711c7f2933f8e64881c [0,2,0,0,0,0|2,0,0]=4 7478 B13R1.528 CC(CO)CNc1cccnc1Cl 6dffdd458a78be60b67ca039dd973b36 [0,2,0,0,0,0|2,0,0]=4 7479 B13R1.528 CC(CO)CNc1cccnc1F 929bdde794363f5368e3db0870b18420 [0,2,0,0,0,0|2,0,0]=4 7480 B13R1.528 CC(CO)CNc1cccnc1I 1731292aaa66ea73ff7053b95087ef0c [0,2,0,0,0,0|2,0,0]=4 7481 B13R1.528 CC(CO)CNc1ccncc1Br 8c5e1fc58e517e56ccd25c802e4ecaef [0,2,0,0,0,0|2,0,0]=4 7482 B13R1.528 CC(CO)CNc1ccncc1Cl 62f9157e3ad33122d9724c2b98206951 [0,2,0,0,0,0|2,0,0]=4 7483 B13R1.528 CC(CO)CNc1ccncc1F 15c2088d16874ac81abf41e0be4c6122 [0,2,0,0,0,0|2,0,0]=4 7484 B13R1.528 CC(CO)CNc1ccncc1I e7faa29f5e4da6ba32340ff59300b5c2 [0,2,0,0,0,0|2,0,0]=4 7485 B13R1.528 CC(CO)CNc1cnccc1Br 7eb62d765405ab50dfa842cddd15a691 [0,2,0,0,0,0|2,0,0]=4 7486 B13R1.528 CC(CO)CNc1cnccc1Cl 444c5bb678fa0f85891f36d769a3846a [0,2,0,0,0,0|2,0,0]=4 7487 B13R1.528 CC(CO)CNc1cnccc1F 8e62b9dec76d166061e863422bba8dc2 [0,2,0,0,0,0|2,0,0]=4 7488 B13R1.528 CC(CO)CNc1cnccc1I e3bf0ef580b93784d3d638891aa4991c [0,2,0,0,0,0|2,0,0]=4 7489 B13R1.528 CC(CO)CNc1cnccc1S f69ed3cef620ec23f4f813a960c605ef [0,2,0,0,0,0|2,0,0]=4 7490 B13R1.528 CC(CO)CNc1ncccc1Br 95d4ce57ec04bc6ee3d5cd33955d8558 [0,2,0,0,0,0|2,0,0]=4 7491 B13R1.528 CC(CO)CNc1ncccc1Cl 7d94d6e8f12f01c8110c2157ccb46a96 [0,2,0,0,0,0|2,0,0]=4 7492 B13R1.528 CC(CO)CNc1ncccc1F 558d35e9a982bf80125bcb1bdca20098 [0,2,0,0,0,0|2,0,0]=4 7493 B13R1.528 CC(CO)CNc1ncccc1I 8617216c948902ab6d2acea20f07f66b [0,2,0,0,0,0|2,0,0]=4 7494 B13R1.528 CC(CO)NCc1cccc[n+]1[O-] fb7d5671bf898da4e4f87f5c30dbea60 [0,2,0,0,0,0|2,0,0]=4 7495 B13R1.528 CC(CO)NCc1ccccc1Br 87f505fc2e9cc51ff8ef7b1566020c78 [0,2,0,0,0,0|1,0,0]=3 7496 B13R1.528 CC(CO)NCc1ccccc1Cl 1fa68ea12feac5a20f497a13121b7ee5 [0,2,0,0,0,0|1,0,0]=3 7497 B13R1.528 CC(CO)NCc1ccccc1F 3bd233c8fdd1e4e31293b88bab53b091 [0,2,0,0,0,0|1,0,0]=3 7498 B13R1.528 CC(CO)NCc1ccccc1I 79b52a5f5a85e83bf421ab9234a61b90 [0,2,0,0,0,0|1,0,0]=3 7499 B13R1.528 CC(CO)NCc1cccnc1Br d07e724dbca0eb2f7ac9f995b94d7a9e [0,2,0,0,0,0|2,0,0]=4 7500 B13R1.528 CC(CO)NCc1cccnc1Cl efb3387f40bf12fd86111efe0c873a91 [0,2,0,0,0,0|2,0,0]=4 7501 B13R1.528 CC(CO)NCc1cccnc1F 8f9a64e5b3248aa22b35e842820bb564 [0,2,0,0,0,0|2,0,0]=4 7502 B13R1.528 CC(CO)NCc1ccncc1Br b8be78fd499979cbab2af8f2dd4e0a9f [0,2,0,0,0,0|2,0,0]=4 7503 B13R1.528 CC(CO)NCc1ccncc1Cl ca612bbab99990b5b6b15570c6174226 [0,2,0,0,0,0|2,0,0]=4 7504 B13R1.528 CC(CO)NCc1ccncc1F 843dbeb316a5fe3bad94580b92b9e5bd [0,2,0,0,0,0|2,0,0]=4 7505 B13R1.528 CC(CO)NCc1ncccc1Br 3a6f0c45fe35abec1bf9ab78d20367c5 [0,2,0,0,0,0|2,0,0]=4 7506 B13R1.528 CC(CO)NCc1ncccc1Cl 726616abccf71af24475fcbcc753ee5a [0,2,0,0,0,0|2,0,0]=4 7507 B13R1.528 CC(CO)NCc1ncccc1F 6e922b41aaf3bd868f9718ecdcc2b65e [0,2,0,0,0,0|2,0,0]=4 7508 B13R1.528 CC(CS)OCc1ccccc1Cl 63f0aaf68c5f549c0b111fed3bbfdd6a [0,2,0,0,0,0|1,1,0]=4 7509 B13R1.528 CC(CS)OCc1ccccc1F 3006e8e0b6e6143b33f3ffb695a06271 [0,2,0,0,0,0|1,1,0]=4 7510 B13R1.528 CC(CS)OCc1ccccc1I 109c2e0a0472fa618292626277a2ab31 [0,2,0,0,0,0|1,1,0]=4 7511 B13R1.528 CCC(C)CNc1ccccc1I da2a4209be7935461952f9708185adce [0,2,0,0,0,0|2,0,0]=4 7512 B13R1.528 CCC(C)COc1ccccc1Br be468c4688082aa97244291df48fc2f1 [0,2,0,0,0,0|2,0,0]=4 7513 B13R1.528 CCC(C)COc1ccccc1C 3ca4bbbb3e4d5c62b65bd3dd429d8a48 [0,2,0,0,0,0|2,0,0]=4 7514 B13R1.528 CCC(C)COc1ccccc1Cl 3970120847213f1e931d3bb33e3cd2de [0,2,0,0,0,0|2,0,0]=4 7515 B13R1.528 CCC(C)COc1ccccc1F 0b1325780fc5c677b7fcc35202197667 [0,2,0,0,0,0|2,0,0]=4 7516 B13R1.528 CCC(C)COc1ccccc1I 91cbe2e377454931e940eafcd88e00b1 [0,2,0,0,0,0|2,0,0]=4 7517 B13R1.528 CCC(C)COc1ccccc1S ba95b25a29668b34fdb8dcf9b7c74324 [0,2,0,0,0,0|2,0,0]=4 7518 B13R1.528 CCC(C)NCc1ccccc1Cl e9f35ce50377c5d8f6fb7804e87ec8c4 [0,2,0,0,0,0|2,0,0]=4 7519 B13R1.528 CCC(C)NCc1ccccc1F 930234aa3b6099e6be59aee1e440d196 [0,2,0,0,0,0|2,0,0]=4 7520 B13R1.528 CCC(C)NCc1ccccc1I 6201fa911018c083778b247086b8cc5f [0,2,0,0,0,0|2,0,0]=4 7521 B13R1.528 CCC(C)OCc1ccccc1Cl 273213ea0efd020f897b42ae4be5bc56 [0,2,0,0,0,0|2,0,0]=4 7522 B13R1.528 CCC(C)OCc1ccccc1F 746aaa2e244d53eded998e467512094c [0,2,0,0,0,0|2,0,0]=4 7523 B13R1.528 CCC(C)OCc1ccccc1I 790eb01b9b2d503f78e3fe029b15e20b [0,2,0,0,0,0|2,0,0]=4 7524 B13R1.528 CCC(O)CNc1c[nH]ccc1=O 2b448775b3782c2626afe6cdd6aa4e22 [0,2,0,0,0,0|2,0,0]=4 7525 B13R1.528 CCC(O)CNc1c[nH]ccc1=S 79406cc5aacf65b6799c091a8c2094a9 [0,2,0,0,0,0|2,0,0]=4 7526 B13R1.528 CCC(O)CNc1cccc[n+]1[O-] 7225304fefb02a02e5a1250c0bd741fc [0,2,0,0,0,0|2,0,0]=4 7527 B13R1.528 CCC(O)CNc1cccnc1Br d87665bf8339823244a584bb117cb391 [0,2,0,0,0,0|2,0,0]=4 7528 B13R1.528 CCC(O)CNc1cccnc1C c2fc157b7b795b91f209995b88fca398 [0,2,0,0,0,0|2,0,0]=4 7529 B13R1.528 CCC(O)CNc1cccnc1Cl f6d68c495f0cd87e7637ed04a43811dd [0,2,0,0,0,0|2,0,0]=4 7530 B13R1.528 CCC(O)CNc1cccnc1F ab860d1315cad8957ce95739eb3edb85 [0,2,0,0,0,0|2,0,0]=4 7531 B13R1.528 CCC(O)CNc1cccnc1I 562df95553dd8f25f28ff997b5f53c42 [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.528 CCC(O)CNc1ccncc1Br 315a216545a17bd0a9b202466e1502c6 [0,2,0,0,0,0|2,0,0]=4 7533 B13R1.528 CCC(O)CNc1ccncc1C 0224bef25b07b0439f29b5c48d8202c4 [0,2,0,0,0,0|2,0,0]=4 7534 B13R1.528 CCC(O)CNc1ccncc1Cl ce0a0d56e288e708b03d10bb78da2877 [0,2,0,0,0,0|2,0,0]=4 7535 B13R1.528 CCC(O)CNc1ccncc1F b958cac7356183074dbc012fe21e8e5d [0,2,0,0,0,0|2,0,0]=4 7536 B13R1.528 CCC(O)CNc1ccncc1I 36dfab54ca33dd950b82bab6e421d420 [0,2,0,0,0,0|2,0,0]=4 7537 B13R1.528 CCC(O)CNc1cnccc1C 76627d045c0e5f830658edb7f81aa74c [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.528 CCC(O)CNc1cnccc1Cl b623c32a4114e7bccc0db98580a0f8ca [0,2,0,0,0,0|2,0,0]=4 7539 B13R1.528 CCC(O)CNc1cnccc1F d1bcb6436f06a121e3300ecb772163f1 [0,2,0,0,0,0|2,0,0]=4 7540 B13R1.528 CCC(O)CNc1cnccc1I 46a3746ce8e616dc0ac9609b910156dc [0,2,0,0,0,0|2,0,0]=4 7541 B13R1.528 CCC(O)CNc1ncccc1Br d5d2e17e36aeec1ec69ce77d8eafc7e4 [0,2,0,0,0,0|2,0,0]=4 7542 B13R1.528 CCC(O)CNc1ncccc1C c6275e77fdfe52a43e609290d73e727c [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.528 CCC(O)CNc1ncccc1Cl 972b235785b4c8a92102adfd0506f911 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.528 CCC(O)CNc1ncccc1F c3fa74cebf82eb2d960fed23e8381b78 [0,2,0,0,0,0|2,0,0]=4 7545 B13R1.528 CCC(O)CNc1ncccc1I faba2326cbd137bf458ef3b3953fe081 [0,2,0,0,0,0|2,0,0]=4 7546 B13R1.528 CCN(C)CCc1ccccc1Cl 0b7b018dd99fadc94260acca4951f5ca [0,2,0,0,0,0|2,0,0]=4 7547 B13R1.528 CCN(C)CCc1ccccc1F 39511dfd45df33723f980b9eb3212e00 [0,2,0,0,0,0|2,0,0]=4 7548 B13R1.528 CCN(C)CCc1ccccc1I 9c0a1cb495618bdea05d12c51443ed8d [0,2,0,0,0,0|2,0,0]=4 7549 B13R1.528 CC[C@@H](C)CNc1ccccc1I d5c8ed1bcd37723931163610c8647156 [0,2,0,0,0,0|2,0,0]=4 7550 B13R1.528 CC[C@@H](C)COc1ccccc1Cl 9f5555c4fefa06059761378daa45251a [0,2,0,0,0,0|2,0,0]=4 7551 B13R1.528 CC[C@@H](C)NCc1ccccc1Cl 0c017ba2bb15145809dccb9d2970b923 [0,2,0,0,0,0|2,0,0]=4 7552 B13R1.528 CC[C@@H](C)NCc1ccccc1F 8420fe95780578d950e2c44d89987299 [0,2,0,0,0,0|2,0,0]=4 7553 B13R1.528 CC[C@@H](C)NCc1ccccc1I f6dc7c4d85d6fe4d33d147c028ef9142 [0,2,0,0,0,0|2,0,0]=4 7554 B13R1.528 CC[C@@H](C)OCc1ccccc1Cl 5be53b86e01b2b097f1b2400c7677048 [0,2,0,0,0,0|2,0,0]=4 7555 B13R1.528 CC[C@@H](C)OCc1ccccc1F 2a58101c18e478e509b77ff748280dad [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.528 CC[C@@H](C)OCc1ccccc1I cf64934f09fe791c3f79992d4c0a0b88 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.528 CC[C@@H](O)CNc1c[nH]ccc1=O 79b73d33494863701bf55e1dddf4bdba [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.528 CC[C@@H](O)CNc1c[nH]ccc1=S 414500d5400d8295b4acb593bcde328e [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.528 CC[C@@H](O)CNc1cccc[n+]1[O-] 3449b63facb0163618ccf444d58b03f1 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.528 CC[C@@H](O)CNc1cnccc1F d8f803d502d49d158341d7e0133cdf16 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.528 CC[C@H](C)CNc1ccccc1I 646c3e3a07de10c38b24a9cd80346bfd [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.528 CC[C@H](C)COc1ccccc1Br 012ef2ac47102873d9452a76da9fd0c4 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.528 CC[C@H](C)COc1ccccc1C edfa8f0687cd472303bfba84eaac57cf [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.528 CC[C@H](C)COc1ccccc1Cl 7c1d96b827a646d50205661df131409c [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.528 CC[C@H](C)COc1ccccc1F db9a7c8dc55b2ae247032e0f14958b44 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.528 CC[C@H](C)COc1ccccc1I 9f7228b34bd7e3238c85bd59ac323b08 [0,2,0,0,0,0|2,0,0]=4 7567 B13R1.528 CC[C@H](C)COc1ccccc1S 47201981302e4494b26c822b51a9a6c3 [0,2,0,0,0,0|2,0,0]=4 7568 B13R1.528 CC[C@H](C)NCc1ccccc1Cl a4f80632964b44be81866a3bffd62d91 [0,2,0,0,0,0|2,0,0]=4 7569 B13R1.528 CC[C@H](C)NCc1ccccc1F 09de97e535d114110419f7d261aa912b [0,2,0,0,0,0|2,0,0]=4 7570 B13R1.528 CC[C@H](C)NCc1ccccc1I f6c24968358a14edd478c0751458d552 [0,2,0,0,0,0|2,0,0]=4 7571 B13R1.528 CC[C@H](C)OCc1ccccc1Cl e1fd7513c32f75cac75294991d030676 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.528 CC[C@H](C)OCc1ccccc1F 92da9e3b11a2a4b8b75412a428d39a2f [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.528 CC[C@H](C)OCc1ccccc1I 8b8c302321da51f37e6fba36b4220d15 [0,2,0,0,0,0|2,0,0]=4 7574 B13R1.528 CN(C=O)CCc1ccccc1Br 63dae1672e2264926ca25cd6057716de [0,2,0,0,0,0|1,0,1]=4 7575 B13R1.528 CN(C=O)CCc1ccccc1Cl 659c1dcc8f393a424f40c70d6debf3f9 [0,2,0,0,0,0|1,0,1]=4 7576 B13R1.528 CN(C=O)CCc1ccccc1F 33fe5ec9010066de683f98dc5d75d1e3 [0,2,0,0,0,0|1,0,1]=4 7577 B13R1.528 CN(CF)CCc1ccccc1Cl f2326adcc9f4c9f8a14b5620993473fa [0,2,0,0,0,0|2,0,0]=4 7578 B13R1.528 CN(CF)CCc1ccccc1F 4a75a1f3c7b9a66b9b7d56d27c5d81f9 [0,2,0,0,0,0|2,0,0]=4 7579 B13R1.528 CN(CO)CCc1ccccc1Cl d8403d5f66f37d422a993d6d51dedc46 [0,2,0,0,0,0|1,0,0]=3 7580 B13R1.528 CN(CO)CCc1ccccc1F bcb4177b73b5cbc0b52cf6c07ba7c2ff [0,2,0,0,0,0|1,0,0]=3 7581 B13R1.528 COC(C)CNc1ccc[nH]c1=S d4c06aa5a84ec57fb51304d82cc54112 [0,2,0,0,0,0|2,0,0]=4 7582 B13R1.528 COC(C)CNc1cccc[n+]1[O-] 27f9f7c69f2722aa486192aee69a9695 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.528 COC(C)CNc1ccccc1Br 706c5788474c42083ad98c2874851b66 [0,2,0,0,0,0|1,0,0]=3 7584 B13R1.528 COC(C)CNc1ccccc1C 748e555f90a1afa65c96db8c7fa4e603 [0,2,0,0,0,0|1,0,0]=3 7585 B13R1.528 COC(C)CNc1ccccc1Cl 56d45fd6edbd868e0b6b6c2b03d12a2b [0,2,0,0,0,0|1,0,0]=3 7586 B13R1.528 COC(C)CNc1ccccc1F 1741d10e2f1cf6c795670aa4a0c7a374 [0,2,0,0,0,0|1,0,0]=3 7587 B13R1.528 COC(C)CNc1ccccc1I b36aa9ec777883a0a7d6bc9a39436763 [0,2,0,0,0,0|1,0,0]=3 7588 B13R1.528 COC(C)CNc1ccccc1S d78b04d62d15b385e5b27601a2441b98 [0,2,0,0,0,0|1,0,0]=3 7589 B13R1.528 COC(C)CNc1cccnc1Br 7f0622cde007242af290b40e8b5a53b7 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.528 COC(C)CNc1cccnc1C 3fdb472e3759daacba77a67b4520c92a [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.528 COC(C)CNc1cccnc1Cl 8b445d8bf1147c24366f32107c07cdbf [0,2,0,0,0,0|2,0,0]=4 7592 B13R1.528 COC(C)CNc1cccnc1F cb3fb2edd493ea480c71c4178a142726 [0,2,0,0,0,0|2,0,0]=4 7593 B13R1.528 COC(C)CNc1cccnc1I 18e688ca2e85e7024f24224a6cadbcdd [0,2,0,0,0,0|2,0,0]=4 7594 B13R1.528 COC(C)CNc1ccncc1Br 6581e83b1ba0929600ffb41c7511de5b [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.528 COC(C)CNc1ccncc1C 8bc1d8d61b6518c2d21f703769e1a65e [0,2,0,0,0,0|2,0,0]=4 7596 B13R1.528 COC(C)CNc1ccncc1Cl 232e17489b87128024cfa8aeaa98f7f2 [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.528 COC(C)CNc1ccncc1F 33ae8b2ef950cb07b6da9b70f49f835f [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.528 COC(C)CNc1ccncc1I fcb72a9a4ae48d3f825fa284fa66e2e4 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.528 COC(C)CNc1cnccc1Br 69e71d096e8526a7a8fb5d872a23444e [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.528 COC(C)CNc1cnccc1C 27c251028eb6a3a7efe267f07d53b8d6 [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.528 COC(C)CNc1cnccc1Cl d84d7976c3a73c94a611e012d95fa9aa [0,2,0,0,0,0|2,0,0]=4 7602 B13R1.528 COC(C)CNc1cnccc1F a17bf595031accf2a953cd19af1f76ec [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.528 COC(C)CNc1cnccc1I 6657e154195b301caac3a8448a0f6e9a [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.528 COC(C)CNc1cnccc1S e0ae59e2fcf29729f0abc058ad77bec3 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.528 COC(C)CNc1ncccc1Br be58729593795edb35aa68d2c74681ae [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.528 COC(C)CNc1ncccc1C 8dbe86699cdfa85d562e19aeeb6d97ba [0,2,0,0,0,0|2,0,0]=4 7607 B13R1.528 COC(C)CNc1ncccc1Cl 5447ba4c93be31177ef15c1cc7e18609 [0,2,0,0,0,0|2,0,0]=4 7608 B13R1.528 COC(C)CNc1ncccc1F 00dfeca57e5ac4976d65acca97fc1b15 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.528 COC(C)CNc1ncccc1I c41c9747f175e9630e9bff24e2fc5319 [0,2,0,0,0,0|2,0,0]=4 7610 B13R1.528 COC(C)COc1ccc[nH]c1=S 2822cbd7e4e86cdd0c30dc328277f1eb [0,2,0,0,0,0|2,0,0]=4 7611 B13R1.528 COC(C)COc1cccc[n+]1[O-] 34db19d884bfa6688d6c389f7df9562a [0,2,0,0,0,0|2,0,0]=4 7612 B13R1.528 COC(C)COc1ccccc1Br 461751f3f68d77b4979142195168e14d [0,2,0,0,0,0|1,0,0]=3 7613 B13R1.528 COC(C)COc1ccccc1C 495d8f066606b6adddcdb363aa1e860c [0,2,0,0,0,0|1,0,0]=3 7614 B13R1.528 COC(C)COc1ccccc1Cl c61a35753e454e7158ed9dca5e89498f [0,2,0,0,0,0|1,0,0]=3 7615 B13R1.528 COC(C)COc1ccccc1F e2300c9eedc66d37c76737adffd6263f [0,2,0,0,0,0|1,0,0]=3 7616 B13R1.528 COC(C)COc1ccccc1I 77cef035028e1c8b82ac5d43c8471725 [0,2,0,0,0,0|1,0,0]=3 7617 B13R1.528 COC(C)COc1ccccc1S 59fda77ebc42a418081c4ef3181391fc [0,2,0,0,0,0|1,0,0]=3 7618 B13R1.528 COC(C)COc1cccnc1Br 448e703c8a139e26a34b6b8c62cf069a [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.528 COC(C)COc1cccnc1C 7ba41d483a47d7ed5a2bcef83cfc4804 [0,2,0,0,0,0|2,0,0]=4 7620 B13R1.528 COC(C)COc1cccnc1Cl 598c9451b3b8e845d88dbfb2963543e5 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.528 COC(C)COc1cccnc1F 00e8abe93742879d9f2e3fe4651ccb59 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.528 COC(C)COc1cccnc1I aa696184a48128a2aee8ea4e5586c381 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.528 COC(C)COc1cccoc1=O c0b96c5cb7e6b701ce8a25e36ee21548 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.528 COC(C)COc1ccncc1Br fdc2596f1d90752e563edebb8b36db89 [0,2,0,0,0,0|2,0,0]=4 7625 B13R1.528 COC(C)COc1ccncc1C 8c499588a109cee50206da5b76ac11fa [0,2,0,0,0,0|2,0,0]=4 7626 B13R1.528 COC(C)COc1ccncc1Cl 4ee54d6e5ed81f54efc0552931bc32b6 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.528 COC(C)COc1ccncc1F 26e5a631abfd79b8675165d277688b1d [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.528 COC(C)COc1cnccc1Br 5e103265ab1149b1c31cb1579bb1cdde [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.528 COC(C)COc1cnccc1C ab2716d3a2cf5a608254d0110b16bf7b [0,2,0,0,0,0|2,0,0]=4 7630 B13R1.528 COC(C)COc1cnccc1Cl a543262811c8ad51cfc36fb3ff2b8830 [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.528 COC(C)COc1cnccc1F 1e68edb958c6d8cbd1d01a7eab64a1f4 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.528 COC(C)COc1cnccc1I 6aa5f01038504209bf608a8367d9ddb5 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.528 COC(C)COc1coccc1=O 0b2e46edbc4ce0d84c87bde95f4dba2f [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.528 COC(C)COc1ncccc1Br 857a1e4af7c1c272b3094f5bf8c82aa8 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.528 COC(C)COc1ncccc1C 36cc91f8e0b5b8d1b9adefb9b722f7fb [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.528 COC(C)COc1ncccc1Cl d6362cdb9388f7edccb255b5ef3ba20b [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.528 COC(C)COc1ncccc1F c9c46a62c5e2a0e0f4b23b7ef14a3452 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.528 COC(C)COn1ccccc1=N f730ae6f8b569bf8f328990ff09b5da6 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.528 COC(C)COn1ccccc1=O 01641e1d4dd006f819f89131a9fc566f [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.528 COC(C)COn1ccccc1=S 1dea634d0b72779dd1379b303a948438 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.528 CO[C@@H](C)CNc1c[nH]ccc1=O 1e084a8959535cf60404d341d90974f1 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.528 CO[C@@H](C)CNc1ccc[nH]c1=S 744c13985a25658077b9464072f1557e [0,2,0,0,0,0|2,0,0]=4 7643 B13R1.528 CO[C@@H](C)CNc1cccc[n+]1[O-] 86603f975dff86f9e89dc56d3a28e387 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.528 CO[C@@H](C)CNc1ccccc1Br e1b666dd9d22baf5aed0a833f7f9bd41 [0,2,0,0,0,0|1,0,0]=3 7645 B13R1.528 CO[C@@H](C)CNc1ccccc1C da2a276e41dd6338df931df793684ca8 [0,2,0,0,0,0|1,0,0]=3 7646 B13R1.528 CO[C@@H](C)CNc1ccccc1Cl 7d2149217db9215b56d6d0d996d9164c [0,2,0,0,0,0|1,0,0]=3 7647 B13R1.528 CO[C@@H](C)CNc1ccccc1F 02165f0609cca5523e963c6b6564fc34 [0,2,0,0,0,0|1,0,0]=3 7648 B13R1.528 CO[C@@H](C)CNc1ccccc1I 0eab562d1f4b4471a7d1db6e20857f8e [0,2,0,0,0,0|1,0,0]=3 7649 B13R1.528 CO[C@@H](C)CNc1ccccc1S 0bc6d83c1f2862ca7d9113162a25d831 [0,2,0,0,0,0|1,0,0]=3 7650 B13R1.528 CO[C@@H](C)CNc1cccnc1Br c487caa781b62a7448624b3c51e57a09 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.528 CO[C@@H](C)CNc1cccnc1C 2f84fc59db43c1fda74eb5084cc968a9 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.528 CO[C@@H](C)CNc1cccnc1Cl 6d155626736c81bd1fcbbbeb81a60e4e [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.528 CO[C@@H](C)CNc1cccnc1F 039c85fe84bf9ce521f42bd83eeb540b [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.528 CO[C@@H](C)CNc1cccnc1I f5bd21bd67fa7c9a7c36ad8acecb7cf5 [0,2,0,0,0,0|2,0,0]=4 7655 B13R1.528 CO[C@@H](C)CNc1ccncc1Br da3b19f7c93185f52d8f4d779d5a85b3 [0,2,0,0,0,0|2,0,0]=4 7656 B13R1.528 CO[C@@H](C)CNc1ccncc1C f81da96c59e5340e9e5e3eedc27be09b [0,2,0,0,0,0|2,0,0]=4 7657 B13R1.528 CO[C@@H](C)CNc1ccncc1Cl ca32f5b6ea94982f20572be1dfae311e [0,2,0,0,0,0|2,0,0]=4 7658 B13R1.528 CO[C@@H](C)CNc1ccncc1F e8618531bb9ee6138ce40683cf1e6d64 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.528 CO[C@@H](C)CNc1ccncc1I f885424ea4d658cdcbd11d49276d731c [0,2,0,0,0,0|2,0,0]=4 7660 B13R1.528 CO[C@@H](C)CNc1cnccc1Br d0256b5c60bc4050fcfc4650f2b84a03 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.528 CO[C@@H](C)CNc1cnccc1C b7a08ed0e8a8511a810925ecb10ed519 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.528 CO[C@@H](C)CNc1cnccc1Cl aaaf552ebb4fb6cbb2ffe60e65a58b17 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.528 CO[C@@H](C)CNc1cnccc1F a10cec16f49a722bb9dc87367f5970a9 [0,2,0,0,0,0|2,0,0]=4 7664 B13R1.528 CO[C@@H](C)CNc1cnccc1I a722337557aa8fe1452b3e52fe23de9e [0,2,0,0,0,0|2,0,0]=4 7665 B13R1.528 CO[C@@H](C)CNc1cnccc1S 3d38ecbfcbc06af25005443a8579a860 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.528 CO[C@@H](C)CNc1ncccc1Br c9ab6467b4aee544e40f1617dd2d389a [0,2,0,0,0,0|2,0,0]=4 7667 B13R1.528 CO[C@@H](C)CNc1ncccc1C b6c524b6a84099cb6cefe22631d87c8a [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.528 CO[C@@H](C)CNc1ncccc1Cl d2c04a33965feaa66523f8b66b5847a3 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.528 CO[C@@H](C)CNc1ncccc1F 56bbb3b2fd50ffe943b1a80ebee51683 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.528 CO[C@@H](C)CNc1ncccc1I d0b2e3cd2a8e509bc4fbf6f8eaa54b1b [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.528 CO[C@@H](C)COc1ccc[nH]c1=S d300ca76191274035709fbb8254d627b [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.528 CO[C@@H](C)COc1cccc[n+]1[O-] 366720058e05cac8aabb46d2cb95f925 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.528 CO[C@@H](C)COc1ccccc1Br e5f30614b6696f26518dd41fe17e9b46 [0,2,0,0,0,0|1,0,0]=3 7674 B13R1.528 CO[C@@H](C)COc1ccccc1C d16c8477ae53857c3b51e180e1a74779 [0,2,0,0,0,0|1,0,0]=3 7675 B13R1.528 CO[C@@H](C)COc1ccccc1Cl eb969bfc63633022f8ebca4fb7917d0b [0,2,0,0,0,0|1,0,0]=3 7676 B13R1.528 CO[C@@H](C)COc1ccccc1F 184058ebc44f4966eaa85f7738808c33 [0,2,0,0,0,0|1,0,0]=3 7677 B13R1.528 CO[C@@H](C)COc1ccccc1I 59fb11f3a892fceca9693e833d860a4c [0,2,0,0,0,0|1,0,0]=3 7678 B13R1.528 CO[C@@H](C)COc1ccccc1S c2b3007d0aa5d5c695d52b6941afed27 [0,2,0,0,0,0|1,0,0]=3 7679 B13R1.528 CO[C@@H](C)COc1cccnc1Br c7dd9cb4b5440286892b090d6c55cc46 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.528 CO[C@@H](C)COc1cccnc1C dfe92a596d7c96597e917835500aa4a9 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.528 CO[C@@H](C)COc1cccnc1Cl ba916c443a215e3de1d54db19d30653c [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.528 CO[C@@H](C)COc1cccnc1F 8a86076de541dcc6f2b0b82776b00f84 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.528 CO[C@@H](C)COc1cccnc1I 01c376b4d1b2d4a76553d1bbcbfa8a9f [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.528 CO[C@@H](C)COc1cccoc1=O 5be1679ca2d59d43d4fa9b74f33ce50d [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.528 CO[C@@H](C)COc1ccncc1Br 6f7bb76af9073bd10d0d9c29b7c79ea7 [0,2,0,0,0,0|2,0,0]=4 7686 B13R1.528 CO[C@@H](C)COc1ccncc1C cee51c0214f1954da625c03ac1a03bb5 [0,2,0,0,0,0|2,0,0]=4 7687 B13R1.528 CO[C@@H](C)COc1ccncc1Cl d82a1517356e9b72a402399ab05ea767 [0,2,0,0,0,0|2,0,0]=4 7688 B13R1.528 CO[C@@H](C)COc1ccncc1F 22ab145fecc58b8c2cd49f817a8d12bf [0,2,0,0,0,0|2,0,0]=4 7689 B13R1.528 CO[C@@H](C)COc1cnccc1Br 6af8f936d71c343e196e76d94d484d5a [0,2,0,0,0,0|2,0,0]=4 7690 B13R1.528 CO[C@@H](C)COc1cnccc1C 1e881ac0d7755291de5608d0fd865c04 [0,2,0,0,0,0|2,0,0]=4 7691 B13R1.528 CO[C@@H](C)COc1cnccc1Cl 5352a0684c9cbf8883e9d6a9ff557651 [0,2,0,0,0,0|2,0,0]=4 7692 B13R1.528 CO[C@@H](C)COc1cnccc1F 3c95228e1d63b7e218152a73eabc3442 [0,2,0,0,0,0|2,0,0]=4 7693 B13R1.528 CO[C@@H](C)COc1cnccc1I baa497da6fc5981472262745ee848575 [0,2,0,0,0,0|2,0,0]=4 7694 B13R1.528 CO[C@@H](C)COc1coccc1=O 098748f77d286354023dfb04fe3ff630 [0,2,0,0,0,0|2,0,0]=4 7695 B13R1.528 CO[C@@H](C)COc1ncccc1Br 8d29f9079f0fb92e48cc6d23994c5331 [0,2,0,0,0,0|2,0,0]=4 7696 B13R1.528 CO[C@@H](C)COc1ncccc1C e2c111f847f18e09da03af73dbc00ec2 [0,2,0,0,0,0|2,0,0]=4 7697 B13R1.528 CO[C@@H](C)COc1ncccc1Cl fea4d660e068169658290289b8f70a97 [0,2,0,0,0,0|2,0,0]=4 7698 B13R1.528 CO[C@@H](C)COc1ncccc1F 2fd0554afd872c70a9e5e3c342317a2b [0,2,0,0,0,0|2,0,0]=4 7699 B13R1.528 CO[C@@H](C)COn1ccccc1=N 58e24906f875af3d19361a3baffeecd2 [0,2,0,0,0,0|2,0,0]=4 7700 B13R1.528 CO[C@@H](C)COn1ccccc1=O 09ebb3a684f0b9663eee28997922643d [0,2,0,0,0,0|2,0,0]=4 7701 B13R1.528 CO[C@@H](C)COn1ccccc1=S a9ebe957c43d0084724296574d6955b8 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.528 CO[C@H](C)CNc1c[nH]ccc1=O 35cc7c7a754135c7bc2fb6bf6a4ddb95 [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.528 CO[C@H](C)CNc1ccc[nH]c1=S 7d32af077485010e6b1d596b584414e5 [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.528 CO[C@H](C)CNc1cccc[n+]1[O-] 6b3862715e48a6f889a1cf7748789ea3 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.528 CO[C@H](C)CNc1ccccc1Br 944f66333332369378ac2b30f22dc163 [0,2,0,0,0,0|1,0,0]=3 7706 B13R1.528 CO[C@H](C)CNc1ccccc1C e69eba302642ab4b2dcf0745ff4d6fca [0,2,0,0,0,0|1,0,0]=3 7707 B13R1.528 CO[C@H](C)CNc1ccccc1Cl 068a70dd88f15d77ae0413adc77f66fc [0,2,0,0,0,0|1,0,0]=3 7708 B13R1.528 CO[C@H](C)CNc1ccccc1F c85450b2730e5724c56925ac89b54c1a [0,2,0,0,0,0|1,0,0]=3 7709 B13R1.528 CO[C@H](C)CNc1ccccc1I 94d2e264e22c84c92c7014bf3bf43135 [0,2,0,0,0,0|1,0,0]=3 7710 B13R1.528 CO[C@H](C)CNc1ccccc1S d1c5a6c5e4916e216e508e6639d5b74f [0,2,0,0,0,0|1,0,0]=3 7711 B13R1.528 CO[C@H](C)CNc1cccnc1Br 2ac9ced3922201f098e57b4a3c852a23 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.528 CO[C@H](C)CNc1cccnc1C 2a91f7050e2f7e396e340bb741df6794 [0,2,0,0,0,0|2,0,0]=4 7713 B13R1.528 CO[C@H](C)CNc1cccnc1Cl 597cccd6d8c8ae3f21539399a94ed70e [0,2,0,0,0,0|2,0,0]=4 7714 B13R1.528 CO[C@H](C)CNc1cccnc1F a624484b2dfd0c6e381d43c7f6e9551c [0,2,0,0,0,0|2,0,0]=4 7715 B13R1.528 CO[C@H](C)CNc1cccnc1I 609eb8a2d64118a8fcf9dd22d1d833a2 [0,2,0,0,0,0|2,0,0]=4 7716 B13R1.528 CO[C@H](C)CNc1ccncc1Br b6604e5ec111a15fe8ad1195982bec99 [0,2,0,0,0,0|2,0,0]=4 7717 B13R1.528 CO[C@H](C)CNc1ccncc1C 40c21604934e979c68e0151c281660d2 [0,2,0,0,0,0|2,0,0]=4 7718 B13R1.528 CO[C@H](C)CNc1ccncc1Cl 47b44368bb1ffc8e494b60238dc61745 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.528 CO[C@H](C)CNc1ccncc1F 83de8e3f0c34aac586ddc3fbcfc85ece [0,2,0,0,0,0|2,0,0]=4 7720 B13R1.528 CO[C@H](C)CNc1ccncc1I 04f49e4da7839c2ef5395f486f7c3168 [0,2,0,0,0,0|2,0,0]=4 7721 B13R1.528 CO[C@H](C)CNc1cnccc1Br 8211201cb762f7340d27d372c218ea9a [0,2,0,0,0,0|2,0,0]=4 7722 B13R1.528 CO[C@H](C)CNc1cnccc1C d1affeae83732e0127fdca5a4335fd34 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.528 CO[C@H](C)CNc1cnccc1Cl 5fbb3aeea451e937b02cbf3d6fff294f [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.528 CO[C@H](C)CNc1cnccc1F 469d0cc5a0eb886cb6071b52837668c3 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.528 CO[C@H](C)CNc1cnccc1I 92aa7735537a2cf93d7932a8abf91012 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.528 CO[C@H](C)CNc1cnccc1S d2ba750ccc0e7079c27820ca3873155f [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.528 CO[C@H](C)CNc1ncccc1Br 500121ad0e207d09a96f5217a63896dc [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.528 CO[C@H](C)CNc1ncccc1C 99a0bf645eece2f615c64c02bbac427c [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.528 CO[C@H](C)CNc1ncccc1Cl 2167299702d6af3da71faec19c012c8c [0,2,0,0,0,0|2,0,0]=4 7730 B13R1.528 CO[C@H](C)CNc1ncccc1F 93cd9b5af46368052f62d3adca702d07 [0,2,0,0,0,0|2,0,0]=4 7731 B13R1.528 CO[C@H](C)CNc1ncccc1I 51b593a56c4610a2e72ab0f1579b6bbb [0,2,0,0,0,0|2,0,0]=4 7732 B13R1.528 CO[C@H](C)COc1ccc[nH]c1=S 84309599c1add183873232249d6c88a7 [0,2,0,0,0,0|2,0,0]=4 7733 B13R1.528 CO[C@H](C)COc1cccc[n+]1[O-] aa854efe92710a0c3e0d3ed24011c5b5 [0,2,0,0,0,0|2,0,0]=4 7734 B13R1.528 CO[C@H](C)COc1ccccc1Br 4c42977be3491d0c77c1cf59de89fc9f [0,2,0,0,0,0|1,0,0]=3 7735 B13R1.528 CO[C@H](C)COc1ccccc1C 0bf3afc7c032bf745271cc1d103ade5c [0,2,0,0,0,0|1,0,0]=3 7736 B13R1.528 CO[C@H](C)COc1ccccc1Cl 19234a0baa4adfbc2fe2866b99212162 [0,2,0,0,0,0|1,0,0]=3 7737 B13R1.528 CO[C@H](C)COc1ccccc1F bd176c1257f5b4ec29c90e0bdc71f71b [0,2,0,0,0,0|1,0,0]=3 7738 B13R1.528 CO[C@H](C)COc1ccccc1I 88a0aef7974b252936474a79071967da [0,2,0,0,0,0|1,0,0]=3 7739 B13R1.528 CO[C@H](C)COc1ccccc1S 863528f825c9a9f699456801468ffaec [0,2,0,0,0,0|1,0,0]=3 7740 B13R1.528 CO[C@H](C)COc1cccnc1Br 58e1bf56a11226b01fc35f7b535d349f [0,2,0,0,0,0|2,0,0]=4 7741 B13R1.528 CO[C@H](C)COc1cccnc1C 49fc196231763997c5faebf462a81e51 [0,2,0,0,0,0|2,0,0]=4 7742 B13R1.528 CO[C@H](C)COc1cccnc1Cl 30acf98d1e9808fadbad764fd40ca2fb [0,2,0,0,0,0|2,0,0]=4 7743 B13R1.528 CO[C@H](C)COc1cccnc1F 4c4f20418d66e9d3441fee464f6a2baa [0,2,0,0,0,0|2,0,0]=4 7744 B13R1.528 CO[C@H](C)COc1cccnc1I 060063f887891d67289bbdb85e570ff8 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.528 CO[C@H](C)COc1cccoc1=O 14df9eabe5406c0fcbb2570d41235c5c [0,2,0,0,0,0|2,0,0]=4 7746 B13R1.528 CO[C@H](C)COc1ccncc1Br 6e7436d19da81a777f65a38316febc7d [0,2,0,0,0,0|2,0,0]=4 7747 B13R1.528 CO[C@H](C)COc1ccncc1C ef25440a376c404f4ba4acb6896724d4 [0,2,0,0,0,0|2,0,0]=4 7748 B13R1.528 CO[C@H](C)COc1ccncc1Cl 5bb6d9ca55a9dc17871c4033a66f44f6 [0,2,0,0,0,0|2,0,0]=4 7749 B13R1.528 CO[C@H](C)COc1ccncc1F 238487eaf5665b63283a92d551c4cd32 [0,2,0,0,0,0|2,0,0]=4 7750 B13R1.528 CO[C@H](C)COc1cnccc1Br 350eb85f677cff8fda5177cd7ac60c90 [0,2,0,0,0,0|2,0,0]=4 7751 B13R1.528 CO[C@H](C)COc1cnccc1C 022e57f85c460f7001f165da55cb48cb [0,2,0,0,0,0|2,0,0]=4 7752 B13R1.528 CO[C@H](C)COc1cnccc1Cl 72e4251162692885eed4360bc88c1ddf [0,2,0,0,0,0|2,0,0]=4 7753 B13R1.528 CO[C@H](C)COc1cnccc1F 2737249fb31cab1c9ed1683f73c24144 [0,2,0,0,0,0|2,0,0]=4 7754 B13R1.528 CO[C@H](C)COc1cnccc1I 5797a4921d1da4d9fbe0e971c26d4fbb [0,2,0,0,0,0|2,0,0]=4 7755 B13R1.528 CO[C@H](C)COc1coccc1=O fe8accb15df63312464463d79b0d68f3 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.528 CO[C@H](C)COc1ncccc1Br 3883a2d3ca32927da77553ab5e5ae56d [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.528 CO[C@H](C)COc1ncccc1C 5be11aaff374f7c1c4d11c5cb93e9738 [0,2,0,0,0,0|2,0,0]=4 7758 B13R1.528 CO[C@H](C)COc1ncccc1Cl b587041d4c4bbb96b86b4464d7eb4ec2 [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.528 CO[C@H](C)COc1ncccc1F 3e43a42cc0155add2a0f2d0a40b71cbb [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.528 CO[C@H](C)COn1ccccc1=N f04d4867faa7ca279b31bf1c0b034d99 [0,2,0,0,0,0|2,0,0]=4 7761 B13R1.528 CO[C@H](C)COn1ccccc1=O 0afd70f1bfd6e66011ac62c5b6f7747d [0,2,0,0,0,0|2,0,0]=4 7762 B13R1.528 CO[C@H](C)COn1ccccc1=S a99b91508b11ff1afebc148b3095da6d [0,2,0,0,0,0|2,0,0]=4 7763 B13R1.528 C[C@@H](CO)CNc1ccc[nH]c1=S a64a003a7466f19af64f7891da299894 [0,2,0,0,0,0|2,0,0]=4 7764 B13R1.528 C[C@@H](CO)CNc1cccc[n+]1[O-] 2bee4c477bde365f7073741d6b78f702 [0,2,0,0,0,0|2,0,0]=4 7765 B13R1.528 C[C@@H](CO)CNc1ccccc1Br 3de5084a6921e6c4e8f82ee0cd61744d [0,2,0,0,0,0|1,0,0]=3 7766 B13R1.528 C[C@@H](CO)CNc1ccccc1Cl 7412af0bb9c5993d3866383bd9a32da4 [0,2,0,0,0,0|1,0,0]=3 7767 B13R1.528 C[C@@H](CO)CNc1ccccc1F 61a0cf1a1f9f79d9ca8cbc146790875b [0,2,0,0,0,0|1,0,0]=3 7768 B13R1.528 C[C@@H](CO)CNc1ccccc1I 125931c7e0d6ea7900ca8572951404ab [0,2,0,0,0,0|1,0,0]=3 7769 B13R1.528 C[C@@H](CO)CNc1ccccc1S 58f5bce03a1983b85837c981bebee2e2 [0,2,0,0,0,0|1,0,0]=3 7770 B13R1.528 C[C@@H](CO)CNc1cccnc1Br 401cc957ae8c6756dd05e29ffa218c96 [0,2,0,0,0,0|2,0,0]=4 7771 B13R1.528 C[C@@H](CO)CNc1cccnc1Cl 135d220f6636f41842b3535e3d62ce28 [0,2,0,0,0,0|2,0,0]=4 7772 B13R1.528 C[C@@H](CO)CNc1cccnc1F 272f9a352e89d6c73d8360840673c774 [0,2,0,0,0,0|2,0,0]=4 7773 B13R1.528 C[C@@H](CO)CNc1cccnc1I 3e45fbceb629e6ed8629056e72513295 [0,2,0,0,0,0|2,0,0]=4 7774 B13R1.528 C[C@@H](CO)CNc1ccncc1Br 850bdeb0a6ce080271a5a70aca096aac [0,2,0,0,0,0|2,0,0]=4 7775 B13R1.528 C[C@@H](CO)CNc1ccncc1Cl a74a7fc763ff3efe2e9e07d5c9d41ab1 [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.528 C[C@@H](CO)CNc1ccncc1F b5f33c6f19be64da7e59ca19939b2575 [0,2,0,0,0,0|2,0,0]=4 7777 B13R1.528 C[C@@H](CO)CNc1ccncc1I 37c792bb8249a6518fb123a3b675fda9 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.528 C[C@@H](CO)CNc1cnccc1Br b015826ebd6fcc7980e345ac7f6a0487 [0,2,0,0,0,0|2,0,0]=4 7779 B13R1.528 C[C@@H](CO)CNc1cnccc1Cl bf26f17a119cb6c4670cc400526d2113 [0,2,0,0,0,0|2,0,0]=4 7780 B13R1.528 C[C@@H](CO)CNc1cnccc1F 24289ac0c3599f7f5f0aadc76404a342 [0,2,0,0,0,0|2,0,0]=4 7781 B13R1.528 C[C@@H](CO)CNc1cnccc1I 33d1f473c8294dc635abf386c9aeea47 [0,2,0,0,0,0|2,0,0]=4 7782 B13R1.528 C[C@@H](CO)CNc1cnccc1S 052cfc97650b3c848d8fa422370fbcee [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.528 C[C@@H](CO)CNc1ncccc1Br 9f8d3d96f3d9ca1bff82c0e932a4a83d [0,2,0,0,0,0|2,0,0]=4 7784 B13R1.528 C[C@@H](CO)CNc1ncccc1Cl 0f77c29d5270c7c2c3306253907ccc56 [0,2,0,0,0,0|2,0,0]=4 7785 B13R1.528 C[C@@H](CO)CNc1ncccc1F 191e6d14566cd83836a5d2717e5fdfef [0,2,0,0,0,0|2,0,0]=4 7786 B13R1.528 C[C@@H](CO)CNc1ncccc1I 724f75f2609d7f75e18d98273e740064 [0,2,0,0,0,0|2,0,0]=4 7787 B13R1.528 C[C@@H](CO)NCc1cccc[n+]1[O-] 9383562a9d5e279e008aeba37c56b6b8 [0,2,0,0,0,0|2,0,0]=4 7788 B13R1.528 C[C@@H](CO)NCc1ccccc1Br e18b2736ed8eb51e9099aa70ce39f040 [0,2,0,0,0,0|1,0,0]=3 7789 B13R1.528 C[C@@H](CO)NCc1ccccc1Cl 5f6a13bccb147528c3f9b61fd5db4f37 [0,2,0,0,0,0|1,0,0]=3 7790 B13R1.528 C[C@@H](CO)NCc1ccccc1F 4ead5b1581e89600db3db3b5e60ca3b5 [0,2,0,0,0,0|1,0,0]=3 7791 B13R1.528 C[C@@H](CO)NCc1ccccc1I 23e7361270c6fc7f5356c1d92a1595f2 [0,2,0,0,0,0|1,0,0]=3 7792 B13R1.528 C[C@@H](CO)NCc1cccnc1Br 5101c8b115f4cab28097ea68eb074f97 [0,2,0,0,0,0|2,0,0]=4 7793 B13R1.528 C[C@@H](CO)NCc1cccnc1Cl 5a9190305c2ef2356d1606221cf4d58e [0,2,0,0,0,0|2,0,0]=4 7794 B13R1.528 C[C@@H](CO)NCc1cccnc1F ed0cb3278faa47fc8ef02b67495f0da8 [0,2,0,0,0,0|2,0,0]=4 7795 B13R1.528 C[C@@H](CO)NCc1ccncc1Br 35fc7f51e515627ba36b752a59f2003d [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.528 C[C@@H](CO)NCc1ccncc1Cl cfe29474408c1ffce8cb0324dbe4e844 [0,2,0,0,0,0|2,0,0]=4 7797 B13R1.528 C[C@@H](CO)NCc1ccncc1F 17ec81fce6879c0c7f1cc1ae3dadc9e6 [0,2,0,0,0,0|2,0,0]=4 7798 B13R1.528 C[C@@H](CO)NCc1ncccc1Br 2cf2fc103f4790d3b2aa05aafcd10a71 [0,2,0,0,0,0|2,0,0]=4 7799 B13R1.528 C[C@@H](CO)NCc1ncccc1Cl f0f26c7d59aeafc8e5e7805a85970db4 [0,2,0,0,0,0|2,0,0]=4 7800 B13R1.528 C[C@@H](CO)NCc1ncccc1F 1b193dd8ea157cce620c22aa1a68b231 [0,2,0,0,0,0|2,0,0]=4 7801 B13R1.528 C[C@H](C=O)NCc1ccccc1Br 098e8ee8b5da872b3310777385c4bfa8 [0,2,0,0,0,0|1,0,1]=4 7802 B13R1.528 C[C@H](C=O)NCc1ccccc1Cl 38a751c81c79a4e17ca60d5039adcad0 [0,2,0,0,0,0|1,0,1]=4 7803 B13R1.528 C[C@H](C=O)NCc1ccccc1F 47729c68c23ca2b1e97207da07948b6f [0,2,0,0,0,0|1,0,1]=4 7804 B13R1.528 C[C@H](C=O)NCc1ccccc1I 0a22c6b9e2137210dc2df30ffff94dce [0,2,0,0,0,0|1,0,1]=4 7805 B13R1.528 C[C@H](C=O)OCc1ccccc1Cl 66a3c67c7af8694140e4aacd90dc83c3 [0,2,0,0,0,0|1,0,1]=4 7806 B13R1.528 C[C@H](C=O)OCc1ccccc1F 047aff045f1e4d4c3609a5e028bd3acb [0,2,0,0,0,0|1,0,1]=4 7807 B13R1.528 C[C@H](C=O)OCc1ccccc1I ee2448bf1353e1ff846e024f979e5ade [0,2,0,0,0,0|1,0,1]=4 7808 B13R1.528 C[C@H](C=O)OCc1ccccc1S 9edd4770f0057c13a090969dff2d4af2 [0,2,0,0,0,0|1,0,1]=4 7809 B13R1.528 C[C@H](CO)CNc1c[nH]ccc1=O aa31020789c39c6cbc9aa23877684371 [0,2,0,0,0,0|2,0,0]=4 7810 B13R1.528 C[C@H](CO)CNc1ccc[nH]c1=S ccd2cae8122246d90b031b87c3656abc [0,2,0,0,0,0|2,0,0]=4 7811 B13R1.528 C[C@H](CO)CNc1cccc[n+]1[O-] c89b7c53d79ddaf7f5749c5e2a8ff1fa [0,2,0,0,0,0|2,0,0]=4 7812 B13R1.528 C[C@H](CO)CNc1ccccc1Br 7b6f2f61566810ac3e90fbd6f2d9c387 [0,2,0,0,0,0|1,0,0]=3 7813 B13R1.528 C[C@H](CO)CNc1ccccc1Cl e87a68c64934c9465028bf1bcedb1054 [0,2,0,0,0,0|1,0,0]=3 7814 B13R1.528 C[C@H](CO)CNc1ccccc1F d5b826b6ee7fc40b80335a968fd2991e [0,2,0,0,0,0|1,0,0]=3 7815 B13R1.528 C[C@H](CO)CNc1ccccc1I e8338d2cd4318e218a229b9245e5e2d7 [0,2,0,0,0,0|1,0,0]=3 7816 B13R1.528 C[C@H](CO)CNc1ccccc1S db53871bfe04cc75dae67727cfbe81ed [0,2,0,0,0,0|1,0,0]=3 7817 B13R1.528 C[C@H](CO)CNc1cccnc1Br a261a3b9ad94a9be0a9291eae779508f [0,2,0,0,0,0|2,0,0]=4 7818 B13R1.528 C[C@H](CO)CNc1cccnc1Cl f2eee75bf6d4078c5bd5f3aa8c7d9717 [0,2,0,0,0,0|2,0,0]=4 7819 B13R1.528 C[C@H](CO)CNc1cccnc1F 3524f97dcfd8e2653338f52bdcf32ab9 [0,2,0,0,0,0|2,0,0]=4 7820 B13R1.528 C[C@H](CO)CNc1cccnc1I 94ead4be84bfbc63fb94c8e3d08bf823 [0,2,0,0,0,0|2,0,0]=4 7821 B13R1.528 C[C@H](CO)CNc1ccncc1Br 380e3efbecddcc12e3295516ef4e3685 [0,2,0,0,0,0|2,0,0]=4 7822 B13R1.528 C[C@H](CO)CNc1ccncc1Cl 92fec910bc561e33a7446db6a2894bcd [0,2,0,0,0,0|2,0,0]=4 7823 B13R1.528 C[C@H](CO)CNc1ccncc1F 70c354ab7237ac8acb39049e79c928e5 [0,2,0,0,0,0|2,0,0]=4 7824 B13R1.528 C[C@H](CO)CNc1ccncc1I 2c7ea6756afcdb919d1581286f0b9373 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.528 C[C@H](CO)CNc1cnccc1Br 0d3727df8c2d44c6a88d57f470f7d8ad [0,2,0,0,0,0|2,0,0]=4 7826 B13R1.528 C[C@H](CO)CNc1cnccc1Cl 93f560323470cd6276841f0295d78e4b [0,2,0,0,0,0|2,0,0]=4 7827 B13R1.528 C[C@H](CO)CNc1cnccc1F 6d5358a3cb784f2bc65c8b80ca3d118b [0,2,0,0,0,0|2,0,0]=4 7828 B13R1.528 C[C@H](CO)CNc1cnccc1I 56e4ee49c8ab929641f2b743fcf7a55d [0,2,0,0,0,0|2,0,0]=4 7829 B13R1.528 C[C@H](CO)CNc1cnccc1S e5e65c752e7d1f85d9f5db1aa91f6249 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.528 C[C@H](CO)CNc1ncccc1Br ccabcc0e1aab1499b260918767d5df00 [0,2,0,0,0,0|2,0,0]=4 7831 B13R1.528 C[C@H](CO)CNc1ncccc1Cl 167050899bb87b8aaf85e8468f5d630c [0,2,0,0,0,0|2,0,0]=4 7832 B13R1.528 C[C@H](CO)CNc1ncccc1F 693778e67fc480c0bdd48e0eb8b20627 [0,2,0,0,0,0|2,0,0]=4 7833 B13R1.528 C[C@H](CO)CNc1ncccc1I 11b6ddfa64c24d09f3787bb5d01c6703 [0,2,0,0,0,0|2,0,0]=4 7834 B13R1.528 C[C@H](CO)NCc1cccc[n+]1[O-] f3582f075a4c9b21559af1cac483d9f2 [0,2,0,0,0,0|2,0,0]=4 7835 B13R1.528 C[C@H](CO)NCc1ccccc1Br 0783c4b7a5131be436eebf2b4153d121 [0,2,0,0,0,0|1,0,0]=3 7836 B13R1.528 C[C@H](CO)NCc1ccccc1Cl f2fc0bda0f346b0dfe5bbaca9dfee403 [0,2,0,0,0,0|1,0,0]=3 7837 B13R1.528 C[C@H](CO)NCc1ccccc1F 2cd4a82fe370b53c03f879722508fc50 [0,2,0,0,0,0|1,0,0]=3 7838 B13R1.528 C[C@H](CO)NCc1ccccc1I ecc235929894be74c0216f5a1356d8ba [0,2,0,0,0,0|1,0,0]=3 7839 B13R1.528 C[C@H](CO)NCc1cccnc1Br 7a4c2b1717cec4061725772ab70657bc [0,2,0,0,0,0|2,0,0]=4 7840 B13R1.528 C[C@H](CO)NCc1cccnc1Cl 3d3a6b982ad8b1d1d16674725863333f [0,2,0,0,0,0|2,0,0]=4 7841 B13R1.528 C[C@H](CO)NCc1cccnc1F 6cb206f1aacf246eb6f989fc00ea5715 [0,2,0,0,0,0|2,0,0]=4 7842 B13R1.528 C[C@H](CO)NCc1ccncc1Br 015ead5fea9a08f748f2399325de51f5 [0,2,0,0,0,0|2,0,0]=4 7843 B13R1.528 C[C@H](CO)NCc1ccncc1Cl 8cbfec47f056803d716d64770e05fb85 [0,2,0,0,0,0|2,0,0]=4 7844 B13R1.528 C[C@H](CO)NCc1ccncc1F d671f84647645f5dc6fa671a956b583c [0,2,0,0,0,0|2,0,0]=4 7845 B13R1.528 C[C@H](CO)NCc1ncccc1Br d057f4ada48c0067f50e833729812575 [0,2,0,0,0,0|2,0,0]=4 7846 B13R1.528 C[C@H](CO)NCc1ncccc1Cl 833d3c681038b75e82f43bd653f68af5 [0,2,0,0,0,0|2,0,0]=4 7847 B13R1.528 C[C@H](CO)NCc1ncccc1F 146e005e18002c53571c9a93ae453c62 [0,2,0,0,0,0|2,0,0]=4 7848 B13R1.528 C[C@H](CS)OCc1ccccc1Cl 22ff9ef15c1df337d22f63260f84c2d9 [0,2,0,0,0,0|1,1,0]=4 7849 B13R1.528 C[C@H](CS)OCc1ccccc1F 3b044071f09811062a091efe26bd933c [0,2,0,0,0,0|1,1,0]=4 7850 B13R1.528 C[C@H](CS)OCc1ccccc1I 5e2448361674a519535c100d10b654af [0,2,0,0,0,0|1,1,0]=4 7851 B13R1.528 Cc1ccccc1CCN(C)C=O 88d01381af2485d4e4ef1e5823267ccf [0,2,0,0,0,0|1,0,1]=4 7852 B13R1.528 Cc1ccccc1CNC(C)C#N 9e8e30627923fcb5a1760a9c392bdf90 [0,2,0,0,0,0|2,0,0]=4 7853 B13R1.528 Cc1ccccc1CNC(C)C=O e3491bccb7ce10f690c52fcd57a988df [0,2,0,0,0,0|1,0,1]=4 7854 B13R1.528 Cc1ccccc1CNC(C)CO 5fe3a20c3e8aacc2c2d84c444fccdb86 [0,2,0,0,0,0|1,0,0]=3 7855 B13R1.528 Cc1ccccc1CN[C@@H](C)CO 5864c5f38a533e91c90ed8963c87fa7d [0,2,0,0,0,0|1,0,0]=3 7856 B13R1.528 Cc1ccccc1CN[C@H](C)C=O a454c2902db789b1c5720d70fada6425 [0,2,0,0,0,0|1,0,1]=4 7857 B13R1.528 Cc1ccccc1CN[C@H](C)CO 569a13e34c1f30de7024d097a0e29725 [0,2,0,0,0,0|1,0,0]=3 7858 B13R1.528 Cc1ccccc1COC(C)C=O 31ef6fd9851b156eac087f5214ef785a [0,2,0,0,0,0|1,0,1]=4 7859 B13R1.528 Cc1ccccc1COC(C)CF e2fe940a32a408ff0495b6c7dd38658a [0,2,0,0,0,0|2,0,0]=4 7860 B13R1.528 Cc1ccccc1NCC(Br)CBr 4874954a2b283b7134ecd65725c78d49 [0,2,0,0,0,0|2,0,0]=4 7861 B13R1.528 Cc1ccccc1NCC(C)CO 42e17ac294b21da2a4da200d7f39f657 [0,2,0,0,0,0|1,0,0]=3 7862 B13R1.528 Cc1ccccc1NCC(F)CO 2f9fbef1b454f0a5caf418a0f3bf7079 [0,2,0,0,0,0|2,0,0]=4 7863 B13R1.528 Cc1ccccc1NCC(O)CO 45b6504f65a450a965c040ed5c619ed8 [0,2,0,0,0,0|1,0,0]=3 7864 B13R1.528 Cc1ccccc1NC[C@@H](C)CO 88f0da12a4989c00a2f35cb81c7f8da0 [0,2,0,0,0,0|1,0,0]=3 7865 B13R1.528 Cc1ccccc1NC[C@@H](F)CO 088ef7f74f39ce597c01d27d79b7c6eb [0,2,0,0,0,0|2,0,0]=4 7866 B13R1.528 Cc1ccccc1NC[C@@H](O)CO 3984cd3caaa90cfa1e01e2936da320f7 [0,2,0,0,0,0|1,0,0]=3 7867 B13R1.528 Cc1ccccc1NC[C@H](C)CO 1135b422ee05beb9de597d0281b6d5e9 [0,2,0,0,0,0|1,0,0]=3 7868 B13R1.528 Cc1ccccc1NC[C@H](F)CO 567d3dea2bd642bc59c9538f94c2e504 [0,2,0,0,0,0|2,0,0]=4 7869 B13R1.528 Cc1ccccc1NC[C@H](O)CO 522d2d726c6d58a3e0844ffab6bfe41f [0,2,0,0,0,0|1,0,0]=3 7870 B13R1.528 Cc1ccccc1OCC(O)CO 20017891106899307a2c5b15b4968e55 [0,2,0,0,0,0|1,0,0]=3 7871 B13R1.528 Cc1ccccc1OC[C@@H](O)CO cca4ca2b9a65a7af2c8a62ae219eb6ef [0,2,0,0,0,0|1,0,0]=3 7872 B13R1.528 Cc1ccccc1OC[C@H](O)CO a1cbca853d15328fb9be4ecc8623dc2a [0,2,0,0,0,0|1,0,0]=3 7873 B13R1.528 Cc1cccnc1CNC(C)CO 1d46c95ac567300ad164cff63a588b05 [0,2,0,0,0,0|2,0,0]=4 7874 B13R1.528 Cc1cccnc1CN[C@@H](C)CO 24c9c8f875ec7823d48c3968183c028f [0,2,0,0,0,0|2,0,0]=4 7875 B13R1.528 Cc1cccnc1CN[C@H](C)CO 58dc286f5fae3db4658f4891bd38662b [0,2,0,0,0,0|2,0,0]=4 7876 B13R1.528 Cc1cccnc1NCC(C)CO 6371fa286ef02078c4ba1fe0ea529451 [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.528 Cc1cccnc1NCC(O)CF ebce4fddb2625d972d7dd7fe0824c3a5 [0,2,0,0,0,0|2,0,0]=4 7878 B13R1.528 Cc1cccnc1NCC(O)CO 862c8cb3c9b9feea8001af6ad886625b [0,2,0,0,0,0|2,0,0]=4 7879 B13R1.528 Cc1cccnc1NC[C@@H](C)CO 46b980252c8a23b215ad4fc3b67eb94c [0,2,0,0,0,0|2,0,0]=4 7880 B13R1.528 Cc1cccnc1NC[C@@H](O)CO 41bb84f1c69d7b50dcd4721c526e5635 [0,2,0,0,0,0|2,0,0]=4 7881 B13R1.528 Cc1cccnc1NC[C@H](C)CO 4f74fd02e16562014dab18755b84d723 [0,2,0,0,0,0|2,0,0]=4 7882 B13R1.528 Cc1cccnc1NC[C@H](O)CO b1817467384d1ec63144376591ddb9b1 [0,2,0,0,0,0|2,0,0]=4 7883 B13R1.528 Cc1cccnc1OCC(O)CO ce3c7147befb801bdac172c2fe04ee76 [0,2,0,0,0,0|2,0,0]=4 7884 B13R1.528 Cc1cccnc1OC[C@@H](O)CO 95db5ba0aded032395f2a87bea4c249a [0,2,0,0,0,0|2,0,0]=4 7885 B13R1.528 Cc1cccnc1OC[C@H](O)CO 11ab74b09c14adcc43b99ec2689c0138 [0,2,0,0,0,0|2,0,0]=4 7886 B13R1.528 Cc1ccncc1NCC(C)CO 0ce8a40332d456c0aec750b66e5bdf27 [0,2,0,0,0,0|2,0,0]=4 7887 B13R1.528 Cc1ccncc1NCC(O)CF 448f242fc5ca4b41459cfe16b34238ed [0,2,0,0,0,0|2,0,0]=4 7888 B13R1.528 Cc1ccncc1NCC(O)CO 4b6dc763260bb07485d9047c9e5fe4c7 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.528 Cc1ccncc1NC[C@@H](C)CO 24e8dcfa9ba2c8e2dc5ad79ab36af5d6 [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.528 Cc1ccncc1NC[C@@H](O)CO b11bb59ebce84c4094e0ed2ea1899cc4 [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.528 Cc1ccncc1NC[C@H](C)CO 3c41b4646f3e9fea28f4c128b61f48c2 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.528 Cc1ccncc1NC[C@H](O)CO b0d579f25035348ccfc25a06ea8dd8b1 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.528 Cc1ccncc1OCC(O)CO 6a10ea4a82030b4eca292a6c0dd9e86d [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.528 Cc1ccncc1OC[C@@H](O)CO 6b290aa795dacd291edfd033b1c7d56a [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.528 Cc1ccncc1OC[C@H](O)CO 7194b2b89189119fc0f747dcc990f506 [0,2,0,0,0,0|2,0,0]=4 7896 B13R1.528 Cc1cnccc1CNC(C)CO a516c98361256b606ddbda29d253e647 [0,2,0,0,0,0|2,0,0]=4 7897 B13R1.528 Cc1cnccc1CN[C@@H](C)CO 62bfe2a19b1f86dd25ee1716dd15d9d8 [0,2,0,0,0,0|2,0,0]=4 7898 B13R1.528 Cc1cnccc1CN[C@H](C)CO fc77b457b2e60ef311932f6759aab907 [0,2,0,0,0,0|2,0,0]=4 7899 B13R1.528 Cc1cnccc1NCC(C)CO 6bb991aa835b95a13d2293b855236e39 [0,2,0,0,0,0|2,0,0]=4 7900 B13R1.528 Cc1cnccc1NCC(O)CF bed303faa21b09fe829881683e7cf639 [0,2,0,0,0,0|2,0,0]=4 7901 B13R1.528 Cc1cnccc1NCC(O)CO f2c7d3c6e5f1598580d04360db5c19fe [0,2,0,0,0,0|2,0,0]=4 7902 B13R1.528 Cc1cnccc1NC[C@@H](C)CO cba7db3ad3e0b4b566ef3dd81bc0e4c5 [0,2,0,0,0,0|2,0,0]=4 7903 B13R1.528 Cc1cnccc1NC[C@@H](O)CO d7bf90bcd1a658b95df85fd6a22e7878 [0,2,0,0,0,0|2,0,0]=4 7904 B13R1.528 Cc1cnccc1NC[C@H](C)CO a59841c863a1b3151f8f8d32fa8a8803 [0,2,0,0,0,0|2,0,0]=4 7905 B13R1.528 Cc1cnccc1NC[C@H](O)CO 1d21af6a782ca8a724c1de97635d40db [0,2,0,0,0,0|2,0,0]=4 7906 B13R1.528 Cc1cnccc1OCC(O)CO cd81e9c166ef80bcc11a706d289fed41 [0,2,0,0,0,0|2,0,0]=4 7907 B13R1.528 Cc1cnccc1OC[C@@H](O)CO 643cb2fbf290beccfd58bcddbeb1dd54 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.528 Cc1cnccc1OC[C@H](O)CO d49c99298c40a4c2d6103ca18348208c [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.528 Cc1ncccc1CNC(C)CO 19171fb9d0b3cc461c5385ea08272d92 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.528 Cc1ncccc1CN[C@@H](C)CO f9f97387d5adacf3ef55968b4f5b801f [0,2,0,0,0,0|2,0,0]=4 7911 B13R1.528 Cc1ncccc1CN[C@H](C)CO 8e49a231576016493fa5f0765b8f38a0 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.528 Cc1ncccc1NCC(C)CO aa67a80cb677d60fb95cc4c99a891bfe [0,2,0,0,0,0|2,0,0]=4 7913 B13R1.528 Cc1ncccc1NCC(O)CF ca49ab68151e86516cb1627838db8e1a [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.528 Cc1ncccc1NCC(O)CO ca08784b8ab227a3accbdbf8f9eb6de9 [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.528 Cc1ncccc1NC[C@@H](C)CO 2012a149c88794d4da65865f6fc5005c [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.528 Cc1ncccc1NC[C@@H](O)CO 8693410d94df10da09012aa97007b2b0 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.528 Cc1ncccc1NC[C@H](C)CO b00d7a360bcb8971c1e9858a2979c94a [0,2,0,0,0,0|2,0,0]=4 7918 B13R1.528 Cc1ncccc1NC[C@H](O)CO dbd7f3671785200c59c7e6cf95b58e88 [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.528 Cc1ncccc1OCC(O)CO 1fb345fc9f83439e5ba58ee6e46aa755 [0,2,0,0,0,0|2,0,0]=4 7920 B13R1.528 Cc1ncccc1OC[C@@H](O)CO a1bbc77a96ce4ec2419fbe587550c02d [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.528 Cc1ncccc1OC[C@H](O)CO e7830559d522fb2648e4f09ec4f59e56 [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.528 N=c1ccccn1OCC(O)CO e348d891a0f952202049427e3eafe356 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.528 N=c1ccccn1OC[C@@H](O)CO 015b26354ad7bb4e25fb266f9a9cb0bd [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.528 N=c1ccccn1OC[C@H](O)CO 55264bfaddf0b6f9a6d5445f64a24f8e [0,2,0,0,0,0|2,0,0]=4 7925 B13R1.528 O=c1cc[nH]cc1NCC(O)CO e4a66098bfaede640c58693af387d9cf [0,2,0,0,0,0|2,0,0]=4 7926 B13R1.528 O=c1cc[nH]cc1NC[C@@H](O)CO d376f5e30d48bf1821090eb58249347e [0,2,0,0,0,0|2,0,0]=4 7927 B13R1.528 O=c1cc[nH]cc1NC[C@H](O)CO 3c146acda336f3b25519b6ebbc5e6bdd [0,2,0,0,0,0|2,0,0]=4 7928 B13R1.528 O=c1ccccn1OCC(O)CO a4b029d4e6b38029482f75a5e5132dd8 [0,2,0,0,0,0|2,0,0]=4 7929 B13R1.528 O=c1ccccn1OC[C@@H](O)CO d6fa39c7eff0405e1aab7ef27608aa12 [0,2,0,0,0,0|2,0,0]=4 7930 B13R1.528 O=c1ccccn1OC[C@H](O)CO b963eb0782023625975b4a6e80c77108 [0,2,0,0,0,0|2,0,0]=4 7931 B13R1.528 O=c1ccocc1OCC(O)CO ab3105ccbb90e13bdbe44408173f6ea3 [0,2,0,0,0,0|2,0,0]=4 7932 B13R1.528 O=c1ccocc1OC[C@@H](O)CO 0e713c42c467c2b6081e71e2bb71cca4 [0,2,0,0,0,0|2,0,0]=4 7933 B13R1.528 O=c1ccocc1OC[C@H](O)CO 103d2fa8493906c4235815c39699b3dc [0,2,0,0,0,0|2,0,0]=4 7934 B13R1.528 O=c1occcc1OCC(O)CO 6171ab40d2514e4f8e4f82bdde2bd037 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.528 O=c1occcc1OC[C@@H](O)CO ef5f538e58903652e3643c850d0981d9 [0,2,0,0,0,0|2,0,0]=4 7936 B13R1.528 O=c1occcc1OC[C@H](O)CO 84cee0de3aca39770e97e6d755dfc084 [0,2,0,0,0,0|2,0,0]=4 7937 B13R1.528 OC(CF)CNc1ccc[nH]c1=S 51603927f01c4d7a10a099e9d031b69c [0,2,0,0,0,0|2,0,0]=4 7938 B13R1.528 OC(CF)CNc1ccccc1Cl a699527ea306790dbb6046a55ccb3498 [0,2,0,0,0,0|1,0,0]=3 7939 B13R1.528 OC(CF)CNc1ccccc1F 473526551861a04b664748e4cdb27172 [0,2,0,0,0,0|1,0,0]=3 7940 B13R1.528 OC(CF)CNc1ccccc1I f1d130a3b64a0e38e9a1b2d64d557c99 [0,2,0,0,0,0|1,0,0]=3 7941 B13R1.528 OC(CF)CNc1ccccc1S 35aa36a824b450e61bdea3d544355a66 [0,2,0,0,0,0|1,0,0]=3 7942 B13R1.528 OC(CF)CNc1cccnc1Br cd52da6dac360c79ec2ec6a8d746a7fa [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.528 OC(CF)CNc1cccnc1Cl c3c0250d622fd7c8b9ea11fd5cda653d [0,2,0,0,0,0|2,0,0]=4 7944 B13R1.528 OC(CF)CNc1cccnc1F fc3ae0ca0645ecc498655e2e68bd6852 [0,2,0,0,0,0|2,0,0]=4 7945 B13R1.528 OC(CF)CNc1cccnc1I de5ffc3cbb8aab4528d92f33b2174200 [0,2,0,0,0,0|2,0,0]=4 7946 B13R1.528 OC(CF)CNc1ccncc1Br 5b7c0622c8ffcdfec73b3d47b1e0da2d [0,2,0,0,0,0|2,0,0]=4 7947 B13R1.528 OC(CF)CNc1ccncc1Cl 5dbbc81a330dd615a648bd7dea1d72a9 [0,2,0,0,0,0|2,0,0]=4 7948 B13R1.528 OC(CF)CNc1ccncc1F 1ad7ae9846c17e6ddebfc3937e546855 [0,2,0,0,0,0|2,0,0]=4 7949 B13R1.528 OC(CF)CNc1ccncc1I 97fe6361d52c6a2702da23d7e99cf5d4 [0,2,0,0,0,0|2,0,0]=4 7950 B13R1.528 OC(CF)CNc1cnccc1Br aaa0b1d3bef2641b00090a377818476a [0,2,0,0,0,0|2,0,0]=4 7951 B13R1.528 OC(CF)CNc1cnccc1Cl faf3be29adc951e625f5238fa722d464 [0,2,0,0,0,0|2,0,0]=4 7952 B13R1.528 OC(CF)CNc1cnccc1F dd49e7a89c93b402c830d97d1a0dc372 [0,2,0,0,0,0|2,0,0]=4 7953 B13R1.528 OC(CF)CNc1cnccc1I 236b73c990c70862e2631400e754d481 [0,2,0,0,0,0|2,0,0]=4 7954 B13R1.528 OC(CF)CNc1cnccc1S 3db6f91b47939fc5b56d784856fe100a [0,2,0,0,0,0|2,0,0]=4 7955 B13R1.528 OC(CF)CNc1ncccc1Br 5155edee3bb99b42d949333e50667ded [0,2,0,0,0,0|2,0,0]=4 7956 B13R1.528 OC(CF)CNc1ncccc1Cl db2380f1c967e8e24fdc5e69fb85a482 [0,2,0,0,0,0|2,0,0]=4 7957 B13R1.528 OC(CF)CNc1ncccc1F 79ddedeb5d16ef1314d2fa0f06672280 [0,2,0,0,0,0|2,0,0]=4 7958 B13R1.528 OC(CF)CNc1ncccc1I 3e9aa85d4a24b9568f279091cca86294 [0,2,0,0,0,0|2,0,0]=4 7959 B13R1.528 OCC(F)CNc1ccccc1F e83b6cb3995b4dc95a5293f13944911d [0,2,0,0,0,0|2,0,0]=4 7960 B13R1.528 OCC(F)CNc1ccccc1S 252b9ccbe9dff7dc908e62b21245e7a6 [0,2,0,0,0,0|2,0,0]=4 7961 B13R1.528 OCC(O)CNc1ccccc1Cl 470717fbc3e0df0a1eb38b92035f106b [0,2,0,0,0,0|1,0,0]=3 7962 B13R1.528 OCC(O)CNc1ccccc1I 014b673eed915116bf2537262e466dc9 [0,2,0,0,0,0|1,0,0]=3 7963 B13R1.528 OCC(O)CNc1cccnc1Br 6011d6cbf5a3daa2c8a03930019c9341 [0,2,0,0,0,0|2,0,0]=4 7964 B13R1.528 OCC(O)CNc1cccnc1Cl 6e922b88466d080a9bf541be5e743015 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.528 OCC(O)CNc1cccnc1F 4ffbbc25dac90583c07238f9a580881e [0,2,0,0,0,0|2,0,0]=4 7966 B13R1.528 OCC(O)CNc1cccnc1I b7be351f6ac74a7b410a7594ab37bab5 [0,2,0,0,0,0|2,0,0]=4 7967 B13R1.528 OCC(O)CNc1ccncc1Br 65e654da307b71e88826260a4fdc8eab [0,2,0,0,0,0|2,0,0]=4 7968 B13R1.528 OCC(O)CNc1ccncc1Cl 4beec376807a5a952589d2442d98a6ee [0,2,0,0,0,0|2,0,0]=4 7969 B13R1.528 OCC(O)CNc1ccncc1F 152a722b4152d0eb773e96c40c168a3d [0,2,0,0,0,0|2,0,0]=4 7970 B13R1.528 OCC(O)CNc1ccncc1I 936cec382e1673c3e92633854f1e3883 [0,2,0,0,0,0|2,0,0]=4 7971 B13R1.528 OCC(O)CNc1cnccc1Br eca67a39383184d6cac945868154d327 [0,2,0,0,0,0|2,0,0]=4 7972 B13R1.528 OCC(O)CNc1cnccc1Cl 010f87c46b31af72422a2a0186ce2f54 [0,2,0,0,0,0|2,0,0]=4 7973 B13R1.528 OCC(O)CNc1cnccc1F 1ac96da2abef120142efa16d76cc4545 [0,2,0,0,0,0|2,0,0]=4 7974 B13R1.528 OCC(O)CNc1cnccc1I 16d728ed4ec1f7a1c33b60fc524ac957 [0,2,0,0,0,0|2,0,0]=4 7975 B13R1.528 OCC(O)CNc1cnccc1S bb73f71856a6597e365e8dad58b35dc2 [0,2,0,0,0,0|2,0,0]=4 7976 B13R1.528 OCC(O)CNc1ncccc1Br 4c4602edc11f1a38c65d48820a2427b8 [0,2,0,0,0,0|2,0,0]=4 7977 B13R1.528 OCC(O)CNc1ncccc1Cl 9bbf91a4b028b9585087f519df2ebe7b [0,2,0,0,0,0|2,0,0]=4 7978 B13R1.528 OCC(O)CNc1ncccc1F c3cc06a65b8213d5548a3786d148488a [0,2,0,0,0,0|2,0,0]=4 7979 B13R1.528 OCC(O)CNc1ncccc1I 514637d30df4240ea0a335c15c5c1d75 [0,2,0,0,0,0|2,0,0]=4 7980 B13R1.528 OCC(O)COc1ccc[nH]c1=S 14a1a882db3362e3ec9334c335635369 [0,2,0,0,0,0|2,0,0]=4 7981 B13R1.528 OCC(O)COc1ccccc1Br 6ef7e5033cff80c68d63c524bd53fda0 [0,2,0,0,0,0|1,0,0]=3 7982 B13R1.528 OCC(O)COc1ccccc1Cl 82cc401b4c507b2b2d8cfd8413bdc51c [0,2,0,0,0,0|1,0,0]=3 7983 B13R1.528 OCC(O)COc1ccccc1F 23541d7c107cf07f835843637ff5e71f [0,2,0,0,0,0|1,0,0]=3 7984 B13R1.528 OCC(O)COc1ccccc1I e7c9b72593fe3614f98630b113733994 [0,2,0,0,0,0|1,0,0]=3 7985 B13R1.528 OCC(O)COc1ccccc1S fd96e6bec63b474400f78a6b6e767330 [0,2,0,0,0,0|1,0,0]=3 7986 B13R1.528 OCC(O)COc1cccnc1Br 6f9e78356e810efeb91067309fc239d4 [0,2,0,0,0,0|2,0,0]=4 7987 B13R1.528 OCC(O)COc1cccnc1Cl fecc15459d14d2e23531b9c2e8b93142 [0,2,0,0,0,0|2,0,0]=4 7988 B13R1.528 OCC(O)COc1cccnc1F fd097d584f98b1aff28a1a2f25d63a6c [0,2,0,0,0,0|2,0,0]=4 7989 B13R1.528 OCC(O)COc1cccnc1I 0c5406782f9305041580a54c4732ffac [0,2,0,0,0,0|2,0,0]=4 7990 B13R1.528 OCC(O)COc1ccncc1Br 728c7a6218fa59e9909d96e680a7f095 [0,2,0,0,0,0|2,0,0]=4 7991 B13R1.528 OCC(O)COc1ccncc1Cl b9506d0f3684cadc8f1172b4ac129625 [0,2,0,0,0,0|2,0,0]=4 7992 B13R1.528 OCC(O)COc1ccncc1F 3ebdd749831441dd0515e51715297963 [0,2,0,0,0,0|2,0,0]=4 7993 B13R1.528 OCC(O)COc1cnccc1Br a9c642125e3caedca4e0fa2f97ae1d08 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.528 OCC(O)COc1cnccc1Cl a8c1e616342d9dd303a7946054eb718f [0,2,0,0,0,0|2,0,0]=4 7995 B13R1.528 OCC(O)COc1cnccc1F cfba2ec22b881c417fe2860d1469908f [0,2,0,0,0,0|2,0,0]=4 7996 B13R1.528 OCC(O)COc1cnccc1I 208948b5707ef722156797aed43738e5 [0,2,0,0,0,0|2,0,0]=4 7997 B13R1.528 OCC(O)COc1ncccc1Br 2160a8db2b5cedaa8ca8153e23247dd0 [0,2,0,0,0,0|2,0,0]=4 7998 B13R1.528 OCC(O)COc1ncccc1Cl 315996cee090073ae9e42cfb701d7121 [0,2,0,0,0,0|2,0,0]=4 7999 B13R1.528 OCC(O)COc1ncccc1F 006814c9e495209e8fdce80425747c6c [0,2,0,0,0,0|2,0,0]=4 8000 B13R1.528 OCC(O)COn1ccccc1=S 0d951bc57eb4d8c1aa72a8ee1c91688c [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.528 OC[C@@H](F)CNc1ccccc1F 921dbed7ce68d6e086f2800cbe7d7566 [0,2,0,0,0,0|2,0,0]=4 8002 B13R1.528 OC[C@@H](F)CNc1ccccc1S 51e8af027883ab318847f42556f8a663 [0,2,0,0,0,0|2,0,0]=4 8003 B13R1.528 OC[C@@H](O)CNc1ccccc1Cl 4049f12117d1a5a58f1fbfb1fee67923 [0,2,0,0,0,0|1,0,0]=3 8004 B13R1.528 OC[C@@H](O)CNc1ccccc1I 9ec6a8c7b4c478fec88d44138b618585 [0,2,0,0,0,0|1,0,0]=3 8005 B13R1.528 OC[C@@H](O)CNc1cccnc1Br 32d4588aa7417144c8ed6053532145c4 [0,2,0,0,0,0|2,0,0]=4 8006 B13R1.528 OC[C@@H](O)CNc1cccnc1Cl 471c33a541ab4dc9a48d1c823538a24e [0,2,0,0,0,0|2,0,0]=4 8007 B13R1.528 OC[C@@H](O)CNc1cccnc1F 0c9005f3ca7d8f4e403cbb331cdeba6c [0,2,0,0,0,0|2,0,0]=4 8008 B13R1.528 OC[C@@H](O)CNc1cccnc1I f6b207e0ab64f8ae0309c793f63be0c3 [0,2,0,0,0,0|2,0,0]=4 8009 B13R1.528 OC[C@@H](O)CNc1ccncc1Br 13250b286f5e5cbf868a2ceb0df11e34 [0,2,0,0,0,0|2,0,0]=4 8010 B13R1.528 OC[C@@H](O)CNc1ccncc1Cl 68b6a948c64ef65bdfb7b5d446a377ff [0,2,0,0,0,0|2,0,0]=4 8011 B13R1.528 OC[C@@H](O)CNc1ccncc1F 409b595b220dcfec90df80ce6a6c1165 [0,2,0,0,0,0|2,0,0]=4 8012 B13R1.528 OC[C@@H](O)CNc1ccncc1I e8fa70341d8864a5963849e7a0621ff0 [0,2,0,0,0,0|2,0,0]=4 8013 B13R1.528 OC[C@@H](O)CNc1cnccc1Br f48b3a7f8c4609607c32b63e9ae7cbab [0,2,0,0,0,0|2,0,0]=4 8014 B13R1.528 OC[C@@H](O)CNc1cnccc1Cl 3ebf1ff15f3fa2e0d9b57543c3de522b [0,2,0,0,0,0|2,0,0]=4 8015 B13R1.528 OC[C@@H](O)CNc1cnccc1F 0d4bd1174827c7a4b1e66bcb48fa68ed [0,2,0,0,0,0|2,0,0]=4 8016 B13R1.528 OC[C@@H](O)CNc1cnccc1I e12da85aa5420c1ce835effc987b1b01 [0,2,0,0,0,0|2,0,0]=4 8017 B13R1.528 OC[C@@H](O)CNc1cnccc1S 70f508236c55c5c4baf07ff16438e2b6 [0,2,0,0,0,0|2,0,0]=4 8018 B13R1.528 OC[C@@H](O)CNc1ncccc1Br bf3684f6869f562a0dfcb349d976b3d9 [0,2,0,0,0,0|2,0,0]=4 8019 B13R1.528 OC[C@@H](O)CNc1ncccc1Cl dff5f8dfe5432591b560d1e3d42fed89 [0,2,0,0,0,0|2,0,0]=4 8020 B13R1.528 OC[C@@H](O)CNc1ncccc1F 996798d268e5cbc771cea60db03ffda9 [0,2,0,0,0,0|2,0,0]=4 8021 B13R1.528 OC[C@@H](O)CNc1ncccc1I 0bd28ecb4432543c27bbb93b19eeff39 [0,2,0,0,0,0|2,0,0]=4 8022 B13R1.528 OC[C@@H](O)COc1ccc[nH]c1=S 20d29d1f6c6be597c8441c06ed1135d1 [0,2,0,0,0,0|2,0,0]=4 8023 B13R1.528 OC[C@@H](O)COc1ccccc1Br 695ee556e5806f4cd4f1d1771f16b796 [0,2,0,0,0,0|1,0,0]=3 8024 B13R1.528 OC[C@@H](O)COc1ccccc1Cl 90ee25003188b01b225893ff84551c1b [0,2,0,0,0,0|1,0,0]=3 8025 B13R1.528 OC[C@@H](O)COc1ccccc1F d6f8dc9de82109f87efd5d40fac5584b [0,2,0,0,0,0|1,0,0]=3 8026 B13R1.528 OC[C@@H](O)COc1ccccc1S 80388b3321953ace4d465036f4bbf052 [0,2,0,0,0,0|1,0,0]=3 8027 B13R1.528 OC[C@@H](O)COc1cccnc1Br cf3fe8d198dd65751b3c4e290a026d5d [0,2,0,0,0,0|2,0,0]=4 8028 B13R1.528 OC[C@@H](O)COc1cccnc1Cl 0cd6d9419e6327e856872f6fccac6fae [0,2,0,0,0,0|2,0,0]=4 8029 B13R1.528 OC[C@@H](O)COc1cccnc1F 2389fd211f81375b8cc2dcb2dfc59d1e [0,2,0,0,0,0|2,0,0]=4 8030 B13R1.528 OC[C@@H](O)COc1cccnc1I 629ec7b1b98ba4c4a9c97825c27efd45 [0,2,0,0,0,0|2,0,0]=4 8031 B13R1.528 OC[C@@H](O)COc1ccncc1Br 684f4c77a8f64344e9fc7c11357e4ae5 [0,2,0,0,0,0|2,0,0]=4 8032 B13R1.528 OC[C@@H](O)COc1ccncc1Cl 7ba7514ff77c911cd5046cf21f99f9a4 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.528 OC[C@@H](O)COc1ccncc1F e7cce1655188f9f7b843cf09b9ec6e07 [0,2,0,0,0,0|2,0,0]=4 8034 B13R1.528 OC[C@@H](O)COc1cnccc1Br b86d0267d8cb1e68a4b7771110f8c67e [0,2,0,0,0,0|2,0,0]=4 8035 B13R1.528 OC[C@@H](O)COc1cnccc1Cl 73de7cb9851202799859183bcd34f600 [0,2,0,0,0,0|2,0,0]=4 8036 B13R1.528 OC[C@@H](O)COc1cnccc1F 4729df2ab326b325dba794070c5865fb [0,2,0,0,0,0|2,0,0]=4 8037 B13R1.528 OC[C@@H](O)COc1cnccc1I 15fb192d5566f6294aaeb72e00dd2edb [0,2,0,0,0,0|2,0,0]=4 8038 B13R1.528 OC[C@@H](O)COc1ncccc1Br 0c0ccc687052d8b07b0a7abc74f3729e [0,2,0,0,0,0|2,0,0]=4 8039 B13R1.528 OC[C@@H](O)COc1ncccc1Cl d4401387a4125d2d184da2ce7c602008 [0,2,0,0,0,0|2,0,0]=4 8040 B13R1.528 OC[C@@H](O)COc1ncccc1F 10e12dfccd118a1d09ee4ff137cfd551 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.528 OC[C@@H](O)COn1ccccc1=S c5e7737f78c6feceb0e7a4d59e3edd1f [0,2,0,0,0,0|2,0,0]=4 8042 B13R1.528 OC[C@H](F)CNc1ccccc1F 8aca225ba1038ecb1473301e07455b2c [0,2,0,0,0,0|2,0,0]=4 8043 B13R1.528 OC[C@H](F)CNc1ccccc1S 702f4d9d454969be7896bd394ec2377d [0,2,0,0,0,0|2,0,0]=4 8044 B13R1.528 OC[C@H](O)CNc1ccccc1Cl dccef92ad3fff4cf6097bbeed177525c [0,2,0,0,0,0|1,0,0]=3 8045 B13R1.528 OC[C@H](O)CNc1ccccc1I 98d6a585df134aeba434d1b8c27be078 [0,2,0,0,0,0|1,0,0]=3 8046 B13R1.528 OC[C@H](O)CNc1cccnc1Br aa6633b206740640698912201b5b6d85 [0,2,0,0,0,0|2,0,0]=4 8047 B13R1.528 OC[C@H](O)CNc1cccnc1Cl b4ae3c3ef20e000d9457be89dff5efbc [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.528 OC[C@H](O)CNc1cccnc1F 70e7bb6621beeba1719664c3929697be [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.528 OC[C@H](O)CNc1cccnc1I f6225d592d4551b428998f3803dceb86 [0,2,0,0,0,0|2,0,0]=4 8050 B13R1.528 OC[C@H](O)CNc1ccncc1Br 7cbbba721c64acfad4ef799c9086b588 [0,2,0,0,0,0|2,0,0]=4 8051 B13R1.528 OC[C@H](O)CNc1ccncc1Cl b92cc1e0a7a594bae65e8cb4506d0f85 [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.528 OC[C@H](O)CNc1ccncc1F 90a91d27b721c4967432162e3c2788e6 [0,2,0,0,0,0|2,0,0]=4 8053 B13R1.528 OC[C@H](O)CNc1ccncc1I 05d72644e06ab4e4ee9f99001ce12f08 [0,2,0,0,0,0|2,0,0]=4 8054 B13R1.528 OC[C@H](O)CNc1cnccc1Br a8fdab4a97e0c6947996473a1b0ec8d0 [0,2,0,0,0,0|2,0,0]=4 8055 B13R1.528 OC[C@H](O)CNc1cnccc1Cl 77033794c9c2d61dbcb77af048c64bcc [0,2,0,0,0,0|2,0,0]=4 8056 B13R1.528 OC[C@H](O)CNc1cnccc1F 0d74525eb32973c340dc2322d69685af [0,2,0,0,0,0|2,0,0]=4 8057 B13R1.528 OC[C@H](O)CNc1cnccc1I 5e7cd2b4d0467b2f293c1826806fc1e7 [0,2,0,0,0,0|2,0,0]=4 8058 B13R1.528 OC[C@H](O)CNc1cnccc1S 9600be96db8c83db701a5483e9098cde [0,2,0,0,0,0|2,0,0]=4 8059 B13R1.528 OC[C@H](O)CNc1ncccc1Br 9362c2dd574319aba1006d0f10b5197b [0,2,0,0,0,0|2,0,0]=4 8060 B13R1.528 OC[C@H](O)CNc1ncccc1Cl 6fcd653c32c9593e80239d6534002a4b [0,2,0,0,0,0|2,0,0]=4 8061 B13R1.528 OC[C@H](O)CNc1ncccc1F 331daff4447f5ab2a23eb01f2827889f [0,2,0,0,0,0|2,0,0]=4 8062 B13R1.528 OC[C@H](O)CNc1ncccc1I 91e953d2d8e23b7b26a1bf09fa287e4f [0,2,0,0,0,0|2,0,0]=4 8063 B13R1.528 OC[C@H](O)COc1ccc[nH]c1=S 668204d0c2795fecf51976790a90ba13 [0,2,0,0,0,0|2,0,0]=4 8064 B13R1.528 OC[C@H](O)COc1ccccc1Br 58d4777f3b2f70c496ccf7c09527d0df [0,2,0,0,0,0|1,0,0]=3 8065 B13R1.528 OC[C@H](O)COc1ccccc1Cl a05ebd6c1457abd89e3e6a77a06daadb [0,2,0,0,0,0|1,0,0]=3 8066 B13R1.528 OC[C@H](O)COc1ccccc1F 0f3e76075e305f4c16f83dac80f6e671 [0,2,0,0,0,0|1,0,0]=3 8067 B13R1.528 OC[C@H](O)COc1ccccc1S 810a9d8a77da07ca0a251387c6332137 [0,2,0,0,0,0|1,0,0]=3 8068 B13R1.528 OC[C@H](O)COc1cccnc1Br 30902a11a9fbefd34a3666f82b420c85 [0,2,0,0,0,0|2,0,0]=4 8069 B13R1.528 OC[C@H](O)COc1cccnc1Cl fac51aaa5aa9e534a29c8feaf2120423 [0,2,0,0,0,0|2,0,0]=4 8070 B13R1.528 OC[C@H](O)COc1cccnc1F 3a52c02bf2e98ec7cd034e3ef9ed05ae [0,2,0,0,0,0|2,0,0]=4 8071 B13R1.528 OC[C@H](O)COc1cccnc1I 6bdcdf70198bb589e2d4de4ef5874e24 [0,2,0,0,0,0|2,0,0]=4 8072 B13R1.528 OC[C@H](O)COc1ccncc1Br f473b7a1be2d0d9d79037f7e7411d70b [0,2,0,0,0,0|2,0,0]=4 8073 B13R1.528 OC[C@H](O)COc1ccncc1Cl ef610ee5fda07f64bdc67353b27e18c1 [0,2,0,0,0,0|2,0,0]=4 8074 B13R1.528 OC[C@H](O)COc1ccncc1F c34f7d040049855ff625e389b7c1c3a0 [0,2,0,0,0,0|2,0,0]=4 8075 B13R1.528 OC[C@H](O)COc1cnccc1Br 86f69502371f47d72aa13d6e1349cc72 [0,2,0,0,0,0|2,0,0]=4 8076 B13R1.528 OC[C@H](O)COc1cnccc1Cl 792cc6be60e0fc4c2584ff296cc5df3a [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.528 OC[C@H](O)COc1cnccc1F 9cb3ed1eafa6846d2986dc3ac5a60b0d [0,2,0,0,0,0|2,0,0]=4 8078 B13R1.528 OC[C@H](O)COc1cnccc1I cb331462866fd6144ed1f10e726ddb17 [0,2,0,0,0,0|2,0,0]=4 8079 B13R1.528 OC[C@H](O)COc1ncccc1Br fb41c64b1295bb8c2f6400b8355ef014 [0,2,0,0,0,0|2,0,0]=4 8080 B13R1.528 OC[C@H](O)COc1ncccc1Cl ab1927155cf665bb750e74488c768c95 [0,2,0,0,0,0|2,0,0]=4 8081 B13R1.528 OC[C@H](O)COc1ncccc1F e25b9568921b0aa550a87349dc5245ef [0,2,0,0,0,0|2,0,0]=4 8082 B13R1.528 OC[C@H](O)COn1ccccc1=S b9c1070d16fa46e876244123f93d04b1 [0,2,0,0,0,0|2,0,0]=4 8083 B13R1.528 [O-][n+]1ccccc1NCC(O)CF 6298ccd23e91f6131fdcaa86ef81027b [0,2,0,0,0,0|2,0,0]=4 8084 B13R1.528 [O-][n+]1ccccc1NCC(O)CO 6037aa566d07700ee47a647439f08697 [0,2,0,0,0,0|2,0,0]=4 8085 B13R1.528 [O-][n+]1ccccc1NC[C@@H](O)CO 1c9348b574710b901aefbf72dfc1f2b1 [0,2,0,0,0,0|2,0,0]=4 8086 B13R1.528 [O-][n+]1ccccc1NC[C@H](O)CO a2325cf069156f1918b7db342f890e65 [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.528 [O-][n+]1ccccc1OCC(O)CO 1807a18dde5391aa75ea4e27f3084b99 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.528 [O-][n+]1ccccc1OC[C@@H](O)CO 229ef77c5804140623388034be695e29 [0,2,0,0,0,0|2,0,0]=4 8089 B13R1.528 [O-][n+]1ccccc1OC[C@H](O)CO c5f3c1396c202f4071d31a68c986fef1 [0,2,0,0,0,0|2,0,0]=4 8090 B13R1.148 CC(C)C(C)Nc1cccc(c1)Br 443379ab9b23719d88da9092b24983e6 [0,2,0,0,0,0|2,0,0]=4 8091 B13R1.148 CC(C)C(C)Nc1cccc(c1)Cl a53c5fb5431422a3dd1ffda40cb8f8c4 [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.148 CC(C)C(C)Nc1cccc(c1)F 257a0c4746df0caccae34c3868b9a5d8 [0,2,0,0,0,0|2,0,0]=4 8093 B13R1.148 CC(C)C(C)Nc1cccc(c1)I 50754ebbeffb26b7157e103a089bdcac [0,2,0,0,0,0|2,0,0]=4 8094 B13R1.148 CC(C)C(C)Oc1cccc(c1)Br 53c44442b3db8198b784982716a0dbc2 [0,2,0,0,0,0|2,0,0]=4 8095 B13R1.148 CC(C)C(C)Oc1cccc(c1)Cl df1b62a729c4ec168854cbcec2443d89 [0,2,0,0,0,0|2,0,0]=4 8096 B13R1.148 CC(C)C(C)Oc1cccc(c1)F 507258e8a17932a510a04c7ce4fd2114 [0,2,0,0,0,0|2,0,0]=4 8097 B13R1.148 CC(C)C(C)Oc1cccc(c1)I c33e27475d2078aff112710a22c78094 [0,2,0,0,0,0|2,0,0]=4 8098 B13R1.148 CC(C)C(C)Oc1cccc(c1)S 0096642c21534001237509b143e0b6bc [0,2,0,0,0,0|2,0,0]=4 8099 B13R1.148 CC(C)N(C)Cc1cccc(c1)Br debbefc45e68e40068639c66f5205dc5 [0,2,0,0,0,0|2,0,0]=4 8100 B13R1.148 CC(C)N(C)Cc1cccc(c1)Cl 0e95e878f131ac5e9fbbbffcafaf322b [0,2,0,0,0,0|2,0,0]=4 8101 B13R1.148 CC(C)N(C)Cc1cccc(c1)F b841e42f3575ee07821ada5f081c8920 [0,2,0,0,0,0|2,0,0]=4 8102 B13R1.148 CC(C)N(C)Cc1cccc(c1)I 7d89947e803f902e709e4253d1eb11a8 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.148 CC(O)C(=O)Nc1cccc(c1)Cl b8a599d7e85ae770e8a68c5cc267f466 [0,2,0,0,0,0|1,0,1]=4 8104 B13R1.148 CC(O)C(=O)Nc1cccc(c1)F dc25092e9a39e0b7779b25c993c01958 [0,2,0,0,0,0|1,0,1]=4 8105 B13R1.148 CC(O)C(=O)Nc1cccc(c1)I 2cadab360e5a0587bab84f925ad33464 [0,2,0,0,0,0|1,0,1]=4 8106 B13R1.148 CC(O)C(=O)Nc1cccc(c1)O 1672a3cb5c1fd6f5988103c2c8ff8671 [0,2,0,0,0,0|1,0,1]=4 8107 B13R1.148 CC(O)C(=O)Nc1cccc(c1)S eed0f0b7118ae998587adf2851501051 [0,2,0,0,0,0|1,0,1]=4 8108 B13R1.148 CC(O)C(C)Nc1ccnc(c1)F 3b0253215f8c6fec7928730728ed1267 [0,2,0,0,0,0|2,0,0]=4 8109 B13R1.148 CC(O)C(C)Nc1cncc(c1)F 1f066ab4faf2b1c73a8e74492533f749 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)Cl a1c172d5b249e08693f9937a70d3be9c [0,2,0,0,0,0|1,0,1]=4 8111 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)F b7c619e84b9e1675780a298b8d41fdc9 [0,2,0,0,0,0|1,0,1]=4 8112 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)I 86fa3da32338471a87f89c2759cf5662 [0,2,0,0,0,0|1,0,1]=4 8113 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)O d9b9907ebd8011aa16949310c6bb5850 [0,2,0,0,0,0|1,0,1]=4 8114 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(c1)S f24cb12812cf14e0a0cf4d5103e6f95f [0,2,0,0,0,0|1,0,1]=4 8115 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)Cl 1d14607f840016a6fda599f4840ca3ce [0,2,0,0,0,0|1,0,1]=4 8116 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)F 87ca5b83e66be66c5814431db9c9a24e [0,2,0,0,0,0|1,0,1]=4 8117 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)I 73217a41ab06f6c897c9cf55b21b9326 [0,2,0,0,0,0|1,0,1]=4 8118 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)O fe06b4035ea9b3e5a1400d939b1340b2 [0,2,0,0,0,0|1,0,1]=4 8119 B13R1.148 C[C@H](O)C(=O)Nc1cccc(c1)S 2cfe954b80793232c6dfdd8b0ee138fa [0,2,0,0,0,0|1,0,1]=4 8120 B13R1.148 Cc1cccc(c1)CN(C)C(C)C b5aef3e4123f7c1656ef8277925a4ea4 [0,2,0,0,0,0|2,0,0]=4 8121 B13R1.148 Cc1cccc(c1)NC(=O)C(C)O 038a3d3dadc88ac7bec83a68aa0c4f12 [0,2,0,0,0,0|1,0,1]=4 8122 B13R1.148 Cc1cccc(c1)NC(=O)[C@@H](C)O d1a0627226c014014072b20b414b9b38 [0,2,0,0,0,0|1,0,1]=4 8123 B13R1.148 Cc1cccc(c1)NC(=O)[C@H](C)O 2a64a5c2358fa0b341a763f5aee9dab7 [0,2,0,0,0,0|1,0,1]=4 8124 B13R1.148 Cc1cccc(c1)NC(C)C(C)C ed3f6ca4276c968048e6858e5a23f240 [0,2,0,0,0,0|2,0,0]=4 8125 B13R1.148 Cc1cccc(c1)NC(C)C(C)O 49bac36716a9f862369351395f8a974e [0,2,0,0,0,0|1,0,0]=3 8126 B13R1.148 Cc1cccc(c1)N[C@@H](C)C(C)C 78cba32003f391a709408326ce262e9d [0,2,0,0,0,0|2,0,0]=4 8127 B13R1.148 Cc1cccc(c1)N[C@H](C)C(C)C d273a9ca92edcc89d62e70e552ae57ca [0,2,0,0,0,0|2,0,0]=4 8128 B13R1.148 Cc1cccc(c1)OC(C)C(C)C d3b10791f9dce807f1f3cad559da150f [0,2,0,0,0,0|2,0,0]=4 8129 B13R1.148 Cc1cncc(c1)NC(C)C(C)O df903a6d89bf1f078d4011814bd9343e [0,2,0,0,0,0|2,0,0]=4 8130 B13R1.202 CC(C)C(C)Oc1ccccc1Cl f3759f0b6bd602af0a9b924b99a65675 [0,2,0,0,0,0|2,0,0]=4 8131 B13R1.202 CC(C)N(C)Cc1ccccc1Cl d11c011803218077186f7c401f128ecf [0,2,0,0,0,0|2,0,0]=4 8132 B13R1.202 CC(C)N(C)Cc1ccccc1F 8a4f5fe84823160167cf0b96d1ab4f1b [0,2,0,0,0,0|2,0,0]=4 8133 B13R1.202 CC(C)N(C)Cc1ccccc1I 6e786d813a1a56dca2b04b26eccfe47c [0,2,0,0,0,0|2,0,0]=4 8134 B13R1.202 CC(O)C(=O)Nc1ccccc1F 65947b1f55168fb79c11c92e6c120cc7 [0,2,0,0,0,0|1,0,1]=4 8135 B13R1.202 CC(O)C(=O)Nc1ccccc1I 33db6cf569b956b7782eebd7cb4ef990 [0,2,0,0,0,0|1,0,1]=4 8136 B13R1.202 CC(O)C(=O)Nc1ccccc1O 5f62fbbd76cd1e1701dc4e765dd82567 [0,2,0,0,0,0|1,0,1]=4 8137 B13R1.202 CC(O)C(=O)Nc1ccccc1S d6aa2eb8bb92c4d31cc5502359b6c158 [0,2,0,0,0,0|1,0,1]=4 8138 B13R1.202 CC(O)C(C)Nc1c[nH]ccc1=O 94b919c5c08dc5c92f89010ebca4e52f [0,2,0,0,0,0|2,0,0]=4 8139 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1F 361c17a13a80c5cf71607eb24ebb5b20 [0,2,0,0,0,0|1,0,1]=4 8140 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1I d86a6e98ece1b8a643cf549478691d0f [0,2,0,0,0,0|1,0,1]=4 8141 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1O a17454cabe139045785797a6831bed2c [0,2,0,0,0,0|1,0,1]=4 8142 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1S e4bb1ebb404ce68f9e637d0721e475a2 [0,2,0,0,0,0|1,0,1]=4 8143 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1F 9b70c05cd0da5bcefef2f8326c2f92a1 [0,2,0,0,0,0|1,0,1]=4 8144 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1I 5a47713b6392335e6087ce226c44e5b2 [0,2,0,0,0,0|1,0,1]=4 8145 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1O 1cc60c00689bf8d2034fd4068f554621 [0,2,0,0,0,0|1,0,1]=4 8146 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1S 95e5756b0d43e378cdca3909bce8145f [0,2,0,0,0,0|1,0,1]=4 8147 B13R1.202 Cc1ccccc1NC(=O)C(C)O 32715341bfe1717841f4c659188385fc [0,2,0,0,0,0|1,0,1]=4 8148 B13R1.202 Cc1ccccc1NC(=O)[C@@H](C)O 07842f348006d8feb2bb6146d063f2fc [0,2,0,0,0,0|1,0,1]=4 8149 B13R1.202 Cc1ccccc1NC(=O)[C@H](C)O fc5a2f2d3a5d7a66f8d52586e59d3151 [0,2,0,0,0,0|1,0,1]=4 8150 B13R1.353 CC(Nc1ccccc1)C(C)(C)O 096ec81e6573419560ffc13a1b9eb03c [0,2,0,0,0,0|1,0,0]=3 8151 B13R1.353 CC(Nc1ccccn1)C(C)(C)O da9e12794cbe681977114a43fd14e17c [0,2,0,0,0,0|2,0,0]=4 8152 B13R1.353 CC(Nc1cccnc1)C(C)(C)O fc4aa769336bb2b2d6a048321c5a79fe [0,2,0,0,0,0|2,0,0]=4 8153 B13R1.353 CC(Nc1ccncc1)C(C)(C)O 6e43d518ee76bc638f8388b630eefe8a [0,2,0,0,0,0|2,0,0]=4 8154 B13R1.353 CC(Oc1ccccn1)C(C)(C)O 2e0e01e0907c8f4ce78bd79a1b8382a5 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.353 CC(Oc1cccnc1)C(C)(C)O a10da141bd3a95438876fab0edaa467f [0,2,0,0,0,0|2,0,0]=4 8156 B13R1.353 CC(Oc1ccncc1)C(C)(C)O 6aef5ad91a3f097aaac9402a2d520438 [0,2,0,0,0,0|2,0,0]=4 8157 B13R1.353 CN(Cc1ccccc1)C(C)(C)C d124a680226ffd358953359ab3663e79 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.353 C[C@@H](Nc1ccccc1)C(C)(C)O 593d9357b9f32cea4a22ede8ef616527 [0,2,0,0,0,0|1,0,0]=3 8159 B13R1.353 C[C@@H](Nc1cccnc1)C(C)(C)O 5f5cf0b23c22e0f49ee86e6935bf9b4d [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.353 C[C@H](Nc1ccccc1)C(C)(C)O c2f040ddb3f175d44747a2b31bbc36f1 [0,2,0,0,0,0|1,0,0]=3 8161 B13R1.353 C[C@H](Nc1cccnc1)C(C)(C)O cb9eaedf6bc49244226f8c14ed231b06 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.418 CC(C)C(C=O)Nc1ccccc1 d774c4f620449b5df4c6d95d952d43bc [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.418 CC(C)C(CO)Nc1ccccc1 73e463f108ef27cc3e0a59536982a4f6 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.418 CC(C)N(C=O)Cc1ccccc1 59fdda873ca35d91d20a94a609f32c50 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.418 CC(C)[C@@H](CO)Nc1ccccc1 621ea11ca58576862a2584e092331c54 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.418 CC(C)[C@H](CO)Nc1ccccc1 02b885f33a460f2bed1b38bf316a4c7d [0,2,0,0,0,0|2,0,0]=4 8167 B13R1.418 CC(O)C(CO)Nc1ccccc1 1e8f6cb14ca59250c768c5e3d4f668b6 [0,2,0,0,0,0|1,0,0]=3 8168 B13R1.418 CC(O)C(CO)Nc1ccccn1 99d5c8818ac0357c15d00c8ca8b93a55 [0,2,0,0,0,0|2,0,0]=4 8169 B13R1.418 CC(O)C(CO)Nc1cccnc1 4947d0c599107ae37702f1a741ec9731 [0,2,0,0,0,0|2,0,0]=4 8170 B13R1.418 CC(O)C(CO)Nc1ccncc1 8de4e717c3ba36b4f0e2b895e04ea29d [0,2,0,0,0,0|2,0,0]=4 8171 B13R1.418 CCC(Nc1ccccc1)C(C)C a8808ebc56c894f8959c32308259e6bf [0,2,0,0,0,0|2,0,0]=4 8172 B13R1.418 CCN(Cc1ccccc1)C(C)C b439275473bd06a8958da1a10f449f1f [0,2,0,0,0,0|2,0,0]=4 8173 B13R1.418 CC[C@@H](Nc1ccccc1)[C@@H](C)O 624d8b099abf238aa44189d4ae4ade73 [0,2,0,0,0,0|1,0,0]=3 8174 B13R1.418 CC[C@@H](Nc1ccccc1)[C@H](C)O 3a226f44fdf073bf50e1ca90a2c33504 [0,2,0,0,0,0|1,0,0]=3 8175 B13R1.418 CC[C@@H](Nc1cccnc1)[C@@H](C)O 105b098ad6b890b7b1c4a0da3f77588d [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.418 CC[C@@H](Nc1cccnc1)[C@H](C)O aab9bb89e8672903303c4f46fb84997f [0,2,0,0,0,0|2,0,0]=4 8177 B13R1.418 CC[C@@H](Nc1ccncc1)[C@@H](C)O cbbc91204c0c95f9e917b1ab9832a7c5 [0,2,0,0,0,0|2,0,0]=4 8178 B13R1.418 CC[C@@H](Nc1ccncc1)[C@H](C)O f4ada287ee61b007f6f684281bc03079 [0,2,0,0,0,0|2,0,0]=4 8179 B13R1.418 CC[C@H](Nc1ccccc1)[C@@H](C)O 703f4981104daad6436cb566226f9207 [0,2,0,0,0,0|1,0,0]=3 8180 B13R1.418 CC[C@H](Nc1cccnc1)[C@@H](C)O 1a4f66cb7f96d26fe76a11c12756ba44 [0,2,0,0,0,0|2,0,0]=4 8181 B13R1.418 CC[C@H](Nc1ccncc1)[C@@H](C)O 0c48ab1332b829b8f70f639acccfe4a8 [0,2,0,0,0,0|2,0,0]=4 8182 B13R1.418 C[C@@H](O)[C@@H](CO)Nc1ccccc1 adb575db4b41efef86eeb12abd0cd138 [0,2,0,0,0,0|1,0,0]=3 8183 B13R1.418 C[C@@H](O)[C@@H](CO)Nc1ccccn1 ec481341e83d1fdbd42a64e97e3c93a9 [0,2,0,0,0,0|2,0,0]=4 8184 B13R1.418 C[C@@H](O)[C@@H](CO)Nc1cccnc1 58251b1fa77826d760c6106c1738516d [0,2,0,0,0,0|2,0,0]=4 8185 B13R1.418 C[C@@H](O)[C@@H](CO)Nc1ccncc1 3f926cbbc8c9dad7c56daf7f55e06f69 [0,2,0,0,0,0|2,0,0]=4 8186 B13R1.418 C[C@@H](O)[C@H](CO)Nc1ccccc1 9489798745464d825b193d3eb89f7f13 [0,2,0,0,0,0|1,0,0]=3 8187 B13R1.418 C[C@@H](O)[C@H](CO)Nc1ccccn1 b30b9b95a01d462aa80602b29946b528 [0,2,0,0,0,0|2,0,0]=4 8188 B13R1.418 C[C@@H](O)[C@H](CO)Nc1cccnc1 d0866f94f15ae83cd4e7c54679a1fbba [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.418 C[C@@H](O)[C@H](CO)Nc1ccncc1 1e00425c8313b29856338439013c265d [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.418 C[C@H](O)[C@@H](CO)Nc1ccccc1 905fe62deba64c4b99612c20bacc881b [0,2,0,0,0,0|1,0,0]=3 8191 B13R1.418 C[C@H](O)[C@@H](CO)Nc1ccccn1 bfaec894369a2b5214a28398793d2309 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.418 C[C@H](O)[C@@H](CO)Nc1cccnc1 c797fc7db62ba365c463b93279797513 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.418 C[C@H](O)[C@@H](CO)Nc1ccncc1 085529598a4be473fac904ea35cb6e9c [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.418 C[C@H](O)[C@H](CO)Nc1ccccc1 36b07726a774138a212e78077d5bec6f [0,2,0,0,0,0|1,0,0]=3 8195 B13R1.418 C[C@H](O)[C@H](CO)Nc1ccccn1 6d56cbe0b3baf4d76cd088b2d935254e [0,2,0,0,0,0|2,0,0]=4 8196 B13R1.418 C[C@H](O)[C@H](CO)Nc1cccnc1 7528c86847ec10ee91b47fbdaef25bbb [0,2,0,0,0,0|2,0,0]=4 8197 B13R1.418 C[C@H](O)[C@H](CO)Nc1ccncc1 cb96a94a1303b634e014758f78b5f9e5 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.1073 CC(O)C(C)(C)Nc1cccnc1 575ab3edf2c67c968d6547380fce7439 [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.1073 CC(O)C(C)(C)Nc1ccncc1 83db0839e9ddc3deae394fb711325240 [0,2,0,0,0,0|2,0,0]=4 8200 B13R1.147 CC(C)CN(C)c1cccc(c1)Br 9f807973652adab3136855d39b4a8bbf [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.147 CC(C)CN(C)c1cccc(c1)Cl 1e481caa03caf007e62eaa3b066cf7e0 [0,2,0,0,0,0|2,0,0]=4 8202 B13R1.147 CC(C)CN(C)c1cccc(c1)F af0f5460ac49c01d041e903be50e1bd2 [0,2,0,0,0,0|2,0,0]=4 8203 B13R1.147 CC(C)CN(C)c1cccc(c1)I 292a438621817c164c460fb5e715f6d4 [0,2,0,0,0,0|2,0,0]=4 8204 B13R1.147 CC(C)NC(C)c1cccc(c1)F 559ce2185363e9c56bcbd8061880d700 [0,2,0,0,0,0|2,0,0]=4 8205 B13R1.147 CC(C)N[C@@H](C)c1cccc(c1)F cb1b80c79cab88285c1eb460fe33a7bb [0,2,0,0,0,0|2,0,0]=4 8206 B13R1.147 CC(C)N[C@H](C)c1cccc(c1)F 314bb32f53129f2e6878a09e87f16255 [0,2,0,0,0,0|2,0,0]=4 8207 B13R1.147 CC(C)OC(C)c1cccc(c1)Br 332bdeb907d3d4434a845ce974754959 [0,2,0,0,0,0|2,0,0]=4 8208 B13R1.147 CC(C)OC(C)c1cccc(c1)Cl 7c39510b5a63353e14f269f549c7a5fc [0,2,0,0,0,0|2,0,0]=4 8209 B13R1.147 CC(C)OC(C)c1cccc(c1)F 7984c7ae3e4ebc87026c9f140b6914b6 [0,2,0,0,0,0|2,0,0]=4 8210 B13R1.147 CC(C)OC(C)c1cccc(c1)I 6d9edf9183017f722daa3e4a35e39fd0 [0,2,0,0,0,0|2,0,0]=4 8211 B13R1.147 CC(C)O[C@@H](C)c1cccc(c1)Br 5a7e3b09cafa33a2185677ca12d1a4b5 [0,2,0,0,0,0|2,0,0]=4 8212 B13R1.147 CC(C)O[C@@H](C)c1cccc(c1)F 1cbe6cf3ac50a36849f783770eeeee85 [0,2,0,0,0,0|2,0,0]=4 8213 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)Br 4d2c91d50a90eb7424833b9bdd803624 [0,2,0,0,0,0|2,0,0]=4 8214 B13R1.147 CC(C)O[C@H](C)c1cccc(c1)F 20eaf75bee54d97cdb26f57420cb1acf [0,2,0,0,0,0|2,0,0]=4 8215 B13R1.147 CC(O)CN(C)c1cc(ccn1)Br 118bd9a8d40f3dd813d978fe6707b7b9 [0,2,0,0,0,0|2,0,0]=4 8216 B13R1.147 CC(O)CN(C)c1cc(ccn1)Cl 004fda4b6233216dd02b0eb8507296a8 [0,2,0,0,0,0|2,0,0]=4 8217 B13R1.147 CC(O)CN(C)c1cc(ccn1)F f20f9a2bd6d5b597b222971f984403f5 [0,2,0,0,0,0|2,0,0]=4 8218 B13R1.147 CC(O)CN(C)c1cc(ccn1)I 054b923457d50ea00f9d63da55ef1f11 [0,2,0,0,0,0|2,0,0]=4 8219 B13R1.147 CC(O)CN(C)c1cccc(c1)Br 29945bdf4ce32025f8baa98b1655290e [0,2,0,0,0,0|1,0,0]=3 8220 B13R1.147 CC(O)CN(C)c1cccc(c1)Cl 1610ba6826c30c3ed91024c53521c041 [0,2,0,0,0,0|1,0,0]=3 8221 B13R1.147 CC(O)CN(C)c1cccc(c1)F d4019c17c15f06b4a486d0b592d7d471 [0,2,0,0,0,0|1,0,0]=3 8222 B13R1.147 CC(O)CN(C)c1cccc(c1)I 79e6103b268e847c87ecdd9ec32af3cc [0,2,0,0,0,0|1,0,0]=3 8223 B13R1.147 CC(O)CN(C)c1ccnc(c1)Br 6d6a60eb2e4e0d530e6e09c7b839a71b [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.147 CC(O)CN(C)c1ccnc(c1)Cl 1b0fc2365d4cce059349f26f2bc1b521 [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.147 CC(O)CN(C)c1ccnc(c1)F bd07328ada9e8dd4dbf413e7ed306e16 [0,2,0,0,0,0|2,0,0]=4 8226 B13R1.147 CC(O)CN(C)c1cncc(c1)Br f86f558ae1497335d60e10c666212083 [0,2,0,0,0,0|2,0,0]=4 8227 B13R1.147 CC(O)CN(C)c1cncc(c1)F e5eb995e8ef6649b615ad1ef98e6aea7 [0,2,0,0,0,0|2,0,0]=4 8228 B13R1.147 C[C@@H](O)CN(C)c1cc(ccn1)Cl 3bb9f2d26ddaace7b676f4aa22c0dd04 [0,2,0,0,0,0|2,0,0]=4 8229 B13R1.147 C[C@@H](O)CN(C)c1cccc(c1)Br 18f38ca12e89b3a8dde98c912e681cd5 [0,2,0,0,0,0|1,0,0]=3 8230 B13R1.147 C[C@H](O)CN(C)c1cc(ccn1)Br bd56145c771f71bbaafb784455f4ed0e [0,2,0,0,0,0|2,0,0]=4 8231 B13R1.147 C[C@H](O)CN(C)c1cc(ccn1)Cl d226a4e5abdc9eca753ffb4618fda032 [0,2,0,0,0,0|2,0,0]=4 8232 B13R1.147 C[C@H](O)CN(C)c1cc(ccn1)F 2a04dceb1aed9745d709a005df121296 [0,2,0,0,0,0|2,0,0]=4 8233 B13R1.147 C[C@H](O)CN(C)c1cc(ccn1)I b5b10b2338d99280ba17dc51b09d55dc [0,2,0,0,0,0|2,0,0]=4 8234 B13R1.147 C[C@H](O)CN(C)c1cccc(c1)Br b58e0fb3caaadf0a39c0247eabe50759 [0,2,0,0,0,0|1,0,0]=3 8235 B13R1.147 C[C@H](O)CN(C)c1cccc(c1)Cl 27a038aca57c34e61bff190b83a458f4 [0,2,0,0,0,0|1,0,0]=3 8236 B13R1.147 C[C@H](O)CN(C)c1cccc(c1)F 330af348d41192e00e6e9d25c95dde8b [0,2,0,0,0,0|1,0,0]=3 8237 B13R1.147 C[C@H](O)CN(C)c1cccc(c1)I 355a3c4b20a1288bf6c0fffb0e2819cb [0,2,0,0,0,0|1,0,0]=3 8238 B13R1.147 C[C@H](O)CN(C)c1ccnc(c1)Br 5523f1dbc70efd579acb34c982e02767 [0,2,0,0,0,0|2,0,0]=4 8239 B13R1.147 C[C@H](O)CN(C)c1ccnc(c1)Cl 0c97a1061050ee3cde556ab323251368 [0,2,0,0,0,0|2,0,0]=4 8240 B13R1.147 C[C@H](O)CN(C)c1ccnc(c1)F c052ae26d8c1364fadd79a5f3933a9c4 [0,2,0,0,0,0|2,0,0]=4 8241 B13R1.147 C[C@H](O)CN(C)c1cncc(c1)Br a5318d6026e85dba739e98db308222a3 [0,2,0,0,0,0|2,0,0]=4 8242 B13R1.147 C[C@H](O)CN(C)c1cncc(c1)F 6afa028af8d6ef71ef2189a5e635fef9 [0,2,0,0,0,0|2,0,0]=4 8243 B13R1.147 Cc1cccc(c1)C(C)NC(C)C ff6dcd87fc99c5c00e274fb8a879c81a [0,2,0,0,0,0|2,0,0]=4 8244 B13R1.147 Cc1cccc(c1)C(C)OC(C)C 2b69fbbe431b546948df51a768e0ae1d [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.147 Cc1cccc(c1)N(C)CC(C)C d4dbd588139f07eef6b8336e65a3ac03 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.147 Cc1cccc(c1)N(C)CC(C)O 55e7f7d62f4f544a8ae76fc8ac846cba [0,2,0,0,0,0|1,0,0]=3 8247 B13R1.147 Cc1cccc(c1)N(C)C[C@H](C)O 5209b9a5b25ec7be3cb38e8f59a6720d [0,2,0,0,0,0|1,0,0]=3 8248 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C 442a73c4aa9dcc334244d87ccbee83d7 [0,2,0,0,0,0|2,0,0]=4 8249 B13R1.147 Cc1cccc(c1)[C@@H](C)OC(C)C e72448bcc85470c7b21a9cedc5fe76d8 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.147 Cc1cccc(c1)[C@H](C)NC(C)C 48ce3f9429528836a7a00cacc0023402 [0,2,0,0,0,0|2,0,0]=4 8251 B13R1.147 Cc1cccc(c1)[C@H](C)OC(C)C b0fafb5f4483def44dad558254d6e04c [0,2,0,0,0,0|2,0,0]=4 8252 B13R1.147 Cc1ccnc(c1)N(C)CC(C)O f8377213fec93533506cdbc0a75b57cc [0,2,0,0,0,0|2,0,0]=4 8253 B13R1.147 Cc1ccnc(c1)N(C)C[C@H](C)O 23b8041782b9e925d0aa1c735531ffac [0,2,0,0,0,0|2,0,0]=4 8254 B13R1.147 Cc1cncc(c1)N(C)CC(C)O 10f1c783770c284737b1112dce74edc3 [0,2,0,0,0,0|2,0,0]=4 8255 B13R1.147 Cc1cncc(c1)N(C)C[C@H](C)O 34aee4f4c5eacdb17cf9e0447eb35cfc [0,2,0,0,0,0|2,0,0]=4 8256 B13R1.201 CC(C)CN(C)c1ccccc1Cl 74abbe0a0acad17dbd09396e7e19ceff [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.201 CC(C)CN(C)c1ccccc1F 3687a8476ff703c4fa88e25ed1fa9562 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.201 CC(C)NC(C)c1ccccc1F e9be2ce15bb61b4369fd97bbdc603c5d [0,2,0,0,0,0|2,0,0]=4 8259 B13R1.201 CC(C)N[C@@H](C)c1ccccc1F 939b73af8906504a0bb75c07cff6f575 [0,2,0,0,0,0|2,0,0]=4 8260 B13R1.201 CC(C)N[C@H](C)c1ccccc1F bff96412a74a539573fa50d8d293f724 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.201 CC(C)OC(C)c1ccccc1F 01a93f81a9bfe428810362a7b5c540ae [0,2,0,0,0,0|2,0,0]=4 8262 B13R1.201 CC(C)O[C@@H](C)c1ccccc1F 82c652d464d543945db976a5e8c8bd9f [0,2,0,0,0,0|2,0,0]=4 8263 B13R1.201 CC(C)O[C@H](C)c1ccccc1F 41bf74dbf51526865fc8c0abc55f05f2 [0,2,0,0,0,0|2,0,0]=4 8264 B13R1.201 CC(O)CN(C)c1c[nH]ccc1=O 0cdebd498177f2c06ada80b801375ebf [0,2,0,0,0,0|2,0,0]=4 8265 B13R1.201 CC(O)CN(C)c1ccccc1Cl f1025fbb1215b30bb9d7a3d57097dd04 [0,2,0,0,0,0|1,0,0]=3 8266 B13R1.201 CC(O)CN(C)c1ccccc1F 318c47def733d990667ea318a97ed5ac [0,2,0,0,0,0|1,0,0]=3 8267 B13R1.201 CC(O)CN(C)c1cccnc1Br 572ffea54512a48c6f440d13776c8909 [0,2,0,0,0,0|2,0,0]=4 8268 B13R1.201 CC(O)CN(C)c1cccnc1Cl 86e99983d13f5f9233106dfb76797488 [0,2,0,0,0,0|2,0,0]=4 8269 B13R1.201 CC(O)CN(C)c1cccnc1F b5806f134ac5f1b4a9ed537dda2ea505 [0,2,0,0,0,0|2,0,0]=4 8270 B13R1.201 CC(O)CN(C)c1cccnc1S 6bd60a2394891bcebf84dfefdef83cba [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.201 CC(O)CN(C)c1ccncc1Br 53edc82b8e71e468064c4644c452a656 [0,2,0,0,0,0|2,0,0]=4 8272 B13R1.201 CC(O)CN(C)c1ccncc1Cl 9f49b6d61cf8218eb877d4e155ac0da3 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.201 CC(O)CN(C)c1ccncc1F d691db0bb561ddc748a00d9d3d6e8764 [0,2,0,0,0,0|2,0,0]=4 8274 B13R1.201 CC(O)CN(C)c1ccncc1I 66ce36dd581fc7da18632c52da5909d9 [0,2,0,0,0,0|2,0,0]=4 8275 B13R1.201 CC(O)CN(C)c1cnccc1Cl 2a85be84b3ac3c55d0fc742a76066fd4 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.201 CC(O)CN(C)c1cnccc1F a01e0ebddfe4c31bf8746bd97d265ba3 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.201 CC(O)CN(C)c1ncccc1Br b09ece377761da1e2d38f1b7028e1d2c [0,2,0,0,0,0|2,0,0]=4 8278 B13R1.201 CC(O)CN(C)c1ncccc1Cl 59c97c035145a63f7da7b1f3f8f78aa1 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.201 CC(O)CN(C)c1ncccc1F df5559c4d9f5510cef8b166b09647083 [0,2,0,0,0,0|2,0,0]=4 8280 B13R1.201 CC(O)CN(C)c1ncccc1I f56d21237826297f230d7a0ebc7d1e77 [0,2,0,0,0,0|2,0,0]=4 8281 B13R1.201 C[C@@H](O)CN(C)c1ccncc1Br db171054465f8fa5d946f0653208472a [0,2,0,0,0,0|2,0,0]=4 8282 B13R1.201 C[C@H](O)CN(C)c1c[nH]ccc1=O a22ba8cc5d65578fbc00f356cc47bab5 [0,2,0,0,0,0|2,0,0]=4 8283 B13R1.201 C[C@H](O)CN(C)c1ccccc1Cl e45acf882ed116cf1c25560c7dca3426 [0,2,0,0,0,0|1,0,0]=3 8284 B13R1.201 C[C@H](O)CN(C)c1ccccc1F 8eaf441bf2e55def9548397d74f574df [0,2,0,0,0,0|1,0,0]=3 8285 B13R1.201 C[C@H](O)CN(C)c1cccnc1Br a0ada85b5b1ac6699e5c6087bcd0311c [0,2,0,0,0,0|2,0,0]=4 8286 B13R1.201 C[C@H](O)CN(C)c1cccnc1Cl 1d5871cd02f210e384e2ddae5648ff60 [0,2,0,0,0,0|2,0,0]=4 8287 B13R1.201 C[C@H](O)CN(C)c1cccnc1F 645268d39d4734ebb1767e470a6067d7 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.201 C[C@H](O)CN(C)c1cccnc1S e6f7f35023ac1a6f022e5ad212f6f09c [0,2,0,0,0,0|2,0,0]=4 8289 B13R1.201 C[C@H](O)CN(C)c1ccncc1Br 3911ce926dabe8648c084352727d51f4 [0,2,0,0,0,0|2,0,0]=4 8290 B13R1.201 C[C@H](O)CN(C)c1ccncc1Cl d98d112c77b379f8fda49f1c291cd9d4 [0,2,0,0,0,0|2,0,0]=4 8291 B13R1.201 C[C@H](O)CN(C)c1ccncc1F 4ecd0b04aedf5b175c27cf804b6f080f [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.201 C[C@H](O)CN(C)c1ccncc1I e77ccc9350d29bf95493987a75268ba6 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.201 C[C@H](O)CN(C)c1cnccc1Cl 7f8be717fe84ba931ed7af0911241bdb [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.201 C[C@H](O)CN(C)c1cnccc1F ceff2f240cff7b05cdb44d654b818599 [0,2,0,0,0,0|2,0,0]=4 8295 B13R1.201 C[C@H](O)CN(C)c1ncccc1Br 2b88d71f018edc2aeef4d9cae6421ed1 [0,2,0,0,0,0|2,0,0]=4 8296 B13R1.201 C[C@H](O)CN(C)c1ncccc1Cl b9d54c534224e53178c3dc340d018b95 [0,2,0,0,0,0|2,0,0]=4 8297 B13R1.201 C[C@H](O)CN(C)c1ncccc1F 61686dc381eca907c061e4e72b4ec61e [0,2,0,0,0,0|2,0,0]=4 8298 B13R1.201 C[C@H](O)CN(C)c1ncccc1I 27dc65aa4eeccc06bcc7dcd78d7c0b93 [0,2,0,0,0,0|2,0,0]=4 8299 B13R1.201 Cc1ccccc1N(C)CC(C)C 11c43fa9672d98c90ecc73858375df7f [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.201 Cc1ccccc1N(C)CC(C)O 143e449b99576c8a752808344bb97d0f [0,2,0,0,0,0|1,0,0]=3 8301 B13R1.201 Cc1ccccc1N(C)C[C@H](C)O 4c018718f6267e72d65c64ff8a69a381 [0,2,0,0,0,0|1,0,0]=3 8302 B13R1.201 Cc1cccnc1N(C)CC(C)O 224e2d7d423b8f24641b183753c91719 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.201 Cc1cccnc1N(C)C[C@H](C)O 5af918daafdfc559222c5ed3bcf23d23 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.201 Cc1ccncc1N(C)CC(C)O 7ec1fc31ad2c7d210373771eee09739f [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.201 Cc1ccncc1N(C)C[C@H](C)O fa4dcb874d721d18aa5136591fad7dec [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.201 Cc1ncccc1N(C)CC(C)O 9d794308dc0d84daa1cc1097b3a3e0a6 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.201 Cc1ncccc1N(C)C[C@H](C)O fb87832111263b4c869b6cedbb48aee1 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.347 CC(C)OC(C)(C)c1ccccc1 94cbf8f2e43b8565e58e92fee31ab520 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.352 CN(CC(C)(C)C)c1ccccc1 158a23a43b218efa856cd9c3370c68dd [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.352 CN(CC(C)(C)O)c1ccccc1 626016ea8818c1aee915e88bc2fa2b82 [0,2,0,0,0,0|1,0,0]=3 8311 B13R1.352 CN(CC(C)(C)O)c1ccccn1 5063106214a755f8a41c66e5a3c5a2b9 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.352 CN(CC(C)(C)O)c1cccnc1 dbcaad3eff93a9f67e11ce6042c8088c [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.352 CN(CC(C)(C)O)c1ccncc1 7302a7d0666419d69b364e815f61e196 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.713 C#CC(OC(C)C)c1ccccc1 65b6523fa03011b37932b4d97b01b814 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.713 C#C[C@@H](OC(C)C)c1ccccc1 65a79cec3b3d9cd654c66d27198ab0ac [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.713 C#C[C@H](OC(C)C)c1ccccc1 68ef7b637ee397331239e908c82abbac [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.713 C=CC(NC(C)C)c1ccccc1 4cc23dc2e7da913484f162e19ae48649 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.713 C=CC(OC(C)C)c1ccccc1 4857960945659ab57a7f2afd00cc12a0 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.713 C=C[C@@H](NC(C)C)c1ccccc1 5efc10170915f5cc9b25a85efb11b26e [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.713 C=C[C@H](NC(C)C)c1ccccc1 9c66b0bbcae37f3953fc1ce6f11c1566 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.713 CC(C)CN(C#N)c1ccccc1 21cc81bc416b8d280f2df86ec5d99dcd [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.713 CC(C)NC(C#N)c1ccccc1 5c3187272992e3741ac64180825cb3d3 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.713 CC(C)NC(CO)c1ccccc1 f7f0b2064527a352b88d8a117cb50314 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.713 CC(C)N[C@@H](CF)c1ccccc1 21e9a6d22217bdae497e12feb931a1f0 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.713 CC(C)N[C@@H](CO)c1ccccc1 6306fa7625bf427066d2cd4dc06e1279 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.713 CC(C)N[C@H](CO)c1ccccc1 edd9491e52236d9e8897c3cf81ff54e9 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.713 CC(C)OC(C=O)c1ccccc1 355a7c4982edcf5a0ba8a1ae1b147522 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.713 CC(C)OC(CF)c1ccccc1 03ea8247c3bef549e5323aad73c0e9e2 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.713 CC(C)O[C@H](CF)c1ccccc1 43ec51a283e680ab66757e5360eee212 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.713 CC(O)CN(C#N)c1ccccc1 d247fd362522ff07346facfb50b761f4 [0,2,0,0,0,0|1,0,0]=3 8331 B13R1.713 CCC(NC(C)C)c1ccccc1 678ffab07e2c862b09480e42d5c62f0b [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.713 CCC(OC(C)C)c1ccccc1 24bcd37e5706ce8532e06856db5b06fd [0,2,0,0,0,0|2,0,0]=4 8333 B13R1.713 CCN(CC(C)C)c1ccccc1 c56ade63abb7331b2d896446534fb57e [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.713 CCN(CC(C)O)c1ccccc1 1d9245f501f71625a9ad9795c125e9a3 [0,2,0,0,0,0|1,0,0]=3 8335 B13R1.713 CCN(CC(C)O)c1cccnc1 6d8d439f6eade2a6a9524745684e1a6b [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.713 CCN(C[C@@H](C)O)c1ccccc1 4080a72e6f93282859322bd906d63ae9 [0,2,0,0,0,0|1,0,0]=3 8337 B13R1.713 CCN(C[C@H](C)O)c1ccccc1 6e18ada8b2c94c6cca20d2efb6881d62 [0,2,0,0,0,0|1,0,0]=3 8338 B13R1.713 CCN(C[C@H](C)O)c1cccnc1 dea936bc8a327b621740990144b38f8a [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.713 CC[C@@H](NC(C)C)c1ccccc1 9588b9e4a1b27c4e5eca895799854d2b [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.713 CC[C@@H](OC(C)C)c1ccccc1 9f269c7a31a314929ac7b227fcb61d60 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.713 CC[C@H](NC(C)C)c1ccccc1 99c4bf6e064840cc67e52a3c4d7765f0 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.713 CC[C@H](OC(C)C)c1ccccc1 aec7232310e4a007d528dd1069053632 [0,2,0,0,0,0|2,0,0]=4 8343 B13R1.713 C[C@@H](O)CN(C#N)c1ccccc1 36e4ac9d3be32ee89944d97c6f076f2f [0,2,0,0,0,0|1,0,0]=3 8344 B13R1.713 C[C@@H](O)CN(C=O)c1ccccc1 94b821f978f07f83231d214ed7a9ca05 [0,2,0,0,0,0|1,0,0]=3 8345 B13R1.713 C[C@@H](O)CN(CF)c1ccccc1 50faf0be8351fd6f2878de0bb7c1f0af [0,2,0,0,0,0|1,0,0]=3 8346 B13R1.713 C[C@@H](O)CN(CO)c1ccccc1 cc19c051186e24e9909d5f675b72a153 [0,2,0,0,0,0|1,0,0]=3 8347 B13R1.713 C[C@H](O)CN(C#N)c1ccccc1 9472b4ae757751d6b2a091ee4c94bfb8 [0,2,0,0,0,0|1,0,0]=3 8348 B13R1.90 C#Cc1ccccc1COC(C)C 31cf47a1248425b2fd63404c5ccd70bf [0,2,0,0,0,0|2,0,0]=4 8349 B13R1.90 C#Cc1ccccc1NCC(C)C ccc3c1a4b95bfb330395925a83966d00 [0,2,0,0,0,0|2,0,0]=4 8350 B13R1.90 C#Cc1ccccc1NCC(C)O 0dd123371f8fe34927b1056122edebd4 [0,2,0,0,0,0|1,0,0]=3 8351 B13R1.90 C#Cc1ccccc1NC[C@@H](C)O 292749a0922c673707ff568efc729ece [0,2,0,0,0,0|1,0,0]=3 8352 B13R1.90 C#Cc1ccccc1NC[C@H](C)O 35f469636df7b0d91134e632d8765d1e [0,2,0,0,0,0|1,0,0]=3 8353 B13R1.90 C#Cc1ccccc1OCC(C)C 65726852dbded74532c46c6c659a5217 [0,2,0,0,0,0|2,0,0]=4 8354 B13R1.90 C#Cc1cccnc1NCC(C)O 277ef54f457a6780c1e34e2a7bae309f [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.90 C#Cc1cccnc1NC[C@@H](C)O a7496456c2f559401479aba2a37a7184 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.90 C#Cc1cccnc1NC[C@H](C)O 57d0ccd49a0275f1beec5b67db54156b [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.90 C#Cc1ccncc1NCC(C)O 92b83c24952c962a4299a2f3a2bf1876 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.90 C#Cc1ccncc1NC[C@H](C)O b9079a215c3158b45e81cb58f2374c34 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.90 C#Cc1cnccc1NCC(C)O 828e26659f8fa877e693fc9ffc60b0d8 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.90 C#Cc1cnccc1NC[C@@H](C)O 93394b7c4a39c51cf933337ba791ba6f [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.90 C#Cc1cnccc1NC[C@H](C)O f83a969b0d9cbc469f074b1a3d9c35cd [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.90 C#Cc1ncccc1NCC(C)O c4aacb158e49fe3e887b6bfc13596372 [0,2,0,0,0,0|2,0,0]=4 8363 B13R1.90 C#Cc1ncccc1NC[C@@H](C)O 88bc57fc150a8c7eaf2c9496feed2822 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.90 C#Cc1ncccc1NC[C@H](C)O 933fd6affa47c869f126f9227c72b02d [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.90 C=Cc1ccccc1COC(C)C fb5eab44688bbc5cbbd1d10faac8c82a [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.90 C=Cc1ccccc1NCC(C)C 7a8680ddff711dab237ee06044518b4f [0,2,0,0,0,0|2,0,0]=4 8367 B13R1.90 C=Cc1ccccc1NCC(C)O 5fc9c5244fad1aee57a024accd93f6c4 [0,2,0,0,0,0|1,0,0]=3 8368 B13R1.90 C=Cc1ccccc1NC[C@@H](C)O 51b48cb02fa11759e2cb3f3773d84bdb [0,2,0,0,0,0|1,0,0]=3 8369 B13R1.90 C=Cc1ccccc1NC[C@H](C)O e0bfa950b6f5b34d29fc6538dba5be34 [0,2,0,0,0,0|1,0,0]=3 8370 B13R1.90 C=Cc1ccccc1OCC(C)C b873301f18488a40d1fea067228b3ae1 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.90 C=Cc1cccnc1NCC(C)O 2f159254f79f58149bb262c2bf03d504 [0,2,0,0,0,0|2,0,0]=4 8372 B13R1.90 C=Cc1cccnc1NC[C@@H](C)O fab3d4e754a717222d37120ed966853d [0,2,0,0,0,0|2,0,0]=4 8373 B13R1.90 C=Cc1cccnc1NC[C@H](C)O 601bb43f9de9621ed71892dcf2f43d34 [0,2,0,0,0,0|2,0,0]=4 8374 B13R1.90 C=Cc1ncccc1NCC(C)O 1a62ec7bcecd4a6395d8e0c5cfc94fd1 [0,2,0,0,0,0|2,0,0]=4 8375 B13R1.90 C=Cc1ncccc1NC[C@@H](C)O 4a895f8a3b814c632850e942a7dad631 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.90 C=Cc1ncccc1NC[C@H](C)O 828d9703116618e45bfb519f00ff8ed8 [0,2,0,0,0,0|2,0,0]=4 8377 B13R1.90 CC(C)CNc1ccccc1C#N f042f6e1d899aa1c11cafabc04126438 [0,2,0,0,0,0|2,0,0]=4 8378 B13R1.90 CC(C)CNc1ccccc1C=O a1ae07533a45393d3b2ac04e8148364a [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.90 CC(C)CNc1ccccc1CBr 51df1cfcbe86d17970b20ced79ab1a70 [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.90 CC(C)CNc1ccccc1CO 4124157cae1b69af9e762a88d46a991e [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.90 CC(C)CNc1ccccc1CS 2acb033740ac342362004f2822131565 [0,2,0,0,0,0|2,0,0]=4 8382 B13R1.90 CC(C)COc1ccccc1C#N fd3b7e19a472c072b04fee8182509442 [0,2,0,0,0,0|2,0,0]=4 8383 B13R1.90 CC(C)COc1ccccc1C=O 3fab6c19e533333a1cf358d140cf8c65 [0,2,0,0,0,0|2,0,0]=4 8384 B13R1.90 CC(C)NCc1ccccc1C#N 0b0bc50c48a179ef236bd4a1ce83bc19 [0,2,0,0,0,0|2,0,0]=4 8385 B13R1.90 CC(C)NCc1ccccc1CO 031ac33de2e9f4fd78186013912119d4 [0,2,0,0,0,0|2,0,0]=4 8386 B13R1.90 CC(C)OCc1ccccc1C#N 79a5df37b2bb62a9fd1773cc0cefe444 [0,2,0,0,0,0|2,0,0]=4 8387 B13R1.90 CC(C)OCc1ccccc1C=O f47ba4e86a22532ba53a9029d0ba3ccc [0,2,0,0,0,0|2,0,0]=4 8388 B13R1.90 CC(O)CNc1ccccc1C#N c8734e07e351a97dda6feeed4da86a27 [0,2,0,0,0,0|1,0,0]=3 8389 B13R1.90 CC(O)CNc1ccccc1C=O b61002d948855c7db3d46235400ea46e [0,2,0,0,0,0|1,0,0]=3 8390 B13R1.90 CC(O)CNc1ccccc1CBr c82145e4127739c1099432f08447960e [0,2,0,0,0,0|1,0,0]=3 8391 B13R1.90 CC(O)CNc1ccccc1CO 00011f8b59562ccd8a77484eca197bd8 [0,2,0,0,0,0|1,0,0]=3 8392 B13R1.90 CC(O)CNc1ccccc1CS cec7a3943a223b92b85d94f1cd7dcde0 [0,2,0,0,0,0|1,0,0]=3 8393 B13R1.90 CC(O)CNc1cccnc1C#N b1878d3b050d65bf8e825c3f1eb4678a [0,2,0,0,0,0|2,0,0]=4 8394 B13R1.90 CC(O)CNc1cccnc1C=O 182d5bdc5b0e9e7c643cbfd1fa171796 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.90 CC(O)CNc1cccnc1CCl dce44bab695306822c3b274d6c3abf52 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.90 CC(O)CNc1cccnc1CO 0e11367901865b9a80356136bd894a98 [0,2,0,0,0,0|2,0,0]=4 8397 B13R1.90 CC(O)CNc1ccncc1C#N 3193d987d81adce24ace04cddb819b85 [0,2,0,0,0,0|2,0,0]=4 8398 B13R1.90 CC(O)CNc1ccncc1C=O 0c7a3271023317363b61eb2a6f3d12f7 [0,2,0,0,0,0|2,0,0]=4 8399 B13R1.90 CC(O)CNc1ccncc1CO 316d6e4931fc00e2889bf49f4b8154a9 [0,2,0,0,0,0|2,0,0]=4 8400 B13R1.90 CC(O)CNc1cnccc1C#N 6ad87c6d0ebd916333d5c392021152f9 [0,2,0,0,0,0|2,0,0]=4 8401 B13R1.90 CC(O)CNc1cnccc1C=O bcba2b44cc6e59aeb1bac7a80adab2d1 [0,2,0,0,0,0|2,0,0]=4 8402 B13R1.90 CC(O)CNc1cnccc1CO 65204691395cb83bd5761a1a11281822 [0,2,0,0,0,0|2,0,0]=4 8403 B13R1.90 CC(O)CNc1ncccc1C#N 328cdd4cdfb5db89cfbb06fe481ef348 [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.90 CC(O)CNc1ncccc1C=O 6a51d6d982b200b1c887741eac32f815 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.90 CC(O)CNc1ncccc1CCl 0cf974916cd5150d661ce47cd08c8f41 [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.90 CC(O)CNc1ncccc1CO 8f1b084cfb0ecbdcc1f3e608c65c52c3 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.90 CCc1ccccc1CNC(C)C d2bf086db39c8d6620b2242a6119745d [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.90 CCc1ccccc1COC(C)C 6b6e93e97204e3985b095ff90b673a88 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.90 CCc1ccccc1NCC(C)C cf88788a1dfa934b9665b297cdd8a180 [0,2,0,0,0,0|2,0,0]=4 8410 B13R1.90 CCc1ccccc1NCC(C)O 90cefcc0eea43a6491e3ed64f2bc3e09 [0,2,0,0,0,0|1,0,0]=3 8411 B13R1.90 CCc1ccccc1NC[C@H](C)O 479f07ac28387f2f0b10b5b7ae25c1ab [0,2,0,0,0,0|1,0,0]=3 8412 B13R1.90 CCc1ccccc1OCC(C)C 9fd0b448948f4adaf5efd2182f70343f [0,2,0,0,0,0|2,0,0]=4 8413 B13R1.90 CCc1cccnc1NCC(C)O db0c47f781d808c5d13789f01ab2faca [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.90 CCc1cccnc1NC[C@@H](C)O e296efa58bae5b69e1437f91fce19de7 [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.90 CCc1cccnc1NC[C@H](C)O 008bd45f1d0434de3ddea1c6d24c300b [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.90 CCc1ncccc1NCC(C)O 95c74e7cc6b78b1a4886b29d243dba8d [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.90 CCc1ncccc1NC[C@H](C)O 56075858ff5264fa941705bfe5d637b3 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.90 COc1ccccc1CNC(C)C 7b7b89b0bbc62ba09af0936401851130 [0,2,0,0,0,0|2,0,0]=4 8419 B13R1.90 COc1ccccc1COC(C)C 97d13b07fb0ffbae08e578d60e7276cb [0,2,0,0,0,0|2,0,0]=4 8420 B13R1.90 COc1ccccc1NCC(C)C 1157829daed01080001162c4383aaeb1 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.90 COc1ccccc1NCC(C)O e31a6126e9f7b655a881dd4d56034dd9 [0,2,0,0,0,0|1,0,0]=3 8422 B13R1.90 COc1ccccc1NC[C@H](C)O b721d1fdc7e5699c861f59f2f185e984 [0,2,0,0,0,0|1,0,0]=3 8423 B13R1.90 COc1ccccc1OCC(C)C f0d602b68716fd0f4261654c1a79a13c [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.90 COc1cccnc1NCC(C)O d27777ee459de6acde86cfb00cc6cebb [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.90 COc1cccnc1NC[C@H](C)O b4b5e69473b1225d56ffe0ff7c7eab1e [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.90 COc1ccncc1NCC(C)O 45888bde4c75264de1f2629b383eab0c [0,2,0,0,0,0|2,0,0]=4 8427 B13R1.90 COc1ccncc1NC[C@H](C)O ea79698c6d408edb0a131cd00a19e5f3 [0,2,0,0,0,0|2,0,0]=4 8428 B13R1.90 COc1cnccc1NCC(C)O 8b784f6007e1b2ab479093356fb35bf0 [0,2,0,0,0,0|2,0,0]=4 8429 B13R1.90 COc1cnccc1NC[C@@H](C)O 3f2313ce62e3d0563ffa9d6259a3465a [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.90 COc1cnccc1NC[C@H](C)O 8052cb7df6eb683f7050972c80eb9ce8 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.90 COc1ncccc1NCC(C)O 053f0704dac057b1648843ee14c5b6bc [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.90 COc1ncccc1NC[C@H](C)O 9ff0e502958a7e744b9a7a8b1e40271f [0,2,0,0,0,0|2,0,0]=4 8433 B13R1.90 CSc1ccccc1CNC(C)C af1a799bfc39f96f73fcad25017bf85f [0,2,0,0,0,0|2,0,0]=4 8434 B13R1.90 CSc1ccccc1COC(C)C 33d20618ab6f37457a43326698481f5a [0,2,0,0,0,0|2,0,0]=4 8435 B13R1.90 CSc1ccccc1NCC(C)C 4723c1469774ecc94918d2e2a9b7767c [0,2,0,0,0,0|2,0,0]=4 8436 B13R1.90 CSc1ccccc1NCC(C)O 72cc4d746cbd174254870183bbea11c6 [0,2,0,0,0,0|1,0,0]=3 8437 B13R1.90 CSc1ccccc1NC[C@H](C)O 7b21b660f44a1cb63c9cff2b92da9745 [0,2,0,0,0,0|1,0,0]=3 8438 B13R1.90 CSc1ccccc1OCC(C)C 47fd6b92d26ec28ed4be1ee5f8defda9 [0,2,0,0,0,0|2,0,0]=4 8439 B13R1.90 CSc1cccnc1NCC(C)O 132ea7fc578c64b8c5d24bb1ea1fd7cf [0,2,0,0,0,0|2,0,0]=4 8440 B13R1.90 CSc1cccnc1NC[C@H](C)O 899c5a2ec6f0e1aaaecc48b3509347cb [0,2,0,0,0,0|2,0,0]=4 8441 B13R1.90 CSc1cnccc1NCC(C)O a17c2600577e2d1232b957d167ec5948 [0,2,0,0,0,0|2,0,0]=4 8442 B13R1.90 CSc1cnccc1NC[C@@H](C)O 0cab8e1d5213784c3394de89f72aacba [0,2,0,0,0,0|2,0,0]=4 8443 B13R1.90 CSc1cnccc1NC[C@H](C)O 7ddfaf3bdf03910724ebe37ef80325a9 [0,2,0,0,0,0|2,0,0]=4 8444 B13R1.90 C[C@@H](O)CNc1ccccc1C#N 85c56150ca7ecd788870d39844ee8772 [0,2,0,0,0,0|1,0,0]=3 8445 B13R1.90 C[C@@H](O)CNc1ccccc1C=O 9589d09ed3812203c6b917c33744dbf8 [0,2,0,0,0,0|1,0,0]=3 8446 B13R1.90 C[C@@H](O)CNc1ccccc1CO 8ecf1d29ea727e5b1f0121bc766b3e67 [0,2,0,0,0,0|1,0,0]=3 8447 B13R1.90 C[C@@H](O)CNc1ccccc1CS b5226cbd49cc484a3e1bec2bfd9bab8e [0,2,0,0,0,0|1,0,0]=3 8448 B13R1.90 C[C@@H](O)CNc1cccnc1C=O b8028766869e2f7c4e18d422dd125d43 [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.90 C[C@@H](O)CNc1cccnc1CCl 6b75d65bb4e921852f1397e56bc5a537 [0,2,0,0,0,0|2,0,0]=4 8450 B13R1.90 C[C@@H](O)CNc1cccnc1CO 4ac051399e3d67fe7222b4e74fcf9751 [0,2,0,0,0,0|2,0,0]=4 8451 B13R1.90 C[C@@H](O)CNc1ccncc1C#N 8e656829041990d1a04126543ef6d7a7 [0,2,0,0,0,0|2,0,0]=4 8452 B13R1.90 C[C@@H](O)CNc1ccncc1C=O 5cdc7ea4454d511f79fc0174bba12210 [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.90 C[C@@H](O)CNc1ccncc1CO 72db084f4817b41d9be2355e8211045d [0,2,0,0,0,0|2,0,0]=4 8454 B13R1.90 C[C@@H](O)CNc1cnccc1C=O 0e57a499f65d675921f33cae23d13b83 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.90 C[C@@H](O)CNc1cnccc1CO e09d8d56fbd626ff2ffdeddaa4d5c582 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.90 C[C@@H](O)CNc1ncccc1C=O 2c8379e07f96f548824ac6f221ab094a [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.90 C[C@@H](O)CNc1ncccc1CCl 1de7f82a181f2cbc008fbbf3b666e54b [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.90 C[C@@H](O)CNc1ncccc1CO d093f0496869d086c09e84d1aab0c6e0 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.90 C[C@H](O)CNc1ccccc1C#N 96800d554671c1323dcce997b7db07ee [0,2,0,0,0,0|1,0,0]=3 8460 B13R1.90 C[C@H](O)CNc1ccccc1C=O fc8ceb0e1952b177c58ad16681bc2bee [0,2,0,0,0,0|1,0,0]=3 8461 B13R1.90 C[C@H](O)CNc1ccccc1CBr 8969fd3043634171d3497814b626193c [0,2,0,0,0,0|1,0,0]=3 8462 B13R1.90 C[C@H](O)CNc1ccccc1CO 228c81eb76e34a71951fdb878aed483b [0,2,0,0,0,0|1,0,0]=3 8463 B13R1.90 C[C@H](O)CNc1ccccc1CS 8be50c347adff6075c8e46d61363a64d [0,2,0,0,0,0|1,0,0]=3 8464 B13R1.90 C[C@H](O)CNc1cccnc1C#N b7edad5f9ebecc2f441e1894be28b059 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.90 C[C@H](O)CNc1cccnc1C=O e5000d4437c58a19523bdcd8d048c41c [0,2,0,0,0,0|2,0,0]=4 8466 B13R1.90 C[C@H](O)CNc1cccnc1CCl a4a7766902fb433d1118b3f6b829e9dd [0,2,0,0,0,0|2,0,0]=4 8467 B13R1.90 C[C@H](O)CNc1cccnc1CO 7187dc775a478c6af886c38af607d1d7 [0,2,0,0,0,0|2,0,0]=4 8468 B13R1.90 C[C@H](O)CNc1ccncc1C#N d0455ce667ecde7259ea0f35b165c4ef [0,2,0,0,0,0|2,0,0]=4 8469 B13R1.90 C[C@H](O)CNc1ccncc1C=O 7e5e0ac8f5344253ef63b04161b81c45 [0,2,0,0,0,0|2,0,0]=4 8470 B13R1.90 C[C@H](O)CNc1ccncc1CO ce369b52e324b27addd9fafb9eaecad0 [0,2,0,0,0,0|2,0,0]=4 8471 B13R1.90 C[C@H](O)CNc1cnccc1C#N a2fdad5bd87325c2d3d2431fda0d3919 [0,2,0,0,0,0|2,0,0]=4 8472 B13R1.90 C[C@H](O)CNc1cnccc1C=O f575fe79579c0724ff050edc355607a6 [0,2,0,0,0,0|2,0,0]=4 8473 B13R1.90 C[C@H](O)CNc1cnccc1CO 142a92abc29ea43f67c6af028a70ed61 [0,2,0,0,0,0|2,0,0]=4 8474 B13R1.90 C[C@H](O)CNc1ncccc1C#N d56f502c362783952a9ecbe1939025f4 [0,2,0,0,0,0|2,0,0]=4 8475 B13R1.90 C[C@H](O)CNc1ncccc1C=O 6ba5770e42d415b0b2a9d77f6c9ad22f [0,2,0,0,0,0|2,0,0]=4 8476 B13R1.90 C[C@H](O)CNc1ncccc1CCl 8710382adb03f220690f494d8a18fd02 [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.90 C[C@H](O)CNc1ncccc1CO 5475e06010530da89f8cc4ea9a936d4c [0,2,0,0,0,0|2,0,0]=4 8478 B13R1.150 CC(C)CNc1cccc(c1Br)Br 624ed407bfe99c7b5343dd372ee33cc1 [0,2,0,0,0,0|2,0,0]=4 8479 B13R1.150 CC(C)CNc1cccc(c1Br)Cl 28c8257a29ef5de0848eebf07d4a8f6d [0,2,0,0,0,0|2,0,0]=4 8480 B13R1.150 CC(C)CNc1cccc(c1Br)F 9234ff4e838ae489499868af1efacf04 [0,2,0,0,0,0|2,0,0]=4 8481 B13R1.150 CC(C)CNc1cccc(c1Br)I 88ae23ba559dcdee96f015fb3fdf7046 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.150 CC(C)CNc1cccc(c1Cl)Br 528c8bd74615723bd056e62c695a00fd [0,2,0,0,0,0|2,0,0]=4 8483 B13R1.150 CC(C)CNc1cccc(c1Cl)Cl 7fc7dffe1eeab09f2eeba6b91234eda3 [0,2,0,0,0,0|2,0,0]=4 8484 B13R1.150 CC(C)CNc1cccc(c1Cl)F aef53b36521ad52e99cff637d352fb2e [0,2,0,0,0,0|2,0,0]=4 8485 B13R1.150 CC(C)CNc1cccc(c1Cl)I 7b33efb9ed3d16713b2c32e53e85ca99 [0,2,0,0,0,0|2,0,0]=4 8486 B13R1.150 CC(C)CNc1cccc(c1Cl)S 905a45b1ca62e66ccc48128b46a91bb5 [0,2,0,0,0,0|2,0,0]=4 8487 B13R1.150 CC(C)CNc1cccc(c1F)Cl 447145a6e10c46a60a1c2ae0c8bba6fd [0,2,0,0,0,0|2,0,0]=4 8488 B13R1.150 CC(C)CNc1cccc(c1F)F 0fbf2abdc69b5b08a2448bf1378012de [0,2,0,0,0,0|2,0,0]=4 8489 B13R1.150 CC(C)CNc1cccc(c1F)I b3f2a84fd2481fd4b07e4e5fd37a89f0 [0,2,0,0,0,0|2,0,0]=4 8490 B13R1.150 CC(C)CNc1cccc(c1I)Cl f2b1adc4d956eca08c5967720d052423 [0,2,0,0,0,0|2,0,0]=4 8491 B13R1.150 CC(C)CNc1cccc(c1I)F 46495027d0ddfac375d5496392bbc41d [0,2,0,0,0,0|2,0,0]=4 8492 B13R1.150 CC(C)COc1cccc(c1Br)Br dbf563656b392c1ff8df98c56a95ec94 [0,2,0,0,0,0|2,0,0]=4 8493 B13R1.150 CC(C)COc1cccc(c1Br)Cl fdd3c2a58e4821bd59d5fbbd53fe3312 [0,2,0,0,0,0|2,0,0]=4 8494 B13R1.150 CC(C)COc1cccc(c1Br)F 51dde5d047aae21c9e8b968758ecab22 [0,2,0,0,0,0|2,0,0]=4 8495 B13R1.150 CC(C)COc1cccc(c1Br)I 422e3fb569ee0e968067aa71bb7d5d90 [0,2,0,0,0,0|2,0,0]=4 8496 B13R1.150 CC(C)COc1cccc(c1Cl)Br 5c05d15d10a8b95b6fba54964ef68e26 [0,2,0,0,0,0|2,0,0]=4 8497 B13R1.150 CC(C)COc1cccc(c1Cl)Cl 870b15dd95664731b78cb05cb4b228bd [0,2,0,0,0,0|2,0,0]=4 8498 B13R1.150 CC(C)COc1cccc(c1Cl)F 4c09fb8b73e2f79d2974a3612efbaf04 [0,2,0,0,0,0|2,0,0]=4 8499 B13R1.150 CC(C)COc1cccc(c1Cl)I b0079077a9a20de39dc522218ae22d77 [0,2,0,0,0,0|2,0,0]=4 8500 B13R1.150 CC(C)COc1cccc(c1F)Cl 913d39d18ffa1e8f2d720b14628810a7 [0,2,0,0,0,0|2,0,0]=4 8501 B13R1.150 CC(C)COc1cccc(c1F)F 2f2718dd9c34bb11178cb80eb00872f1 [0,2,0,0,0,0|2,0,0]=4 8502 B13R1.150 CC(C)COc1cccc(c1F)I e16749c5d4628e4e9591ba433b64cd09 [0,2,0,0,0,0|2,0,0]=4 8503 B13R1.150 CC(C)COc1cccc(c1I)Br 5a2527bf5cce7b661e24113e9f75e338 [0,2,0,0,0,0|2,0,0]=4 8504 B13R1.150 CC(C)COc1cccc(c1I)Cl 9ff5089776c2378735ad8fe72cd3101f [0,2,0,0,0,0|2,0,0]=4 8505 B13R1.150 CC(C)COc1cccc(c1I)F f9325c7c9a4f6ffa494a7111ea78b2b1 [0,2,0,0,0,0|2,0,0]=4 8506 B13R1.150 CC(C)NCc1cccc(c1Br)F 2b9b031b79365e3c9d86972536773c30 [0,2,0,0,0,0|2,0,0]=4 8507 B13R1.150 CC(C)NCc1cccc(c1Br)I 2f213fcbe69adc3d3939004614a4af00 [0,2,0,0,0,0|2,0,0]=4 8508 B13R1.150 CC(C)NCc1cccc(c1Cl)Cl dfefd8a03da6fc2f08610bd2ec0a2f4f [0,2,0,0,0,0|2,0,0]=4 8509 B13R1.150 CC(C)NCc1cccc(c1Cl)F fe664731ea404b0c19d29e63580f8f24 [0,2,0,0,0,0|2,0,0]=4 8510 B13R1.150 CC(C)NCc1cccc(c1Cl)I 2006909fcf46cc2ce244b3ccfab71a19 [0,2,0,0,0,0|2,0,0]=4 8511 B13R1.150 CC(C)NCc1cccc(c1F)Br 435dd13442c52283a93f5a3000513322 [0,2,0,0,0,0|2,0,0]=4 8512 B13R1.150 CC(C)NCc1cccc(c1F)Cl 24d55c02a83221f53a6c57ee395423fc [0,2,0,0,0,0|2,0,0]=4 8513 B13R1.150 CC(C)NCc1cccc(c1F)F 4a07ec803ac12c235aad65e0ee2fbb87 [0,2,0,0,0,0|2,0,0]=4 8514 B13R1.150 CC(C)OCc1cccc(c1Br)Br c3414bfa8955228816488d41f1ff4d52 [0,2,0,0,0,0|2,0,0]=4 8515 B13R1.150 CC(C)OCc1cccc(c1Br)Cl c8a8dada82c4686d35f12a94a589446d [0,2,0,0,0,0|2,0,0]=4 8516 B13R1.150 CC(C)OCc1cccc(c1Br)F 76c074a477f9a12e13ccfd3ec4dac65b [0,2,0,0,0,0|2,0,0]=4 8517 B13R1.150 CC(C)OCc1cccc(c1Br)I 170e97f1c25408c720e84b41848bb711 [0,2,0,0,0,0|2,0,0]=4 8518 B13R1.150 CC(C)OCc1cccc(c1Cl)Br 7496f31b4208e65329153676d2e33102 [0,2,0,0,0,0|2,0,0]=4 8519 B13R1.150 CC(C)OCc1cccc(c1Cl)Cl 85d20886e05646ea8c571d190345e9f3 [0,2,0,0,0,0|2,0,0]=4 8520 B13R1.150 CC(C)OCc1cccc(c1Cl)F 5d79ae73899dbcd7df55974a4496c508 [0,2,0,0,0,0|2,0,0]=4 8521 B13R1.150 CC(C)OCc1cccc(c1Cl)I 7d098ff60ac0153213d94fb0e32a8f52 [0,2,0,0,0,0|2,0,0]=4 8522 B13R1.150 CC(C)OCc1cccc(c1F)Br 735a5287844109324bf84690d3681438 [0,2,0,0,0,0|2,0,0]=4 8523 B13R1.150 CC(C)OCc1cccc(c1F)Cl e6e2b800f41c0696e87d419d78e5a1f5 [0,2,0,0,0,0|2,0,0]=4 8524 B13R1.150 CC(C)OCc1cccc(c1F)F a6674b21e7423f2e39aa8012a9108517 [0,2,0,0,0,0|2,0,0]=4 8525 B13R1.150 CC(C)OCc1cccc(c1F)I 855749041890fd3db08fe1b421a55f25 [0,2,0,0,0,0|2,0,0]=4 8526 B13R1.150 CC(C)OCc1cccc(c1I)Br 0ba7b239b9aca5487e11ce2863189080 [0,2,0,0,0,0|2,0,0]=4 8527 B13R1.150 CC(C)OCc1cccc(c1I)F af17a0fcea1d23622a7691490f37fc6b [0,2,0,0,0,0|2,0,0]=4 8528 B13R1.150 CC(O)CNc1cc[nH]c(=O)c1I 868a47733bd137314c9c3064c29cf890 [0,2,0,0,0,0|2,0,0]=4 8529 B13R1.150 CC(O)CNc1cccc(=O)n1C b7f4bf71c5f1f7e9852bfa66eff9bcbc [0,2,0,0,0,0|2,0,0]=4 8530 B13R1.150 CC(O)CNc1cccc(c1Br)Br 99e60c330b187aba420cb9915a27b62c [0,2,0,0,0,0|1,0,0]=3 8531 B13R1.150 CC(O)CNc1cccc(c1Br)Cl b18c97a73833de8a1da84072ca0322bb [0,2,0,0,0,0|1,0,0]=3 8532 B13R1.150 CC(O)CNc1cccc(c1Br)F f318ca08d9fba22f803e3ebd238e9d48 [0,2,0,0,0,0|1,0,0]=3 8533 B13R1.150 CC(O)CNc1cccc(c1Br)I 0e1ef63e9258f85a445771991a93ef78 [0,2,0,0,0,0|1,0,0]=3 8534 B13R1.150 CC(O)CNc1cccc(c1Cl)Br 2aeda9350e326d08f5e60d3ebc303530 [0,2,0,0,0,0|1,0,0]=3 8535 B13R1.150 CC(O)CNc1cccc(c1Cl)Cl b7bd98373913e39fa24dd2d302718e76 [0,2,0,0,0,0|1,0,0]=3 8536 B13R1.150 CC(O)CNc1cccc(c1Cl)F 646a03d137dc670ae8e1b10d9884e31c [0,2,0,0,0,0|1,0,0]=3 8537 B13R1.150 CC(O)CNc1cccc(c1Cl)I 4b1a16ec565924ba75372501399b82c0 [0,2,0,0,0,0|1,0,0]=3 8538 B13R1.150 CC(O)CNc1cccc(c1F)Cl e712450da2876d8cf7b8f9ccc7075280 [0,2,0,0,0,0|1,0,0]=3 8539 B13R1.150 CC(O)CNc1cccc(c1F)F cbcbad4183a7357b2974cdfd15717805 [0,2,0,0,0,0|1,0,0]=3 8540 B13R1.150 CC(O)CNc1cccc(c1F)I 27b14617158807af6080ca8650b1b6bc [0,2,0,0,0,0|1,0,0]=3 8541 B13R1.150 CC(O)CNc1cccc(c1I)Cl 8884eb2afdf6a3c8c85122dc5c457791 [0,2,0,0,0,0|1,0,0]=3 8542 B13R1.150 CC(O)CNc1cccc(c1I)F c6d607d831356f9a7e02f8c680f4c620 [0,2,0,0,0,0|1,0,0]=3 8543 B13R1.150 CC(O)CNc1cccn(c1=O)C a28f7163f0f315cc766a2622724a31f6 [0,2,0,0,0,0|2,0,0]=4 8544 B13R1.150 CC(O)CNc1ccnc(c1Br)Cl d2b605fc841fed687d0d037685701818 [0,2,0,0,0,0|2,0,0]=4 8545 B13R1.150 CC(O)CNc1ccnc(c1Br)F 40b2291845d9cded46fc1b4ee3269a70 [0,2,0,0,0,0|2,0,0]=4 8546 B13R1.150 CC(O)CNc1ccnc(c1Cl)Br 3fae54b457f41d2064d1e76221a8c07c [0,2,0,0,0,0|2,0,0]=4 8547 B13R1.150 CC(O)CNc1ccnc(c1Cl)Cl 84a44326801ca209b4bdb9eabbdf5976 [0,2,0,0,0,0|2,0,0]=4 8548 B13R1.150 CC(O)CNc1ccnc(c1F)Br dbef3f7d207aef12d2cb057b9decb1ef [0,2,0,0,0,0|2,0,0]=4 8549 B13R1.150 CC(O)CNc1ccnc(c1F)Cl 2c2e9efaa0158df1c6d87237bdf37c24 [0,2,0,0,0,0|2,0,0]=4 8550 B13R1.150 CC(O)CNc1ccnc(c1F)F ca1348fe9e9d923c6619123de0464b95 [0,2,0,0,0,0|2,0,0]=4 8551 B13R1.150 CC(O)CNc1ccnc(c1I)Br d4e418fdafa2931c7651442e447283eb [0,2,0,0,0,0|2,0,0]=4 8552 B13R1.150 CC(O)CNc1ccnc(c1I)Cl ad3ba5fb610b35e056fe0cbccdc0a0ea [0,2,0,0,0,0|2,0,0]=4 8553 B13R1.150 CC(O)CNc1ccnc(c1I)F 47148fdb95f84643549c745dba7eacec [0,2,0,0,0,0|2,0,0]=4 8554 B13R1.150 CC(O)CNc1ccnc(c1N)N 7b44c1dbe8ab7503477b47d6338688fd [0,2,0,0,0,0|2,0,0]=4 8555 B13R1.150 CC(O)CNc1cncc(c1Br)Cl e129d801825c4abf9a427cddce3895ab [0,2,0,0,0,0|2,0,0]=4 8556 B13R1.150 CC(O)CNc1cncc(c1Cl)Br bba1ab3f666af158064c1a035f801b21 [0,2,0,0,0,0|2,0,0]=4 8557 B13R1.150 CC(O)CNc1cncc(c1Cl)Cl 92acb12d14f799a4d75eb9c56de26a08 [0,2,0,0,0,0|2,0,0]=4 8558 B13R1.150 CC(O)CNc1cncc(c1Cl)F a99fa9f10618ad9a50fa39cc496bc3cc [0,2,0,0,0,0|2,0,0]=4 8559 B13R1.150 CC(O)CNc1cncc(c1F)Cl 9e681d3e95265b1fe86f98343d38f3c3 [0,2,0,0,0,0|2,0,0]=4 8560 B13R1.150 CC(O)CNc1cncc(c1I)Br d02e68f091076435b950230c115cbf82 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.150 CC(O)CNc1cncc(c1I)Cl f9aa7a3de9fa2aad131ddb3f07bd8789 [0,2,0,0,0,0|2,0,0]=4 8562 B13R1.150 CC(O)CNc1cncc(c1I)F b206263d00ddccb2a9947ff6885b6dc9 [0,2,0,0,0,0|2,0,0]=4 8563 B13R1.150 CC(O)CNc1cncc(c1N)N 1d50c95356b3c0b6db22ef9a5ec3b75d [0,2,0,0,0,0|2,0,0]=4 8564 B13R1.150 CC(O)CNc1nccc(c1Br)Br 54dea6a2c82388103f51bc2ab6890cbc [0,2,0,0,0,0|2,0,0]=4 8565 B13R1.150 CC(O)CNc1nccc(c1Br)Cl 817a1b42fe234006488a5989210106f0 [0,2,0,0,0,0|2,0,0]=4 8566 B13R1.150 CC(O)CNc1nccc(c1Br)F 79679f4b3664867b1b65293fb1afa0ec [0,2,0,0,0,0|2,0,0]=4 8567 B13R1.150 CC(O)CNc1nccc(c1Cl)Br a54babbed32d2de39456f118b744421f [0,2,0,0,0,0|2,0,0]=4 8568 B13R1.150 CC(O)CNc1nccc(c1Cl)Cl b45fdf2b6503a6a5645b6b933a6d8821 [0,2,0,0,0,0|2,0,0]=4 8569 B13R1.150 CC(O)CNc1nccc(c1Cl)I 3d9056eb51e99d3af2ec8ae1345678e4 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.150 CC(O)CNc1nccc(c1Cl)S 0a1c896c3e0c44e62078206b2921566f [0,2,0,0,0,0|2,0,0]=4 8571 B13R1.150 CC(O)CNc1nccc(c1F)Br 8856aad53675576426a17d90c14b640c [0,2,0,0,0,0|2,0,0]=4 8572 B13R1.150 CC(O)CNc1nccc(c1F)Cl 45d3eb478811eea42fe49b3b5a22758b [0,2,0,0,0,0|2,0,0]=4 8573 B13R1.150 CC(O)CNc1nccc(c1F)F 9344e0252d13290b036066cdb465e299 [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.150 CC(O)CNc1nccc(c1F)I eaf3de22e2f5bff73e4f8ef4ed74c71f [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.150 CC(O)CNc1nccc(c1I)Br 5f7b7784edb75de3363dda899419e35f [0,2,0,0,0,0|2,0,0]=4 8576 B13R1.150 CC(O)CNc1nccc(c1I)Cl e42ee3625f0592d6d7fa908568c157b0 [0,2,0,0,0,0|2,0,0]=4 8577 B13R1.150 CC(O)CNc1nccc(c1N)N 3be537348893ff2fcc8c5b880a684b79 [0,2,0,0,0,0|2,0,0]=4 8578 B13R1.150 C[C@@H](O)CNc1cccc(c1Br)Cl f730c9900ad303b3b379f70222975483 [0,2,0,0,0,0|1,0,0]=3 8579 B13R1.150 C[C@@H](O)CNc1cccn(c1=O)C ca2fc974f1af73727122b49dcf31c871 [0,2,0,0,0,0|2,0,0]=4 8580 B13R1.150 C[C@@H](O)CNc1ccnc(c1Br)Cl 3745588ce6d16718b3f18d98b85526e2 [0,2,0,0,0,0|2,0,0]=4 8581 B13R1.150 C[C@@H](O)CNc1ccnc(c1Br)F f86125e2d019a641fffbc78bb7bff528 [0,2,0,0,0,0|2,0,0]=4 8582 B13R1.150 C[C@@H](O)CNc1ccnc(c1Cl)Br 3e7445543d898607034dffa37f8efa22 [0,2,0,0,0,0|2,0,0]=4 8583 B13R1.150 C[C@@H](O)CNc1ccnc(c1Cl)Cl cd1900402609cb8e31e11122d4d3d39f [0,2,0,0,0,0|2,0,0]=4 8584 B13R1.150 C[C@@H](O)CNc1ccnc(c1F)Br 48428eba0a13b3832dbec0a918ff932d [0,2,0,0,0,0|2,0,0]=4 8585 B13R1.150 C[C@@H](O)CNc1ccnc(c1F)Cl cc17e96cff45b261122a4e1e17ae09f5 [0,2,0,0,0,0|2,0,0]=4 8586 B13R1.150 C[C@@H](O)CNc1ccnc(c1F)F 7e0b3ccd2e94fb9371b891c95eb9af75 [0,2,0,0,0,0|2,0,0]=4 8587 B13R1.150 C[C@@H](O)CNc1ccnc(c1I)Br c2a59a94124736a321a8fa3c11d4590d [0,2,0,0,0,0|2,0,0]=4 8588 B13R1.150 C[C@@H](O)CNc1ccnc(c1I)Cl cfd565d446e24182816daf9f0641941e [0,2,0,0,0,0|2,0,0]=4 8589 B13R1.150 C[C@@H](O)CNc1ccnc(c1I)F 66b8b774639d7a352395def3544d862e [0,2,0,0,0,0|2,0,0]=4 8590 B13R1.150 C[C@@H](O)CNc1ccnc(c1N)N 596c805a0a5671c3bfecec90572dca24 [0,2,0,0,0,0|2,0,0]=4 8591 B13R1.150 C[C@@H](O)CNc1cncc(c1Br)Cl 6f1abf7db729d872b353a9948f0ad185 [0,2,0,0,0,0|2,0,0]=4 8592 B13R1.150 C[C@@H](O)CNc1cncc(c1Cl)Br 6b2dc81f2332c228d4447e7e48e556d6 [0,2,0,0,0,0|2,0,0]=4 8593 B13R1.150 C[C@@H](O)CNc1cncc(c1Cl)Cl 3049a5af409c848eac1f0f4442cef086 [0,2,0,0,0,0|2,0,0]=4 8594 B13R1.150 C[C@@H](O)CNc1cncc(c1Cl)F 908d942bff87f6a27ee857d14dcfd895 [0,2,0,0,0,0|2,0,0]=4 8595 B13R1.150 C[C@@H](O)CNc1cncc(c1F)Cl 6399acc04ee3fc2a8b4671ab6796d4db [0,2,0,0,0,0|2,0,0]=4 8596 B13R1.150 C[C@@H](O)CNc1cncc(c1I)Cl d21ef0673ffe7d5fa9194322c100bae1 [0,2,0,0,0,0|2,0,0]=4 8597 B13R1.150 C[C@@H](O)CNc1cncc(c1I)F 82f7e178115ad3b543495f391785ac35 [0,2,0,0,0,0|2,0,0]=4 8598 B13R1.150 C[C@@H](O)CNc1cncc(c1N)N a3558984335ce24e1578ede9bf63b45a [0,2,0,0,0,0|2,0,0]=4 8599 B13R1.150 C[C@@H](O)CNc1nccc(c1Br)Cl 42305b6eca6ba1a23d66d993f4c1328b [0,2,0,0,0,0|2,0,0]=4 8600 B13R1.150 C[C@@H](O)CNc1nccc(c1Br)F 3edfe185f5c6b2f64ad00f7de32be181 [0,2,0,0,0,0|2,0,0]=4 8601 B13R1.150 C[C@@H](O)CNc1nccc(c1Cl)Cl b65ab74947e5da4961f47f50ddb3c245 [0,2,0,0,0,0|2,0,0]=4 8602 B13R1.150 C[C@@H](O)CNc1nccc(c1F)Cl 5ae8928b44c6fa18c1494630ba1f96a4 [0,2,0,0,0,0|2,0,0]=4 8603 B13R1.150 C[C@@H](O)CNc1nccc(c1F)F 996348d17395479f685a21759a36e358 [0,2,0,0,0,0|2,0,0]=4 8604 B13R1.150 C[C@@H](O)CNc1nccc(c1F)I eb88e9a83a3329b0d7e454d77c5eeabb [0,2,0,0,0,0|2,0,0]=4 8605 B13R1.150 C[C@@H](O)CNc1nccc(c1I)Cl da9119f78639e7e822b679bc04e761e7 [0,2,0,0,0,0|2,0,0]=4 8606 B13R1.150 C[C@@H](O)CNc1nccc(c1N)N 8129351542017245ad6346a9d82554fe [0,2,0,0,0,0|2,0,0]=4 8607 B13R1.150 C[C@H](O)CNc1cc[nH]c(=O)c1I be95f3fcb4e2b766700a108ee070dd89 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.150 C[C@H](O)CNc1cccc(=O)n1C d07fd3373a3b89b3af44acefe305934d [0,2,0,0,0,0|2,0,0]=4 8609 B13R1.150 C[C@H](O)CNc1cccc(c1Br)Br 8d4bfe01e54fb55e7d5ead3bd1ab67f4 [0,2,0,0,0,0|1,0,0]=3 8610 B13R1.150 C[C@H](O)CNc1cccc(c1Br)Cl 3d5a3e693b78b3d133a38e10ddfa493c [0,2,0,0,0,0|1,0,0]=3 8611 B13R1.150 C[C@H](O)CNc1cccc(c1Br)F fea906ee05bb8a0e232575debdbf6296 [0,2,0,0,0,0|1,0,0]=3 8612 B13R1.150 C[C@H](O)CNc1cccc(c1Br)I ce21dec4306076093e43befaefd8c325 [0,2,0,0,0,0|1,0,0]=3 8613 B13R1.150 C[C@H](O)CNc1cccc(c1Cl)Br b449d4ec1635dba30f4b9f0de01a3e64 [0,2,0,0,0,0|1,0,0]=3 8614 B13R1.150 C[C@H](O)CNc1cccc(c1Cl)Cl 7909a8fcc219c0518d2446c2f81dabd1 [0,2,0,0,0,0|1,0,0]=3 8615 B13R1.150 C[C@H](O)CNc1cccc(c1Cl)F 101fa10db4f4675f24ab2371831f5c22 [0,2,0,0,0,0|1,0,0]=3 8616 B13R1.150 C[C@H](O)CNc1cccc(c1Cl)I a294c9098fa4100c05d1684cf69e8583 [0,2,0,0,0,0|1,0,0]=3 8617 B13R1.150 C[C@H](O)CNc1cccc(c1F)Cl f6f400d408a0cc44ad875d5e988390ed [0,2,0,0,0,0|1,0,0]=3 8618 B13R1.150 C[C@H](O)CNc1cccc(c1F)F 8f547d91ccac1d78b1e3abc0f65a91c6 [0,2,0,0,0,0|1,0,0]=3 8619 B13R1.150 C[C@H](O)CNc1cccc(c1F)I e98dae85a125a222083dc806a7dbb10c [0,2,0,0,0,0|1,0,0]=3 8620 B13R1.150 C[C@H](O)CNc1cccc(c1I)Cl 64d65becad25db141709c33b43624976 [0,2,0,0,0,0|1,0,0]=3 8621 B13R1.150 C[C@H](O)CNc1cccc(c1I)F 561104ca884fa4716593f2953c718e2a [0,2,0,0,0,0|1,0,0]=3 8622 B13R1.150 C[C@H](O)CNc1cccn(c1=O)C dba929dc0d003837888b5288d73d92e1 [0,2,0,0,0,0|2,0,0]=4 8623 B13R1.150 C[C@H](O)CNc1ccnc(c1Br)Cl 3f6fb26b433e0663104a31c5299445b7 [0,2,0,0,0,0|2,0,0]=4 8624 B13R1.150 C[C@H](O)CNc1ccnc(c1Br)F c9fc72fbb36f9282dbe90b48ea310e41 [0,2,0,0,0,0|2,0,0]=4 8625 B13R1.150 C[C@H](O)CNc1ccnc(c1Cl)Br d7e56b071cc3d41045ab5a4e54250544 [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.150 C[C@H](O)CNc1ccnc(c1Cl)Cl e076b4fb065266cb260098047950aae7 [0,2,0,0,0,0|2,0,0]=4 8627 B13R1.150 C[C@H](O)CNc1ccnc(c1F)Br 9974e281741ed5142df1e196f2c54b35 [0,2,0,0,0,0|2,0,0]=4 8628 B13R1.150 C[C@H](O)CNc1ccnc(c1F)Cl 41ed8acec1ec3e9c92e75a30e2f90912 [0,2,0,0,0,0|2,0,0]=4 8629 B13R1.150 C[C@H](O)CNc1ccnc(c1F)F 6f86df274f79cf6e015e9b01294e2a00 [0,2,0,0,0,0|2,0,0]=4 8630 B13R1.150 C[C@H](O)CNc1ccnc(c1I)Br 022243978ef7a1e5bbdabbe4c923ac38 [0,2,0,0,0,0|2,0,0]=4 8631 B13R1.150 C[C@H](O)CNc1ccnc(c1I)Cl 886508549a477cd2f0e4fab0ead86cff [0,2,0,0,0,0|2,0,0]=4 8632 B13R1.150 C[C@H](O)CNc1ccnc(c1I)F 49ff964692963037a5f844a5b07ac0d7 [0,2,0,0,0,0|2,0,0]=4 8633 B13R1.150 C[C@H](O)CNc1ccnc(c1N)N 76ebd2d7cd7f1e064cb17ae97d5f9ecc [0,2,0,0,0,0|2,0,0]=4 8634 B13R1.150 C[C@H](O)CNc1cncc(c1Br)Cl 5dbe737ee6673c79d1ea0fc3c3e9b71d [0,2,0,0,0,0|2,0,0]=4 8635 B13R1.150 C[C@H](O)CNc1cncc(c1Cl)Br d6637ee0a79d89c4ed18c75062545b6a [0,2,0,0,0,0|2,0,0]=4 8636 B13R1.150 C[C@H](O)CNc1cncc(c1Cl)Cl b0a9a927e9cc4a8582e6e77af8b359f8 [0,2,0,0,0,0|2,0,0]=4 8637 B13R1.150 C[C@H](O)CNc1cncc(c1Cl)F b68622a504ad490c2d09fef7f2e7215c [0,2,0,0,0,0|2,0,0]=4 8638 B13R1.150 C[C@H](O)CNc1cncc(c1F)Cl e0476c7be8bda06a3e06659d802d8cc4 [0,2,0,0,0,0|2,0,0]=4 8639 B13R1.150 C[C@H](O)CNc1cncc(c1I)Br 11c7a7ec924b1d53dce7c567b0d8f257 [0,2,0,0,0,0|2,0,0]=4 8640 B13R1.150 C[C@H](O)CNc1cncc(c1I)Cl d411b1e9d14e1f38d00cf1dbd735ea55 [0,2,0,0,0,0|2,0,0]=4 8641 B13R1.150 C[C@H](O)CNc1cncc(c1I)F 798d8d5938ff4d12336dcb7dd3a73b7c [0,2,0,0,0,0|2,0,0]=4 8642 B13R1.150 C[C@H](O)CNc1cncc(c1N)N bf21dcc4014fdb6d458c796a75af4c1f [0,2,0,0,0,0|2,0,0]=4 8643 B13R1.150 C[C@H](O)CNc1nccc(c1Br)Br 852aa99428d80cf5ac0088fe19a18552 [0,2,0,0,0,0|2,0,0]=4 8644 B13R1.150 C[C@H](O)CNc1nccc(c1Br)Cl e52614d6a0bf643f9d818f7f89033c5c [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.150 C[C@H](O)CNc1nccc(c1Br)F 07e42dd23e74f7bfb69d23168ca3b2f9 [0,2,0,0,0,0|2,0,0]=4 8646 B13R1.150 C[C@H](O)CNc1nccc(c1Cl)Br 30a75f0b0a8858e6b1a8b1fde540afe7 [0,2,0,0,0,0|2,0,0]=4 8647 B13R1.150 C[C@H](O)CNc1nccc(c1Cl)Cl 2065e5c666315c57e590e3aaf30363fc [0,2,0,0,0,0|2,0,0]=4 8648 B13R1.150 C[C@H](O)CNc1nccc(c1Cl)I 7861d9161396acb93f2e538b05a3ae39 [0,2,0,0,0,0|2,0,0]=4 8649 B13R1.150 C[C@H](O)CNc1nccc(c1Cl)S 3f89e59f8886fa7d178cd50ac8f96a7e [0,2,0,0,0,0|2,0,0]=4 8650 B13R1.150 C[C@H](O)CNc1nccc(c1F)Br 0132e1d17878fd6250ef32f07d743f7d [0,2,0,0,0,0|2,0,0]=4 8651 B13R1.150 C[C@H](O)CNc1nccc(c1F)Cl bce0986ee6d19aa1d8c1c91062e323a5 [0,2,0,0,0,0|2,0,0]=4 8652 B13R1.150 C[C@H](O)CNc1nccc(c1F)F 7332537cb42613127130054373e66b8d [0,2,0,0,0,0|2,0,0]=4 8653 B13R1.150 C[C@H](O)CNc1nccc(c1F)I bfeb535f24b2daa0838b574c1a7ae4ba [0,2,0,0,0,0|2,0,0]=4 8654 B13R1.150 C[C@H](O)CNc1nccc(c1I)Br 07c4c07c6030c82c61aa27342c502c38 [0,2,0,0,0,0|2,0,0]=4 8655 B13R1.150 C[C@H](O)CNc1nccc(c1I)Cl 7c317002ca09ee79932a1a179c80f382 [0,2,0,0,0,0|2,0,0]=4 8656 B13R1.150 C[C@H](O)CNc1nccc(c1N)N ca6fe663a3782a489a269502034dcd99 [0,2,0,0,0,0|2,0,0]=4 8657 B13R1.150 Cc1c(cccc1CNC(C)C)Cl 786270622675cdef0f97cd6dccb4b180 [0,2,0,0,0,0|2,0,0]=4 8658 B13R1.150 Cc1c(cccc1CNC(C)C)F b0a76c40b41e8a65c41bf64f00ae1348 [0,2,0,0,0,0|2,0,0]=4 8659 B13R1.150 Cc1c(cccc1COC(C)C)Br d2a9d9a728c3a1e50f9cb64c4b3ae6df [0,2,0,0,0,0|2,0,0]=4 8660 B13R1.150 Cc1c(cccc1COC(C)C)Cl 50e3aff03af3244dfbb46eb1095e6226 [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.150 Cc1c(cccc1COC(C)C)F 1ee68dab7e56b2037e4282fc06ddbaad [0,2,0,0,0,0|2,0,0]=4 8662 B13R1.150 Cc1c(cccc1COC(C)C)I ce41c6e21ae79f69735ed1d94d978d66 [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.150 Cc1c(cccc1NCC(C)C)Br 79ec19690ca90c28bb3bb08c8093f072 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.150 Cc1c(cccc1NCC(C)C)Cl a4e530ebffea93163395cda500757dda [0,2,0,0,0,0|2,0,0]=4 8665 B13R1.150 Cc1c(cccc1NCC(C)C)F 4d1ca0915a94e6b4624837e0ad24bee0 [0,2,0,0,0,0|2,0,0]=4 8666 B13R1.150 Cc1c(cccc1NCC(C)C)I 18423dbcd382016031f34c59bb10e61f [0,2,0,0,0,0|2,0,0]=4 8667 B13R1.150 Cc1c(cccc1NCC(C)O)Br 4a77dd4268934490aa3ce4cd81e6372c [0,2,0,0,0,0|1,0,0]=3 8668 B13R1.150 Cc1c(cccc1NCC(C)O)Cl 0691f7eb8f0b597c634590fa9ffbfb83 [0,2,0,0,0,0|1,0,0]=3 8669 B13R1.150 Cc1c(cccc1NCC(C)O)F 33a48c25a1454dc7793525ece5e1afa8 [0,2,0,0,0,0|1,0,0]=3 8670 B13R1.150 Cc1c(cccc1NCC(C)O)I e4852c9466b19b767c31b58b63497595 [0,2,0,0,0,0|1,0,0]=3 8671 B13R1.150 Cc1c(cccc1NC[C@H](C)O)Br a2d9677ae03d950a15b249ecdafd7e94 [0,2,0,0,0,0|1,0,0]=3 8672 B13R1.150 Cc1c(cccc1NC[C@H](C)O)Cl a3e7da402759b094468adfd91fc357f0 [0,2,0,0,0,0|1,0,0]=3 8673 B13R1.150 Cc1c(cccc1NC[C@H](C)O)F b9623835b19f14b2c04624906db3f5d9 [0,2,0,0,0,0|1,0,0]=3 8674 B13R1.150 Cc1c(cccc1NC[C@H](C)O)I b47c20714b201edadcf64d3b9054b824 [0,2,0,0,0,0|1,0,0]=3 8675 B13R1.150 Cc1c(cccc1OCC(C)C)Br 4f9469078a733b9fd3110ba57fd6c6b7 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.150 Cc1c(cccc1OCC(C)C)Cl 300a11279a3e9010eb939960e880f87b [0,2,0,0,0,0|2,0,0]=4 8677 B13R1.150 Cc1c(cccc1OCC(C)C)F c189289438dc4096865a1fdaa4373cc2 [0,2,0,0,0,0|2,0,0]=4 8678 B13R1.150 Cc1c(cccc1OCC(C)C)I 1063476a0de2484c91c91abd7ea0e23e [0,2,0,0,0,0|2,0,0]=4 8679 B13R1.150 Cc1c(ccnc1Br)NCC(C)O e5a28f37f498ec41110326d0f35a5546 [0,2,0,0,0,0|2,0,0]=4 8680 B13R1.150 Cc1c(ccnc1Br)NC[C@@H](C)O bb0bc8fa5924684d8ea72ad8c962db4d [0,2,0,0,0,0|2,0,0]=4 8681 B13R1.150 Cc1c(ccnc1Br)NC[C@H](C)O 2be348d59645c1b378a8b142081c3e03 [0,2,0,0,0,0|2,0,0]=4 8682 B13R1.150 Cc1c(ccnc1Cl)NCC(C)O 4ce3a5d2fa2a7af2d795b17aa93fe36d [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.150 Cc1c(ccnc1Cl)NC[C@@H](C)O 5088353b8b497f39c3a0a28a269a8496 [0,2,0,0,0,0|2,0,0]=4 8684 B13R1.150 Cc1c(ccnc1Cl)NC[C@H](C)O 758219f6b8d76333ed7f0b3fa79637fb [0,2,0,0,0,0|2,0,0]=4 8685 B13R1.150 Cc1c(ccnc1F)NCC(C)O 321118e4e8d44f4e7b5d4d555b002fcf [0,2,0,0,0,0|2,0,0]=4 8686 B13R1.150 Cc1c(ccnc1F)NC[C@@H](C)O 314fafe9053b58783313eac9af1211c5 [0,2,0,0,0,0|2,0,0]=4 8687 B13R1.150 Cc1c(ccnc1F)NC[C@H](C)O 58f6c4d3affbd6961d23cd5dcf2b3294 [0,2,0,0,0,0|2,0,0]=4 8688 B13R1.150 Cc1c(ccnc1NCC(C)O)Br f5e9f871f71ac7b78f29fa6cc520d072 [0,2,0,0,0,0|2,0,0]=4 8689 B13R1.150 Cc1c(ccnc1NCC(C)O)Cl 1d8fc656423f6d8c50b6a263e321b301 [0,2,0,0,0,0|2,0,0]=4 8690 B13R1.150 Cc1c(ccnc1NCC(C)O)F b1f03d841f624276da18335bd3727335 [0,2,0,0,0,0|2,0,0]=4 8691 B13R1.150 Cc1c(ccnc1NCC(C)O)I 43e1d225f67534ba59c82d9f2a6ee6a6 [0,2,0,0,0,0|2,0,0]=4 8692 B13R1.150 Cc1c(ccnc1NC[C@@H](C)O)Cl f6544c8b4d65c58547d90137aff6e536 [0,2,0,0,0,0|2,0,0]=4 8693 B13R1.150 Cc1c(ccnc1NC[C@@H](C)O)F a6d6e381ba96da4f0a8e34616aa5d5dc [0,2,0,0,0,0|2,0,0]=4 8694 B13R1.150 Cc1c(ccnc1NC[C@@H](C)O)I 610e487084ae5a8e32de541efe5be241 [0,2,0,0,0,0|2,0,0]=4 8695 B13R1.150 Cc1c(ccnc1NC[C@H](C)O)Br 1f6a7dffa742a4f2926b2d7aa03480b8 [0,2,0,0,0,0|2,0,0]=4 8696 B13R1.150 Cc1c(ccnc1NC[C@H](C)O)Cl e53ccdeb9c2dee8b6e03faa5b9e98958 [0,2,0,0,0,0|2,0,0]=4 8697 B13R1.150 Cc1c(ccnc1NC[C@H](C)O)F 5dc504d7d58d19413bec34a92320e410 [0,2,0,0,0,0|2,0,0]=4 8698 B13R1.150 Cc1c(ccnc1NC[C@H](C)O)I 3c3e4bc2a3da57d680ab7804b9d568a7 [0,2,0,0,0,0|2,0,0]=4 8699 B13R1.150 Cc1c(cncc1NCC(C)O)Br 78ffb8e735f410acc9f4bf92d36a63e8 [0,2,0,0,0,0|2,0,0]=4 8700 B13R1.150 Cc1c(cncc1NCC(C)O)Cl 78f5a9d4c3670db74f9d2e3946e09b88 [0,2,0,0,0,0|2,0,0]=4 8701 B13R1.150 Cc1c(cncc1NCC(C)O)F a472f136ae1df0a23069b674b2af0de8 [0,2,0,0,0,0|2,0,0]=4 8702 B13R1.150 Cc1c(cncc1NC[C@@H](C)O)Br 4ae648b39f388dea2bac448bde690f39 [0,2,0,0,0,0|2,0,0]=4 8703 B13R1.150 Cc1c(cncc1NC[C@@H](C)O)Cl 16b645899cf475d2022e113f9a5fd8d8 [0,2,0,0,0,0|2,0,0]=4 8704 B13R1.150 Cc1c(cncc1NC[C@H](C)O)Br 13fcb8b550df8c6d19cdb37cfeb4f01f [0,2,0,0,0,0|2,0,0]=4 8705 B13R1.150 Cc1c(cncc1NC[C@H](C)O)Cl 2a6c0542d9babecfd24bd0647d29b2d3 [0,2,0,0,0,0|2,0,0]=4 8706 B13R1.150 Cc1c(cncc1NC[C@H](C)O)F 6f748cdee43f8dc91ef1ef91dbb189b6 [0,2,0,0,0,0|2,0,0]=4 8707 B13R1.150 Cc1cccc([n+]1[O-])NCC(C)O d2935985da7bee714a0ae2dab302eb6d [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.150 Cc1cccc([n+]1[O-])NC[C@@H](C)O f7f6c6afc9dbbb3625c6c9a6ccf4abf6 [0,2,0,0,0,0|2,0,0]=4 8709 B13R1.150 Cc1cccc([n+]1[O-])NC[C@H](C)O 765138a0626cab2e281f19873fffcceb [0,2,0,0,0,0|2,0,0]=4 8710 B13R1.150 Cc1cccc(c1Br)CNC(C)C b81b3f659ff8cf614d5df306b1863ac7 [0,2,0,0,0,0|2,0,0]=4 8711 B13R1.150 Cc1cccc(c1Br)COC(C)C 13fcf8c7c2c13372744b9422b93298d3 [0,2,0,0,0,0|2,0,0]=4 8712 B13R1.150 Cc1cccc(c1Br)NCC(C)C 9fd46f840f76c40c230bf7d38e24b7b4 [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.150 Cc1cccc(c1Br)NCC(C)O 523c1d7af2c233e8cc3d5f05127cf317 [0,2,0,0,0,0|1,0,0]=3 8714 B13R1.150 Cc1cccc(c1Br)NC[C@H](C)O db7feba57b3fdea473dd867882e52c5c [0,2,0,0,0,0|1,0,0]=3 8715 B13R1.150 Cc1cccc(c1Br)OCC(C)C 31632eae5f9817bd3bca734dfc463337 [0,2,0,0,0,0|2,0,0]=4 8716 B13R1.150 Cc1cccc(c1C)CNC(C)C 1a93093f485e184236bc5750772f4e62 [0,2,0,0,0,0|2,0,0]=4 8717 B13R1.150 Cc1cccc(c1C)COC(C)C f8bd4caaf66fe752f9ddfe5b4d3c0d7b [0,2,0,0,0,0|2,0,0]=4 8718 B13R1.150 Cc1cccc(c1C)NCC(C)C caa1d80fa8c5159b194ac641104cb804 [0,2,0,0,0,0|2,0,0]=4 8719 B13R1.150 Cc1cccc(c1C)NCC(C)O 3e410bdad67afc2bd31a6f1da27bd85d [0,2,0,0,0,0|1,0,0]=3 8720 B13R1.150 Cc1cccc(c1C)NC[C@H](C)O b3050f76aaaa4565e3030633bb404405 [0,2,0,0,0,0|1,0,0]=3 8721 B13R1.150 Cc1cccc(c1C)OCC(C)C d20b3aa25a186c837668afe0e92c94e8 [0,2,0,0,0,0|2,0,0]=4 8722 B13R1.150 Cc1cccc(c1Cl)CNC(C)C be29f86f5ec08207ecbfba13117647c5 [0,2,0,0,0,0|2,0,0]=4 8723 B13R1.150 Cc1cccc(c1Cl)COC(C)C e1d51f171b98ef39557a436ab0521e97 [0,2,0,0,0,0|2,0,0]=4 8724 B13R1.150 Cc1cccc(c1Cl)NCC(C)C e52e42634047072cd141b6a706199a2d [0,2,0,0,0,0|2,0,0]=4 8725 B13R1.150 Cc1cccc(c1Cl)NCC(C)O d4f1aa39780c22206411aaeabcb5d101 [0,2,0,0,0,0|1,0,0]=3 8726 B13R1.150 Cc1cccc(c1Cl)NC[C@H](C)O ba68b34ccc446387a2c39c5799b2163c [0,2,0,0,0,0|1,0,0]=3 8727 B13R1.150 Cc1cccc(c1Cl)OCC(C)C c87acb677bc9e297ec8ef90938f4835b [0,2,0,0,0,0|2,0,0]=4 8728 B13R1.150 Cc1cccc(c1F)CNC(C)C 9b863d20863041e88a59e9c147ad66aa [0,2,0,0,0,0|2,0,0]=4 8729 B13R1.150 Cc1cccc(c1F)COC(C)C ccd9e294536e7eed939ef2de58ddcb45 [0,2,0,0,0,0|2,0,0]=4 8730 B13R1.150 Cc1cccc(c1F)NCC(C)C c32a5e0f792362069e0f10886d907e4b [0,2,0,0,0,0|2,0,0]=4 8731 B13R1.150 Cc1cccc(c1F)NCC(C)O 40cb68316801b54e95ca72500397546f [0,2,0,0,0,0|1,0,0]=3 8732 B13R1.150 Cc1cccc(c1F)NC[C@H](C)O e3586108a64db6db13ca82460768b76a [0,2,0,0,0,0|1,0,0]=3 8733 B13R1.150 Cc1cccc(c1F)OCC(C)C 86481c1982e50785ec20371e317d9ffd [0,2,0,0,0,0|2,0,0]=4 8734 B13R1.150 Cc1cccc(c1I)COC(C)C 0a8863012b1414404ef1ad81c9de8b5c [0,2,0,0,0,0|2,0,0]=4 8735 B13R1.150 Cc1cccc(c1I)NCC(C)C 0b0a538ab1c3d8cf0a9c83d839cd9557 [0,2,0,0,0,0|2,0,0]=4 8736 B13R1.150 Cc1cccc(c1I)NCC(C)O 104db74b5bc8aafc47566746d91dcc40 [0,2,0,0,0,0|1,0,0]=3 8737 B13R1.150 Cc1cccc(c1I)NC[C@H](C)O ad7e2e625a9df8a5745bbd410a095096 [0,2,0,0,0,0|1,0,0]=3 8738 B13R1.150 Cc1cccc(c1I)OCC(C)C 022a002967b0a19ce0b421c9c4a67b28 [0,2,0,0,0,0|2,0,0]=4 8739 B13R1.150 Cc1ccnc(c1Br)NCC(C)O d1a5d0b943e45c5b6118c37984da57bd [0,2,0,0,0,0|2,0,0]=4 8740 B13R1.150 Cc1ccnc(c1Br)NC[C@@H](C)O 401232ca6fa7b9c1e4c6ca1e6164e643 [0,2,0,0,0,0|2,0,0]=4 8741 B13R1.150 Cc1ccnc(c1Br)NC[C@H](C)O 39c77e26291da830551dd6d87ffa5056 [0,2,0,0,0,0|2,0,0]=4 8742 B13R1.150 Cc1ccnc(c1C)NCC(C)O cf38b759b605918f8e866aeeae772dfd [0,2,0,0,0,0|2,0,0]=4 8743 B13R1.150 Cc1ccnc(c1C)NC[C@@H](C)O 43d4633fc9f64c94489d3c40819ae90e [0,2,0,0,0,0|2,0,0]=4 8744 B13R1.150 Cc1ccnc(c1C)NC[C@H](C)O da8d7124d530f9abfae83ad7ec20d3dc [0,2,0,0,0,0|2,0,0]=4 8745 B13R1.150 Cc1ccnc(c1Cl)NCC(C)O d7ebe7ba787f14d203aee6b7a7dee89a [0,2,0,0,0,0|2,0,0]=4 8746 B13R1.150 Cc1ccnc(c1Cl)NC[C@@H](C)O 6f679706d3d51ea777850dbae5c2508a [0,2,0,0,0,0|2,0,0]=4 8747 B13R1.150 Cc1ccnc(c1Cl)NC[C@H](C)O c5aed974a733cb2d97a7db9e95f79eb5 [0,2,0,0,0,0|2,0,0]=4 8748 B13R1.150 Cc1ccnc(c1F)NCC(C)O 5141c9761ba5ead9f4a880f8cadc514f [0,2,0,0,0,0|2,0,0]=4 8749 B13R1.150 Cc1ccnc(c1F)NC[C@@H](C)O edda6d7534869edf3b7d56df77d0012d [0,2,0,0,0,0|2,0,0]=4 8750 B13R1.150 Cc1ccnc(c1F)NC[C@H](C)O 6a081e1caea9e16afd077e964918e30e [0,2,0,0,0,0|2,0,0]=4 8751 B13R1.150 Cc1ccnc(c1I)NCC(C)O 924b3612c26330ede8d45a023847133e [0,2,0,0,0,0|2,0,0]=4 8752 B13R1.150 Cc1ccnc(c1I)NC[C@@H](C)O aba7ce0403d867b5171cb9e0f9efe50d [0,2,0,0,0,0|2,0,0]=4 8753 B13R1.150 Cc1ccnc(c1I)NC[C@H](C)O 90dee9b6239e3d399b641eec289f1753 [0,2,0,0,0,0|2,0,0]=4 8754 B13R1.150 Cc1nccc(c1Br)NCC(C)O 1d1a0de275a9098e32915bcecb6c4cc4 [0,2,0,0,0,0|2,0,0]=4 8755 B13R1.150 Cc1nccc(c1Br)NC[C@@H](C)O d93ab37173085c1aa817e178bd8355ef [0,2,0,0,0,0|2,0,0]=4 8756 B13R1.150 Cc1nccc(c1Br)NC[C@H](C)O b8a41951a53b18b39cb823c323dcd28f [0,2,0,0,0,0|2,0,0]=4 8757 B13R1.150 Cc1nccc(c1C)NCC(C)O f8edf203a553884019249586d33f34ee [0,2,0,0,0,0|2,0,0]=4 8758 B13R1.150 Cc1nccc(c1C)NC[C@@H](C)O 56cb22a61b31bdcd9ab4a13628c6b8d4 [0,2,0,0,0,0|2,0,0]=4 8759 B13R1.150 Cc1nccc(c1C)NC[C@H](C)O 953b283cd761446277e0afacbdd9bc52 [0,2,0,0,0,0|2,0,0]=4 8760 B13R1.150 Cc1nccc(c1Cl)NCC(C)O e6b448cddaab22977aae61fbe3aeda11 [0,2,0,0,0,0|2,0,0]=4 8761 B13R1.150 Cc1nccc(c1Cl)NC[C@@H](C)O a74d277dec0f4c482ab773debd0894a9 [0,2,0,0,0,0|2,0,0]=4 8762 B13R1.150 Cc1nccc(c1Cl)NC[C@H](C)O 030e11f2dacc82d6e80d1936aa87df91 [0,2,0,0,0,0|2,0,0]=4 8763 B13R1.150 Cc1nccc(c1F)NCC(C)O 90bf0eebd0785751bdb2ac6a79b728fd [0,2,0,0,0,0|2,0,0]=4 8764 B13R1.150 Cc1nccc(c1F)NC[C@@H](C)O 4870cde570f3d39b14ec38a8964b474e [0,2,0,0,0,0|2,0,0]=4 8765 B13R1.150 Cc1nccc(c1F)NC[C@H](C)O 7c8483fc221682f48b98808a0413fe36 [0,2,0,0,0,0|2,0,0]=4 8766 B13R1.150 Cc1nccc(c1I)NCC(C)O c8e66c1f2e7a71bcf6c7a5b91cbc698c [0,2,0,0,0,0|2,0,0]=4 8767 B13R1.150 Cc1nccc(c1I)NC[C@@H](C)O c291bfa29b2bd5e15a68f330eaf1f892 [0,2,0,0,0,0|2,0,0]=4 8768 B13R1.150 Cc1nccc(c1I)NC[C@H](C)O d0cf1b60128ef428fd570fa0a6f24d5c [0,2,0,0,0,0|2,0,0]=4 8769 B13R1.157 CC(C)(C)CNc1ccccc1Cl 6e7c839679d9360e2b9dbc76d7b35c0b [0,2,0,0,0,0|2,0,0]=4 8770 B13R1.157 CC(C)(C)CNc1ccccc1I b501c0b1f08e0eeb89f7e77efed06375 [0,2,0,0,0,0|2,0,0]=4 8771 B13R1.157 CC(C)(C)COc1ccccc1Cl bf502c9e768a1366eeeae0b734baee6e [0,2,0,0,0,0|2,0,0]=4 8772 B13R1.157 CC(C)(C)COc1ccccc1F eee2943de9c04d3316a108a7c14b12a9 [0,2,0,0,0,0|2,0,0]=4 8773 B13R1.157 CC(C)(C)COc1ccccc1I 9dc96264f599989d51c9291d91e242ed [0,2,0,0,0,0|2,0,0]=4 8774 B13R1.157 CC(C)(C)NCc1ccccc1Cl 6a3779bc70632039f6583632e6a76659 [0,2,0,0,0,0|2,0,0]=4 8775 B13R1.157 CC(C)(C)NCc1ccccc1F e7f7f953cc6e46e88a4fac9a53542ece [0,2,0,0,0,0|2,0,0]=4 8776 B13R1.157 CC(C)(C)NCc1ccccc1I 4b199fa1c3fe1bd5cb09a1b4220bc287 [0,2,0,0,0,0|2,0,0]=4 8777 B13R1.157 CC(C)(F)CNc1ccccc1Cl dd636243c8e96b7c105412d7ed035a7a [0,2,0,0,0,0|2,0,0]=4 8778 B13R1.157 CC(C)(F)CNc1ccccc1I df892a5ce930bf5e52a32f44f2936725 [0,2,0,0,0,0|2,0,0]=4 8779 B13R1.157 CC(C)(F)COc1ccccc1Cl f8a4abf59e6cb960fbce3965787adf50 [0,2,0,0,0,0|2,0,0]=4 8780 B13R1.157 CC(C)(F)COc1ccccc1F 41b589c79d1ece2f41804e1c4e70114a [0,2,0,0,0,0|2,0,0]=4 8781 B13R1.157 CC(C)(F)COc1ccccc1I c472709b6972b8be0fac47330a387388 [0,2,0,0,0,0|2,0,0]=4 8782 B13R1.157 CC(C)(O)CNc1c[nH]ccc1=O ae978d23a6ae93cd6191b32c6d95c11f [0,2,0,0,0,0|2,0,0]=4 8783 B13R1.157 CC(C)(O)CNc1ccc[nH]c1=S 338da1cd4146ee3c2287a20ceb4ce9b3 [0,2,0,0,0,0|2,0,0]=4 8784 B13R1.157 CC(C)(O)CNc1cccc[n+]1[O-] 3a6240a010ea203b5f96b0a74efb3e9e [0,2,0,0,0,0|2,0,0]=4 8785 B13R1.157 CC(C)(O)CNc1ccccc1Cl 88d67d9e098b12b95df23ad684a842ed [0,2,0,0,0,0|1,0,0]=3 8786 B13R1.157 CC(C)(O)CNc1ccccc1I cbf75f05ddcc2671ad44b8dd79642994 [0,2,0,0,0,0|1,0,0]=3 8787 B13R1.157 CC(C)(O)CNc1cccnc1Br a01388c35f6945a572a9694276d7afc0 [0,2,0,0,0,0|2,0,0]=4 8788 B13R1.157 CC(C)(O)CNc1cccnc1Cl e29eec49c1647c9343e56c6f0fca0a40 [0,2,0,0,0,0|2,0,0]=4 8789 B13R1.157 CC(C)(O)CNc1cccnc1F dd97213a418031eddbce91f328f1fa66 [0,2,0,0,0,0|2,0,0]=4 8790 B13R1.157 CC(C)(O)CNc1cccnc1I 9519447101f952d4618496927a6c82c1 [0,2,0,0,0,0|2,0,0]=4 8791 B13R1.157 CC(C)(O)CNc1ccncc1Br 4198bcedc8da5d259b14c9287a744156 [0,2,0,0,0,0|2,0,0]=4 8792 B13R1.157 CC(C)(O)CNc1ccncc1Cl c3d91a95be4dfd05a7bb6c21ad157725 [0,2,0,0,0,0|2,0,0]=4 8793 B13R1.157 CC(C)(O)CNc1ccncc1F e9746bd053e68d31dc6f0e60c9f344cd [0,2,0,0,0,0|2,0,0]=4 8794 B13R1.157 CC(C)(O)CNc1ccncc1I 022253f0cc7bfa76452b481b426611a5 [0,2,0,0,0,0|2,0,0]=4 8795 B13R1.157 CC(C)(O)CNc1cnccc1Br b1d377ceceda60baf1228123ec506c6d [0,2,0,0,0,0|2,0,0]=4 8796 B13R1.157 CC(C)(O)CNc1cnccc1Cl db974f0d37349a03ccf207dc2ae52e76 [0,2,0,0,0,0|2,0,0]=4 8797 B13R1.157 CC(C)(O)CNc1cnccc1F fc451669c8a6b39d1621f9bdf956e977 [0,2,0,0,0,0|2,0,0]=4 8798 B13R1.157 CC(C)(O)CNc1cnccc1I 7b992fcda472f1ebcec0df4253017e72 [0,2,0,0,0,0|2,0,0]=4 8799 B13R1.157 CC(C)(O)CNc1cnccc1S bf3a042ab502ba6cd69d452b38bfa6a7 [0,2,0,0,0,0|2,0,0]=4 8800 B13R1.157 CC(C)(O)CNc1ncccc1Br d7599e855e70a9e6cda31a2cfef22fe7 [0,2,0,0,0,0|2,0,0]=4 8801 B13R1.157 CC(C)(O)CNc1ncccc1Cl b9e5fc41f0cbf2b0a8d866761dd99ccf [0,2,0,0,0,0|2,0,0]=4 8802 B13R1.157 CC(C)(O)CNc1ncccc1F 82dc254382515a4117d3de0e165e75b4 [0,2,0,0,0,0|2,0,0]=4 8803 B13R1.157 CC(C)(O)CNc1ncccc1I cf6015d8d77be138df40b396661b977a [0,2,0,0,0,0|2,0,0]=4 8804 B13R1.157 CC(C)(O)COc1ccc[nH]c1=S df23ce64648ea7d7ff9622cdef6b4d08 [0,2,0,0,0,0|2,0,0]=4 8805 B13R1.157 CC(C)(O)COc1ccccc1Cl 2a129be7430274a014dc190130afcbaf [0,2,0,0,0,0|1,0,0]=3 8806 B13R1.157 CC(C)(O)COc1ccccc1F 3a8a1310802fad4e1e912432a6cb5432 [0,2,0,0,0,0|1,0,0]=3 8807 B13R1.157 CC(C)(O)COc1cccnc1Br c1a068380ceeb3bc6b74f33ef13dcb9d [0,2,0,0,0,0|2,0,0]=4 8808 B13R1.157 CC(C)(O)COc1cccnc1Cl d36c4b716854a9f8701a5786946f60f0 [0,2,0,0,0,0|2,0,0]=4 8809 B13R1.157 CC(C)(O)COc1cccnc1F ea4580f0220dc61576e22ea3004ac27c [0,2,0,0,0,0|2,0,0]=4 8810 B13R1.157 CC(C)(O)COc1cccnc1I f42c4f4636fef00b0a3bed25f13cae3c [0,2,0,0,0,0|2,0,0]=4 8811 B13R1.157 CC(C)(O)COc1cccoc1=O 9e65b491f7cf7fdf40231e35ea9867da [0,2,0,0,0,0|2,0,0]=4 8812 B13R1.157 CC(C)(O)COc1ccncc1Br f5c77a771aff59c38f6f8d673419d6e5 [0,2,0,0,0,0|2,0,0]=4 8813 B13R1.157 CC(C)(O)COc1ccncc1Cl e04f0a87777d74daa9e8781e2d919a02 [0,2,0,0,0,0|2,0,0]=4 8814 B13R1.157 CC(C)(O)COc1ccncc1F 8fa138bd6a9a189b0b78138581d4190a [0,2,0,0,0,0|2,0,0]=4 8815 B13R1.157 CC(C)(O)COc1cnccc1Br 2f6c5ecb9d63719ee16c0ba147e9e1c3 [0,2,0,0,0,0|2,0,0]=4 8816 B13R1.157 CC(C)(O)COc1cnccc1Cl 6f7b776ec71264e256a5621bd0f4769f [0,2,0,0,0,0|2,0,0]=4 8817 B13R1.157 CC(C)(O)COc1cnccc1F e611d823474408c37f2dcb57aaac3900 [0,2,0,0,0,0|2,0,0]=4 8818 B13R1.157 CC(C)(O)COc1cnccc1I 7768e1f5ef372948e8a0469c84f717a8 [0,2,0,0,0,0|2,0,0]=4 8819 B13R1.157 CC(C)(O)COc1coccc1=O 2f4533ec9d03bec615eb81caef7fcf1f [0,2,0,0,0,0|2,0,0]=4 8820 B13R1.157 CC(C)(O)COc1ncccc1Br 99ef074fab64f50cbb2c941c605ecac3 [0,2,0,0,0,0|2,0,0]=4 8821 B13R1.157 CC(C)(O)COc1ncccc1Cl b77e816713b307c53bba732e618e0f23 [0,2,0,0,0,0|2,0,0]=4 8822 B13R1.157 CC(C)(O)COc1ncccc1F 82328772aecfbac91371abbed55e5c36 [0,2,0,0,0,0|2,0,0]=4 8823 B13R1.157 CC(C)(O)COn1ccccc1=N e07f51ef0d8070e245b9e99fdbadb75c [0,2,0,0,0,0|2,0,0]=4 8824 B13R1.157 CC(C)(O)COn1ccccc1=O cc6f0a429b01beb0f1ce7a4549d32355 [0,2,0,0,0,0|2,0,0]=4 8825 B13R1.157 CC(C)(O)COn1ccccc1=S d35ef13f76369bc88a6b3cc532339ad8 [0,2,0,0,0,0|2,0,0]=4 8826 B13R1.157 CC(F)(F)CNc1ccccc1Cl b6b20f5bff28084afd312eaee66ae993 [0,2,0,0,0,0|2,0,0]=4 8827 B13R1.157 CC(F)(F)CNc1ccccc1F 8e846a8980cad4f05a4c84afe7767a82 [0,2,0,0,0,0|2,0,0]=4 8828 B13R1.157 CC(F)(F)CNc1ccccc1I a450f1ba0fb85f77e9f3817c8070bcb5 [0,2,0,0,0,0|2,0,0]=4 8829 B13R1.157 CC(F)(F)COc1ccccc1Cl 426e91474ac5b3979a2ff89cbda90536 [0,2,0,0,0,0|2,0,0]=4 8830 B13R1.157 CC(F)(F)COc1ccccc1F 8d459a46b2713f65f1dba751e890d20f [0,2,0,0,0,0|2,0,0]=4 8831 B13R1.157 Cc1ccccc1CNC(C)(C)C 4adc1987e9d22266fc1e741572269cda [0,2,0,0,0,0|2,0,0]=4 8832 B13R1.157 Cc1ccccc1OCC(C)(C)C a6e2cba8b3421b537fbf1ffe481845db [0,2,0,0,0,0|2,0,0]=4 8833 B13R1.157 Cc1ccccc1OCC(C)(C)F aac4db2086f5c9063b50eb045881ced0 [0,2,0,0,0,0|2,0,0]=4 8834 B13R1.157 Cc1ccccc1OCC(C)(C)O caa869fe19f17637aefbd82d14fa3c3b [0,2,0,0,0,0|1,0,0]=3 8835 B13R1.157 Cc1cccnc1NCC(C)(C)O b12c75a195976854e754a98f7749e020 [0,2,0,0,0,0|2,0,0]=4 8836 B13R1.157 Cc1cccnc1OCC(C)(C)O 5478f5edc4f2ff4b04ca381ce8b3366c [0,2,0,0,0,0|2,0,0]=4 8837 B13R1.157 Cc1ccncc1NCC(C)(C)O a8ae57bac3f21b06d9150bd129deae38 [0,2,0,0,0,0|2,0,0]=4 8838 B13R1.157 Cc1ccncc1OCC(C)(C)O 74c23cf4fd3490dc67ed4f0813c67c87 [0,2,0,0,0,0|2,0,0]=4 8839 B13R1.157 Cc1cnccc1NCC(C)(C)O 5ca91748a1df921ee782a17f777766a0 [0,2,0,0,0,0|2,0,0]=4 8840 B13R1.157 Cc1cnccc1OCC(C)(C)O 2b096ae557b1d427b52c9ec1dc4e2246 [0,2,0,0,0,0|2,0,0]=4 8841 B13R1.157 Cc1ncccc1NCC(C)(C)O 7e1ebd14f2b74482daffb9608c3fbc2d [0,2,0,0,0,0|2,0,0]=4 8842 B13R1.157 Cc1ncccc1OCC(C)(C)O 4a8378d2d4d4cc9c53a7dfa809a34dc4 [0,2,0,0,0,0|2,0,0]=4 8843 B13R1.893 CC(C)CNc1cc(ccc1Br)Br 101cd9d05b7fa7d0273be35e7067dc57 [0,2,0,0,0,0|2,0,0]=4 8844 B13R1.893 CC(C)CNc1cc(ccc1Br)Cl e03619ec41a2dfa0d7c2d9d9543c3dd0 [0,2,0,0,0,0|2,0,0]=4 8845 B13R1.893 CC(C)CNc1cc(ccc1Br)F 0213b4bf29035a765c39f9f6f71e36ef [0,2,0,0,0,0|2,0,0]=4 8846 B13R1.893 CC(C)CNc1cc(ccc1Br)I ac0cf6bd86bdec0fc082e5a367508755 [0,2,0,0,0,0|2,0,0]=4 8847 B13R1.893 CC(C)CNc1cc(ccc1Cl)Br 2d59b40649382583fda17f6ba7db9295 [0,2,0,0,0,0|2,0,0]=4 8848 B13R1.893 CC(C)CNc1cc(ccc1Cl)Cl df1cd852d834d9301b92068aa1d4209e [0,2,0,0,0,0|2,0,0]=4 8849 B13R1.893 CC(C)CNc1cc(ccc1Cl)F e00367910f9108c05b7f26874a49403d [0,2,0,0,0,0|2,0,0]=4 8850 B13R1.893 CC(C)CNc1cc(ccc1Cl)I ae442b428895bfdd953cc78d77e3eeae [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.893 CC(C)CNc1cc(ccc1F)Br 827e55f725ae5acf25f3431cefe8fc31 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.893 CC(C)CNc1cc(ccc1F)Cl 4cb508f913bcb74a3f38c1b5a95e0dbd [0,2,0,0,0,0|2,0,0]=4 8853 B13R1.893 CC(C)CNc1cc(ccc1F)F 5aff139bd8ce75905f4d78f506231240 [0,2,0,0,0,0|2,0,0]=4 8854 B13R1.893 CC(C)CNc1cc(ccc1F)I b1b10a17aca1fcecd39f6de867c2de5a [0,2,0,0,0,0|2,0,0]=4 8855 B13R1.893 CC(C)CNc1cc(ccc1I)Br 0142959f12f96395b51e8b819d977deb [0,2,0,0,0,0|2,0,0]=4 8856 B13R1.893 CC(C)CNc1cc(ccc1I)Cl d87cc7b34fade8b02e231d14dfd576fc [0,2,0,0,0,0|2,0,0]=4 8857 B13R1.893 CC(C)CNc1cc(ccc1I)F 6da537c7d74f4dbb15f9f853372c2d26 [0,2,0,0,0,0|2,0,0]=4 8858 B13R1.893 CC(C)CNc1cc(ccc1N)N 058b10fabc4c34e979e4f9e67548e3a1 [0,2,0,0,0,0|2,0,0]=4 8859 B13R1.893 CC(C)CNc1cc(ccc1S)Br ead77eda54c484c6c1f48288d76c5245 [0,2,0,0,0,0|2,0,0]=4 8860 B13R1.893 CC(C)CNc1cc(ccc1S)Cl 345e1979ea57806b992b57dee12a76dd [0,2,0,0,0,0|2,0,0]=4 8861 B13R1.893 CC(C)CNc1cc(ccc1S)F 788b7eeaad18f9656174945ad9360c33 [0,2,0,0,0,0|2,0,0]=4 8862 B13R1.893 CC(C)COc1cc(ccc1Br)Cl e46de45ac878b0623ed10fd7e1ea1a07 [0,2,0,0,0,0|2,0,0]=4 8863 B13R1.893 CC(C)COc1cc(ccc1Br)F 901d1c1074986703514045182dfa54ad [0,2,0,0,0,0|2,0,0]=4 8864 B13R1.893 CC(C)COc1cc(ccc1Br)I f296dde35a1422786e4652fdf0ab398d [0,2,0,0,0,0|2,0,0]=4 8865 B13R1.893 CC(C)COc1cc(ccc1Cl)Br 13db133988e502f045a6e12066f3e23c [0,2,0,0,0,0|2,0,0]=4 8866 B13R1.893 CC(C)COc1cc(ccc1Cl)Cl cb5bbe250ce99f18e90fd65703d32119 [0,2,0,0,0,0|2,0,0]=4 8867 B13R1.893 CC(C)COc1cc(ccc1Cl)F 204a4d543dfd570caddf4d81c3a66aef [0,2,0,0,0,0|2,0,0]=4 8868 B13R1.893 CC(C)COc1cc(ccc1Cl)I d1efca0a85ff0ddeb39a41f780ff3511 [0,2,0,0,0,0|2,0,0]=4 8869 B13R1.893 CC(C)COc1cc(ccc1F)Br 4746a6440905988226ee0da552e7d631 [0,2,0,0,0,0|2,0,0]=4 8870 B13R1.893 CC(C)COc1cc(ccc1F)Cl 2ed87ad437d9a23df9298eb0d23403eb [0,2,0,0,0,0|2,0,0]=4 8871 B13R1.893 CC(C)COc1cc(ccc1F)F 79d12cdf035e491b183b12c00ed80b25 [0,2,0,0,0,0|2,0,0]=4 8872 B13R1.893 CC(C)COc1cc(ccc1F)I 6000cf34d9dd149b87d4f9eabb3470ff [0,2,0,0,0,0|2,0,0]=4 8873 B13R1.893 CC(C)COc1cc(ccc1I)Br d5e542ffdd79f21ca2199c14a9456839 [0,2,0,0,0,0|2,0,0]=4 8874 B13R1.893 CC(C)COc1cc(ccc1I)Cl 59a13702bb17188714c62f9d01c078e9 [0,2,0,0,0,0|2,0,0]=4 8875 B13R1.893 CC(C)COc1cc(ccc1I)F 612ab08ebb2076cc8307b5ab76e13ce0 [0,2,0,0,0,0|2,0,0]=4 8876 B13R1.893 CC(C)NCc1cc(ccc1Cl)Br 2b82ec9904c64a2f7ceecebf2b984c6a [0,2,0,0,0,0|2,0,0]=4 8877 B13R1.893 CC(C)NCc1cc(ccc1Cl)Cl 4fd9be4672d24156bf09f39467f0d052 [0,2,0,0,0,0|2,0,0]=4 8878 B13R1.893 CC(C)NCc1cc(ccc1Cl)F 240bb3ead25ac0a1a924fbe817d16cec [0,2,0,0,0,0|2,0,0]=4 8879 B13R1.893 CC(C)NCc1cc(ccc1F)Br cc46f06164997e07baea97d7ed80453a [0,2,0,0,0,0|2,0,0]=4 8880 B13R1.893 CC(C)NCc1cc(ccc1F)Cl 139233f1a16133d28161aefe615e9bcb [0,2,0,0,0,0|2,0,0]=4 8881 B13R1.893 CC(C)NCc1cc(ccc1F)F a0e756b864d3e269df3ef7d5c5c406fb [0,2,0,0,0,0|2,0,0]=4 8882 B13R1.893 CC(C)NCc1cc(ccc1I)Br 587960d99e7c60ad63888e92108eb7af [0,2,0,0,0,0|2,0,0]=4 8883 B13R1.893 CC(C)OCC1=CC(=O)C=CC1=O 52e2d73f1a99b0168d0a26fcb4607fb8 [0,2,0,0,0,0|2,0,0]=4 8884 B13R1.893 CC(C)OCc1cc(ccc1Br)Cl 0abecf35d6435414c680c729ba378085 [0,2,0,0,0,0|2,0,0]=4 8885 B13R1.893 CC(C)OCc1cc(ccc1Br)I 8071933dda3c531f4e6da7c81ee2f5de [0,2,0,0,0,0|2,0,0]=4 8886 B13R1.893 CC(C)OCc1cc(ccc1Cl)Br 8528ecc47c7a19add41f75e05c303de5 [0,2,0,0,0,0|2,0,0]=4 8887 B13R1.893 CC(C)OCc1cc(ccc1Cl)Cl 138baecb3808f926371632a5f9c5eb58 [0,2,0,0,0,0|2,0,0]=4 8888 B13R1.893 CC(C)OCc1cc(ccc1Cl)F d0af32acdab445682cc85384c1626530 [0,2,0,0,0,0|2,0,0]=4 8889 B13R1.893 CC(C)OCc1cc(ccc1Cl)I d5aaacdbc110bb91f7b845fa042f99e5 [0,2,0,0,0,0|2,0,0]=4 8890 B13R1.893 CC(C)OCc1cc(ccc1F)Br 1d8c6ed698e1b1f0ee9c1545aaee5e1e [0,2,0,0,0,0|2,0,0]=4 8891 B13R1.893 CC(C)OCc1cc(ccc1F)Cl de5551cacbcf2e1a07fab87755a39feb [0,2,0,0,0,0|2,0,0]=4 8892 B13R1.893 CC(C)OCc1cc(ccc1F)F db711074581cabbefd6f3d54819962d3 [0,2,0,0,0,0|2,0,0]=4 8893 B13R1.893 CC(C)OCc1cc(ccc1F)I 9d9862343ea4ca0d07b60d4bbca3dfe8 [0,2,0,0,0,0|2,0,0]=4 8894 B13R1.893 CC(C)OCc1cc(ccc1I)Br 2174eef1c6edfc37646869b4ec0cdf02 [0,2,0,0,0,0|2,0,0]=4 8895 B13R1.893 CC(C)OCc1cc(ccc1I)Cl 866b47e9d4a3e3bf244b30dc7134a1d1 [0,2,0,0,0,0|2,0,0]=4 8896 B13R1.893 CC(C)OCc1cc(ccc1I)F 58344ec405a119e69cd0cd1b66167dd4 [0,2,0,0,0,0|2,0,0]=4 8897 B13R1.893 CC(O)CNc1cc(ccc1Br)Br b7841c6981a22793dd83dcd402c3141b [0,2,0,0,0,0|1,0,0]=3 8898 B13R1.893 CC(O)CNc1cc(ccc1Br)Cl 985c340dcbcc0fef6114cb80aec9a079 [0,2,0,0,0,0|1,0,0]=3 8899 B13R1.893 CC(O)CNc1cc(ccc1Br)F 41e292b1de914244e3c3d316ba0122e0 [0,2,0,0,0,0|1,0,0]=3 8900 B13R1.893 CC(O)CNc1cc(ccc1Br)I a111b8fd421d10ae22254386a1b08875 [0,2,0,0,0,0|1,0,0]=3 8901 B13R1.893 CC(O)CNc1cc(ccc1Cl)Br c5493cdf44eea9be012e25e20eb919e1 [0,2,0,0,0,0|1,0,0]=3 8902 B13R1.893 CC(O)CNc1cc(ccc1Cl)Cl d01b3c1555ff1a9ede127eaa2e542c30 [0,2,0,0,0,0|1,0,0]=3 8903 B13R1.893 CC(O)CNc1cc(ccc1Cl)F b89b703baeff9526b5e370a961fc1ffa [0,2,0,0,0,0|1,0,0]=3 8904 B13R1.893 CC(O)CNc1cc(ccc1Cl)I 9fc2d9b19cd69e44fd19015a5d3ef299 [0,2,0,0,0,0|1,0,0]=3 8905 B13R1.893 CC(O)CNc1cc(ccc1F)Br 112a6022e69b943e615d837e4f915466 [0,2,0,0,0,0|1,0,0]=3 8906 B13R1.893 CC(O)CNc1cc(ccc1F)Cl 939bd2e3ad7870b02de2b7dcb1459040 [0,2,0,0,0,0|1,0,0]=3 8907 B13R1.893 CC(O)CNc1cc(ccc1F)F 923374ece8ee88a48e8543f9504d5d48 [0,2,0,0,0,0|1,0,0]=3 8908 B13R1.893 CC(O)CNc1cc(ccc1F)I 0ac82e072a7ecef9c471c0edd1d6bf2d [0,2,0,0,0,0|1,0,0]=3 8909 B13R1.893 CC(O)CNc1cc(ccc1I)Br 9161d801aa715e8ba81570274c72e377 [0,2,0,0,0,0|1,0,0]=3 8910 B13R1.893 CC(O)CNc1cc(ccc1I)Cl b3353e74ac54a27b5093294503c7b777 [0,2,0,0,0,0|1,0,0]=3 8911 B13R1.893 CC(O)CNc1cc(ccc1I)F 8008ddf4636a176881d4bac3349a2f58 [0,2,0,0,0,0|1,0,0]=3 8912 B13R1.893 CC(O)CNc1cc(ccc1S)Br 0efe6c49939a7f5f1404ac84699e556d [0,2,0,0,0,0|1,0,0]=3 8913 B13R1.893 CC(O)CNc1cc(ccc1S)Cl 4e147be4b11bc80b194d4c770df487e8 [0,2,0,0,0,0|1,0,0]=3 8914 B13R1.893 CC(O)CNc1cc(ccc1S)F 5f2184e3c0b8dd6c7e7abc7c724beafa [0,2,0,0,0,0|1,0,0]=3 8915 B13R1.893 CC(O)CNc1cc(cnc1Br)Br eeea409eda8bd043ebb8ef67fd11bd65 [0,2,0,0,0,0|2,0,0]=4 8916 B13R1.893 CC(O)CNc1cc(cnc1Br)Cl 546766fd041c871e88e1145b81da6c0c [0,2,0,0,0,0|2,0,0]=4 8917 B13R1.893 CC(O)CNc1cc(cnc1Br)F 012c06e8be1cdd038adb3ab9ac0323c6 [0,2,0,0,0,0|2,0,0]=4 8918 B13R1.893 CC(O)CNc1cc(cnc1Br)I a426489952f27fc7e72ab5b5a70c781e [0,2,0,0,0,0|2,0,0]=4 8919 B13R1.893 CC(O)CNc1cc(cnc1Cl)Br 8d78a455999eb17d25459c1cb801c7da [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.893 CC(O)CNc1cc(cnc1Cl)Cl 02b7e7f46dbdaf14b725a22316f60cba [0,2,0,0,0,0|2,0,0]=4 8921 B13R1.893 CC(O)CNc1cc(cnc1Cl)F 38ceee0741f1dc16db019d7f8773a0b8 [0,2,0,0,0,0|2,0,0]=4 8922 B13R1.893 CC(O)CNc1cc(cnc1Cl)I 8e19c99056dc015fd5a009946dd951ee [0,2,0,0,0,0|2,0,0]=4 8923 B13R1.893 CC(O)CNc1cc(cnc1F)Br 04a5f1638f879f22404daaec5d8745d5 [0,2,0,0,0,0|2,0,0]=4 8924 B13R1.893 CC(O)CNc1cc(cnc1F)Cl 0427ff9b60110e4ceeb044f8132cb8a3 [0,2,0,0,0,0|2,0,0]=4 8925 B13R1.893 CC(O)CNc1cc(cnc1I)Br 6d7efc91ce169f273991832a8dbd3cda [0,2,0,0,0,0|2,0,0]=4 8926 B13R1.893 CC(O)CNc1cc(cnc1I)Cl b94d807acf7db8650fb88cf691dc4205 [0,2,0,0,0,0|2,0,0]=4 8927 B13R1.893 CC(O)CNc1cc(cnc1N)N 4ae4f360fe1626e13cbdc6f9fd7eabad [0,2,0,0,0,0|2,0,0]=4 8928 B13R1.893 CC(O)CNc1cc(ncc1Br)Br 844c9bc71b89e2707d5705ec9f7d5d32 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.893 CC(O)CNc1cc(ncc1Br)Cl 8623692e7051c716df631d2fec3fa750 [0,2,0,0,0,0|2,0,0]=4 8930 B13R1.893 CC(O)CNc1cc(ncc1Br)F 920d14d8cc8a3db45b9748997156f818 [0,2,0,0,0,0|2,0,0]=4 8931 B13R1.893 CC(O)CNc1cc(ncc1Cl)Br aa8c6ca4c09c5be21dc49b9058265d6a [0,2,0,0,0,0|2,0,0]=4 8932 B13R1.893 CC(O)CNc1cc(ncc1Cl)Cl b0cd92b1068574a97a88ff6c319dd923 [0,2,0,0,0,0|2,0,0]=4 8933 B13R1.893 CC(O)CNc1cc(ncc1Cl)F 98cd9cb40dfa9b87745ff7ed23f7be20 [0,2,0,0,0,0|2,0,0]=4 8934 B13R1.893 CC(O)CNc1cc(ncc1F)Br fecb33e7133c5683e41069d7312ad2a0 [0,2,0,0,0,0|2,0,0]=4 8935 B13R1.893 CC(O)CNc1cc(ncc1F)Cl 76449d686db9e2b5d7867c6eef6281d3 [0,2,0,0,0,0|2,0,0]=4 8936 B13R1.893 CC(O)CNc1cc(ncc1F)F 6c92846ddfb7eafbe3ef2655be73195a [0,2,0,0,0,0|2,0,0]=4 8937 B13R1.893 CC(O)CNc1cc(ncc1I)Br 4ef814f9e68292a39a5f41712f5c040b [0,2,0,0,0,0|2,0,0]=4 8938 B13R1.893 CC(O)CNc1cc(ncc1I)Cl 65e95c112781588fd4cef868d9356154 [0,2,0,0,0,0|2,0,0]=4 8939 B13R1.893 CC(O)CNc1cc(ncc1I)F b7a84b6f2886be6fd9939efa8bb6a34f [0,2,0,0,0,0|2,0,0]=4 8940 B13R1.893 CC(O)CNc1nc(ccc1Br)Br 5d7bc18c9822557f359cded14bcc5bb7 [0,2,0,0,0,0|2,0,0]=4 8941 B13R1.893 CC(O)CNc1nc(ccc1Br)Cl f57e8cf51b8bb688e512577b161fb7b7 [0,2,0,0,0,0|2,0,0]=4 8942 B13R1.893 CC(O)CNc1nc(ccc1Br)F ca67c353a789cca149d234a80f26e9f8 [0,2,0,0,0,0|2,0,0]=4 8943 B13R1.893 CC(O)CNc1nc(ccc1Br)I 4cbd16eba3c9947a566c88f3ee246296 [0,2,0,0,0,0|2,0,0]=4 8944 B13R1.893 CC(O)CNc1nc(ccc1Cl)Br aaceb7509c34b99a78b120d2d7fa7787 [0,2,0,0,0,0|2,0,0]=4 8945 B13R1.893 CC(O)CNc1nc(ccc1Cl)Cl 96a62a8b269a85275ac6ecea60e395e4 [0,2,0,0,0,0|2,0,0]=4 8946 B13R1.893 CC(O)CNc1nc(ccc1F)Br 392cc8bf45659ec5471132e7effa7f81 [0,2,0,0,0,0|2,0,0]=4 8947 B13R1.893 CC(O)CNc1nc(ccc1F)Cl 563eec24c5220751af3c4513d24e2b42 [0,2,0,0,0,0|2,0,0]=4 8948 B13R1.893 CC(O)CNc1nc(ccc1F)F 2a2386533224650b8f388397b81fb502 [0,2,0,0,0,0|2,0,0]=4 8949 B13R1.893 CC(O)CNc1nc(ccc1I)Br 1b0b37626d12c252b335ca90e1d7e2ae [0,2,0,0,0,0|2,0,0]=4 8950 B13R1.893 CC(O)CNc1nc(ccc1I)Cl c496f7115053f26ef3bcae9fdab63436 [0,2,0,0,0,0|2,0,0]=4 8951 B13R1.893 CC(O)CNc1nc(ccc1N)N 6b8a0e6c7832b718c9a0452a2c31b7e5 [0,2,0,0,0,0|2,0,0]=4 8952 B13R1.893 C[C@@H](O)CNc1cc(ccc1F)I ac878fb377050d0bc0a74db83138257f [0,2,0,0,0,0|1,0,0]=3 8953 B13R1.893 C[C@@H](O)CNc1cc(ccc1I)Cl d483bc467f6e729b990efda8478102a1 [0,2,0,0,0,0|1,0,0]=3 8954 B13R1.893 C[C@@H](O)CNc1cc(ccc1I)F eec404e1734cd04970b141e9eb33d091 [0,2,0,0,0,0|1,0,0]=3 8955 B13R1.893 C[C@@H](O)CNc1cc(cnc1Br)I 5c93b2d7843276ad284458be20a04baa [0,2,0,0,0,0|2,0,0]=4 8956 B13R1.893 C[C@@H](O)CNc1cc(cnc1Cl)Cl 0d336012ee539ec2cbc5006f4fe3358f [0,2,0,0,0,0|2,0,0]=4 8957 B13R1.893 C[C@@H](O)CNc1cc(cnc1Cl)I f35ddcc9bfe4abfcd3fff9327896a976 [0,2,0,0,0,0|2,0,0]=4 8958 B13R1.893 C[C@@H](O)CNc1cc(cnc1N)N 68eff43bd4d16ac449716fa872adebe5 [0,2,0,0,0,0|2,0,0]=4 8959 B13R1.893 C[C@@H](O)CNc1cc(ncc1I)F dd1fc6cf2bf1180484f5b025553146b2 [0,2,0,0,0,0|2,0,0]=4 8960 B13R1.893 C[C@@H](O)CNc1nc(ccc1F)F 57133d6f91bff1fd1e7416092ee20c3a [0,2,0,0,0,0|2,0,0]=4 8961 B13R1.893 C[C@@H](O)CNc1nc(ccc1N)N 3bf4c36ea3f1e14ba5e1ca00498cfbb0 [0,2,0,0,0,0|2,0,0]=4 8962 B13R1.893 C[C@H](O)CNc1cc(ccc1Br)Br 2d18cf1d8713d5b566dcc46df707a954 [0,2,0,0,0,0|1,0,0]=3 8963 B13R1.893 C[C@H](O)CNc1cc(ccc1Br)Cl 95244ec4e495f3fbb914c2d87843f441 [0,2,0,0,0,0|1,0,0]=3 8964 B13R1.893 C[C@H](O)CNc1cc(ccc1Br)F b2717e8dec627029165893ee9d880785 [0,2,0,0,0,0|1,0,0]=3 8965 B13R1.893 C[C@H](O)CNc1cc(ccc1Br)I 8916f096b57ebecedcda39388c2db897 [0,2,0,0,0,0|1,0,0]=3 8966 B13R1.893 C[C@H](O)CNc1cc(ccc1Cl)Br ef996ec22615473d02b3a8632dd0c188 [0,2,0,0,0,0|1,0,0]=3 8967 B13R1.893 C[C@H](O)CNc1cc(ccc1Cl)Cl 4e005b3b159f956ce2b3b6de8db2ffe2 [0,2,0,0,0,0|1,0,0]=3 8968 B13R1.893 C[C@H](O)CNc1cc(ccc1Cl)F 28586de426e9f81c278f6d0160f8742f [0,2,0,0,0,0|1,0,0]=3 8969 B13R1.893 C[C@H](O)CNc1cc(ccc1Cl)I e737134119ca5da5b0f581b9816bcbfd [0,2,0,0,0,0|1,0,0]=3 8970 B13R1.893 C[C@H](O)CNc1cc(ccc1F)Br c9ea6e7182186d88f3fd80362f178506 [0,2,0,0,0,0|1,0,0]=3 8971 B13R1.893 C[C@H](O)CNc1cc(ccc1F)Cl 01814df583f2a375ac21e0a8e1a11c0d [0,2,0,0,0,0|1,0,0]=3 8972 B13R1.893 C[C@H](O)CNc1cc(ccc1F)F 8e14d4ac868902a60d9cac5f4b144eba [0,2,0,0,0,0|1,0,0]=3 8973 B13R1.893 C[C@H](O)CNc1cc(ccc1F)I f18ac8b5ab915658f7a4f73eec75c3ea [0,2,0,0,0,0|1,0,0]=3 8974 B13R1.893 C[C@H](O)CNc1cc(ccc1I)Br d3e46ea9227dc6163400875dbb9d4da2 [0,2,0,0,0,0|1,0,0]=3 8975 B13R1.893 C[C@H](O)CNc1cc(ccc1I)Cl 53ee786aaff5fe31a2aff3cc70b1e2da [0,2,0,0,0,0|1,0,0]=3 8976 B13R1.893 C[C@H](O)CNc1cc(ccc1I)F 9487dcd126390bd87cab164b09ebf47b [0,2,0,0,0,0|1,0,0]=3 8977 B13R1.893 C[C@H](O)CNc1cc(ccc1S)Br b735be7a7d85f0603ee2a61c7794918e [0,2,0,0,0,0|1,0,0]=3 8978 B13R1.893 C[C@H](O)CNc1cc(ccc1S)Cl 9ead4d5e9f11e48e636e6a825184ec4b [0,2,0,0,0,0|1,0,0]=3 8979 B13R1.893 C[C@H](O)CNc1cc(ccc1S)F 4d4f4da67f4de5431496696fc18ef03d [0,2,0,0,0,0|1,0,0]=3 8980 B13R1.893 C[C@H](O)CNc1cc(cnc1Br)Br cefe00b1d05c18e3244fdbd835bc91b9 [0,2,0,0,0,0|2,0,0]=4 8981 B13R1.893 C[C@H](O)CNc1cc(cnc1Br)Cl 2f9a8d2a7c49a17c791451eedfa8a219 [0,2,0,0,0,0|2,0,0]=4 8982 B13R1.893 C[C@H](O)CNc1cc(cnc1Br)F d848e7fd5428d54ee6ac2badab6a2699 [0,2,0,0,0,0|2,0,0]=4 8983 B13R1.893 C[C@H](O)CNc1cc(cnc1Br)I ac496ba120a48916e36a8a39440fd4a2 [0,2,0,0,0,0|2,0,0]=4 8984 B13R1.893 C[C@H](O)CNc1cc(cnc1Cl)Br 32295dc2e8163eb24a507b30d4bf2af9 [0,2,0,0,0,0|2,0,0]=4 8985 B13R1.893 C[C@H](O)CNc1cc(cnc1Cl)Cl 0dd7c2e31885efaca8213d05481d3ef0 [0,2,0,0,0,0|2,0,0]=4 8986 B13R1.893 C[C@H](O)CNc1cc(cnc1Cl)F 2b2a30ec0aca50bdf600284ec1f94466 [0,2,0,0,0,0|2,0,0]=4 8987 B13R1.893 C[C@H](O)CNc1cc(cnc1Cl)I 527341dfd6672c906ae4dc2967b1cb07 [0,2,0,0,0,0|2,0,0]=4 8988 B13R1.893 C[C@H](O)CNc1cc(cnc1F)Br 438f453dda2be2869ee069d24421362d [0,2,0,0,0,0|2,0,0]=4 8989 B13R1.893 C[C@H](O)CNc1cc(cnc1F)Cl 1282c05aa47806c9a0d2a416f57b1fe9 [0,2,0,0,0,0|2,0,0]=4 8990 B13R1.893 C[C@H](O)CNc1cc(cnc1I)Br 1f881868974746a44207560db5509b19 [0,2,0,0,0,0|2,0,0]=4 8991 B13R1.893 C[C@H](O)CNc1cc(cnc1I)Cl 938c9451ccb5ddc4b9e164807f072f3a [0,2,0,0,0,0|2,0,0]=4 8992 B13R1.893 C[C@H](O)CNc1cc(cnc1N)N 10303ac9aee51855b3d79108cc0495dd [0,2,0,0,0,0|2,0,0]=4 8993 B13R1.893 C[C@H](O)CNc1cc(ncc1Br)Br d5233d30db0b9f53fb7915002f24b3b3 [0,2,0,0,0,0|2,0,0]=4 8994 B13R1.893 C[C@H](O)CNc1cc(ncc1Br)Cl 1d07869350d0db39e99a384652d3c8d8 [0,2,0,0,0,0|2,0,0]=4 8995 B13R1.893 C[C@H](O)CNc1cc(ncc1Br)F d3168c915c7a4259f84210f73f9d1e95 [0,2,0,0,0,0|2,0,0]=4 8996 B13R1.893 C[C@H](O)CNc1cc(ncc1Cl)Br 45df45a9ee58db4851709b2489d28a3c [0,2,0,0,0,0|2,0,0]=4 8997 B13R1.893 C[C@H](O)CNc1cc(ncc1Cl)Cl 0b5f918843e884067e6a516a2c706e8e [0,2,0,0,0,0|2,0,0]=4 8998 B13R1.893 C[C@H](O)CNc1cc(ncc1Cl)F d18f5399c4183a2450bf8b92a0552c6c [0,2,0,0,0,0|2,0,0]=4 8999 B13R1.893 C[C@H](O)CNc1cc(ncc1F)Br 690d26f0447db718727bfbc776e97ee8 [0,2,0,0,0,0|2,0,0]=4 9000 B13R1.893 C[C@H](O)CNc1cc(ncc1F)Cl e9d20684ffe0fb492c14c00a77940d63 [0,2,0,0,0,0|2,0,0]=4 9001 B13R1.893 C[C@H](O)CNc1cc(ncc1F)F f0c94a09f7a24115f92dc35625f3ef0d [0,2,0,0,0,0|2,0,0]=4 9002 B13R1.893 C[C@H](O)CNc1cc(ncc1I)Br 04a8503c8b25f69ef95ff7707763cbf2 [0,2,0,0,0,0|2,0,0]=4 9003 B13R1.893 C[C@H](O)CNc1cc(ncc1I)Cl b32bc2ea1850fcac94721c909eb3345c [0,2,0,0,0,0|2,0,0]=4 9004 B13R1.893 C[C@H](O)CNc1cc(ncc1I)F fef811d64a1ce60de22aaaec9aab9c51 [0,2,0,0,0,0|2,0,0]=4 9005 B13R1.893 C[C@H](O)CNc1nc(ccc1Br)Br 9ace67bd24b266ede32b123d80165b4c [0,2,0,0,0,0|2,0,0]=4 9006 B13R1.893 C[C@H](O)CNc1nc(ccc1Br)Cl c3e5a6941829fd58623bd60eb270ff06 [0,2,0,0,0,0|2,0,0]=4 9007 B13R1.893 C[C@H](O)CNc1nc(ccc1Br)F bec60adc7268e5eb354d308e9fc36a6c [0,2,0,0,0,0|2,0,0]=4 9008 B13R1.893 C[C@H](O)CNc1nc(ccc1Br)I a0f31ef2257daed3d33679f7da154b1b [0,2,0,0,0,0|2,0,0]=4 9009 B13R1.893 C[C@H](O)CNc1nc(ccc1Cl)Br 690a321cc6b62c3ea526f82ee8539bd3 [0,2,0,0,0,0|2,0,0]=4 9010 B13R1.893 C[C@H](O)CNc1nc(ccc1Cl)Cl de1821c2293a88d40842c2a526407a09 [0,2,0,0,0,0|2,0,0]=4 9011 B13R1.893 C[C@H](O)CNc1nc(ccc1F)Br 72e44911f7db1b91c0d78fed158fec90 [0,2,0,0,0,0|2,0,0]=4 9012 B13R1.893 C[C@H](O)CNc1nc(ccc1F)Cl 8c4023b7d0868277b40aa91006b2d70f [0,2,0,0,0,0|2,0,0]=4 9013 B13R1.893 C[C@H](O)CNc1nc(ccc1F)F 1c724fd8e73961897a417d025f6a0380 [0,2,0,0,0,0|2,0,0]=4 9014 B13R1.893 C[C@H](O)CNc1nc(ccc1I)Br 12d1427c414f891263ef5d223657f2aa [0,2,0,0,0,0|2,0,0]=4 9015 B13R1.893 C[C@H](O)CNc1nc(ccc1I)Cl d6de6889aa05384e6dd5fbd38c61f6d2 [0,2,0,0,0,0|2,0,0]=4 9016 B13R1.893 C[C@H](O)CNc1nc(ccc1N)N 4932ae93b0b649243a987e67c7e3de9e [0,2,0,0,0,0|2,0,0]=4 9017 B13R1.893 Cc1cc(c(cn1)C)NCC(C)O bc1d91559115df3e6c2043ca35eaba63 [0,2,0,0,0,0|2,0,0]=4 9018 B13R1.893 Cc1cc(c(cn1)C)NC[C@H](C)O dc787c621ec9a03e1d71b4ee79c76c75 [0,2,0,0,0,0|2,0,0]=4 9019 B13R1.893 Cc1cc(c(cn1)Cl)NCC(C)O dc2a3f9fd46b3057eb54e3c2d7280460 [0,2,0,0,0,0|2,0,0]=4 9020 B13R1.893 Cc1cc(c(cn1)Cl)NC[C@H](C)O fec3f9d18fc5f33997eac3168c4f6176 [0,2,0,0,0,0|2,0,0]=4 9021 B13R1.893 Cc1cc(c(cn1)F)NCC(C)O db7e1364fcc6ad0116312d2e6639cbda [0,2,0,0,0,0|2,0,0]=4 9022 B13R1.893 Cc1cc(c(cn1)F)NC[C@H](C)O 3393d429908eb6e73f85975eeafa4fb5 [0,2,0,0,0,0|2,0,0]=4 9023 B13R1.893 Cc1cc(c(cn1)I)NCC(C)O fad25119a8bc8ea4dcf6cd567ff46f27 [0,2,0,0,0,0|2,0,0]=4 9024 B13R1.893 Cc1cc(c(cn1)I)NC[C@H](C)O cc0728460a011a4e38d069b2fd30658c [0,2,0,0,0,0|2,0,0]=4 9025 B13R1.893 Cc1ccc(c(c1)CNC(C)C)Cl 34ae7562a821c1bc9c45d7dd0be82053 [0,2,0,0,0,0|2,0,0]=4 9026 B13R1.893 Cc1ccc(c(c1)CNC(C)C)F 6e612d2fa3a7158bc4141b6248153339 [0,2,0,0,0,0|2,0,0]=4 9027 B13R1.893 Cc1ccc(c(c1)COC(C)C)C 1fc2cb29e0fbafbc35f497d0566a1fd5 [0,2,0,0,0,0|2,0,0]=4 9028 B13R1.893 Cc1ccc(c(c1)COC(C)C)Cl 24140d1b630cb96889d1e3fbf4d54a38 [0,2,0,0,0,0|2,0,0]=4 9029 B13R1.893 Cc1ccc(c(c1)COC(C)C)F fcf09327a2d935a4b54d25c99ee4f417 [0,2,0,0,0,0|2,0,0]=4 9030 B13R1.893 Cc1ccc(c(c1)COC(C)C)I 8a3cf2c3625c4d571827c3e3f8236fec [0,2,0,0,0,0|2,0,0]=4 9031 B13R1.893 Cc1ccc(c(c1)NCC(C)C)C f3643520e204b4db7e79678745a5a861 [0,2,0,0,0,0|2,0,0]=4 9032 B13R1.893 Cc1ccc(c(c1)NCC(C)C)Cl 203981b1a66c1f5c9b0c6699ec6d2d4b [0,2,0,0,0,0|2,0,0]=4 9033 B13R1.893 Cc1ccc(c(c1)NCC(C)C)F d28aaaab0dd25506de0ebd2fd32500d3 [0,2,0,0,0,0|2,0,0]=4 9034 B13R1.893 Cc1ccc(c(c1)NCC(C)C)I a2cf2a218c5a6465b5d6f509adcf5995 [0,2,0,0,0,0|2,0,0]=4 9035 B13R1.893 Cc1ccc(c(c1)NCC(C)O)Br 66e3e39eb9635f3ad8868667b0fd1ebc [0,2,0,0,0,0|1,0,0]=3 9036 B13R1.893 Cc1ccc(c(c1)NCC(C)O)C b24336808f660c6dc4c909a069807104 [0,2,0,0,0,0|1,0,0]=3 9037 B13R1.893 Cc1ccc(c(c1)NCC(C)O)Cl 41eab59ae23d8163962fcba93f0eff01 [0,2,0,0,0,0|1,0,0]=3 9038 B13R1.893 Cc1ccc(c(c1)NCC(C)O)F e99975bf2fd2c9e7afb8c59f0af4831f [0,2,0,0,0,0|1,0,0]=3 9039 B13R1.893 Cc1ccc(c(c1)NCC(C)O)I 67602742ab4680ad243f386ded81b0e2 [0,2,0,0,0,0|1,0,0]=3 9040 B13R1.893 Cc1ccc(c(c1)NC[C@@H](C)O)C 6380b12f6e1205bc441f453e5d5c48d0 [0,2,0,0,0,0|1,0,0]=3 9041 B13R1.893 Cc1ccc(c(c1)NC[C@@H](C)O)I 5a173cc4bca1b5ece8421d2aa0b624d5 [0,2,0,0,0,0|1,0,0]=3 9042 B13R1.893 Cc1ccc(c(c1)NC[C@H](C)O)Br 615ac37b67a656a19a03c006251a9f3c [0,2,0,0,0,0|1,0,0]=3 9043 B13R1.893 Cc1ccc(c(c1)NC[C@H](C)O)C fb5389e7c84850eed3e7ae18e1dc0087 [0,2,0,0,0,0|1,0,0]=3 9044 B13R1.893 Cc1ccc(c(c1)NC[C@H](C)O)Cl 0c7828db59a501b5f1a2eb2cee50dc89 [0,2,0,0,0,0|1,0,0]=3 9045 B13R1.893 Cc1ccc(c(c1)NC[C@H](C)O)F c6c6687a4e095484460b3f249ad630d6 [0,2,0,0,0,0|1,0,0]=3 9046 B13R1.893 Cc1ccc(c(c1)NC[C@H](C)O)I 3612f0b23ebfcaf798756e9cd7cb83cf [0,2,0,0,0,0|1,0,0]=3 9047 B13R1.893 Cc1ccc(c(c1)OCC(C)C)C 29ce2187bcccbe6dbf2c870662665bd2 [0,2,0,0,0,0|2,0,0]=4 9048 B13R1.893 Cc1ccc(c(c1)OCC(C)C)Cl 79e02e640bdfe21871b941bb3c81dda2 [0,2,0,0,0,0|2,0,0]=4 9049 B13R1.893 Cc1ccc(c(c1)OCC(C)C)F bb142fd0a6381586f0f07d54eeda91be [0,2,0,0,0,0|2,0,0]=4 9050 B13R1.893 Cc1ccc(c(c1)OCC(C)C)I bb3b60aca67951ff5e7f7a4a862a4029 [0,2,0,0,0,0|2,0,0]=4 9051 B13R1.893 Cc1ccc(c(n1)NCC(C)O)Br 53b319864c8f831fddc7ec6b52f59cd0 [0,2,0,0,0,0|2,0,0]=4 9052 B13R1.893 Cc1ccc(c(n1)NCC(C)O)C 32d5875c8bfe1c3f6d4c9ddb05a89f72 [0,2,0,0,0,0|2,0,0]=4 9053 B13R1.893 Cc1ccc(c(n1)NCC(C)O)F 48aa54f03604952473c004628425329f [0,2,0,0,0,0|2,0,0]=4 9054 B13R1.893 Cc1ccc(c(n1)NCC(C)O)I 68d24be9a2dbd4e0552bd6130c55df77 [0,2,0,0,0,0|2,0,0]=4 9055 B13R1.893 Cc1ccc(c(n1)NC[C@@H](C)O)C b0d593a374bfadde12afd8a22b29f8fd [0,2,0,0,0,0|2,0,0]=4 9056 B13R1.893 Cc1ccc(c(n1)NC[C@@H](C)O)F feca74a80953751d1db55353b6d7fbc9 [0,2,0,0,0,0|2,0,0]=4 9057 B13R1.893 Cc1ccc(c(n1)NC[C@@H](C)O)I 4e0d0e22fd60d8b784acc5bd5a06f383 [0,2,0,0,0,0|2,0,0]=4 9058 B13R1.893 Cc1ccc(c(n1)NC[C@H](C)O)Br c567a014a5c15a6f3aa9f30d54c4e4b4 [0,2,0,0,0,0|2,0,0]=4 9059 B13R1.893 Cc1ccc(c(n1)NC[C@H](C)O)C bff298ac714b24bf11013bb6a6d4f741 [0,2,0,0,0,0|2,0,0]=4 9060 B13R1.893 Cc1ccc(c(n1)NC[C@H](C)O)F ea82a8a5dab11a9be8be6f08738c123c [0,2,0,0,0,0|2,0,0]=4 9061 B13R1.893 Cc1ccc(c(n1)NC[C@H](C)O)I ef49b103c831c022ef35195594a49176 [0,2,0,0,0,0|2,0,0]=4 9062 B13R1.893 Cc1ccc(cc1CNC(C)C)F 312623a32d32d717a91dddc73e94cacb [0,2,0,0,0,0|2,0,0]=4 9063 B13R1.893 Cc1ccc(cc1COC(C)C)Cl 44a6d354395293c2e76608501419d07c [0,2,0,0,0,0|2,0,0]=4 9064 B13R1.893 Cc1ccc(cc1COC(C)C)F ba1429a5272d9ede057bda9b40bd408c [0,2,0,0,0,0|2,0,0]=4 9065 B13R1.893 Cc1ccc(cc1COC(C)C)I 66de779fcf96a4d6871e7b5ea7f2c56a [0,2,0,0,0,0|2,0,0]=4 9066 B13R1.893 Cc1ccc(cc1NCC(C)C)Br cdfb20d42a7597ff498463ff6d56cef7 [0,2,0,0,0,0|2,0,0]=4 9067 B13R1.893 Cc1ccc(cc1NCC(C)C)Cl 3c1e2c401e93bf84542014ed80ccb01f [0,2,0,0,0,0|2,0,0]=4 9068 B13R1.893 Cc1ccc(cc1NCC(C)C)F c8bcbf1f2f51ec794879562db44ebd00 [0,2,0,0,0,0|2,0,0]=4 9069 B13R1.893 Cc1ccc(cc1NCC(C)C)I 942ef824647ad2d147639793468125a9 [0,2,0,0,0,0|2,0,0]=4 9070 B13R1.893 Cc1ccc(cc1NCC(C)C)O 65f27e432eb7d1664d64aaf9eec85a89 [0,2,0,0,0,0|2,0,0]=4 9071 B13R1.893 Cc1ccc(cc1NCC(C)O)Br 3b917219bf5153b928c044b1cac36988 [0,2,0,0,0,0|1,0,0]=3 9072 B13R1.893 Cc1ccc(cc1NCC(C)O)Cl 2a04e70c06f0c64027872e87090f1918 [0,2,0,0,0,0|1,0,0]=3 9073 B13R1.893 Cc1ccc(cc1NCC(C)O)F 20d837a9dc42b6009f54edcf18460132 [0,2,0,0,0,0|1,0,0]=3 9074 B13R1.893 Cc1ccc(cc1NCC(C)O)I 644280f58ec5abfe91c9cd42fdf9c60c [0,2,0,0,0,0|1,0,0]=3 9075 B13R1.893 Cc1ccc(cc1NC[C@H](C)O)Br c1d1047431c52238e82d100887756098 [0,2,0,0,0,0|1,0,0]=3 9076 B13R1.893 Cc1ccc(cc1NC[C@H](C)O)Cl 83b22a2af8583ba41b0a87a7bc41ef1f [0,2,0,0,0,0|1,0,0]=3 9077 B13R1.893 Cc1ccc(cc1NC[C@H](C)O)F d71997dc6310e9f13102ba61a7d228aa [0,2,0,0,0,0|1,0,0]=3 9078 B13R1.893 Cc1ccc(cc1NC[C@H](C)O)I 1132335e164d860209b6f459595328d0 [0,2,0,0,0,0|1,0,0]=3 9079 B13R1.893 Cc1ccc(cc1OCC(C)C)Br ded0f34af80b6dbe4b8692fc6b6745e1 [0,2,0,0,0,0|2,0,0]=4 9080 B13R1.893 Cc1ccc(cc1OCC(C)C)Cl 8301f305ba490bad542590a5b58cd23a [0,2,0,0,0,0|2,0,0]=4 9081 B13R1.893 Cc1ccc(cc1OCC(C)C)F a86997865114989776cc55292b94ee30 [0,2,0,0,0,0|2,0,0]=4 9082 B13R1.893 Cc1ccc(cc1OCC(C)C)I 4a122f902626915d37303d0cd7b78201 [0,2,0,0,0,0|2,0,0]=4 9083 B13R1.893 Cc1ccc(nc1NCC(C)O)Br fb3becd6274a5c22ff9e4272c49cbd78 [0,2,0,0,0,0|2,0,0]=4 9084 B13R1.893 Cc1ccc(nc1NCC(C)O)Cl 27801b531b5b560ca3b9d4a652c9f420 [0,2,0,0,0,0|2,0,0]=4 9085 B13R1.893 Cc1ccc(nc1NC[C@H](C)O)Br 5fe9837a922f7b7e98a278354ae1f736 [0,2,0,0,0,0|2,0,0]=4 9086 B13R1.893 Cc1ccc(nc1NC[C@H](C)O)Cl 5f9dfbe04ab10ce0d95a4373cef770bb [0,2,0,0,0,0|2,0,0]=4 9087 B13R1.893 Cc1cnc(c(c1)NCC(C)O)Br 516c1967285230a9952ac53ca1135143 [0,2,0,0,0,0|2,0,0]=4 9088 B13R1.893 Cc1cnc(c(c1)NCC(C)O)C 5671e681f68a12539c9bb94601e88fb0 [0,2,0,0,0,0|2,0,0]=4 9089 B13R1.893 Cc1cnc(c(c1)NCC(C)O)Cl d7b37dd9a419a2d6a72c992dce3e0a03 [0,2,0,0,0,0|2,0,0]=4 9090 B13R1.893 Cc1cnc(c(c1)NCC(C)O)F b6d80f8ab7a281b5b1e1d27ffaf72d89 [0,2,0,0,0,0|2,0,0]=4 9091 B13R1.893 Cc1cnc(c(c1)NC[C@@H](C)O)C ad802d5cc0e2d3494494b862a44eba7d [0,2,0,0,0,0|2,0,0]=4 9092 B13R1.893 Cc1cnc(c(c1)NC[C@H](C)O)Br f21de88eaee097e88cac0eb117b54454 [0,2,0,0,0,0|2,0,0]=4 9093 B13R1.893 Cc1cnc(c(c1)NC[C@H](C)O)C b12010fb3bbf0bb810d29f64539956d6 [0,2,0,0,0,0|2,0,0]=4 9094 B13R1.893 Cc1cnc(c(c1)NC[C@H](C)O)Cl 9c8c7587cee0010c85c56581b6ee68cb [0,2,0,0,0,0|2,0,0]=4 9095 B13R1.893 Cc1cnc(c(c1)NC[C@H](C)O)F df8c45c94cbb1f0c134677d882339c77 [0,2,0,0,0,0|2,0,0]=4 9096 B13R1.893 Cc1cnc(cc1NCC(C)O)Br 25038845ea3f8d2494ac278857050afb [0,2,0,0,0,0|2,0,0]=4 9097 B13R1.893 Cc1cnc(cc1NCC(C)O)Cl d51cd8d0e1c609ad3e39b271ef2e0a73 [0,2,0,0,0,0|2,0,0]=4 9098 B13R1.893 Cc1cnc(cc1NCC(C)O)F f329fc1a2cd3cdfce2945f394b292740 [0,2,0,0,0,0|2,0,0]=4 9099 B13R1.893 Cc1cnc(cc1NC[C@H](C)O)Br 6d188779c5ad2fccfe174117d7e02bff [0,2,0,0,0,0|2,0,0]=4 9100 B13R1.893 Cc1cnc(cc1NC[C@H](C)O)Cl 71cae79009a8f80280546209590bd49a [0,2,0,0,0,0|2,0,0]=4 9101 B13R1.893 Cc1cnc(cc1NC[C@H](C)O)F fb76f77a47710da6de2c29fd47a2aa85 [0,2,0,0,0,0|2,0,0]=4 9102 B13R1.893 Cc1ncc(cc1NCC(C)O)Br e8d60d98d8e7f0f8cbe33393eb785df7 [0,2,0,0,0,0|2,0,0]=4 9103 B13R1.893 Cc1ncc(cc1NCC(C)O)Cl 305294d10307a2d17fdc51b2d3a43830 [0,2,0,0,0,0|2,0,0]=4 9104 B13R1.893 Cc1ncc(cc1NCC(C)O)F c6a5e4d3eedca185a2720e93fa115be0 [0,2,0,0,0,0|2,0,0]=4 9105 B13R1.893 Cc1ncc(cc1NC[C@@H](C)O)Br 8e6b5ee6b5432890d6108f6a89e0a288 [0,2,0,0,0,0|2,0,0]=4 9106 B13R1.893 Cc1ncc(cc1NC[C@@H](C)O)Cl 53e76b07b5f7acb2daf5613cd497a16c [0,2,0,0,0,0|2,0,0]=4 9107 B13R1.893 Cc1ncc(cc1NC[C@@H](C)O)F 779b6c736d77202cf19442b9b6c7f44c [0,2,0,0,0,0|2,0,0]=4 9108 B13R1.893 Cc1ncc(cc1NC[C@H](C)O)Br 38e4d191b6c7ddd1a805454aacce1879 [0,2,0,0,0,0|2,0,0]=4 9109 B13R1.893 Cc1ncc(cc1NC[C@H](C)O)Cl b0625aa6c484a2970f441a7f707902e8 [0,2,0,0,0,0|2,0,0]=4 9110 B13R1.893 Cc1ncc(cc1NC[C@H](C)O)F 8a24a5a05b5b472b634efd4151b8d5b6 [0,2,0,0,0,0|2,0,0]=4 9111 B13R1.3787 CC(C)CNc1c(cccc1Br)Br f48c8841aa890dc662e40f9077f8fa4d [0,2,0,0,0,0|2,0,0]=4 9112 B13R1.3787 CC(C)CNc1c(cccc1Br)Cl 437c8e542507ba07c16d6a224b54334b [0,2,0,0,0,0|2,0,0]=4 9113 B13R1.3787 CC(C)CNc1c(cccc1Br)F 7201746ac6cf6d9d297cc08db29388c0 [0,2,0,0,0,0|2,0,0]=4 9114 B13R1.3787 CC(C)CNc1c(cccc1Cl)Cl 981043711b38d60ecd5acdd3dec8282b [0,2,0,0,0,0|2,0,0]=4 9115 B13R1.3787 CC(C)CNc1c(cccc1Cl)F 9e29d0ee609089ac1f3bb75fd4530f0f [0,2,0,0,0,0|2,0,0]=4 9116 B13R1.3787 CC(C)CNc1c(cccc1Cl)S d74a4f8df8bdff79c22b3b2680dfd554 [0,2,0,0,0,0|2,0,0]=4 9117 B13R1.3787 CC(C)CNc1c(cccc1F)F 451d50b551e3e2bc63d663c85dd30d06 [0,2,0,0,0,0|2,0,0]=4 9118 B13R1.3787 CC(C)CNc1c(cccc1I)Br 5dc5b81bec1b1e6ef8972a8c9a4107f5 [0,2,0,0,0,0|2,0,0]=4 9119 B13R1.3787 CC(C)CNc1c(cccc1I)Cl 7ec857d89784b2565ed626fb113e2a3d [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.3787 CC(C)CNc1c(cccc1I)F 1a5a579e2d138829f061557786383abf [0,2,0,0,0,0|2,0,0]=4 9121 B13R1.3787 CC(C)CNc1c(cccc1S)F d4aa534db5f551d9d64568c0faa79944 [0,2,0,0,0,0|2,0,0]=4 9122 B13R1.3787 CC(C)COc1c(cccc1Br)Br 8064493fbf8320391781d9f874221026 [0,2,0,0,0,0|2,0,0]=4 9123 B13R1.3787 CC(C)COc1c(cccc1Br)Cl 79993aa2a325ebb76e87cf9a4b625403 [0,2,0,0,0,0|2,0,0]=4 9124 B13R1.3787 CC(C)COc1c(cccc1Br)F fda28c58ba43960630335009bf8ee040 [0,2,0,0,0,0|2,0,0]=4 9125 B13R1.3787 CC(C)COc1c(cccc1Cl)Cl 50e3f8cdb5a6725b96ace8ea75e6c202 [0,2,0,0,0,0|2,0,0]=4 9126 B13R1.3787 CC(C)COc1c(cccc1Cl)F 445f5471eeba4932f3722f7a0e5c1201 [0,2,0,0,0,0|2,0,0]=4 9127 B13R1.3787 CC(C)COc1c(cccc1F)F 70a02f0a8959950b04cf4dae933a1b87 [0,2,0,0,0,0|2,0,0]=4 9128 B13R1.3787 CC(C)COc1c(cccc1I)Cl daff9531e7878417a627f1f83a549111 [0,2,0,0,0,0|2,0,0]=4 9129 B13R1.3787 CC(C)COc1c(cccc1I)F 2d2e016950252a990c42cd88625f4ec2 [0,2,0,0,0,0|2,0,0]=4 9130 B13R1.3787 CC(C)COc1c(cccc1I)I c29218ebabfefd18345cbda71dd4cf23 [0,2,0,0,0,0|2,0,0]=4 9131 B13R1.3787 CC(C)NCc1c(cccc1Br)Br bccad78f3122b5c007e51043ec4b2788 [0,2,0,0,0,0|2,0,0]=4 9132 B13R1.3787 CC(C)NCc1c(cccc1Br)Cl 99ce78f10ca8cebd62e656824b7d96af [0,2,0,0,0,0|2,0,0]=4 9133 B13R1.3787 CC(C)NCc1c(cccc1Br)F 44c2b927325cd96e6da395e335dd63e0 [0,2,0,0,0,0|2,0,0]=4 9134 B13R1.3787 CC(C)NCc1c(cccc1Cl)Cl a65adc4124d71e5a8bdd2d7b71a93aa7 [0,2,0,0,0,0|2,0,0]=4 9135 B13R1.3787 CC(C)NCc1c(cccc1Cl)F 9179b1db4b52ddbd8e59a17ba0393547 [0,2,0,0,0,0|2,0,0]=4 9136 B13R1.3787 CC(C)NCc1c(cccc1F)F 803948f3294d2521c561c8680883010f [0,2,0,0,0,0|2,0,0]=4 9137 B13R1.3787 CC(C)OCc1c(cccc1Br)Br 721c28e5b248d398f67751390d319efc [0,2,0,0,0,0|2,0,0]=4 9138 B13R1.3787 CC(C)OCc1c(cccc1Br)Cl ee46bf06bee000906b664838b6880d15 [0,2,0,0,0,0|2,0,0]=4 9139 B13R1.3787 CC(C)OCc1c(cccc1Cl)Cl 9d6ccb82decce68657a6cf7e9a42f94d [0,2,0,0,0,0|2,0,0]=4 9140 B13R1.3787 CC(C)OCc1c(cccc1Cl)F ba35301cf55feb4d35db38ff64e22298 [0,2,0,0,0,0|2,0,0]=4 9141 B13R1.3787 CC(C)OCc1c(cccc1F)F b515c6a00f5f69d21131e73232f69a30 [0,2,0,0,0,0|2,0,0]=4 9142 B13R1.3787 CC(C)OCc1c(cccc1I)Cl 1f5d714df9039e9e5a600b0db328ec95 [0,2,0,0,0,0|2,0,0]=4 9143 B13R1.3787 CC(C)OCc1c(cccc1I)F d03a0d3f3817ef4bf475f0286d630abb [0,2,0,0,0,0|2,0,0]=4 9144 B13R1.3787 CC(O)CNc1c(cc[nH]c1=O)F 29351006fb13c9c91c43d7c2caad4130 [0,2,0,0,0,0|2,0,0]=4 9145 B13R1.3787 CC(O)CNc1c(cccc1Br)Br 11de047e8c8e7c4e79be05e2577ae112 [0,2,0,0,0,0|1,0,0]=3 9146 B13R1.3787 CC(O)CNc1c(cccc1Br)Cl 5956279de7064b67f6bee30078c26918 [0,2,0,0,0,0|1,0,0]=3 9147 B13R1.3787 CC(O)CNc1c(cccc1Br)F 1cbd273f9cae0a0817ca922763aa2b7e [0,2,0,0,0,0|1,0,0]=3 9148 B13R1.3787 CC(O)CNc1c(cccc1Cl)Cl 540ad760f7eb236ab67ebe3040c1b149 [0,2,0,0,0,0|1,0,0]=3 9149 B13R1.3787 CC(O)CNc1c(cccc1Cl)F b37f83a1e59f205f0c98d471bf675592 [0,2,0,0,0,0|1,0,0]=3 9150 B13R1.3787 CC(O)CNc1c(cccc1Cl)S 1fb8848dcff3f6a01ab1baba6378e64f [0,2,0,0,0,0|1,0,0]=3 9151 B13R1.3787 CC(O)CNc1c(cccc1F)F 48a7b90c5779ddb0c5551ed390bdd079 [0,2,0,0,0,0|1,0,0]=3 9152 B13R1.3787 CC(O)CNc1c(cccc1I)Br 497c1939de02a174c311cf651e593eef [0,2,0,0,0,0|1,0,0]=3 9153 B13R1.3787 CC(O)CNc1c(cccc1I)Cl 29baca2fc6567c4276e2d31141d52ff0 [0,2,0,0,0,0|1,0,0]=3 9154 B13R1.3787 CC(O)CNc1c(cccc1I)F c01ece1b9b235423140401b58be03f03 [0,2,0,0,0,0|1,0,0]=3 9155 B13R1.3787 CC(O)CNc1c(cccc1S)F 32c7ece9cc12e97c0de72a97a40a3123 [0,2,0,0,0,0|1,0,0]=3 9156 B13R1.3787 CC(O)CNc1c(ccnc1Br)Br f98b3f43fd53f8b30b2f5e7f5271f003 [0,2,0,0,0,0|2,0,0]=4 9157 B13R1.3787 CC(O)CNc1c(ccnc1Br)Cl e6305bc727f9a628a378b4b541493297 [0,2,0,0,0,0|2,0,0]=4 9158 B13R1.3787 CC(O)CNc1c(ccnc1Cl)Br 0d344d2d6e47031b5128b65825b6529e [0,2,0,0,0,0|2,0,0]=4 9159 B13R1.3787 CC(O)CNc1c(ccnc1Cl)Cl 1d66963cc6b845ab8fbdfa1d611390d4 [0,2,0,0,0,0|2,0,0]=4 9160 B13R1.3787 CC(O)CNc1c(ccnc1Cl)I 2a0d2d86597e6e490308d72be6d810ea [0,2,0,0,0,0|2,0,0]=4 9161 B13R1.3787 CC(O)CNc1c(ccnc1F)Cl d4eac58a98baccb6977f26993b60b88b [0,2,0,0,0,0|2,0,0]=4 9162 B13R1.3787 CC(O)CNc1c(ccnc1F)F aff11f2d3c412e9109531f4d0a9e63f4 [0,2,0,0,0,0|2,0,0]=4 9163 B13R1.3787 CC(O)CNc1c(ccnc1N)N e31ea0eb17baf2bfd4ecc1a09ae8c221 [0,2,0,0,0,0|2,0,0]=4 9164 B13R1.3787 CC(O)CNc1c(cncc1Br)Br ee41c55194831e42d79fd5750fb62f8c [0,2,0,0,0,0|2,0,0]=4 9165 B13R1.3787 CC(O)CNc1c(cncc1Br)Cl db4d57fe7ce35caf7e80385d1b536ffd [0,2,0,0,0,0|2,0,0]=4 9166 B13R1.3787 CC(O)CNc1c(cncc1Br)F 62c8aef5318d773a95dfd9db64e28a4c [0,2,0,0,0,0|2,0,0]=4 9167 B13R1.3787 CC(O)CNc1c(cncc1Cl)Cl d169ce6f4714aab35a08c145e1d273f8 [0,2,0,0,0,0|2,0,0]=4 9168 B13R1.3787 CC(O)CNc1c(cncc1F)F 50e2a806a347964dc542ee927116d31f [0,2,0,0,0,0|2,0,0]=4 9169 B13R1.3787 CC(O)CNc1c(cncc1I)Br bb166da82e781f9e40b667692f6a5780 [0,2,0,0,0,0|2,0,0]=4 9170 B13R1.3787 CC(O)CNc1c(cncc1I)Cl 6ef7bd718d868abf27eaa9c55889492e [0,2,0,0,0,0|2,0,0]=4 9171 B13R1.3787 CC(O)CNc1c(cncc1I)F 2ce4efee134da60cf8c913da7a5b6358 [0,2,0,0,0,0|2,0,0]=4 9172 B13R1.3787 CC(O)CNc1c(cncc1I)I 70763a175bf8e158d760ad713a46c0a3 [0,2,0,0,0,0|2,0,0]=4 9173 B13R1.3787 C[C@@H](O)CNc1c(cccc1S)F 28da4b1396a45b939d9d7d574a628623 [0,2,0,0,0,0|1,0,0]=3 9174 B13R1.3787 C[C@@H](O)CNc1c(ccnc1Cl)Cl 56dd3e2c97e211f70695cd1d58aec06a [0,2,0,0,0,0|2,0,0]=4 9175 B13R1.3787 C[C@@H](O)CNc1c(ccnc1Cl)I 4a50619900ba32755c27d269908c19fb [0,2,0,0,0,0|2,0,0]=4 9176 B13R1.3787 C[C@@H](O)CNc1c(ccnc1F)Cl 136673b1e25a8886c27372ae4a0ff469 [0,2,0,0,0,0|2,0,0]=4 9177 B13R1.3787 C[C@@H](O)CNc1c(ccnc1F)F df201c26420a119b4858170d1e86d35d [0,2,0,0,0,0|2,0,0]=4 9178 B13R1.3787 C[C@@H](O)CNc1c(ccnc1N)N a89f466b3374e7ae9e50f06139923bc9 [0,2,0,0,0,0|2,0,0]=4 9179 B13R1.3787 C[C@@H](O)CNc1c(cncc1Br)Br 82308869569dc120c58f4e17bac30a90 [0,2,0,0,0,0|2,0,0]=4 9180 B13R1.3787 C[C@@H](O)CNc1c(cncc1Br)F 04a047a20157193dbadc9fafa3b60309 [0,2,0,0,0,0|2,0,0]=4 9181 B13R1.3787 C[C@@H](O)CNc1c(cncc1Cl)Cl 9980fc4aa7d5f9eeb7fdc34cd97c6b8b [0,2,0,0,0,0|2,0,0]=4 9182 B13R1.3787 C[C@@H](O)CNc1c(cncc1F)F 3f113b3798a994708fabee6820917888 [0,2,0,0,0,0|2,0,0]=4 9183 B13R1.3787 C[C@@H](O)CNc1c(cncc1I)Br 6e145f530e1f74e7ec78e6bf88d4f515 [0,2,0,0,0,0|2,0,0]=4 9184 B13R1.3787 C[C@@H](O)CNc1c(cncc1I)Cl 3157717d0ca43622d81b28fa1911f1eb [0,2,0,0,0,0|2,0,0]=4 9185 B13R1.3787 C[C@@H](O)CNc1c(cncc1I)F 4530927d2bb08ca10d1ef9948dda083d [0,2,0,0,0,0|2,0,0]=4 9186 B13R1.3787 C[C@@H](O)CNc1c(cncc1I)I cb455ca264fa9ccefa757fa71dfd3ff4 [0,2,0,0,0,0|2,0,0]=4 9187 B13R1.3787 C[C@H](O)CNc1c(cc[nH]c1=O)F a99474647746444ccc0fc3b413675fbe [0,2,0,0,0,0|2,0,0]=4 9188 B13R1.3787 C[C@H](O)CNc1c(cccc1Br)Br a9f1764c4e36414f77582af5cd1586b8 [0,2,0,0,0,0|1,0,0]=3 9189 B13R1.3787 C[C@H](O)CNc1c(cccc1Br)Cl a354bfceb160c807a00705ce45c58e41 [0,2,0,0,0,0|1,0,0]=3 9190 B13R1.3787 C[C@H](O)CNc1c(cccc1Br)F b9d55d2b5a91c54b6d39ca9e2a399b66 [0,2,0,0,0,0|1,0,0]=3 9191 B13R1.3787 C[C@H](O)CNc1c(cccc1Cl)Cl fbeb3179e50cfbcf7b2bde24e80c52f2 [0,2,0,0,0,0|1,0,0]=3 9192 B13R1.3787 C[C@H](O)CNc1c(cccc1Cl)F e51bbbc1892bb9723e21729452484a11 [0,2,0,0,0,0|1,0,0]=3 9193 B13R1.3787 C[C@H](O)CNc1c(cccc1Cl)S 7efad8aa989c4d6c0017d39f67bbc6cb [0,2,0,0,0,0|1,0,0]=3 9194 B13R1.3787 C[C@H](O)CNc1c(cccc1F)F cdae250c84685873dd7f951747fc639a [0,2,0,0,0,0|1,0,0]=3 9195 B13R1.3787 C[C@H](O)CNc1c(cccc1I)Br ad8c3c243aea93931b41e2b838131033 [0,2,0,0,0,0|1,0,0]=3 9196 B13R1.3787 C[C@H](O)CNc1c(cccc1I)Cl b0a7cdf4baf746a4e00a4ebeed81cff2 [0,2,0,0,0,0|1,0,0]=3 9197 B13R1.3787 C[C@H](O)CNc1c(cccc1I)F e38803ebf028546f14d264cbe0323c6b [0,2,0,0,0,0|1,0,0]=3 9198 B13R1.3787 C[C@H](O)CNc1c(cccc1S)F 13c93e9b76eaca95195ee46e8c3e9616 [0,2,0,0,0,0|1,0,0]=3 9199 B13R1.3787 C[C@H](O)CNc1c(ccnc1Br)Br b94b029de25fbd6857661ca6b61497d8 [0,2,0,0,0,0|2,0,0]=4 9200 B13R1.3787 C[C@H](O)CNc1c(ccnc1Br)Cl a0460279ef2b14d631f6ab36cc97e71a [0,2,0,0,0,0|2,0,0]=4 9201 B13R1.3787 C[C@H](O)CNc1c(ccnc1Cl)Br e2c3c47289802158cd0a6e9f493f9248 [0,2,0,0,0,0|2,0,0]=4 9202 B13R1.3787 C[C@H](O)CNc1c(ccnc1Cl)Cl ceed421edb3d049215a04fd3791e9dce [0,2,0,0,0,0|2,0,0]=4 9203 B13R1.3787 C[C@H](O)CNc1c(ccnc1Cl)I 57ba1643fa4eb8a9e8cfca85bca50694 [0,2,0,0,0,0|2,0,0]=4 9204 B13R1.3787 C[C@H](O)CNc1c(ccnc1F)Cl 42ec5896a9b85316765918d8b808f600 [0,2,0,0,0,0|2,0,0]=4 9205 B13R1.3787 C[C@H](O)CNc1c(ccnc1F)F 875a43de321d2c88271a280dcc2efec5 [0,2,0,0,0,0|2,0,0]=4 9206 B13R1.3787 C[C@H](O)CNc1c(ccnc1N)N abe55477694d2d2197c6cc32659193c5 [0,2,0,0,0,0|2,0,0]=4 9207 B13R1.3787 C[C@H](O)CNc1c(cncc1Br)Br 31844c56b29d8727b1ed6bdda5358ae8 [0,2,0,0,0,0|2,0,0]=4 9208 B13R1.3787 C[C@H](O)CNc1c(cncc1Br)Cl d923aa1e164fb8c4ba1bb89aeb89151e [0,2,0,0,0,0|2,0,0]=4 9209 B13R1.3787 C[C@H](O)CNc1c(cncc1Br)F a5dd9d9a6b2f576476abc9fe03c31f19 [0,2,0,0,0,0|2,0,0]=4 9210 B13R1.3787 C[C@H](O)CNc1c(cncc1Cl)Cl ec9cb27b434baaa191aed66e0f818cdd [0,2,0,0,0,0|2,0,0]=4 9211 B13R1.3787 C[C@H](O)CNc1c(cncc1F)F 958610662f1de526135e011c3b1ccae8 [0,2,0,0,0,0|2,0,0]=4 9212 B13R1.3787 C[C@H](O)CNc1c(cncc1I)Br 9fb4cd86a4aa4b73d93d02dbf8884367 [0,2,0,0,0,0|2,0,0]=4 9213 B13R1.3787 C[C@H](O)CNc1c(cncc1I)Cl d75e5275cb39ffb26594906bfa03c44b [0,2,0,0,0,0|2,0,0]=4 9214 B13R1.3787 C[C@H](O)CNc1c(cncc1I)F afe56d77d93e2cb7ff3631a959c53491 [0,2,0,0,0,0|2,0,0]=4 9215 B13R1.3787 C[C@H](O)CNc1c(cncc1I)I bbd51eaf27c402a414425d87a1b63827 [0,2,0,0,0,0|2,0,0]=4 9216 B13R1.3787 Cc1cccc(c1CNC(C)C)C 8e1918afd9e9904507d9f33c96f885ad [0,2,0,0,0,0|2,0,0]=4 9217 B13R1.3787 Cc1cccc(c1CNC(C)C)Cl 09e78c51b6e758a8f41690983bee50f0 [0,2,0,0,0,0|2,0,0]=4 9218 B13R1.3787 Cc1cccc(c1CNC(C)C)F 54320453c6a840d4bf3468953c505106 [0,2,0,0,0,0|2,0,0]=4 9219 B13R1.3787 Cc1cccc(c1COC(C)C)C 10224fd0c8243b89b9451f0eb77c6c4e [0,2,0,0,0,0|2,0,0]=4 9220 B13R1.3787 Cc1cccc(c1COC(C)C)Cl ea8c775db7aec22c623e90db72984698 [0,2,0,0,0,0|2,0,0]=4 9221 B13R1.3787 Cc1cccc(c1COC(C)C)F 4c130c70d6c358318c42cd7261f58e16 [0,2,0,0,0,0|2,0,0]=4 9222 B13R1.3787 Cc1cccc(c1COC(C)C)I 6eecf7fcc64fd2756f0d60197f1b95b2 [0,2,0,0,0,0|2,0,0]=4 9223 B13R1.3787 Cc1cccc(c1NCC(C)C)Br cb18f95e650c84d77582511bdf119a33 [0,2,0,0,0,0|2,0,0]=4 9224 B13R1.3787 Cc1cccc(c1NCC(C)C)C c7bc261f2d794c658c00c891011d38e9 [0,2,0,0,0,0|2,0,0]=4 9225 B13R1.3787 Cc1cccc(c1NCC(C)C)Cl caf4ac4f1b2001c463ecb2eee88bb288 [0,2,0,0,0,0|2,0,0]=4 9226 B13R1.3787 Cc1cccc(c1NCC(C)C)F 7fa4fd7e8406f95f44ceea3ea0fdefd9 [0,2,0,0,0,0|2,0,0]=4 9227 B13R1.3787 Cc1cccc(c1NCC(C)C)I 7c187eac65475ef148baf1586ff32602 [0,2,0,0,0,0|2,0,0]=4 9228 B13R1.3787 Cc1cccc(c1NCC(C)O)Br 6f2c9eb231a2b8a774219828a682b678 [0,2,0,0,0,0|1,0,0]=3 9229 B13R1.3787 Cc1cccc(c1NCC(C)O)C 8ed9bded08b2b248b818ce4d4c4ba538 [0,2,0,0,0,0|1,0,0]=3 9230 B13R1.3787 Cc1cccc(c1NCC(C)O)Cl 80dbb2ee226b350162c37b4df6c517d5 [0,2,0,0,0,0|1,0,0]=3 9231 B13R1.3787 Cc1cccc(c1NCC(C)O)F 44a1299d47c7bd12fd658a7d237f0c0a [0,2,0,0,0,0|1,0,0]=3 9232 B13R1.3787 Cc1cccc(c1NCC(C)O)I 3092ef6c3fd389b015210a6dac3e3a5a [0,2,0,0,0,0|1,0,0]=3 9233 B13R1.3787 Cc1cccc(c1NC[C@H](C)O)Br 9bde55a3b1c4e607e78c064c6ebf3466 [0,2,0,0,0,0|1,0,0]=3 9234 B13R1.3787 Cc1cccc(c1NC[C@H](C)O)C 3c1b7438237713f2e13ae43b476c1cbe [0,2,0,0,0,0|1,0,0]=3 9235 B13R1.3787 Cc1cccc(c1NC[C@H](C)O)Cl 0244fb319033ca4997836970d993ac04 [0,2,0,0,0,0|1,0,0]=3 9236 B13R1.3787 Cc1cccc(c1NC[C@H](C)O)F e13f35078c824db1d5a85ca797398ddf [0,2,0,0,0,0|1,0,0]=3 9237 B13R1.3787 Cc1cccc(c1NC[C@H](C)O)I 6a202fe5e48758fbed01119c186d91a6 [0,2,0,0,0,0|1,0,0]=3 9238 B13R1.3787 Cc1cccc(c1OCC(C)C)Br 2218b41a0c858299241f82c94139647e [0,2,0,0,0,0|2,0,0]=4 9239 B13R1.3787 Cc1cccc(c1OCC(C)C)C 38e63b8cc4c92007e9b7aadeb34c6b3f [0,2,0,0,0,0|2,0,0]=4 9240 B13R1.3787 Cc1cccc(c1OCC(C)C)Cl 0974df2317f45b4fb0eb8a599d35b8a0 [0,2,0,0,0,0|2,0,0]=4 9241 B13R1.3787 Cc1cccc(c1OCC(C)C)F 2ecca6e721779e65fb3b59e1310719e0 [0,2,0,0,0,0|2,0,0]=4 9242 B13R1.3787 Cc1cccc(c1OCC(C)C)I c2f736db537c893d2f9ef71eab83284c [0,2,0,0,0,0|2,0,0]=4 9243 B13R1.3787 Cc1ccnc(c1NCC(C)O)Br bb056e4b6325aac034434cac453c3ff8 [0,2,0,0,0,0|2,0,0]=4 9244 B13R1.3787 Cc1ccnc(c1NCC(C)O)C 745ced05bcaf9d750719053a19c6aa3f [0,2,0,0,0,0|2,0,0]=4 9245 B13R1.3787 Cc1ccnc(c1NCC(C)O)Cl 22d01de6066f2a26d24b05d6da6d9b40 [0,2,0,0,0,0|2,0,0]=4 9246 B13R1.3787 Cc1ccnc(c1NCC(C)O)F d512da661615496f503961362f6e0fe8 [0,2,0,0,0,0|2,0,0]=4 9247 B13R1.3787 Cc1ccnc(c1NC[C@@H](C)O)C fb166358fd582d56b3e2dd9d645d67a8 [0,2,0,0,0,0|2,0,0]=4 9248 B13R1.3787 Cc1ccnc(c1NC[C@@H](C)O)Cl 668d1c5218a03bb2eb23947441a4f330 [0,2,0,0,0,0|2,0,0]=4 9249 B13R1.3787 Cc1ccnc(c1NC[C@@H](C)O)F 843a448558ce3c71c44c6d6089d71507 [0,2,0,0,0,0|2,0,0]=4 9250 B13R1.3787 Cc1ccnc(c1NC[C@H](C)O)Br e99adb8fd6d6dab03ef678170e528d73 [0,2,0,0,0,0|2,0,0]=4 9251 B13R1.3787 Cc1ccnc(c1NC[C@H](C)O)C 6eef8a7879a0c984df84f6371421acd4 [0,2,0,0,0,0|2,0,0]=4 9252 B13R1.3787 Cc1ccnc(c1NC[C@H](C)O)Cl 10c10e468a2f4572c67f33b5b521ce1c [0,2,0,0,0,0|2,0,0]=4 9253 B13R1.3787 Cc1ccnc(c1NC[C@H](C)O)F 48b4db651137d33b7e9838256fd2ddab [0,2,0,0,0,0|2,0,0]=4 9254 B13R1.3787 Cc1cncc(c1NCC(C)O)Br 5a21938f95628208da2138f6520cf3c6 [0,2,0,0,0,0|2,0,0]=4 9255 B13R1.3787 Cc1cncc(c1NCC(C)O)C 056de21dba05be973cbec470986259e7 [0,2,0,0,0,0|2,0,0]=4 9256 B13R1.3787 Cc1cncc(c1NCC(C)O)Cl b17023a4710b032b38d03d7430abad0d [0,2,0,0,0,0|2,0,0]=4 9257 B13R1.3787 Cc1cncc(c1NCC(C)O)F af7b24ac0849617e8bc140d189b08b86 [0,2,0,0,0,0|2,0,0]=4 9258 B13R1.3787 Cc1cncc(c1NCC(C)O)I 34bffe659b1c0adb2d66a03eb6636cb2 [0,2,0,0,0,0|2,0,0]=4 9259 B13R1.3787 Cc1cncc(c1NC[C@@H](C)O)Cl 5dc8cd2ca380eddd75a3e14cb918a798 [0,2,0,0,0,0|2,0,0]=4 9260 B13R1.3787 Cc1cncc(c1NC[C@@H](C)O)F 5a530457dee209f59513afca90ce2476 [0,2,0,0,0,0|2,0,0]=4 9261 B13R1.3787 Cc1cncc(c1NC[C@H](C)O)Br c5ac9ea6b917bcf3f432b224d4c985cb [0,2,0,0,0,0|2,0,0]=4 9262 B13R1.3787 Cc1cncc(c1NC[C@H](C)O)C 27536975805eeb344247b48b65f53c58 [0,2,0,0,0,0|2,0,0]=4 9263 B13R1.3787 Cc1cncc(c1NC[C@H](C)O)Cl 9ba1c2dcc200a45dbd504a3b0cac492c [0,2,0,0,0,0|2,0,0]=4 9264 B13R1.3787 Cc1cncc(c1NC[C@H](C)O)F e4f91fee873f331122dd123f2e0f7d13 [0,2,0,0,0,0|2,0,0]=4 9265 B13R1.3787 Cc1cncc(c1NC[C@H](C)O)I 97822a5ea107e602ed6f4b9bf8eddbf9 [0,2,0,0,0,0|2,0,0]=4 9266 B13R1.3787 Cc1nccc(c1NCC(C)O)Br 637fbd38cf57ce3dec6721351ad7f0ae [0,2,0,0,0,0|2,0,0]=4 9267 B13R1.3787 Cc1nccc(c1NCC(C)O)Cl a7e54ff383d1679e5b5366aa89bc3f90 [0,2,0,0,0,0|2,0,0]=4 9268 B13R1.3787 Cc1nccc(c1NC[C@@H](C)O)Cl 479586e653b67e126e4d1687f490874a [0,2,0,0,0,0|2,0,0]=4 9269 B13R1.3787 Cc1nccc(c1NC[C@H](C)O)Br 19ded7352f03e16bb039db9e2f525c77 [0,2,0,0,0,0|2,0,0]=4 9270 B13R1.3787 Cc1nccc(c1NC[C@H](C)O)Cl 107ed6abfa995f26b32580399e9f657a [0,2,0,0,0,0|2,0,0]=4 9271 B13R1.643 C#Cc1cc(ccn1)NCC(C)O c3296579ee3c54fba29bffa6eb830993 [0,2,0,0,0,0|2,0,0]=4 9272 B13R1.643 C#Cc1cc(ccn1)NC[C@@H](C)O c876a4a41aeff76fd6334f589b8dd0e9 [0,2,0,0,0,0|2,0,0]=4 9273 B13R1.643 C#Cc1cc(ccn1)NC[C@H](C)O b05e283b3002ac024854b96923fd6edc [0,2,0,0,0,0|2,0,0]=4 9274 B13R1.643 C#Cc1cccc(c1)CNC(C)C b2048ca746f5a8c6eb5b2837b415d0b9 [0,2,0,0,0,0|2,0,0]=4 9275 B13R1.643 C#Cc1cccc(c1)COC(C)C 9ae9fd72fbfa600aba8086d5a61248e2 [0,2,0,0,0,0|2,0,0]=4 9276 B13R1.643 C#Cc1cccc(c1)NCC(C)C 9bd70333849c8b1e61a0ba3fb2ae8b78 [0,2,0,0,0,0|2,0,0]=4 9277 B13R1.643 C#Cc1cccc(c1)NCC(C)O bcb971cb64d074eb5c7a45a5a62ca8ae [0,2,0,0,0,0|1,0,0]=3 9278 B13R1.643 C#Cc1cccc(c1)NC[C@@H](C)O 24d0a765326029289d15287710c37e56 [0,2,0,0,0,0|1,0,0]=3 9279 B13R1.643 C#Cc1cccc(c1)NC[C@H](C)O 4ca8406ff570d2f5eb053a96c2edb913 [0,2,0,0,0,0|1,0,0]=3 9280 B13R1.643 C#Cc1cccc(c1)OCC(C)C 9eaa4273b9d821d45b818b2f5da25db2 [0,2,0,0,0,0|2,0,0]=4 9281 B13R1.643 C#Cc1cccc(n1)NCC(C)O d33dea1411912c6476dce425dad5de75 [0,2,0,0,0,0|2,0,0]=4 9282 B13R1.643 C#Cc1cccc(n1)NC[C@@H](C)O ec674a3769b842f382bb60b0feb7c4cf [0,2,0,0,0,0|2,0,0]=4 9283 B13R1.643 C#Cc1cccc(n1)NC[C@H](C)O d826fd868b13f8f380b120ccba6bc5b2 [0,2,0,0,0,0|2,0,0]=4 9284 B13R1.643 C#Cc1ccnc(c1)NCC(C)O fdc5496c4703d0047097a66ca85980d2 [0,2,0,0,0,0|2,0,0]=4 9285 B13R1.643 C#Cc1ccnc(c1)NC[C@@H](C)O af2a90e1c10ff85b2b6a7498cb872392 [0,2,0,0,0,0|2,0,0]=4 9286 B13R1.643 C#Cc1ccnc(c1)NC[C@H](C)O e676828f287af5d07e3af813607ddd52 [0,2,0,0,0,0|2,0,0]=4 9287 B13R1.643 C#Cc1cncc(c1)NCC(C)O 855de25b52bed4a685c146611dde822f [0,2,0,0,0,0|2,0,0]=4 9288 B13R1.643 C#Cc1cncc(c1)NC[C@@H](C)O 9109a627d10f587f5afc425eae505895 [0,2,0,0,0,0|2,0,0]=4 9289 B13R1.643 C#Cc1cncc(c1)NC[C@H](C)O 02f1aa493e0f335046fe298f78e575de [0,2,0,0,0,0|2,0,0]=4 9290 B13R1.643 C=Cc1cc(ccn1)NCC(C)O eb77c192b769e3a8584da2cec60d7e48 [0,2,0,0,0,0|2,0,0]=4 9291 B13R1.643 C=Cc1cc(ccn1)NC[C@@H](C)O 0a9893ecdf88dc7b0dad2c756ee488a7 [0,2,0,0,0,0|2,0,0]=4 9292 B13R1.643 C=Cc1cc(ccn1)NC[C@H](C)O b6e40a1365310795918dd818c04d1895 [0,2,0,0,0,0|2,0,0]=4 9293 B13R1.643 C=Cc1cccc(c1)COC(C)C 8bcb987d4210627e4ce67fa8aa29d664 [0,2,0,0,0,0|2,0,0]=4 9294 B13R1.643 C=Cc1cccc(c1)NCC(C)C c4b5c25bd88869f3c345dab1c4eedd71 [0,2,0,0,0,0|2,0,0]=4 9295 B13R1.643 C=Cc1cccc(c1)NCC(C)O 175eddc47920ecffe71d38f6a80d07d4 [0,2,0,0,0,0|1,0,0]=3 9296 B13R1.643 C=Cc1cccc(c1)NC[C@@H](C)O b2214c13c07c8a4d5fcc9914484cc4d9 [0,2,0,0,0,0|1,0,0]=3 9297 B13R1.643 C=Cc1cccc(c1)NC[C@H](C)O 5d6c5051cc1d2a0c5320aa68b2f9117f [0,2,0,0,0,0|1,0,0]=3 9298 B13R1.643 C=Cc1cccc(c1)OCC(C)C 2b29e3e656c28ea9ef468d1370eb7a2a [0,2,0,0,0,0|2,0,0]=4 9299 B13R1.643 C=Cc1cccc(n1)NCC(C)O 4fc946b69b51732e3938b38354e5462a [0,2,0,0,0,0|2,0,0]=4 9300 B13R1.643 C=Cc1cccc(n1)NC[C@@H](C)O aeec101fee1e0f3af52b713799451789 [0,2,0,0,0,0|2,0,0]=4 9301 B13R1.643 C=Cc1cccc(n1)NC[C@H](C)O ce60ff8b40a57ff646c11181b935085d [0,2,0,0,0,0|2,0,0]=4 9302 B13R1.643 C=Cc1ccnc(c1)NCC(C)O e4cd12fa12a58b12d021b3efdb06fc76 [0,2,0,0,0,0|2,0,0]=4 9303 B13R1.643 C=Cc1ccnc(c1)NC[C@@H](C)O b45e37c86950bb65cafb4b131fd31406 [0,2,0,0,0,0|2,0,0]=4 9304 B13R1.643 C=Cc1ccnc(c1)NC[C@H](C)O 11aa383db5e664e587c3b10e0d905b5d [0,2,0,0,0,0|2,0,0]=4 9305 B13R1.643 C=Cc1cncc(c1)NCC(C)O 62cb176cd984446e4f8b0c082182c7b4 [0,2,0,0,0,0|2,0,0]=4 9306 B13R1.643 C=Cc1cncc(c1)NC[C@@H](C)O b963edf86659f1fc2d1830f41148dca9 [0,2,0,0,0,0|2,0,0]=4 9307 B13R1.643 C=Cc1cncc(c1)NC[C@H](C)O e1a4afb633be237f1ca4989f86512e30 [0,2,0,0,0,0|2,0,0]=4 9308 B13R1.643 CC(C)CNc1cccc(c1)C#N 3776c89da10ff032bafc333a2770f5a2 [0,2,0,0,0,0|2,0,0]=4 9309 B13R1.643 CC(C)CNc1cccc(c1)C=O 47f69b78a707de212a2fb6a7bc3c6f63 [0,2,0,0,0,0|2,0,0]=4 9310 B13R1.643 CC(C)CNc1cccc(c1)CBr b247629b4ae5a7796bedda2732126079 [0,2,0,0,0,0|2,0,0]=4 9311 B13R1.643 CC(C)CNc1cccc(c1)CF c6685810c6196f84b695b1b98c9e7011 [0,2,0,0,0,0|2,0,0]=4 9312 B13R1.643 CC(C)CNc1cccc(c1)CO d01921f070b14fe166668ba0ab69c71a [0,2,0,0,0,0|2,0,0]=4 9313 B13R1.643 CC(C)CNc1cccc(c1)CS 9996c8afbf11a4d3965ed7b89c4781fb [0,2,0,0,0,0|2,0,0]=4 9314 B13R1.643 CC(C)CNc1cccc(c1)ON 21f4386979fae762326a7a15b25afbfa [0,2,0,0,0,0|2,0,0]=4 9315 B13R1.643 CC(C)COc1cccc(c1)C#N d0b9eb069b71647b3c680d8c033d35a1 [0,2,0,0,0,0|2,0,0]=4 9316 B13R1.643 CC(C)COc1cccc(c1)C=O 99903834ee7d4fff23f549bc3a795f70 [0,2,0,0,0,0|2,0,0]=4 9317 B13R1.643 CC(C)NCc1cccc(c1)C#N 268d6da9404d553aafd1253f6dd38eee [0,2,0,0,0,0|2,0,0]=4 9318 B13R1.643 CC(C)NCc1cccc(c1)CO c548a51828a7c7b86f441534a774aa5e [0,2,0,0,0,0|2,0,0]=4 9319 B13R1.643 CC(C)OCc1cccc(c1)C#N ad482f55ec1469710b2628dc1afc82ff [0,2,0,0,0,0|2,0,0]=4 9320 B13R1.643 CC(C)OCc1cccc(c1)C=O 41ab9715967bc4a2e2c88688dcdf3714 [0,2,0,0,0,0|2,0,0]=4 9321 B13R1.643 CC(O)CNc1cc(ccn1)C#N f3e9e6399326029f27eb724b45f8a223 [0,2,0,0,0,0|2,0,0]=4 9322 B13R1.643 CC(O)CNc1cc(ccn1)C=O 058599bc9e8793bda44f87bc289b7ff1 [0,2,0,0,0,0|2,0,0]=4 9323 B13R1.643 CC(O)CNc1cc(ccn1)CCl 1284ba53568a9ae104fcec0a9512db69 [0,2,0,0,0,0|2,0,0]=4 9324 B13R1.643 CC(O)CNc1cc(ccn1)CO 4726ee026168e4e7d8f533d1dcde7ea6 [0,2,0,0,0,0|2,0,0]=4 9325 B13R1.643 CC(O)CNc1cccc(c1)C#N 0f74bb5d6f439c0b68181f5c2fa14e2b [0,2,0,0,0,0|1,0,0]=3 9326 B13R1.643 CC(O)CNc1cccc(c1)C=O 6038c74ab780e5e1c7ce4652d38ab223 [0,2,0,0,0,0|1,0,0]=3 9327 B13R1.643 CC(O)CNc1cccc(c1)CBr 8d55ae4155ebf6a935ad16c86e7a72c7 [0,2,0,0,0,0|1,0,0]=3 9328 B13R1.643 CC(O)CNc1cccc(c1)CF 31138d7b682c21267c207d81ac7775d8 [0,2,0,0,0,0|1,0,0]=3 9329 B13R1.643 CC(O)CNc1cccc(c1)CO 67958f6b36f19ed1edb68ac6dd9e1fcc [0,2,0,0,0,0|1,0,0]=3 9330 B13R1.643 CC(O)CNc1cccc(c1)CS bf4180c91865a4368cf40e7fa1a8c017 [0,2,0,0,0,0|1,0,0]=3 9331 B13R1.643 CC(O)CNc1cccc(c1)ON 285a770e6cdea50e794e1d66e1a9b761 [0,2,0,0,0,0|1,0,0]=3 9332 B13R1.643 CC(O)CNc1cccc(n1)C#N 7397a536afa55899b4beff1c199dbaf5 [0,2,0,0,0,0|2,0,0]=4 9333 B13R1.643 CC(O)CNc1cccc(n1)C=O 3fb36dccc611ecfd43fd3375c857c50b [0,2,0,0,0,0|2,0,0]=4 9334 B13R1.643 CC(O)CNc1cccc(n1)CO 09075418424db73b3f6648c506776465 [0,2,0,0,0,0|2,0,0]=4 9335 B13R1.643 CC(O)CNc1ccnc(c1)C#N d9450a1dc87e09ba3e89c71eff5c259c [0,2,0,0,0,0|2,0,0]=4 9336 B13R1.643 CC(O)CNc1ccnc(c1)C=O 4fb74f060578ea4076992ac97160d536 [0,2,0,0,0,0|2,0,0]=4 9337 B13R1.643 CC(O)CNc1ccnc(c1)CO ad10d92b1a213e835921f1b05eaf6415 [0,2,0,0,0,0|2,0,0]=4 9338 B13R1.643 CC(O)CNc1cncc(c1)C#N 0278338db9b9eb41f66aa7606a66ec66 [0,2,0,0,0,0|2,0,0]=4 9339 B13R1.643 CC(O)CNc1cncc(c1)C=O 875063f43a5d07a72ef6ee5a86d806c7 [0,2,0,0,0,0|2,0,0]=4 9340 B13R1.643 CC(O)CNc1cncc(c1)CCl a9a43c2a6fee21bf60d161347377aca6 [0,2,0,0,0,0|2,0,0]=4 9341 B13R1.643 CC(O)CNc1cncc(c1)CO 6fc5b788ec124a7157b6367bd8315c2f [0,2,0,0,0,0|2,0,0]=4 9342 B13R1.643 CCc1cc(ccn1)NCC(C)O 27f80bb6858031dce7e3ba5763a4000c [0,2,0,0,0,0|2,0,0]=4 9343 B13R1.643 CCc1cc(ccn1)NC[C@@H](C)O 858e2aec7f9ca768551008404e5b50d2 [0,2,0,0,0,0|2,0,0]=4 9344 B13R1.643 CCc1cc(ccn1)NC[C@H](C)O 8b5521fc092989c67fb05facae713f4e [0,2,0,0,0,0|2,0,0]=4 9345 B13R1.643 CCc1cccc(c1)CNC(C)C c26468e4900e6f357c5d62b354281a00 [0,2,0,0,0,0|2,0,0]=4 9346 B13R1.643 CCc1cccc(c1)COC(C)C 588db156ead49f22f45c495c515a32f1 [0,2,0,0,0,0|2,0,0]=4 9347 B13R1.643 CCc1cccc(c1)NCC(C)C 08adfee7371d0f4f89959dbad599c2b6 [0,2,0,0,0,0|2,0,0]=4 9348 B13R1.643 CCc1cccc(c1)NCC(C)O e58b4066bf24178b30609baf9db99ba2 [0,2,0,0,0,0|1,0,0]=3 9349 B13R1.643 CCc1cccc(c1)NC[C@@H](C)O 917cb3feac503c6f43061df1ff594e85 [0,2,0,0,0,0|1,0,0]=3 9350 B13R1.643 CCc1cccc(c1)NC[C@H](C)O 1934133e1c43863e55d9250594548dab [0,2,0,0,0,0|1,0,0]=3 9351 B13R1.643 CCc1cccc(c1)OCC(C)C 26e4f62669f7a608855fbcf8e08be338 [0,2,0,0,0,0|2,0,0]=4 9352 B13R1.643 CCc1cccc(n1)NCC(C)O 3aad036ffc36ca70740886958b1bd55a [0,2,0,0,0,0|2,0,0]=4 9353 B13R1.643 CCc1cccc(n1)NC[C@@H](C)O 0eaea89a9186f1d85baa7a4f7e90b1ac [0,2,0,0,0,0|2,0,0]=4 9354 B13R1.643 CCc1cccc(n1)NC[C@H](C)O 921d9678f95a617f52996274bd302691 [0,2,0,0,0,0|2,0,0]=4 9355 B13R1.643 CCc1ccnc(c1)NCC(C)O 49dd83f0031f09dc13673e96c916815d [0,2,0,0,0,0|2,0,0]=4 9356 B13R1.643 CCc1ccnc(c1)NC[C@@H](C)O 0f4d36eb1551c6b6ef7bdac05bf3a78f [0,2,0,0,0,0|2,0,0]=4 9357 B13R1.643 CCc1ccnc(c1)NC[C@H](C)O f9fd9791ff684e46a32873ce42c05916 [0,2,0,0,0,0|2,0,0]=4 9358 B13R1.643 CCc1cncc(c1)NCC(C)O a5b1313a161b53554e65c5550d800a2d [0,2,0,0,0,0|2,0,0]=4 9359 B13R1.643 CCc1cncc(c1)NC[C@@H](C)O 3528597714f628b10a513c342edc0b08 [0,2,0,0,0,0|2,0,0]=4 9360 B13R1.643 CCc1cncc(c1)NC[C@H](C)O 857ffef3a935f916dfdf678ce1fd436e [0,2,0,0,0,0|2,0,0]=4 9361 B13R1.643 COc1cc(ccn1)NCC(C)O 008c1d0ff63d45657fa34c7b22364ffd [0,2,0,0,0,0|2,0,0]=4 9362 B13R1.643 COc1cc(ccn1)NC[C@@H](C)O c007990b2b5054ba3c3d2298dd7d7c67 [0,2,0,0,0,0|2,0,0]=4 9363 B13R1.643 COc1cc(ccn1)NC[C@H](C)O 388eef210d6a37a37e3fe530dd9888d7 [0,2,0,0,0,0|2,0,0]=4 9364 B13R1.643 COc1cccc(c1)CNC(C)C 3f1aeca4736ffab26e77cf9504e2bbc4 [0,2,0,0,0,0|2,0,0]=4 9365 B13R1.643 COc1cccc(c1)COC(C)C 629672a8d72e3d6378b7616905860a41 [0,2,0,0,0,0|2,0,0]=4 9366 B13R1.643 COc1cccc(c1)NCC(C)C 47fb82c19d3de9dfe818b0460ad3fd07 [0,2,0,0,0,0|2,0,0]=4 9367 B13R1.643 COc1cccc(c1)NCC(C)O f0eae12216b1fcb898cdba76172f3121 [0,2,0,0,0,0|1,0,0]=3 9368 B13R1.643 COc1cccc(c1)NC[C@@H](C)O b42a93485a74a89300e709e3383ed8d3 [0,2,0,0,0,0|1,0,0]=3 9369 B13R1.643 COc1cccc(c1)NC[C@H](C)O 0f51f7d42734fce3c7daf292ba855c39 [0,2,0,0,0,0|1,0,0]=3 9370 B13R1.643 COc1cccc(c1)OCC(C)C 4ee3c1e1839775aa21f3110536e026dc [0,2,0,0,0,0|2,0,0]=4 9371 B13R1.643 COc1cccc(n1)NCC(C)O 7e26775bf2cbddcb4881884f0b23169c [0,2,0,0,0,0|2,0,0]=4 9372 B13R1.643 COc1cccc(n1)NC[C@H](C)O 06a3435711098735f45bd88d667c7e3d [0,2,0,0,0,0|2,0,0]=4 9373 B13R1.643 COc1ccnc(c1)NCC(C)O 5f8832782d20138d10f121692e089fd7 [0,2,0,0,0,0|2,0,0]=4 9374 B13R1.643 COc1ccnc(c1)NC[C@@H](C)O d938478a59015f15fae5b67355efc23c [0,2,0,0,0,0|2,0,0]=4 9375 B13R1.643 COc1ccnc(c1)NC[C@H](C)O 060d1f536be2183016f1362998752587 [0,2,0,0,0,0|2,0,0]=4 9376 B13R1.643 COc1cncc(c1)NCC(C)O c9f3a7dc4889147ec1ee738961816c5c [0,2,0,0,0,0|2,0,0]=4 9377 B13R1.643 COc1cncc(c1)NC[C@@H](C)O 0ab9a80d9cf00d1cce4d1f3105b81c16 [0,2,0,0,0,0|2,0,0]=4 9378 B13R1.643 COc1cncc(c1)NC[C@H](C)O edc766f420ff74a6672bfd2c0304c947 [0,2,0,0,0,0|2,0,0]=4 9379 B13R1.643 CSc1cc(ccn1)NCC(C)O 5d4c18fe4f418b62cde26bde60623bf0 [0,2,0,0,0,0|2,0,0]=4 9380 B13R1.643 CSc1cc(ccn1)NC[C@@H](C)O 99f6d83628afe1b418e2d8978bf4b85d [0,2,0,0,0,0|2,0,0]=4 9381 B13R1.643 CSc1cc(ccn1)NC[C@H](C)O 84ee8bd20df677bea0689dece140c758 [0,2,0,0,0,0|2,0,0]=4 9382 B13R1.643 CSc1cccc(c1)CNC(C)C 8c0e1d8e9f3c8b0f5636162ba8436ddb [0,2,0,0,0,0|2,0,0]=4 9383 B13R1.643 CSc1cccc(c1)COC(C)C 3e10486e2ca960854e530926e7095253 [0,2,0,0,0,0|2,0,0]=4 9384 B13R1.643 CSc1cccc(c1)NCC(C)C 7ed2b55632b1a21982fd00dd3cce1144 [0,2,0,0,0,0|2,0,0]=4 9385 B13R1.643 CSc1cccc(c1)NCC(C)O 413e9b101b3c7fe3df25d762ada4e0eb [0,2,0,0,0,0|1,0,0]=3 9386 B13R1.643 CSc1cccc(c1)NC[C@@H](C)O 527d3a7ae3df5de480504bc9eac111f3 [0,2,0,0,0,0|1,0,0]=3 9387 B13R1.643 CSc1cccc(c1)NC[C@H](C)O a84745b14ee9a71cf6772422002fb01b [0,2,0,0,0,0|1,0,0]=3 9388 B13R1.643 CSc1cccc(c1)OCC(C)C 772482e22aa72ebd36f5f950ce95e48b [0,2,0,0,0,0|2,0,0]=4 9389 B13R1.643 CSc1cccc(n1)NCC(C)O 3fd7311b065fc906e2770b13d146022e [0,2,0,0,0,0|2,0,0]=4 9390 B13R1.643 CSc1cccc(n1)NC[C@H](C)O 283774a7d2d6a554282f37fd8da59883 [0,2,0,0,0,0|2,0,0]=4 9391 B13R1.643 CSc1ccnc(c1)NCC(C)O c1d03567e99aad3f0117ea15e57daded [0,2,0,0,0,0|2,0,0]=4 9392 B13R1.643 CSc1ccnc(c1)NC[C@@H](C)O f00157ed0f3b21da0db31fed2c93b78d [0,2,0,0,0,0|2,0,0]=4 9393 B13R1.643 CSc1ccnc(c1)NC[C@H](C)O 97ee7672b15e5a80ec49143f6620baa6 [0,2,0,0,0,0|2,0,0]=4 9394 B13R1.643 C[C@@H](O)CNc1cc(ccn1)C#N 71ff63e1ee325f7c464b89c49224f845 [0,2,0,0,0,0|2,0,0]=4 9395 B13R1.643 C[C@@H](O)CNc1cc(ccn1)C=O 86d9cee97b62219ffc36c7307ca4a71d [0,2,0,0,0,0|2,0,0]=4 9396 B13R1.643 C[C@@H](O)CNc1cc(ccn1)CCl 57d048d3fc572b861d817294dc327985 [0,2,0,0,0,0|2,0,0]=4 9397 B13R1.643 C[C@@H](O)CNc1cc(ccn1)CO e31a0542da09dfdbdb239c79a1ee612a [0,2,0,0,0,0|2,0,0]=4 9398 B13R1.643 C[C@@H](O)CNc1cccc(c1)C#N 7ef4e5824eae2816262b4d851cadceec [0,2,0,0,0,0|1,0,0]=3 9399 B13R1.643 C[C@@H](O)CNc1cccc(c1)C=O 919211368d90ce6a73d10d0c45b48e2d [0,2,0,0,0,0|1,0,0]=3 9400 B13R1.643 C[C@@H](O)CNc1cccc(c1)CBr e72ddab2d4871ee7c66a02e1080b2be0 [0,2,0,0,0,0|1,0,0]=3 9401 B13R1.643 C[C@@H](O)CNc1cccc(c1)CF a1a8eca1078f83ce502210ec85db2513 [0,2,0,0,0,0|1,0,0]=3 9402 B13R1.643 C[C@@H](O)CNc1cccc(c1)CO c26338dbed6cc8d986a74dd93c118534 [0,2,0,0,0,0|1,0,0]=3 9403 B13R1.643 C[C@@H](O)CNc1cccc(c1)CS dbea41d368c9ae6df89bd28cbd380d9a [0,2,0,0,0,0|1,0,0]=3 9404 B13R1.643 C[C@@H](O)CNc1cccc(c1)ON 9296d093d54be90aa4010a1956412e7a [0,2,0,0,0,0|1,0,0]=3 9405 B13R1.643 C[C@@H](O)CNc1cccc(n1)C#N 3d4300f7849dd39eca333041f290b9b1 [0,2,0,0,0,0|2,0,0]=4 9406 B13R1.643 C[C@@H](O)CNc1cccc(n1)C=O 945f441f54256cb2b66dac8ed7f04c39 [0,2,0,0,0,0|2,0,0]=4 9407 B13R1.643 C[C@@H](O)CNc1cccc(n1)CO a7ec129cc2353fb108538355195fc4f7 [0,2,0,0,0,0|2,0,0]=4 9408 B13R1.643 C[C@@H](O)CNc1ccnc(c1)C#N 0e95097ff462964aff3aa183738c7fbf [0,2,0,0,0,0|2,0,0]=4 9409 B13R1.643 C[C@@H](O)CNc1ccnc(c1)C=O dfcb414e144b13300a99dd7bf11c96f0 [0,2,0,0,0,0|2,0,0]=4 9410 B13R1.643 C[C@@H](O)CNc1ccnc(c1)CO 34be66300f965d446cff40c75a6d0aa1 [0,2,0,0,0,0|2,0,0]=4 9411 B13R1.643 C[C@@H](O)CNc1cncc(c1)C#N 060317a2ae9c18e4546adce58aa643c1 [0,2,0,0,0,0|2,0,0]=4 9412 B13R1.643 C[C@@H](O)CNc1cncc(c1)C=O c15a606416b1c88bdc6f88d0fa9f0126 [0,2,0,0,0,0|2,0,0]=4 9413 B13R1.643 C[C@@H](O)CNc1cncc(c1)CCl 9a002a36a853fb12b7cec718b90780af [0,2,0,0,0,0|2,0,0]=4 9414 B13R1.643 C[C@@H](O)CNc1cncc(c1)CO a5b7707b9dde2573f9a7e2c454359842 [0,2,0,0,0,0|2,0,0]=4 9415 B13R1.643 C[C@H](O)CNc1cc(ccn1)C#N b6e3bdf23cae0867d5d0a66a28fc5d68 [0,2,0,0,0,0|2,0,0]=4 9416 B13R1.643 C[C@H](O)CNc1cc(ccn1)C=O 1d50b4135c102e9ce7b361f5726f01a4 [0,2,0,0,0,0|2,0,0]=4 9417 B13R1.643 C[C@H](O)CNc1cc(ccn1)CCl 3429d4f9edd1a0aac851b340c4baa996 [0,2,0,0,0,0|2,0,0]=4 9418 B13R1.643 C[C@H](O)CNc1cc(ccn1)CO 419e2794d4246d47e9e2f60700327ce6 [0,2,0,0,0,0|2,0,0]=4 9419 B13R1.643 C[C@H](O)CNc1cccc(c1)C#N 19e4e20a30349be86b9e472488b548bc [0,2,0,0,0,0|1,0,0]=3 9420 B13R1.643 C[C@H](O)CNc1cccc(c1)C=O de0fcc974ae5d64907caf1f9c3287901 [0,2,0,0,0,0|1,0,0]=3 9421 B13R1.643 C[C@H](O)CNc1cccc(c1)CBr 45fcdab00da6a41657cf8ada15f70326 [0,2,0,0,0,0|1,0,0]=3 9422 B13R1.643 C[C@H](O)CNc1cccc(c1)CF 8f35e665503ca53d742fdcbc06bd544b [0,2,0,0,0,0|1,0,0]=3 9423 B13R1.643 C[C@H](O)CNc1cccc(c1)CO 06fd785fa78809dbb34ed396d2b7c445 [0,2,0,0,0,0|1,0,0]=3 9424 B13R1.643 C[C@H](O)CNc1cccc(c1)CS 2fcd61040213031414f07085beb2daea [0,2,0,0,0,0|1,0,0]=3 9425 B13R1.643 C[C@H](O)CNc1cccc(c1)ON 21ea22fadad521138f64ecf1e62543d4 [0,2,0,0,0,0|1,0,0]=3 9426 B13R1.643 C[C@H](O)CNc1cccc(n1)C#N 522235bb798f6b28b827e320f3addc60 [0,2,0,0,0,0|2,0,0]=4 9427 B13R1.643 C[C@H](O)CNc1cccc(n1)C=O 4a63fcc3ead76333e5645c98f5fc0a0e [0,2,0,0,0,0|2,0,0]=4 9428 B13R1.643 C[C@H](O)CNc1cccc(n1)CO 65ac31fa8b0dad48d85794a44f9690cb [0,2,0,0,0,0|2,0,0]=4 9429 B13R1.643 C[C@H](O)CNc1ccnc(c1)C#N fc38d51e30a1556e9709a4c707655bd3 [0,2,0,0,0,0|2,0,0]=4 9430 B13R1.643 C[C@H](O)CNc1ccnc(c1)C=O ea1c8d85f93843ca4fa3260a898061f3 [0,2,0,0,0,0|2,0,0]=4 9431 B13R1.643 C[C@H](O)CNc1ccnc(c1)CO bcd64798d242a56fc6006f63fe58df6a [0,2,0,0,0,0|2,0,0]=4 9432 B13R1.643 C[C@H](O)CNc1cncc(c1)C#N e57b70155a7ddfe7c5be2f89b6e8c080 [0,2,0,0,0,0|2,0,0]=4 9433 B13R1.643 C[C@H](O)CNc1cncc(c1)C=O 59597200feb11116f5113124710f50cb [0,2,0,0,0,0|2,0,0]=4 9434 B13R1.643 C[C@H](O)CNc1cncc(c1)CCl afeaa0496193c7546fafa40d3286976a [0,2,0,0,0,0|2,0,0]=4 9435 B13R1.643 C[C@H](O)CNc1cncc(c1)CO 585c1426fa5dfc32656de965e7ae3fba [0,2,0,0,0,0|2,0,0]=4 9436 B13R1.838 CC(C)(C)CNc1cccc(c1)Br baf75b858556b394ef51f4cf2c3dfe6a [0,2,0,0,0,0|2,0,0]=4 9437 B13R1.838 CC(C)(C)CNc1cccc(c1)Cl 7fb4ddee233e4074e40b1ae3c6258b19 [0,2,0,0,0,0|2,0,0]=4 9438 B13R1.838 CC(C)(C)CNc1cccc(c1)F cfa05c90a881927ce594f75bc3a8e7d9 [0,2,0,0,0,0|2,0,0]=4 9439 B13R1.838 CC(C)(C)CNc1cccc(c1)I b36ecb6396ef67ba8a154bed98c6a68b [0,2,0,0,0,0|2,0,0]=4 9440 B13R1.838 CC(C)(C)CNc1cccc(c1)S a8edb63448aac662b236846fcb1815f5 [0,2,0,0,0,0|2,0,0]=4 9441 B13R1.838 CC(C)(C)COc1cccc(c1)Br 697903a44e38eaf3a589e479ed86fdce [0,2,0,0,0,0|2,0,0]=4 9442 B13R1.838 CC(C)(C)COc1cccc(c1)Cl 6c637130771f24a9377898fd33a2b746 [0,2,0,0,0,0|2,0,0]=4 9443 B13R1.838 CC(C)(C)COc1cccc(c1)F 4c68b7a1291d88be5e5bebb21cd4f691 [0,2,0,0,0,0|2,0,0]=4 9444 B13R1.838 CC(C)(C)COc1cccc(c1)I 81cc073e2eb6c4715f12d82f1c90f69d [0,2,0,0,0,0|2,0,0]=4 9445 B13R1.838 CC(C)(C)COc1cccc(c1)S 784a0337632705f1f7ad2633c7785cbc [0,2,0,0,0,0|2,0,0]=4 9446 B13R1.838 CC(C)(C)NCc1cccc(c1)Br 2a627f01ff40e3ff3d20171ec87711af [0,2,0,0,0,0|2,0,0]=4 9447 B13R1.838 CC(C)(C)NCc1cccc(c1)Cl 2f5bff7af873d6106b1c61113979f7e7 [0,2,0,0,0,0|2,0,0]=4 9448 B13R1.838 CC(C)(C)NCc1cccc(c1)F dad58ec3585748d36e5138fa42c21c0f [0,2,0,0,0,0|2,0,0]=4 9449 B13R1.838 CC(C)(C)NCc1cccc(c1)I e154d5344d8e5f839dba397dbe001fd0 [0,2,0,0,0,0|2,0,0]=4 9450 B13R1.838 CC(C)(F)CNc1cccc(c1)Br 938718488a8f0290717eb8e7b756a96f [0,2,0,0,0,0|2,0,0]=4 9451 B13R1.838 CC(C)(F)CNc1cccc(c1)Cl 296c013b36e8b6ccdb448d1f6332f190 [0,2,0,0,0,0|2,0,0]=4 9452 B13R1.838 CC(C)(F)CNc1cccc(c1)F e7947ec6d4d06c34fb0e5c0fcfbc0805 [0,2,0,0,0,0|2,0,0]=4 9453 B13R1.838 CC(C)(F)CNc1cccc(c1)I 09cbb710e39825e0d54192002e37fdb1 [0,2,0,0,0,0|2,0,0]=4 9454 B13R1.838 CC(C)(F)CNc1cccc(c1)S 0cf7a584ff9214efc3051936a025b96c [0,2,0,0,0,0|2,0,0]=4 9455 B13R1.838 CC(C)(F)COc1cccc(c1)Br bc8930795547395c7882b27e8277d174 [0,2,0,0,0,0|2,0,0]=4 9456 B13R1.838 CC(C)(F)COc1cccc(c1)Cl fdf3d90a1ebb6b3122581c52dc903313 [0,2,0,0,0,0|2,0,0]=4 9457 B13R1.838 CC(C)(F)COc1cccc(c1)F 90e1c1b7cde7a6df9d186b13c0eb7f64 [0,2,0,0,0,0|2,0,0]=4 9458 B13R1.838 CC(C)(F)COc1cccc(c1)I e69a46ff9e6a3e1d3dc6185d8a4d7db9 [0,2,0,0,0,0|2,0,0]=4 9459 B13R1.838 CC(C)(F)COc1cccc(c1)S 40d91380dd591de77b858956f120da10 [0,2,0,0,0,0|2,0,0]=4 9460 B13R1.838 CC(C)(O)CNc1cc(ccn1)Br c46889eb1105208546122067cab24dc8 [0,2,0,0,0,0|2,0,0]=4 9461 B13R1.838 CC(C)(O)CNc1cc(ccn1)Cl cbd38de99524271262f0680fafc659af [0,2,0,0,0,0|2,0,0]=4 9462 B13R1.838 CC(C)(O)CNc1cc(ccn1)F 8dd8ba5796748d0b944b66c8fe4527ed [0,2,0,0,0,0|2,0,0]=4 9463 B13R1.838 CC(C)(O)CNc1cc(ccn1)I cb434c4eba6eb2b35cda07ccfd0960fd [0,2,0,0,0,0|2,0,0]=4 9464 B13R1.838 CC(C)(O)CNc1cc[nH]c(=S)c1 622955a38f854719e044bd2742ab7633 [0,2,0,0,0,0|2,0,0]=4 9465 B13R1.838 CC(C)(O)CNc1cccc(c1)Br ed28effb2213c2744a4079d090be6f7a [0,2,0,0,0,0|1,0,0]=3 9466 B13R1.838 CC(C)(O)CNc1cccc(c1)Cl 6ce5e9bdd479deb87376ebbcdd3b4380 [0,2,0,0,0,0|1,0,0]=3 9467 B13R1.838 CC(C)(O)CNc1cccc(c1)F 92e54c6a2c178702f9205a7e3d4600d1 [0,2,0,0,0,0|1,0,0]=3 9468 B13R1.838 CC(C)(O)CNc1cccc(c1)I 2a8222392559007b2d4367925fb1f65e [0,2,0,0,0,0|1,0,0]=3 9469 B13R1.838 CC(C)(O)CNc1cccc(c1)S 32058f9612296373fb0c23d497aa2c08 [0,2,0,0,0,0|1,0,0]=3 9470 B13R1.838 CC(C)(O)CNc1cccc(n1)Br d043816e3e1b97beb7a95bd6f68dc7eb [0,2,0,0,0,0|2,0,0]=4 9471 B13R1.838 CC(C)(O)CNc1cccc(n1)Cl d99bebaf0e42995891309023401cef59 [0,2,0,0,0,0|2,0,0]=4 9472 B13R1.838 CC(C)(O)CNc1cccc(n1)F 6430e959c210b7f8aca8b54084a44a88 [0,2,0,0,0,0|2,0,0]=4 9473 B13R1.838 CC(C)(O)CNc1cccc(n1)I eadefff6dee9de95b398ec4bd9c1a689 [0,2,0,0,0,0|2,0,0]=4 9474 B13R1.838 CC(C)(O)CNc1ccnc(c1)Br cdf0453ed1c7c8715b316d84ca15565c [0,2,0,0,0,0|2,0,0]=4 9475 B13R1.838 CC(C)(O)CNc1ccnc(c1)Cl 0e95fd2d101632da1227dd2ecd9c4a51 [0,2,0,0,0,0|2,0,0]=4 9476 B13R1.838 CC(C)(O)CNc1ccnc(c1)F 80f4c15b87a89b21630856abe3f3b45f [0,2,0,0,0,0|2,0,0]=4 9477 B13R1.838 CC(C)(O)CNc1ccnc(c1)I 5de17a9db9deaae2bacd3cefe6147bf8 [0,2,0,0,0,0|2,0,0]=4 9478 B13R1.838 CC(C)(O)CNc1cncc(c1)Br 1347c9527c9eb925326ec00ff8e527d0 [0,2,0,0,0,0|2,0,0]=4 9479 B13R1.838 CC(C)(O)CNc1cncc(c1)Cl 1f5f96bbedd63357929d55ff37fadc05 [0,2,0,0,0,0|2,0,0]=4 9480 B13R1.838 CC(C)(O)CNc1cncc(c1)F fab32bcec56b0658a1de887cf2f1194e [0,2,0,0,0,0|2,0,0]=4 9481 B13R1.838 CC(C)(O)CNc1cncc(c1)I 2b7050a0763628d3fd255bce261f2bdb [0,2,0,0,0,0|2,0,0]=4 9482 B13R1.838 CC(C)(O)COc1cc(ccn1)Br 7810d586ed8a4d022f8f12cb7561ce38 [0,2,0,0,0,0|2,0,0]=4 9483 B13R1.838 CC(C)(O)COc1cc(ccn1)Cl 3b98f4c8eb63d6999c902bdd58f2f827 [0,2,0,0,0,0|2,0,0]=4 9484 B13R1.838 CC(C)(O)COc1cc(ccn1)F 93e881ed423f3d63de34e6bd7bab87b6 [0,2,0,0,0,0|2,0,0]=4 9485 B13R1.838 CC(C)(O)COc1ccc[n+](c1)[O-] bf52a63ff81dafadff66129a24a1f7d7 [0,2,0,0,0,0|2,0,0]=4 9486 B13R1.838 CC(C)(O)COc1cccc(=O)[nH]1 b64ff56e233b819729ee9150bf96c9bf [0,2,0,0,0,0|2,0,0]=4 9487 B13R1.838 CC(C)(O)COc1cccc(c1)Br 92184b83adf6915dbcdb98109e1493d9 [0,2,0,0,0,0|1,0,0]=3 9488 B13R1.838 CC(C)(O)COc1cccc(c1)Cl 748ecdef1f34f441777f5ed81688a7d0 [0,2,0,0,0,0|1,0,0]=3 9489 B13R1.838 CC(C)(O)COc1cccc(c1)F 834e989cf63e39a16d3d4e79ade49ccb [0,2,0,0,0,0|1,0,0]=3 9490 B13R1.838 CC(C)(O)COc1cccc(c1)I 4c692d4892e43c05daf05cc22774640b [0,2,0,0,0,0|1,0,0]=3 9491 B13R1.838 CC(C)(O)COc1cccc(c1)S 4c89a19517b4e2815f0b5fa4222036f5 [0,2,0,0,0,0|1,0,0]=3 9492 B13R1.838 CC(C)(O)COc1cccc(n1)Br f4686c45c250c346ba67c561ec534851 [0,2,0,0,0,0|2,0,0]=4 9493 B13R1.838 CC(C)(O)COc1cccc(n1)F 0b7c4aabaaeab5481f2d874780a68ac7 [0,2,0,0,0,0|2,0,0]=4 9494 B13R1.838 CC(C)(O)COc1ccnc(c1)Br 6436d319e58deadd857540c767ae07cc [0,2,0,0,0,0|2,0,0]=4 9495 B13R1.838 CC(C)(O)COc1ccnc(c1)Cl a134c39542c02b9b8ee2beaa1ee071ca [0,2,0,0,0,0|2,0,0]=4 9496 B13R1.838 CC(C)(O)COc1ccnc(c1)F a9628a57032f326e0de5fdbbcc7f0893 [0,2,0,0,0,0|2,0,0]=4 9497 B13R1.838 CC(C)(O)COc1cncc(c1)Cl 4ddf4b66d5b551825438250476c2bef4 [0,2,0,0,0,0|2,0,0]=4 9498 B13R1.838 CC(C)(O)COc1cncc(c1)F 7a9f1c64efa3baebfbc76312077a4e8e [0,2,0,0,0,0|2,0,0]=4 9499 B13R1.838 CC(C)(O)COc1cncc(c1)I 04b180a48bb701385f3e80a28ff812af [0,2,0,0,0,0|2,0,0]=4 9500 B13R1.838 CC(F)(F)CNc1cccc(c1)Br 75e9f858220e5dd41c137c1ad60b704e [0,2,0,0,0,0|2,0,0]=4 9501 B13R1.838 CC(F)(F)CNc1cccc(c1)Cl db656d06afb33d92aad1ea5ac562755a [0,2,0,0,0,0|2,0,0]=4 9502 B13R1.838 CC(F)(F)CNc1cccc(c1)F 35b021e958592e279cb3f880d9a30ca9 [0,2,0,0,0,0|2,0,0]=4 9503 B13R1.838 CC(F)(F)CNc1cccc(c1)I 4e01071aa4da82c818771f720a322761 [0,2,0,0,0,0|2,0,0]=4 9504 B13R1.838 CC(F)(F)CNc1cccc(c1)S 895fe496635f0123eba86834f5ad8a93 [0,2,0,0,0,0|2,0,0]=4 9505 B13R1.838 CC(F)(F)COc1cccc(c1)Br a061888466fd427e4fa8241e44d2fa17 [0,2,0,0,0,0|2,0,0]=4 9506 B13R1.838 CC(F)(F)COc1cccc(c1)Cl 94eeda2cc54d823dbbc6a1a0c3e08f97 [0,2,0,0,0,0|2,0,0]=4 9507 B13R1.838 CC(F)(F)COc1cccc(c1)F c43a2dd44bf9d7ef23a49ab5117d2094 [0,2,0,0,0,0|2,0,0]=4 9508 B13R1.838 CC(F)(F)COc1cccc(c1)I 13e9839e83c856162b0231503818588a [0,2,0,0,0,0|2,0,0]=4 9509 B13R1.838 CC(F)(F)COc1cccc(c1)S a9784b51555a41444b72c669b4dad029 [0,2,0,0,0,0|2,0,0]=4 9510 B13R1.838 Cc1cc(ccn1)NCC(C)(C)O 214f1bfa35a7fd5468078bc166afbe7a [0,2,0,0,0,0|2,0,0]=4 9511 B13R1.838 Cc1cc(ccn1)OCC(C)(C)O 98e85e42874282b8d9dad78a611a76bb [0,2,0,0,0,0|2,0,0]=4 9512 B13R1.838 Cc1cccc(c1)CNC(C)(C)C 7ca08ff58505abf877124ebf01ee32d0 [0,2,0,0,0,0|2,0,0]=4 9513 B13R1.838 Cc1cccc(c1)NCC(C)(C)C 919856ba20c3e770b4712549d66aa483 [0,2,0,0,0,0|2,0,0]=4 9514 B13R1.838 Cc1cccc(c1)NCC(C)(C)F 87532f5f58c51ae97518cf58d76c6565 [0,2,0,0,0,0|2,0,0]=4 9515 B13R1.838 Cc1cccc(c1)NCC(C)(C)O f1db7bb2c22d5c4552bc10a9c724a1b9 [0,2,0,0,0,0|1,0,0]=3 9516 B13R1.838 Cc1cccc(c1)NCC(C)(F)F 91bb6a0596e75d17f779688f1919e391 [0,2,0,0,0,0|2,0,0]=4 9517 B13R1.838 Cc1cccc(c1)OCC(C)(C)C 6abb47a884a0409ab83dd87acceca337 [0,2,0,0,0,0|2,0,0]=4 9518 B13R1.838 Cc1cccc(c1)OCC(C)(C)F ecc493a49ec4b89f1206a8b0e30ecd05 [0,2,0,0,0,0|2,0,0]=4 9519 B13R1.838 Cc1cccc(c1)OCC(C)(C)O 0d914434b91d75bbc9a79ebafa1e0d0e [0,2,0,0,0,0|1,0,0]=3 9520 B13R1.838 Cc1cccc(c1)OCC(C)(F)F 34a04d94513c60dfc34227945998fedb [0,2,0,0,0,0|2,0,0]=4 9521 B13R1.838 Cc1cccc(n1)NCC(C)(C)O 62dd00bc62e3d22326ce474213d3a93b [0,2,0,0,0,0|2,0,0]=4 9522 B13R1.838 Cc1cccc(n1)OCC(C)(C)O bd839d88f3b5adea28c72234cf284398 [0,2,0,0,0,0|2,0,0]=4 9523 B13R1.838 Cc1ccnc(c1)NCC(C)(C)O b335cd4c317a037a19afb29a061e3745 [0,2,0,0,0,0|2,0,0]=4 9524 B13R1.838 Cc1ccnc(c1)OCC(C)(C)O 0fd45b0246ff97590f4009b0243999cb [0,2,0,0,0,0|2,0,0]=4 9525 B13R1.838 Cc1cncc(c1)NCC(C)(C)O d553fbd01c9bdd1af7afa52480f51a45 [0,2,0,0,0,0|2,0,0]=4 9526 B13R1.838 Cc1cncc(c1)OCC(C)(C)O 0b05c2417f083d00a30a35e6f7c03707 [0,2,0,0,0,0|2,0,0]=4 9527 B13R1.3420 CC(C)CNc1cc(cc(c1)Br)Br 29abfed23c1412e53f8b82437176a5a3 [0,2,0,0,0,0|2,0,0]=4 9528 B13R1.3420 CC(C)CNc1cc(cc(c1)Br)Cl 30a1a927748de2b69da6df3ee7eaf2db [0,2,0,0,0,0|2,0,0]=4 9529 B13R1.3420 CC(C)CNc1cc(cc(c1)Br)F b181a4d24af739e724b11e07d02be836 [0,2,0,0,0,0|2,0,0]=4 9530 B13R1.3420 CC(C)CNc1cc(cc(c1)Cl)Cl 70445f76befa6aa77ec9d0b4d57cce87 [0,2,0,0,0,0|2,0,0]=4 9531 B13R1.3420 CC(C)CNc1cc(cc(c1)Cl)F ec9373b1a93aee1dd098bfc2dcdf346f [0,2,0,0,0,0|2,0,0]=4 9532 B13R1.3420 CC(C)CNc1cc(cc(c1)F)F 98469d677fbce81bbfacd56be9008966 [0,2,0,0,0,0|2,0,0]=4 9533 B13R1.3420 CC(C)CNc1cc(cc(c1)I)Br d07fc9a5a3016c6449697d2d99570cdc [0,2,0,0,0,0|2,0,0]=4 9534 B13R1.3420 CC(C)CNc1cc(cc(c1)I)Cl 07bcaeb5756574d970067251e5003d64 [0,2,0,0,0,0|2,0,0]=4 9535 B13R1.3420 CC(C)CNc1cc(cc(c1)I)F b691e7f37cf1acd3fbd13cb699c324f5 [0,2,0,0,0,0|2,0,0]=4 9536 B13R1.3420 CC(C)CNc1cc(cc(c1)I)I 773a8e12f93c509ec8153d5732a93648 [0,2,0,0,0,0|2,0,0]=4 9537 B13R1.3420 CC(C)CNc1cc(cc(c1)N)N dc1a2b954cb8f914b71e64d49b4aacd3 [0,2,0,0,0,0|2,0,0]=4 9538 B13R1.3420 CC(C)CNc1cc(cc(c1)S)F ba47941b42f17b586f946fa6238fb976 [0,2,0,0,0,0|2,0,0]=4 9539 B13R1.3420 CC(C)COc1cc(cc(c1)Br)Br 40d85acbb652060daf535f676f6a6722 [0,2,0,0,0,0|2,0,0]=4 9540 B13R1.3420 CC(C)COc1cc(cc(c1)Br)Cl cf69b3b1b2b8f3656104bfbf10c3ae63 [0,2,0,0,0,0|2,0,0]=4 9541 B13R1.3420 CC(C)COc1cc(cc(c1)Br)F 211c194a3e1e5137d7edf4a5b7edd3ef [0,2,0,0,0,0|2,0,0]=4 9542 B13R1.3420 CC(C)COc1cc(cc(c1)Cl)Cl 92bccd7027deb3955ebdc6bb5f890289 [0,2,0,0,0,0|2,0,0]=4 9543 B13R1.3420 CC(C)COc1cc(cc(c1)Cl)F ea1fd712b3bcd43d3a89271d07324bde [0,2,0,0,0,0|2,0,0]=4 9544 B13R1.3420 CC(C)COc1cc(cc(c1)F)F 760aec92285778c3633ad73bc84a7993 [0,2,0,0,0,0|2,0,0]=4 9545 B13R1.3420 CC(C)COc1cc(cc(c1)I)Br 64dee99206a2692fb6c1b2911ad1ce20 [0,2,0,0,0,0|2,0,0]=4 9546 B13R1.3420 CC(C)COc1cc(cc(c1)I)Cl 1ef6029d36a5cfd1e4cf89e71bd86ad4 [0,2,0,0,0,0|2,0,0]=4 9547 B13R1.3420 CC(C)COc1cc(cc(c1)I)F 99598ddda1be4caffa5699a65e69d0f0 [0,2,0,0,0,0|2,0,0]=4 9548 B13R1.3420 CC(C)NCc1cc(cc(c1)Br)Br 9417a380d8fec3d514cb0326acd2d0c8 [0,2,0,0,0,0|2,0,0]=4 9549 B13R1.3420 CC(C)NCc1cc(cc(c1)Br)Cl 7c518f8ff084f2246290a921720253f4 [0,2,0,0,0,0|2,0,0]=4 9550 B13R1.3420 CC(C)NCc1cc(cc(c1)Br)F 15a4f4215db86c2ef95c1249fb578f47 [0,2,0,0,0,0|2,0,0]=4 9551 B13R1.3420 CC(C)NCc1cc(cc(c1)Cl)Cl 4292c339a70bf8163ce7fae4e353ba7b [0,2,0,0,0,0|2,0,0]=4 9552 B13R1.3420 CC(C)NCc1cc(cc(c1)Cl)F deb370fbc257a53e3710c78ce59e1f13 [0,2,0,0,0,0|2,0,0]=4 9553 B13R1.3420 CC(C)NCc1cc(cc(c1)F)F 4517c2b8c280b0ca1c1c7c34c83ae18d [0,2,0,0,0,0|2,0,0]=4 9554 B13R1.3420 CC(C)OCc1cc(cc(c1)Br)Br a3ca42779a488dfcf755d6f513bde863 [0,2,0,0,0,0|2,0,0]=4 9555 B13R1.3420 CC(C)OCc1cc(cc(c1)Br)Cl dc9f7e0d0fa2bf3e82075b7cd8da0e7b [0,2,0,0,0,0|2,0,0]=4 9556 B13R1.3420 CC(C)OCc1cc(cc(c1)Br)F ae20fc4a8e8cf3df0b4f5af6fcdc6c15 [0,2,0,0,0,0|2,0,0]=4 9557 B13R1.3420 CC(C)OCc1cc(cc(c1)Cl)Cl 8be35dbe470534253c61bcd5c3bde14e [0,2,0,0,0,0|2,0,0]=4 9558 B13R1.3420 CC(C)OCc1cc(cc(c1)Cl)F c422aba5299adf0cc9e66cfa219d9ff2 [0,2,0,0,0,0|2,0,0]=4 9559 B13R1.3420 CC(C)OCc1cc(cc(c1)F)F c3be4a344c015fa393d69b1bab2399bf [0,2,0,0,0,0|2,0,0]=4 9560 B13R1.3420 CC(C)OCc1cc(cc(c1)I)Br fea003d96ac1eeac92b92ea00e28e6bd [0,2,0,0,0,0|2,0,0]=4 9561 B13R1.3420 CC(C)OCc1cc(cc(c1)I)Cl 7ce740a55eddd4e8396f30e48139e63c [0,2,0,0,0,0|2,0,0]=4 9562 B13R1.3420 CC(C)OCc1cc(cc(c1)I)F abdc9973f7d969e3a5a22eeff0fdbfcb [0,2,0,0,0,0|2,0,0]=4 9563 B13R1.3420 CC(C)OCc1cc(cc(c1)I)I ffe664a1d89ffbb58a735abb67a63020 [0,2,0,0,0,0|2,0,0]=4 9564 B13R1.3420 CC(C)OCc1cc(cc(c1)O)O 3276ab97441688dd03038a6b938d4da8 [0,2,0,0,0,0|2,0,0]=4 9565 B13R1.3420 CC(O)CNc1cc([nH]c(=O)c1)F 0ddba4728abe5cf2d380f9a865c48572 [0,2,0,0,0,0|2,0,0]=4 9566 B13R1.3420 CC(O)CNc1cc(cc(c1)Br)Br 78449ac77c5ecb41c179a4d1e92f5020 [0,2,0,0,0,0|1,0,0]=3 9567 B13R1.3420 CC(O)CNc1cc(cc(c1)Br)Cl 4c89dceb8601593a12ea404d38311fff [0,2,0,0,0,0|1,0,0]=3 9568 B13R1.3420 CC(O)CNc1cc(cc(c1)Br)F cacfa7f854f1c4e15ba78504ea7f00c1 [0,2,0,0,0,0|1,0,0]=3 9569 B13R1.3420 CC(O)CNc1cc(cc(c1)Cl)Cl de8728b43bb287c17463499f418d4b17 [0,2,0,0,0,0|1,0,0]=3 9570 B13R1.3420 CC(O)CNc1cc(cc(c1)Cl)F 89f133e317b3458cc99930d35b08855d [0,2,0,0,0,0|1,0,0]=3 9571 B13R1.3420 CC(O)CNc1cc(cc(c1)F)F 2bfbc6b65c3c24f99e95822d01335d01 [0,2,0,0,0,0|1,0,0]=3 9572 B13R1.3420 CC(O)CNc1cc(cc(c1)I)Br 78928125dcdaf9c2ac4f03ffb4aec72e [0,2,0,0,0,0|1,0,0]=3 9573 B13R1.3420 CC(O)CNc1cc(cc(c1)I)Cl 2671df45ef9f14e317bd7445710cf19e [0,2,0,0,0,0|1,0,0]=3 9574 B13R1.3420 CC(O)CNc1cc(cc(c1)I)F c6648a441399aceb0714fc503e766818 [0,2,0,0,0,0|1,0,0]=3 9575 B13R1.3420 CC(O)CNc1cc(cc(c1)I)I f93b930398f977e0e410785d74403e44 [0,2,0,0,0,0|1,0,0]=3 9576 B13R1.3420 CC(O)CNc1cc(cc(c1)N)N 3d085afa4109ce25266e2ea2237e84fb [0,2,0,0,0,0|1,0,0]=3 9577 B13R1.3420 CC(O)CNc1cc(cc(c1)S)F 63ca1d61ba26ff1977bbedab4660e7d4 [0,2,0,0,0,0|1,0,0]=3 9578 B13R1.3420 CC(O)CNc1cc(cc(c1)S)S 63c92930f662afc212de974e8a70926e [0,2,0,0,0,0|1,0,0]=3 9579 B13R1.3420 CC(O)CNc1cc(cc(n1)Br)Br 5a115219444355a3cdf9ecb9cd2943bb [0,2,0,0,0,0|2,0,0]=4 9580 B13R1.3420 CC(O)CNc1cc(cc(n1)Br)Cl 6250f37a3e88cfec698660ba8c705abe [0,2,0,0,0,0|2,0,0]=4 9581 B13R1.3420 CC(O)CNc1cc(cc(n1)Cl)Br f8e7e1be3c9ecd7d8ca1969fc3744eaa [0,2,0,0,0,0|2,0,0]=4 9582 B13R1.3420 CC(O)CNc1cc(cc(n1)Cl)Cl f7f4c929175ca3c85b4ab02a8969b391 [0,2,0,0,0,0|2,0,0]=4 9583 B13R1.3420 CC(O)CNc1cc(cc(n1)Cl)F d9376e55f399b090d77574142e234738 [0,2,0,0,0,0|2,0,0]=4 9584 B13R1.3420 CC(O)CNc1cc(cc(n1)Cl)I cc4493707713e0e20e47c6bad58a45d0 [0,2,0,0,0,0|2,0,0]=4 9585 B13R1.3420 CC(O)CNc1cc(cc(n1)F)Br e0a06a48d75904fa13923e200a285ef8 [0,2,0,0,0,0|2,0,0]=4 9586 B13R1.3420 CC(O)CNc1cc(nc(c1)Br)Br 65a27cad2e0fc93a88d5bc3f5d2bb79d [0,2,0,0,0,0|2,0,0]=4 9587 B13R1.3420 CC(O)CNc1cc(nc(c1)Br)Cl 8eca0a05e2cb989fa88ca3947069d0b3 [0,2,0,0,0,0|2,0,0]=4 9588 B13R1.3420 CC(O)CNc1cc(nc(c1)Cl)Cl bd54b457de9cd9c06303f30d5a794b9a [0,2,0,0,0,0|2,0,0]=4 9589 B13R1.3420 CC(O)CNc1cc(nc(c1)Cl)F 0c2e811e6dcf4f9f11d76fb1de93ea30 [0,2,0,0,0,0|2,0,0]=4 9590 B13R1.3420 CC(O)CNc1cc(nc(c1)F)F a7e63144a09259ce077d1671fbd3585f [0,2,0,0,0,0|2,0,0]=4 9591 B13R1.3420 CC(O)CNc1cc(nc(c1)N)N 079178625114a480a468847f85ddee88 [0,2,0,0,0,0|2,0,0]=4 9592 B13R1.3420 C[C@@H](O)CNc1cc([nH]c(=O)c1)F 5b9e22992934ad7eaabe99833b19173f [0,2,0,0,0,0|2,0,0]=4 9593 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)Br)Br 71ce6c07ec3ee826244f4894709fb4aa [0,2,0,0,0,0|1,0,0]=3 9594 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)Br)Cl 61e3ae03ee891986158e76983bd6dab6 [0,2,0,0,0,0|1,0,0]=3 9595 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)Br)F b7ffa62722e3909d911996e0d488b306 [0,2,0,0,0,0|1,0,0]=3 9596 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)Cl)Cl e1cadd691c469f5170c3a75c23f89ad4 [0,2,0,0,0,0|1,0,0]=3 9597 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)Cl)F ccde42986f95555b53c9fb2328570f5c [0,2,0,0,0,0|1,0,0]=3 9598 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)F)F 84f724b44ab70458436fee329d990f66 [0,2,0,0,0,0|1,0,0]=3 9599 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)I)Br f89286a71cbfed91a4b0299beca2fd4e [0,2,0,0,0,0|1,0,0]=3 9600 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)I)Cl f036677cfc077a35386d4722f6ea6c40 [0,2,0,0,0,0|1,0,0]=3 9601 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)I)F 68b2e0e6e0c3977818fe753432d44960 [0,2,0,0,0,0|1,0,0]=3 9602 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)I)I a990c16c3a0c95e72536eb77e41eddae [0,2,0,0,0,0|1,0,0]=3 9603 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)N)N 46bb338f194503c58c8d2af81c3e6d0c [0,2,0,0,0,0|1,0,0]=3 9604 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)S)F 09589132fb9ce26cfe3200b79a344902 [0,2,0,0,0,0|1,0,0]=3 9605 B13R1.3420 C[C@@H](O)CNc1cc(cc(c1)S)S 0a2978c4127b1dbcafc1cf652a7c9c87 [0,2,0,0,0,0|1,0,0]=3 9606 B13R1.3420 C[C@@H](O)CNc1cc(cc(n1)Br)Br 9f2bc758f69899abf37062e51bbd948d [0,2,0,0,0,0|2,0,0]=4 9607 B13R1.3420 C[C@@H](O)CNc1cc(nc(c1)Br)Br 12fdad57a2dba7fd9ddc4dad557ebb88 [0,2,0,0,0,0|2,0,0]=4 9608 B13R1.3420 C[C@@H](O)CNc1cc(nc(c1)Br)Cl 825b7824fa5892cc9367fae804639209 [0,2,0,0,0,0|2,0,0]=4 9609 B13R1.3420 C[C@@H](O)CNc1cc(nc(c1)Cl)Cl d7ba0f03583edca64b18a8792f006549 [0,2,0,0,0,0|2,0,0]=4 9610 B13R1.3420 C[C@@H](O)CNc1cc(nc(c1)Cl)F 511f26a9cb51effd200f44aa5659558e [0,2,0,0,0,0|2,0,0]=4 9611 B13R1.3420 C[C@@H](O)CNc1cc(nc(c1)F)F 545457caa8d1105cb562d6ef1376d7a4 [0,2,0,0,0,0|2,0,0]=4 9612 B13R1.3420 C[C@@H](O)CNc1cc(nc(c1)N)N a2b2273f7a0ddc32e72beabb29a02ac5 [0,2,0,0,0,0|2,0,0]=4 9613 B13R1.3420 C[C@H](O)CNc1cc([nH]c(=O)c1)F 42bfbcebb8c8c9bd6398e63360bf1213 [0,2,0,0,0,0|2,0,0]=4 9614 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)Br)Br 8dbf6ebd8a3a3b63476c923844fe1f2c [0,2,0,0,0,0|1,0,0]=3 9615 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)Br)Cl f76ea88fe2494baeadd03e6d664a9e0a [0,2,0,0,0,0|1,0,0]=3 9616 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)Br)F 514dd10eeb0b57901019c80b1e488c18 [0,2,0,0,0,0|1,0,0]=3 9617 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)Cl)Cl f43fa0383c6900bc8e20847097c0bd43 [0,2,0,0,0,0|1,0,0]=3 9618 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)Cl)F 646d187bdfb940f2a2b21a78509d1bff [0,2,0,0,0,0|1,0,0]=3 9619 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)F)F 70b26f94ba2ddeb53fa32a90015f803d [0,2,0,0,0,0|1,0,0]=3 9620 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)I)Br e0e4f3eeebce54a98afbce5ce156080e [0,2,0,0,0,0|1,0,0]=3 9621 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)I)Cl 4977814067e0f3ff53a0d25c9ce48608 [0,2,0,0,0,0|1,0,0]=3 9622 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)I)F 6f60da28738635f739359cdca0f3e054 [0,2,0,0,0,0|1,0,0]=3 9623 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)I)I 3927a4a0bf93140e3a45ba3f386ca508 [0,2,0,0,0,0|1,0,0]=3 9624 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)N)N fda144ba7028e8c319c74249c6c8865e [0,2,0,0,0,0|1,0,0]=3 9625 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)S)F dc51e90b4bbcfdf466a26d9c1dbc4bd3 [0,2,0,0,0,0|1,0,0]=3 9626 B13R1.3420 C[C@H](O)CNc1cc(cc(c1)S)S 3a0a94c7dd6b11bf0c584499a237d3d3 [0,2,0,0,0,0|1,0,0]=3 9627 B13R1.3420 C[C@H](O)CNc1cc(cc(n1)Br)Br 778248d8d046ca28cdc3a35d445cb383 [0,2,0,0,0,0|2,0,0]=4 9628 B13R1.3420 C[C@H](O)CNc1cc(cc(n1)Br)Cl cb32e6ea361cfccf9465d3d1fd1efcef [0,2,0,0,0,0|2,0,0]=4 9629 B13R1.3420 C[C@H](O)CNc1cc(cc(n1)Cl)Br 612a3934972f85822fb88d99a9a465fc [0,2,0,0,0,0|2,0,0]=4 9630 B13R1.3420 C[C@H](O)CNc1cc(cc(n1)Cl)Cl 63583c85af7ca4c6cf7e7e63d8b7acd7 [0,2,0,0,0,0|2,0,0]=4 9631 B13R1.3420 C[C@H](O)CNc1cc(cc(n1)Cl)F 58faa402af570be738af8fe66996ebca [0,2,0,0,0,0|2,0,0]=4 9632 B13R1.3420 C[C@H](O)CNc1cc(cc(n1)Cl)I 3a736b239985a4cd6e384f9b49b63069 [0,2,0,0,0,0|2,0,0]=4 9633 B13R1.3420 C[C@H](O)CNc1cc(cc(n1)F)Br 0a2585b4c342acb5170f5d20fe383871 [0,2,0,0,0,0|2,0,0]=4 9634 B13R1.3420 C[C@H](O)CNc1cc(nc(c1)Br)Br 5710fdc2c2e9133ba2c72603e13ccc5d [0,2,0,0,0,0|2,0,0]=4 9635 B13R1.3420 C[C@H](O)CNc1cc(nc(c1)Br)Cl a1b270c0d3e2d950b42287608a45757a [0,2,0,0,0,0|2,0,0]=4 9636 B13R1.3420 C[C@H](O)CNc1cc(nc(c1)Cl)Cl b16a93769118e49458f847fec732a81d [0,2,0,0,0,0|2,0,0]=4 9637 B13R1.3420 C[C@H](O)CNc1cc(nc(c1)Cl)F c1b59f258d2c44421bf67ebb285798d0 [0,2,0,0,0,0|2,0,0]=4 9638 B13R1.3420 C[C@H](O)CNc1cc(nc(c1)F)F 8e61ac6f21036bdf9520e0b4154a8333 [0,2,0,0,0,0|2,0,0]=4 9639 B13R1.3420 C[C@H](O)CNc1cc(nc(c1)N)N 94ba38e8958238cb7612a6667bfce785 [0,2,0,0,0,0|2,0,0]=4 9640 B13R1.3420 Cc1cc(cc(=O)o1)NCC(C)O 2ead90e02811c04a13a6857fab008717 [0,2,0,0,0,0|2,0,0]=4 9641 B13R1.3420 Cc1cc(cc(=O)o1)NC[C@@H](C)O 2f2effe95460d10908ede97cc21a99b7 [0,2,0,0,0,0|2,0,0]=4 9642 B13R1.3420 Cc1cc(cc(=O)o1)NC[C@H](C)O 2fe7f5924e6eed0f1b847a52f7b24b7e [0,2,0,0,0,0|2,0,0]=4 9643 B13R1.3420 Cc1cc(cc(c1)CNC(C)C)Br 44e6d747eceb53cfeb96a8caa801ca2f [0,2,0,0,0,0|2,0,0]=4 9644 B13R1.3420 Cc1cc(cc(c1)CNC(C)C)C 029949f9a585ae2fcc3d8d8468593bf9 [0,2,0,0,0,0|2,0,0]=4 9645 B13R1.3420 Cc1cc(cc(c1)CNC(C)C)Cl 417ee71a6bc00185165e0b26ab5c745c [0,2,0,0,0,0|2,0,0]=4 9646 B13R1.3420 Cc1cc(cc(c1)CNC(C)C)F c18500ad88b103acb24468b006b45947 [0,2,0,0,0,0|2,0,0]=4 9647 B13R1.3420 Cc1cc(cc(c1)COC(C)C)Br 54da9cc10f7b71c31beddbe3d07b3548 [0,2,0,0,0,0|2,0,0]=4 9648 B13R1.3420 Cc1cc(cc(c1)COC(C)C)C 733408a6e5450c968a1535577bd84c2c [0,2,0,0,0,0|2,0,0]=4 9649 B13R1.3420 Cc1cc(cc(c1)COC(C)C)Cl f65bfa5d015d6245ca5000ebad062793 [0,2,0,0,0,0|2,0,0]=4 9650 B13R1.3420 Cc1cc(cc(c1)COC(C)C)F 449a3f9eba64c3e8df8192752df05baa [0,2,0,0,0,0|2,0,0]=4 9651 B13R1.3420 Cc1cc(cc(c1)COC(C)C)I dc4d3127eeba3e006065c23b29c3bf74 [0,2,0,0,0,0|2,0,0]=4 9652 B13R1.3420 Cc1cc(cc(c1)NCC(C)C)Br d52e44c0e82f0a03441b5ded1fa8e8e2 [0,2,0,0,0,0|2,0,0]=4 9653 B13R1.3420 Cc1cc(cc(c1)NCC(C)C)C 6553c74b21b6d582b4feadc5f7efb877 [0,2,0,0,0,0|2,0,0]=4 9654 B13R1.3420 Cc1cc(cc(c1)NCC(C)C)Cl e3020fe9e888d400ec1be04940a3b1b2 [0,2,0,0,0,0|2,0,0]=4 9655 B13R1.3420 Cc1cc(cc(c1)NCC(C)C)F 32f4c3d604d521ec9c3504c664761edb [0,2,0,0,0,0|2,0,0]=4 9656 B13R1.3420 Cc1cc(cc(c1)NCC(C)C)I cfa570a34f4af7b5be33981d60258895 [0,2,0,0,0,0|2,0,0]=4 9657 B13R1.3420 Cc1cc(cc(c1)NCC(C)O)Br 17597668ab7b5d32fed965dfe6d2e22c [0,2,0,0,0,0|1,0,0]=3 9658 B13R1.3420 Cc1cc(cc(c1)NCC(C)O)C c9118b0e45e51431a92b9a0b4050dafe [0,2,0,0,0,0|1,0,0]=3 9659 B13R1.3420 Cc1cc(cc(c1)NCC(C)O)Cl 62bf1964f9b03a396b045907b976b36a [0,2,0,0,0,0|1,0,0]=3 9660 B13R1.3420 Cc1cc(cc(c1)NCC(C)O)F f2d67dd683206872c71201d0b7501c9c [0,2,0,0,0,0|1,0,0]=3 9661 B13R1.3420 Cc1cc(cc(c1)NCC(C)O)I 800c869588a888ae37288ab0ea8a269c [0,2,0,0,0,0|1,0,0]=3 9662 B13R1.3420 Cc1cc(cc(c1)NC[C@@H](C)O)Br 5af3d65b40a256d549ccac8e97f38fe3 [0,2,0,0,0,0|1,0,0]=3 9663 B13R1.3420 Cc1cc(cc(c1)NC[C@@H](C)O)C 29e627b42b620635047245814ddc6245 [0,2,0,0,0,0|1,0,0]=3 9664 B13R1.3420 Cc1cc(cc(c1)NC[C@@H](C)O)Cl bf193aea79cf8e25bc4ed0df942e25c4 [0,2,0,0,0,0|1,0,0]=3 9665 B13R1.3420 Cc1cc(cc(c1)NC[C@@H](C)O)F f088f73720c35beb3bd66329052a1641 [0,2,0,0,0,0|1,0,0]=3 9666 B13R1.3420 Cc1cc(cc(c1)NC[C@@H](C)O)I 771975e413237f1a169ba1dab9c2149e [0,2,0,0,0,0|1,0,0]=3 9667 B13R1.3420 Cc1cc(cc(c1)NC[C@H](C)O)Br 74351e8ad72745371f73bb5984929e61 [0,2,0,0,0,0|1,0,0]=3 9668 B13R1.3420 Cc1cc(cc(c1)NC[C@H](C)O)C ecaa6109e8f39a92691beac57eaa5961 [0,2,0,0,0,0|1,0,0]=3 9669 B13R1.3420 Cc1cc(cc(c1)NC[C@H](C)O)Cl 104053fb1780567283553087084f993f [0,2,0,0,0,0|1,0,0]=3 9670 B13R1.3420 Cc1cc(cc(c1)NC[C@H](C)O)F 018b5a1d299f2d68ac35d05e1a748b83 [0,2,0,0,0,0|1,0,0]=3 9671 B13R1.3420 Cc1cc(cc(c1)NC[C@H](C)O)I 085067f4b77a7398cb120d882fd5978d [0,2,0,0,0,0|1,0,0]=3 9672 B13R1.3420 Cc1cc(cc(c1)OCC(C)C)Br 7bd9751bb17772f16ac2b7cb412c8fd2 [0,2,0,0,0,0|2,0,0]=4 9673 B13R1.3420 Cc1cc(cc(c1)OCC(C)C)C e6d70eb040288f772a3590f6ff7b19ff [0,2,0,0,0,0|2,0,0]=4 9674 B13R1.3420 Cc1cc(cc(c1)OCC(C)C)Cl c73298a266821276efb3c050537f3dc2 [0,2,0,0,0,0|2,0,0]=4 9675 B13R1.3420 Cc1cc(cc(c1)OCC(C)C)F 6012e8e3e444b54acc66b946d48f4a9d [0,2,0,0,0,0|2,0,0]=4 9676 B13R1.3420 Cc1cc(cc(c1)OCC(C)C)I f1de5523ca6cce17fe502077ef574dce [0,2,0,0,0,0|2,0,0]=4 9677 B13R1.3420 Cc1cc(cc(n1)Br)NCC(C)O 8c090b3ed6abb50ac4dd012dbf17a6ab [0,2,0,0,0,0|2,0,0]=4 9678 B13R1.3420 Cc1cc(cc(n1)Br)NC[C@@H](C)O 386963c4ea5f60e96c606c68cecf5e36 [0,2,0,0,0,0|2,0,0]=4 9679 B13R1.3420 Cc1cc(cc(n1)Br)NC[C@H](C)O 6ed658fe4ce6e6113b77b32b7a726d00 [0,2,0,0,0,0|2,0,0]=4 9680 B13R1.3420 Cc1cc(cc(n1)C)NCC(C)O 1da7b7bfe62ceaf3d38e7c554f1bf383 [0,2,0,0,0,0|2,0,0]=4 9681 B13R1.3420 Cc1cc(cc(n1)C)NC[C@@H](C)O b9d644862c9c35b77ba20db40e257aea [0,2,0,0,0,0|2,0,0]=4 9682 B13R1.3420 Cc1cc(cc(n1)C)NC[C@H](C)O 16ee2fffd2daec4ad691624587513870 [0,2,0,0,0,0|2,0,0]=4 9683 B13R1.3420 Cc1cc(cc(n1)Cl)NCC(C)O f5301da144ac9028838d0c406933731e [0,2,0,0,0,0|2,0,0]=4 9684 B13R1.3420 Cc1cc(cc(n1)Cl)NC[C@@H](C)O 093105dcc2dd548d8ee1b7cd68bc1d23 [0,2,0,0,0,0|2,0,0]=4 9685 B13R1.3420 Cc1cc(cc(n1)Cl)NC[C@H](C)O 98f38c0d477aff4d0e04bda714bc37ad [0,2,0,0,0,0|2,0,0]=4 9686 B13R1.3420 Cc1cc(cc(n1)F)NCC(C)O 01bf8140407d30ff039e321a7a85b46f [0,2,0,0,0,0|2,0,0]=4 9687 B13R1.3420 Cc1cc(cc(n1)F)NC[C@@H](C)O 371063e3ff2599477623fb7876842e5d [0,2,0,0,0,0|2,0,0]=4 9688 B13R1.3420 Cc1cc(cc(n1)F)NC[C@H](C)O b3e334fa47c2bb34eb7c24bec482ef5c [0,2,0,0,0,0|2,0,0]=4 9689 B13R1.3420 Cc1cc(cc(n1)NCC(C)O)Br d2d4e8f617d11c64f142eb6d6ee8d97a [0,2,0,0,0,0|2,0,0]=4 9690 B13R1.3420 Cc1cc(cc(n1)NCC(C)O)Cl 2ce94f39ec7b7257d7f850c25bea8bef [0,2,0,0,0,0|2,0,0]=4 9691 B13R1.3420 Cc1cc(cc(n1)NC[C@H](C)O)Br 8fb6ddfed323b496c6d37251e5c74b02 [0,2,0,0,0,0|2,0,0]=4 9692 B13R1.3420 Cc1cc(cc(n1)NC[C@H](C)O)Cl ecb5c7523edf4de5ff0a284211f02956 [0,2,0,0,0,0|2,0,0]=4 9693 B13R1.3420 Cc1cc(nc(c1)NCC(C)O)Br 19b6a0b2e9e37a69a122d8298a3faa67 [0,2,0,0,0,0|2,0,0]=4 9694 B13R1.3420 Cc1cc(nc(c1)NCC(C)O)C cd0ceba85747323ed9e670250447a003 [0,2,0,0,0,0|2,0,0]=4 9695 B13R1.3420 Cc1cc(nc(c1)NCC(C)O)Cl 9d54e396412c77b50a50ccca365699e1 [0,2,0,0,0,0|2,0,0]=4 9696 B13R1.3420 Cc1cc(nc(c1)NCC(C)O)F 1756762038801090dc6339f85dcbf22a [0,2,0,0,0,0|2,0,0]=4 9697 B13R1.3420 Cc1cc(nc(c1)NC[C@@H](C)O)F bfc6b42907550ed23bac80c5bbe5a6bc [0,2,0,0,0,0|2,0,0]=4 9698 B13R1.3420 Cc1cc(nc(c1)NC[C@H](C)O)Br 501c58f41f9c26dd6dd1df2fde231ddd [0,2,0,0,0,0|2,0,0]=4 9699 B13R1.3420 Cc1cc(nc(c1)NC[C@H](C)O)C 62a9ddfee9d90bfb06c97ef1865f39c9 [0,2,0,0,0,0|2,0,0]=4 9700 B13R1.3420 Cc1cc(nc(c1)NC[C@H](C)O)Cl e0c403a94db87dac51fac3232c13844f [0,2,0,0,0,0|2,0,0]=4 9701 B13R1.3420 Cc1cc(nc(c1)NC[C@H](C)O)F 3ee3fa3330882e3562321c46cdb5afb4 [0,2,0,0,0,0|2,0,0]=4 9702 B11R1.172 CC(O)CCNc1cccs1 2be6abdeb25e1a613e3824969dae5a95 [0,0,1,1,0,0|2,0,0]=4 9703 B11R1.172 CC(O)CCNc1ccoc1 0d5aace06c195fae7236613b1f15760c [0,0,1,1,0,0|2,0,0]=4 9704 B11R1.172 CC(O)CCNc1ccsc1 b48c5909989be673f586a9eaa1eb5314 [0,0,1,1,0,0|2,0,0]=4 9705 B11R1.172 C[C@@H](O)CCNc1cccs1 4f802c737665298fc909b0e83238e6ea [0,0,1,1,0,0|2,0,0]=4 9706 B11R1.172 C[C@@H](O)CCNc1ccoc1 f528c33cfde9ed2040e1fc72eaabddad [0,0,1,1,0,0|2,0,0]=4 9707 B11R1.172 C[C@@H](O)CCNc1ccsc1 6dc915693327cd94d5daa62ba1536867 [0,0,1,1,0,0|2,0,0]=4 9708 B11R1.172 C[C@H](O)CCNc1cccs1 3016d239b47ebdea25cc9af11da7d6d7 [0,0,1,1,0,0|2,0,0]=4 9709 B11R1.172 C[C@H](O)CCNc1ccoc1 a8dc0afe0ca1e4ba9281aaecb84be944 [0,0,1,1,0,0|2,0,0]=4 9710 B11R1.172 C[C@H](O)CCNc1ccsc1 c012236e140f600d6a72c1c916e439a7 [0,0,1,1,0,0|2,0,0]=4 9711 B11R1.287 C=C/C=C/C(=O)N1CC(C1)O 29289df2cb2a0a3cb0c0232fd7663b27 [0,0,1,1,0,0|2,0,0]=4 9712 B11R1.287 C=C/C=C\C(=O)N1CC(C1)O ce855d9852c8c441c1e396e74e4640bc [0,0,1,1,0,0|2,0,0]=4 9713 B11R1.287 C=CC=CC(=O)N1CC(C1)O 50526e357c1ad5d7182ad207aa629950 [0,0,1,1,0,0|2,0,0]=4 9714 B11R2.238 c1cc(ccn1)NC2CC2 5ad70d53c8f8554348b48da331d79b17 [1,0,0,1,0,0|2,0,0]=4 9715 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [1,0,0,1,0,0|1,0,0]=3 9716 B11R2.238 c1ccc(nc1)OC2CC2 05f70841461656fba19d4e6cae35b4c4 [1,0,0,1,0,0|2,0,0]=4 9717 B11R2.238 c1cncc(c1)NC2CC2 faca6d2d50c0b4a3e50cda13d58850cf [1,0,0,1,0,0|2,0,0]=4 9718 B11R2.238 c1cncc(c1)OC2CC2 e02f03b072be3d2fd90f9a4a8c487a8f [1,0,0,1,0,0|2,0,0]=4 9719 B13R2.17 CC1CC1NCc2ccccc2 4cfdb83dc2f71acc5d554cb409a717c1 [0,0,0,1,0,1|1,0,0]=3 9720 B13R2.17 CC1CC1NCc2ccccn2 121876e18a2f119328db7859e4087861 [0,0,0,1,0,1|2,0,0]=4 9721 B13R2.17 CC1CC1NCc2cccnc2 0e773e8c8aceca3868b86af9296f500e [0,0,0,1,0,1|2,0,0]=4 9722 B13R2.17 F[C@@H]1C[C@@H]1NCc2ccccc2 9057fb3773bb37e850e9042278f52f9f [0,0,0,1,0,1|1,0,0]=3 9723 B13R2.17 F[C@@H]1C[C@@H]1NCc2ccccn2 2a46537095f0affef1459093ef1ed854 [0,0,0,1,0,1|2,0,0]=4 9724 B13R2.17 F[C@@H]1C[C@@H]1NCc2cccnc2 cb6d6849ee7d7329017cef178064cec6 [0,0,0,1,0,1|2,0,0]=4 9725 B13R2.17 F[C@@H]1C[C@H]1NCc2ccccc2 a39cd5d5b0b9ea9be80edae1c65369c8 [0,0,0,1,0,1|1,0,0]=3 9726 B13R2.17 F[C@@H]1C[C@H]1NCc2ccccn2 2353d23ac98d9dd2788e0836b34f270e [0,0,0,1,0,1|2,0,0]=4 9727 B13R2.17 F[C@@H]1C[C@H]1NCc2cccnc2 a40c01cb915e2dca43fe416a4ce2c624 [0,0,0,1,0,1|2,0,0]=4 9728 B13R2.17 F[C@H]1C[C@@H]1NCc2ccccc2 9d64da63517ba661c4fcc8089982ed2a [0,0,0,1,0,1|1,0,0]=3 9729 B13R2.17 F[C@H]1C[C@@H]1NCc2ccccn2 141df897a4117d1653092f78023d1a94 [0,0,0,1,0,1|2,0,0]=4 9730 B13R2.17 F[C@H]1C[C@@H]1NCc2cccnc2 aeea1a25e202a5867292722af564b37d [0,0,0,1,0,1|2,0,0]=4 9731 B13R2.31 FC1CC(C1)Nc2ccccc2 0063bbac983356a468d92ce93db46f65 [0,0,0,1,0,1|1,0,0]=3 9732 B13R2.31 FC1CC(C1)Nc2cccnc2 b85dd1e2771a97c35237c6eb1988ef7f [0,0,0,1,0,1|2,0,0]=4 9733 B13R2.31 FC1CC(C1)Nc2ccncc2 5234f00060bc37773a4b9a068d553834 [0,0,0,1,0,1|2,0,0]=4 9734 B13R2.31 FC1CN(C1)Cc2ccccc2 11bcd9d3b1770453c4c550c6eff15e2a [0,0,0,1,0,1|1,0,0]=3 9735 B13R2.31 FC1CN(C1)Cc2ccccn2 41f5a3adafbe448dae2d526a3f68c4dc [0,0,0,1,0,1|2,0,0]=4 9736 B13R2.31 FC1CN(C1)Cc2cccnc2 9c4f745a4c640a7ffeddbe890913f9e1 [0,0,0,1,0,1|2,0,0]=4 9737 B13R2.31 F[C@H]1C[C@@H](C1)Nc2ccccc2 3921582339f7025e25d54e17c3371c3b [0,0,0,1,0,1|1,0,0]=3 9738 B13R2.31 F[C@H]1C[C@@H](C1)Nc2cccnc2 375949c9621ca528a692ed272970a9de [0,0,0,1,0,1|2,0,0]=4 9739 B13R2.31 F[C@H]1C[C@@H](C1)Nc2ccncc2 d4fe856d8d8c518ed26527e69c54b054 [0,0,0,1,0,1|2,0,0]=4 9740 B13R2.31 F[C@H]1C[C@H](C1)Nc2ccccc2 31f90c435e0d11c0b8f04dc213b35f83 [0,0,0,1,0,1|1,0,0]=3 9741 B13R2.31 F[C@H]1C[C@H](C1)Nc2cccnc2 52869d3eaf944516d206b3e9e9cf57c9 [0,0,0,1,0,1|2,0,0]=4 9742 B13R2.31 F[C@H]1C[C@H](C1)Nc2ccncc2 3d841fc9413ad31c57b61d96af38ce0a [0,0,0,1,0,1|2,0,0]=4 9743 B13R2.31 OC1CC(C1)Nc2ccccc2 71a911754938dd37972ada3ece1543ca [0,0,0,1,0,1|0,0,0]=2 9744 B13R2.31 OC1CC(C1)Nc2ccccn2 44691850885e2ad0ce72bcfecf24c83d [0,0,0,1,0,1|1,0,0]=3 9745 B13R2.31 OC1CC(C1)Nc2cccnc2 5c74d72d14e07d0dc98adf8993221f81 [0,0,0,1,0,1|1,0,0]=3 9746 B13R2.31 OC1CC(C1)Nc2cccnn2 e5d79e86223e2e77104503730600f254 [0,0,0,1,0,1|2,0,0]=4 9747 B13R2.31 OC1CC(C1)Nc2ccncc2 81c5de2fc19ebfa91dc90670ec32df85 [0,0,0,1,0,1|1,0,0]=3 9748 B13R2.31 OC1CC(C1)Nc2ccncn2 dc38163bc68aabd88193dd69e13c9a50 [0,0,0,1,0,1|2,0,0]=4 9749 B13R2.31 OC1CC(C1)Nc2ccnnc2 2d8e8e146f21048413e1d6eabb5e8f9c [0,0,0,1,0,1|2,0,0]=4 9750 B13R2.31 OC1CC(C1)Nc2cnccn2 bc3770e3ed7ab4df96e8184fff3c3040 [0,0,0,1,0,1|2,0,0]=4 9751 B13R2.31 OC1CC(C1)Nc2ncccn2 387e4cc86b03c9306538342dc04a30fb [0,0,0,1,0,1|2,0,0]=4 9752 B13R2.31 OC1CN(C1)Cc2ccccc2 0f2d1ffeab9162a1a1611f924b72d074 [0,0,0,1,0,1|0,0,0]=2 9753 B13R2.31 OC1CN(C1)Cc2ccccn2 e39284a2f035eae0a1a0d83c31d97ddc [0,0,0,1,0,1|1,0,0]=3 9754 B13R2.31 OC1CN(C1)Cc2cccnc2 d4775bfc9a576a7f7765658ad2c8a474 [0,0,0,1,0,1|1,0,0]=3 9755 B13R2.31 OC1CN(C1)Cc2cccnn2 8495120121cef29a8e90bd7c1b793c01 [0,0,0,1,0,1|2,0,0]=4 9756 B13R2.31 OC1CN(C1)Cc2ccncn2 54128112724962198b42beeb6efec67a [0,0,0,1,0,1|2,0,0]=4 9757 B13R2.31 OC1CN(C1)Cc2cncnc2 86c6dfde6bb3a4bacfc5754db126bfdb [0,0,0,1,0,1|2,0,0]=4 9758 B13R2.31 OC1CN(C1)Cc2ncccn2 7583fc7775f9eeff56d065f85750196e [0,0,0,1,0,1|2,0,0]=4 9759 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccccc2 641154e36386b330b5a15763bdae2c55 [0,0,0,1,0,1|0,0,0]=2 9760 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccccn2 d7e00d0b1421f416418d31e93e11fbd4 [0,0,0,1,0,1|1,0,0]=3 9761 B13R2.31 O[C@H]1C[C@@H](C1)Nc2cccnc2 c4af757615ba95ceafeb4f63ee78bbce [0,0,0,1,0,1|1,0,0]=3 9762 B13R2.31 O[C@H]1C[C@@H](C1)Nc2cccnn2 31bd1b76045703ad0e0cb5138a1a124c [0,0,0,1,0,1|2,0,0]=4 9763 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccncc2 76b1773f9f9fde213d45e1b38d8c29a2 [0,0,0,1,0,1|1,0,0]=3 9764 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccncn2 428e55c2a0c26df45dd763bb806b857f [0,0,0,1,0,1|2,0,0]=4 9765 B13R2.31 O[C@H]1C[C@@H](C1)Nc2cnccn2 7209e35c879982425a909f808bd06320 [0,0,0,1,0,1|2,0,0]=4 9766 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ncccn2 8f4607579fd9a2054c64604fa9486505 [0,0,0,1,0,1|2,0,0]=4 9767 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccccc2 d2b195e256c89f17ba7eddc9ef42ea1b [0,0,0,1,0,1|0,0,0]=2 9768 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccccn2 47811582224b4533acdb77ff4e1924a7 [0,0,0,1,0,1|1,0,0]=3 9769 B13R2.31 O[C@H]1C[C@H](C1)Nc2cccnc2 48c58c6e1418953af39efc42a0a77a3f [0,0,0,1,0,1|1,0,0]=3 9770 B13R2.31 O[C@H]1C[C@H](C1)Nc2cccnn2 c153144d2242dad9c9de987b54190660 [0,0,0,1,0,1|2,0,0]=4 9771 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccncc2 cd175cf568bb2b76283374aba740641b [0,0,0,1,0,1|1,0,0]=3 9772 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccncn2 8bf044ce0b890617a2c5e9a8e3eda8f3 [0,0,0,1,0,1|2,0,0]=4 9773 B13R2.31 O[C@H]1C[C@H](C1)Nc2cnccn2 53e2ab3a82b01cb6f06dfcca46635b4e [0,0,0,1,0,1|2,0,0]=4 9774 B13R2.31 O[C@H]1C[C@H](C1)Nc2ncccn2 7dcf3f24e23c0a1cdb0106beea3f5ff3 [0,0,0,1,0,1|2,0,0]=4 9775 B13R2.72 CC(=O)N1CCc2c1cccc2 06be9692527493672f216ca7cabc8bee [0,0,0,1,0,1|0,0,2]=4 9776 B13R2.72 CC(C)N1CCc2c1cccc2 c4d404164fbe04e55e440222637ad19d [0,0,0,1,0,1|1,0,0]=3 9777 B13R2.72 CC(C)N1CCc2c1cccn2 a94148289c0ed61288ba27d3b9239f5c [0,0,0,1,0,1|2,0,0]=4 9778 B13R2.72 CC(C)N1CCc2c1ccnc2 c69dbb6b41fd181297f767884fb092e0 [0,0,0,1,0,1|2,0,0]=4 9779 B13R2.72 CC(C)N1CCc2c1cncc2 dd7fa58e555eb673fbeff5e55a0da7c9 [0,0,0,1,0,1|2,0,0]=4 9780 B13R2.72 CC(C)N1CCc2c1nccc2 7adac50c72ac57d13f806e8e59be3150 [0,0,0,1,0,1|2,0,0]=4 9781 B13R2.187 CC1(CC1Nc2ccccc2)C 93e5b134d0f7db927f308848af5dc163 [0,0,0,1,0,1|1,0,0]=3 9782 B13R2.187 CC1(CC1Nc2ccccn2)C d675a0665f97c2e697d6b55050fa6656 [0,0,0,1,0,1|2,0,0]=4 9783 B13R2.187 CC1(CC1Nc2cccnc2)C ff49427f74100050425a897ca07b9470 [0,0,0,1,0,1|2,0,0]=4 9784 B13R2.187 CC1(CC1Nc2ccncc2)C fdd7570e6b4d356e29f27138edf69c31 [0,0,0,1,0,1|2,0,0]=4 9785 B13R2.187 CC1(CC1Oc2ccccn2)C 0f155b42ef173d269762e3658c2eb5d3 [0,0,0,1,0,1|2,0,0]=4 9786 B13R2.187 CC1(CC1Oc2cccnc2)C 55b51860623379e3d993c191e375510a [0,0,0,1,0,1|2,0,0]=4 9787 B13R2.187 CC1(CC1Oc2ccncc2)C 4e8bf299c9272829116d4ac78fc725ce [0,0,0,1,0,1|2,0,0]=4 9788 B13R2.187 CC1(CN1Cc2ccccc2)C 809486764f942be742a7f44bea5d4c20 [0,0,0,1,0,1|1,0,0]=3 9789 B13R2.187 CC1(CN1Cc2ccccn2)C cb5015c03663756481f2399007980e0f [0,0,0,1,0,1|2,0,0]=4 9790 B13R2.187 CC1(CN1Cc2cccnc2)C 46be8e8f6dfcaae4d7a8ed91cbec91c2 [0,0,0,1,0,1|2,0,0]=4 9791 B13R2.187 CC1(C[C@@H]1Nc2ccccc2)C e4d47fb69ec4679d7af8da26d624bf0d [0,0,0,1,0,1|1,0,0]=3 9792 B13R2.187 CC1(C[C@@H]1Nc2cccnc2)C 227730bf26bece2e762326832ff9c811 [0,0,0,1,0,1|2,0,0]=4 9793 B13R2.187 CC1(C[C@H]1Nc2ccccc2)C e70944f25f328cba8b838d11767a7492 [0,0,0,1,0,1|1,0,0]=3 9794 B13R2.187 CC1(C[C@H]1Nc2cccnc2)C 8c4baad5fa068138bff939ff89fe13cb [0,0,0,1,0,1|2,0,0]=4 9795 B13R2.187 FC1(CC1Nc2ccccc2)F c00989354b57583589b34cf138bf5f9d [0,0,0,1,0,1|2,0,0]=4 9796 B13R2.423 CC(=O)N1CC1c2ccccc2 bdc9a9f283b4c1f3b1a56bf7092820e7 [0,0,0,1,0,1|0,0,2]=4 9797 B13R2.423 CC(=O)N1C[C@@H]1c2ccccc2 580257c50481dcd5a619adce6e734789 [0,0,0,1,0,1|0,0,2]=4 9798 B13R2.423 CC(C)N1CC1c2ccccc2 18f4891ac6aabb6616be1fee9081b7fc [0,0,0,1,0,1|1,0,0]=3 9799 B13R2.423 CC(C)N1C[C@@H]1c2ccccc2 3bf2363aada52a88447fe37132928179 [0,0,0,1,0,1|1,0,0]=3 9800 B13R2.2382 c1cc(ccn1)CCNC2CC2 37fc3949e4098458a348e17c320ec999 [0,0,0,1,0,1|2,0,0]=4 9801 B13R2.2382 c1cc(ccn1)CCOC2CC2 19d5440455d988fe5c18acd5290656c0 [0,0,0,1,0,1|2,0,0]=4 9802 B13R2.2382 c1cc(ccn1)CNCC2CC2 775d0a45524d5e9ebfe0e25baf33adc4 [0,0,0,1,0,1|2,0,0]=4 9803 B13R2.2382 c1cc(ccn1)COCC2CC2 8e9f342a1f1338ebfe3e0fc85a1adbcc [0,0,0,1,0,1|2,0,0]=4 9804 B13R2.2382 c1cc(ccn1)NCCC2CC2 5523de297fc887d1e48e5ae30e7c2dae [0,0,0,1,0,1|2,0,0]=4 9805 B13R2.2382 c1cc(ccn1)OCCC2CC2 595a41c03f6a700af5ded2a3b44d0072 [0,0,0,1,0,1|2,0,0]=4 9806 B13R2.2382 c1ccc(cc1)CCNC2CC2 c0acc909907416c990faac6461a17e3d [0,0,0,1,0,1|1,0,0]=3 9807 B13R2.2382 c1ccc(cc1)CCOC2CC2 9b4d64189ccdbb3669ef5879f884feb2 [0,0,0,1,0,1|1,0,0]=3 9808 B13R2.2382 c1ccc(cc1)CNCC2CC2 80cb94d2a5ebc9f070dab6079001726b [0,0,0,1,0,1|1,0,0]=3 9809 B13R2.2382 c1ccc(cc1)COCC2CC2 d94b6c445a4cec9ce9fd36dbab98e454 [0,0,0,1,0,1|1,0,0]=3 9810 B13R2.2382 c1ccc(cc1)NCCC2CC2 757c7212fbff1795e50d72252d44f390 [0,0,0,1,0,1|1,0,0]=3 9811 B13R2.2382 c1ccc(cc1)NCCN2CC2 16ddcb828f5878255a3b51a418f374af [0,0,0,1,0,1|2,0,0]=4 9812 B13R2.2382 c1ccc(cc1)SCOC2CC2 c8088614beed42bddddc4bb699109e72 [0,0,0,1,0,1|2,0,0]=4 9813 B13R2.2382 c1ccc(nc1)CCNC2CC2 35a709cccf393853b019f29ebf684a4a [0,0,0,1,0,1|2,0,0]=4 9814 B13R2.2382 c1ccc(nc1)CCOC2CC2 81f197f8b1a75cc83cddcb9f7e0b3370 [0,0,0,1,0,1|2,0,0]=4 9815 B13R2.2382 c1ccc(nc1)CNCC2CC2 3cec5e94e357e7a3297e9daffdff2c8b [0,0,0,1,0,1|2,0,0]=4 9816 B13R2.2382 c1ccc(nc1)COCC2CC2 dcec08f65100a950b995b893d71f3651 [0,0,0,1,0,1|2,0,0]=4 9817 B13R2.2382 c1ccc(nc1)NCCC2CC2 cf5c6d56e49ce97108498eddb38dd3d0 [0,0,0,1,0,1|2,0,0]=4 9818 B13R2.2382 c1ccc(nc1)OCCC2CC2 130d29ab7acdfdb06b924ed3eb497713 [0,0,0,1,0,1|2,0,0]=4 9819 B13R2.2382 c1cncc(c1)CCNC2CC2 9457e793100f8397b19f06d1daa242e4 [0,0,0,1,0,1|2,0,0]=4 9820 B13R2.2382 c1cncc(c1)CCOC2CC2 34f15578df9dbd2f0c78f1dd6cdc5f46 [0,0,0,1,0,1|2,0,0]=4 9821 B13R2.2382 c1cncc(c1)CNCC2CC2 68b46c24d878721f2c4008748c137fe1 [0,0,0,1,0,1|2,0,0]=4 9822 B13R2.2382 c1cncc(c1)COCC2CC2 0a913cf9f29ab010c40b67f584f65f33 [0,0,0,1,0,1|2,0,0]=4 9823 B13R2.2382 c1cncc(c1)NCCC2CC2 2e760af68eeb387ed645545ea996fb4c [0,0,0,1,0,1|2,0,0]=4 9824 B13R2.2382 c1cncc(c1)OCCC2CC2 7549c0ad14f1b5848b13873b4ca1b73f [0,0,0,1,0,1|2,0,0]=4 9825 B13R2.5881 CC(C)OC1Cc2c1cccc2 0e53db9fba641338134d98c1f8ac06b0 [0,0,0,1,0,1|1,0,0]=3 9826 B13R2.525 CC1CC1Nc2ccc(cc2)S 7a17d2e48c75aeb35f0bf11ac5361263 [0,1,0,1,0,0|2,0,0]=4 9827 B13R2.525 F[C@@H]1C[C@@H]1Nc2ccc(cc2)S 886d0f061bc5c4662932abd04d60b102 [0,1,0,1,0,0|2,0,0]=4 9828 B13R2.525 F[C@@H]1C[C@H]1Nc2ccc(cc2)S e0a4745def0a9476219989c759933099 [0,1,0,1,0,0|2,0,0]=4 9829 B13R2.525 F[C@H]1C[C@@H]1Nc2ccc(cc2)S 823ea18e441a5ba4ccdf4009fef7ddd2 [0,1,0,1,0,0|2,0,0]=4 9830 B13R2.527 Brc1ccc(cc1)CNC2CC2 41c4b0b01161d68c1334b58a2d976561 [0,1,0,1,0,0|2,0,0]=4 9831 B13R2.527 Brc1ccc(cc1)COC2CC2 bcd0d069642f486929d29a3e28cfa0fc [0,1,0,1,0,0|2,0,0]=4 9832 B13R2.527 Brc1ccc(cc1)NCC2CC2 ad0bccdbaa4e5d4292fe77f0286a543b [0,1,0,1,0,0|2,0,0]=4 9833 B13R2.527 Brc1ccc(cc1)OCC2CC2 6e719e49b908d2dc7cf719b5244380e1 [0,1,0,1,0,0|2,0,0]=4 9834 B13R2.527 Cc1ccc(cc1)CNC2CC2 66120eae50d73955bf64f3bb33a8ed69 [0,1,0,1,0,0|2,0,0]=4 9835 B13R2.527 Cc1ccc(cc1)COC2CC2 49e013e5a795c838f2a7826c7f08320c [0,1,0,1,0,0|2,0,0]=4 9836 B13R2.527 Cc1ccc(cc1)NCC2CC2 a53b11f6229398b5b0a90791beb8706a [0,1,0,1,0,0|2,0,0]=4 9837 B13R2.527 Cc1ccc(cc1)OCC2CC2 3e7a8fbbc538f764b970cd591115d543 [0,1,0,1,0,0|2,0,0]=4 9838 B13R2.527 Clc1ccc(cc1)CNC2CC2 4fc554a6d78ba9864c5780202e54b259 [0,1,0,1,0,0|2,0,0]=4 9839 B13R2.527 Clc1ccc(cc1)COC2CC2 d543aed2c6905a4e1b5339c24b2b2eb3 [0,1,0,1,0,0|2,0,0]=4 9840 B13R2.527 Clc1ccc(cc1)NCC2CC2 ee064e6e5fabdfb0a8255b3d510423b7 [0,1,0,1,0,0|2,0,0]=4 9841 B13R2.527 Clc1ccc(cc1)OCC2CC2 17128611dc1b472161596e3de19fdbd9 [0,1,0,1,0,0|2,0,0]=4 9842 B13R2.527 Fc1ccc(cc1)CNC2CC2 985dd799068b4a28b47b55cadb428a4c [0,1,0,1,0,0|2,0,0]=4 9843 B13R2.527 Fc1ccc(cc1)COC2CC2 dba40af6c6adc40a4937a7d7c55cb005 [0,1,0,1,0,0|2,0,0]=4 9844 B13R2.527 Fc1ccc(cc1)NCC2CC2 8681421e9fa2dfbc10740362a91ed7fa [0,1,0,1,0,0|2,0,0]=4 9845 B13R2.527 Fc1ccc(cc1)OCC2CC2 0cd850290317c97b5e28446d1c42a4df [0,1,0,1,0,0|2,0,0]=4 9846 B13R2.527 Ic1ccc(cc1)CNC2CC2 8ccd5c570d4ed2e616f8ec7203fec7d6 [0,1,0,1,0,0|2,0,0]=4 9847 B13R2.527 Ic1ccc(cc1)COC2CC2 7a6a5768c6d5f296bdf6c0b697767875 [0,1,0,1,0,0|2,0,0]=4 9848 B13R2.527 Ic1ccc(cc1)NCC2CC2 847648e051631cc3ee49012164105d5b [0,1,0,1,0,0|2,0,0]=4 9849 B13R2.527 Ic1ccc(cc1)OCC2CC2 006b0a8e1c973c215927d707e9af25f6 [0,1,0,1,0,0|2,0,0]=4 9850 B13R2.527 Sc1ccc(cc1)COC2CC2 b7d16cd5793e0215c67f5d70989d7cfa [0,1,0,1,0,0|2,0,0]=4 9851 B13R2.527 Sc1ccc(cc1)NCC2CC2 65cc0e59526764f6c196fc2722a3de30 [0,1,0,1,0,0|2,0,0]=4 9852 B13R2.527 Sc1ccc(cc1)OCC2CC2 4eb55565b03303779fb77d63eee1479f [0,1,0,1,0,0|2,0,0]=4 9853 B13R2.27 CC1OCC1Nc2ccccc2 b128ac395a9059b65dba0d9ea3bb54f0 [0,1,0,1,0,0|1,0,0]=3 9854 B13R2.27 CC1OCC1Nc2cccnc2 a2815f5d1bde65b1f48c020a9355877b [0,1,0,1,0,0|2,0,0]=4 9855 B13R2.27 CC1OCC1Nc2ccncc2 c4d37837bb1c77578b5172106235fccc [0,1,0,1,0,0|2,0,0]=4 9856 B13R2.27 C[C@@H]1CC[C@@H]1Nc2ccccc2 684c63eb5cb578cf14151b91d0b0133b [0,1,0,1,0,0|2,0,0]=4 9857 B13R2.27 C[C@@H]1CC[C@H]1Nc2ccccc2 a6e394c4737b64f13f3ac1a417405627 [0,1,0,1,0,0|2,0,0]=4 9858 B13R2.27 FC1CCC1Nc2ccccc2 8228dbbb5f10c6f0996225edf3d6da10 [0,1,0,1,0,0|2,0,0]=4 9859 B13R2.27 OC1CCC1Nc2ccccc2 22ccf36632920e2347d87311840cec60 [0,1,0,1,0,0|1,0,0]=3 9860 B13R2.27 OC1CCC1Nc2ccccn2 275af09b7e9d2edd2d30c2a5b4be22de [0,1,0,1,0,0|2,0,0]=4 9861 B13R2.27 OC1CCC1Nc2cccnc2 67d194dc39b7a2d96352aba38e4ab411 [0,1,0,1,0,0|2,0,0]=4 9862 B13R2.27 O[C@@H]1CC[C@@H]1Nc2ccccc2 24c8c18bf092a8f81f52a0ac3b04502e [0,1,0,1,0,0|1,0,0]=3 9863 B13R2.27 O[C@@H]1CC[C@@H]1Nc2ccccn2 b1a3e96f0c60ac131df5aeec9ee3c3aa [0,1,0,1,0,0|2,0,0]=4 9864 B13R2.27 O[C@@H]1CC[C@@H]1Nc2cccnc2 fc314e15002919d23e0d2601d5a1549d [0,1,0,1,0,0|2,0,0]=4 9865 B13R2.27 O[C@@H]1CC[C@H]1Nc2ccccc2 9e1f3d8791b3f567d82f5ab87fc30aa0 [0,1,0,1,0,0|1,0,0]=3 9866 B13R2.27 O[C@@H]1CC[C@H]1Nc2ccccn2 2abc7a25bd7e6c91dcac518aa81b1ba9 [0,1,0,1,0,0|2,0,0]=4 9867 B13R2.27 O[C@@H]1CC[C@H]1Nc2cccnc2 41aed7190bb0acfe49ccc80092315b8d [0,1,0,1,0,0|2,0,0]=4 9868 B13R2.27 O[C@H]1CC[C@@H]1Nc2ccccc2 1b260cec7536bcd5d480a3538bb0afac [0,1,0,1,0,0|1,0,0]=3 9869 B13R2.27 O[C@H]1CC[C@@H]1Nc2ccccn2 4385b1b759b0182c0bc107ed52b000e8 [0,1,0,1,0,0|2,0,0]=4 9870 B13R2.27 O[C@H]1CC[C@@H]1Nc2cccnc2 85fb158708ddce3bf5387719f1662170 [0,1,0,1,0,0|2,0,0]=4 9871 B13R2.27 O[C@H]1CC[C@H]1Nc2ccccc2 904496f66b00f360c1e9937cd611b9b4 [0,1,0,1,0,0|1,0,0]=3 9872 B13R2.27 O[C@H]1CC[C@H]1Nc2ccccn2 1104f332f50fb1372fe1337b016863eb [0,1,0,1,0,0|2,0,0]=4 9873 B13R2.27 O[C@H]1CC[C@H]1Nc2cccnc2 411ddf49669d2300916c999e255cdd00 [0,1,0,1,0,0|2,0,0]=4 9874 B13R2.50 CCN1C[C@@H]1Cc2ccccc2 72eee314b16c58dc582e3e6a580d139e [0,1,0,1,0,0|2,0,0]=4 9875 B13R2.50 CO[C@H]1C[C@H]1Nc2ccccc2 c907af03b24a61b55e237c5a004024cc [0,1,0,1,0,0|1,0,0]=3 9876 B13R2.50 CO[C@H]1C[C@H]1Nc2cccnc2 547f9d4d68b0826efa95c856b5cccdf8 [0,1,0,1,0,0|2,0,0]=4 9877 B13R2.50 CO[C@H]1C[C@H]1Nc2ccncc2 6b739a97ce0ade5163d8a064c3e135cb [0,1,0,1,0,0|2,0,0]=4 9878 B13R2.50 FCN1C[C@@H]1Cc2ccccc2 2fe655d2e6a0d0b8abc537a648ad2309 [0,1,0,1,0,0|2,0,0]=4 9879 B13R2.50 O=CC1CC1Nc2ccccc2 5edb64d99c77ee695f9b3ae79ba42ae1 [0,1,0,1,0,0|1,0,1]=4 9880 B13R2.50 O=CN1C[C@@H]1Cc2ccccc2 5a3201b1a4fc78f9585897c7bc378194 [0,1,0,1,0,0|1,0,1]=4 9881 B13R2.50 OCN1C[C@@H]1Cc2ccccc2 23c338218cf740a486abdd836934ba8d [0,1,0,1,0,0|1,0,0]=3 9882 B13R2.50 OC[C@@H]1C[C@@H]1Nc2ccccc2 b25fe7a9e0e6df82ab17af5b293ded33 [0,1,0,1,0,0|1,0,0]=3 9883 B13R2.50 OC[C@@H]1C[C@@H]1Nc2cccnc2 9819ed6ca6e9bc0f0e3f0e205cbe573a [0,1,0,1,0,0|2,0,0]=4 9884 B13R2.50 OC[C@@H]1C[C@H]1Nc2ccccc2 7ada4cf4faab81f6024b1c8d048f713e [0,1,0,1,0,0|1,0,0]=3 9885 B13R2.50 OC[C@@H]1C[C@H]1Nc2cccnc2 cb64ea04dcac2500f94e1ac8cbe21cf4 [0,1,0,1,0,0|2,0,0]=4 9886 B13R2.50 OC[C@H]1C[C@@H]1Nc2ccccc2 45bcb86784bb39a18fadb0ac9283526b [0,1,0,1,0,0|1,0,0]=3 9887 B13R2.50 OC[C@H]1C[C@@H]1Nc2cccnc2 b88d1d9c923c6bb7f250f8052dac4041 [0,1,0,1,0,0|2,0,0]=4 9888 B13R2.52 CCN1CC(C1)c2ccccc2 69d4cc457ae2e1f78728361f56079908 [0,1,0,1,0,0|2,0,0]=4 9889 B13R2.52 FCN1CC(C1)c2ccccc2 2f123790cc63657dd270bace14c92804 [0,1,0,1,0,0|2,0,0]=4 9890 B13R2.52 O=CN1CC(C1)c2ccccc2 60ae2110ec584e869c28cd5ab53f6793 [0,1,0,1,0,0|1,0,1]=4 9891 B13R2.52 OCN1CC(C1)c2ccccc2 5a51a2f1f7462df2c3c0a04f740b1f18 [0,1,0,1,0,0|1,0,0]=3 9892 B13R2.52 OCN1CC(C1)c2ccccn2 0af605af3b5b3f8e0c9e3aba9a2ec833 [0,1,0,1,0,0|2,0,0]=4 9893 B13R2.52 OCN1CC(C1)c2cccnc2 4cc58ac470e87853d4d076e439deb736 [0,1,0,1,0,0|2,0,0]=4 9894 B13R2.52 OCN1CC(C1)c2ccncc2 3562f0103389b0f0d4ff600a91a34a77 [0,1,0,1,0,0|2,0,0]=4 9895 B13R2.57 CCN1CCc2ccccc2C1 0fb8fe72984abaf69967df9e6f6e197f [0,1,0,1,0,0|2,0,0]=4 9896 B13R2.57 FCN1CCc2ccccc2C1 e944048925a5467cbac175d10e41d2dc [0,1,0,1,0,0|2,0,0]=4 9897 B13R2.57 O=CN1CCc2ccccc2C1 ca6a2fd7719eafb50844fee2e23df55a [0,1,0,1,0,0|1,0,1]=4 9898 B13R2.57 OCN1CCc2ccccc2C1 272e6afe58584ab22f1180c6512179a8 [0,1,0,1,0,0|1,0,0]=3 9899 B13R2.57 OCN1CCc2cccnc2C1 89c2754128e6c90c44f538a3649ab259 [0,1,0,1,0,0|2,0,0]=4 9900 B13R2.57 OCN1CCc2ccncc2C1 11e899b444d69ebb7eb6e3e6edc70c58 [0,1,0,1,0,0|2,0,0]=4 9901 B13R2.57 OCN1CCc2cnccc2C1 8cee8cd136cfc0a33602c23f5c8504b8 [0,1,0,1,0,0|2,0,0]=4 9902 B13R2.57 OCN1CCc2ncccc2C1 2b25c768df1338c2684f5a58055fb958 [0,1,0,1,0,0|2,0,0]=4 9903 B13R2.2383 c1cc(ccn1)NCC2CCO2 635bb11fded7b85ce11adb291221a37d [0,1,0,1,0,0|2,0,0]=4 9904 B13R2.2383 c1cc(ccn1)NCC2COC2 2e4691c4859d53ff169c1972cc14961e [0,1,0,1,0,0|2,0,0]=4 9905 B13R2.2383 c1cc(ccn1)NC[C@@H]2CCO2 e6000b169ef3fe913c4e1f59223596e9 [0,1,0,1,0,0|2,0,0]=4 9906 B13R2.2383 c1cc(ccn1)NC[C@H]2CCO2 7819f63f83612443a5c850561ab0964b [0,1,0,1,0,0|2,0,0]=4 9907 B13R2.2383 c1cc(ccn1)OCC2CCO2 06dcade9a9a1ef7b1aa9c7a55c20ba4e [0,1,0,1,0,0|2,0,0]=4 9908 B13R2.2383 c1cc(ccn1)OCC2COC2 df2a5870239ee345dedea807ae4b7353 [0,1,0,1,0,0|2,0,0]=4 9909 B13R2.2383 c1cc(ccn1)OC[C@@H]2CCO2 d90aa46ddcd0103ceea17189cfc229e6 [0,1,0,1,0,0|2,0,0]=4 9910 B13R2.2383 c1cc(ccn1)OC[C@H]2CCO2 8c6f4491c3cf290ae405b0b88465d126 [0,1,0,1,0,0|2,0,0]=4 9911 B13R2.2383 c1ccc(cc1)CCN2CCC2 22a53212ff75b5e3f191773b1880daf5 [0,1,0,1,0,0|2,0,0]=4 9912 B13R2.2383 c1ccc(cc1)CNC2CCC2 3a6b392b1d26d51094292814d17ea686 [0,1,0,1,0,0|2,0,0]=4 9913 B13R2.2383 c1ccc(cc1)CNC2COC2 51d5165ff5651c61c73d43baba847d87 [0,1,0,1,0,0|1,0,0]=3 9914 B13R2.2383 c1ccc(cc1)COC2CCC2 f8bbcd5737453dbd625ce5790467cebd [0,1,0,1,0,0|2,0,0]=4 9915 B13R2.2383 c1ccc(cc1)COC2COC2 2c8e62ffef83aa8a09ed28b5aa67341f [0,1,0,1,0,0|1,0,0]=3 9916 B13R2.2383 c1ccc(cc1)COC2CSC2 b5a61bc7e3ee8b14ae3f92aa0cb8d4b8 [0,1,0,1,0,0|1,1,0]=4 9917 B13R2.2383 c1ccc(cc1)NCC2CCC2 fc90e0c4b244b2a8349c32f4ee278f6b [0,1,0,1,0,0|2,0,0]=4 9918 B13R2.2383 c1ccc(cc1)NCC2CCO2 5d818abbab86ded9891dd9b13b40da91 [0,1,0,1,0,0|1,0,0]=3 9919 B13R2.2383 c1ccc(cc1)NCC2COC2 0546e72f0eb7c92451540454a2c852c0 [0,1,0,1,0,0|1,0,0]=3 9920 B13R2.2383 c1ccc(cc1)NC[C@@H]2CCO2 20cdb3b5e9bd81893451addec1bb2ae9 [0,1,0,1,0,0|1,0,0]=3 9921 B13R2.2383 c1ccc(cc1)NC[C@H]2CCO2 fc1288ba6814eb5377d68c20a59f5fff [0,1,0,1,0,0|1,0,0]=3 9922 B13R2.2383 c1ccc(nc1)CNC2COC2 0d51ecf839465eff3d20be52611becaa [0,1,0,1,0,0|2,0,0]=4 9923 B13R2.2383 c1ccc(nc1)COC2COC2 5e3815e68710e45d683f4941a6b117fe [0,1,0,1,0,0|2,0,0]=4 9924 B13R2.2383 c1ccc(nc1)NCC2CCO2 a02a57a51212b230fc2f8096e11ab8e5 [0,1,0,1,0,0|2,0,0]=4 9925 B13R2.2383 c1ccc(nc1)NCC2COC2 7214761ce84b7f2d2d0b2d637c9b966b [0,1,0,1,0,0|2,0,0]=4 9926 B13R2.2383 c1ccc(nc1)NC[C@@H]2CCO2 4dc0ff35dc0a0af30c73235f8ad7e881 [0,1,0,1,0,0|2,0,0]=4 9927 B13R2.2383 c1ccc(nc1)NC[C@H]2CCO2 6fd6d1b013a23cf98a2a545f547b8bb9 [0,1,0,1,0,0|2,0,0]=4 9928 B13R2.2383 c1ccc(nc1)OCC2CCO2 376b904d3e7a2fe22cf77af61fc98a8e [0,1,0,1,0,0|2,0,0]=4 9929 B13R2.2383 c1ccc(nc1)OCC2COC2 c7c87902c930923140d3595a78fdfad3 [0,1,0,1,0,0|2,0,0]=4 9930 B13R2.2383 c1ccc(nc1)OC[C@@H]2CCO2 eab224f9de923902970d18cf7ce72866 [0,1,0,1,0,0|2,0,0]=4 9931 B13R2.2383 c1ccc(nc1)OC[C@H]2CCO2 c7a2b579440aab14ae69dfa466310b9c [0,1,0,1,0,0|2,0,0]=4 9932 B13R2.2383 c1cncc(c1)CNC2COC2 6f7cfda0c2ab85e4f669f6d8536f8bc8 [0,1,0,1,0,0|2,0,0]=4 9933 B13R2.2383 c1cncc(c1)COC2COC2 7f809c9194b47312ec512e8d6a4f19fb [0,1,0,1,0,0|2,0,0]=4 9934 B13R2.2383 c1cncc(c1)NCC2CCO2 1413bf22772bab5b81aff0c82ffc6d08 [0,1,0,1,0,0|2,0,0]=4 9935 B13R2.2383 c1cncc(c1)NCC2COC2 aa981f01179f9c207d755b6ce782b9a6 [0,1,0,1,0,0|2,0,0]=4 9936 B13R2.2383 c1cncc(c1)NC[C@@H]2CCO2 643dd1490ed802158651f70091677282 [0,1,0,1,0,0|2,0,0]=4 9937 B13R2.2383 c1cncc(c1)NC[C@H]2CCO2 b506c4c0e6f72e2805afa13b5756fc25 [0,1,0,1,0,0|2,0,0]=4 9938 B13R2.2383 c1cncc(c1)OCC2CCO2 3d1ba6634725bf9aa0f833f24024df07 [0,1,0,1,0,0|2,0,0]=4 9939 B13R2.2383 c1cncc(c1)OCC2COC2 e66750eb6b0eff0e72ef2035001c4d06 [0,1,0,1,0,0|2,0,0]=4 9940 B13R2.2383 c1cncc(c1)OC[C@@H]2CCO2 6ec046c93914b9af0ba1cc8fc47c39a4 [0,1,0,1,0,0|2,0,0]=4 9941 B13R2.2383 c1cncc(c1)OC[C@H]2CCO2 2c604d8c892eb684b953aba7f508f3ba [0,1,0,1,0,0|2,0,0]=4 9942 B13R2.3203 CC1(CC1)CNc2ccccc2 5b2747131755eb0c99d5e012d3191cf2 [0,1,0,1,0,0|2,0,0]=4 9943 B13R2.3203 CC1(CC1)NCc2ccccc2 95cfa4c5deeec624a45ab39a0fdc89eb [0,1,0,1,0,0|2,0,0]=4 9944 B13R2.3203 FC1(CC1)CNc2ccccc2 da20d03de0e5f75efd87dcec5af5315e [0,1,0,1,0,0|2,0,0]=4 9945 B13R2.3203 OC1(CC1)CNc2ccccc2 001eef834af10e6558220e5838dcdaee [0,1,0,1,0,0|1,0,0]=3 9946 B13R2.3203 OC1(CC1)CNc2cccnc2 fbcbf83f08b49ae0d550ba6d6f6a87a2 [0,1,0,1,0,0|2,0,0]=4 9947 B13R2.435 CC(C)N1Cc2ccccc2C1 58f5cd39317a8c58a43d857d684b1d15 [0,1,0,1,0,0|2,0,0]=4 9948 B13R2.444 CC(Nc1ccccc1)C2CC2 3706ecba23e815e6be707c911b57e057 [0,1,0,1,0,0|2,0,0]=4 9949 B13R2.444 CN(Cc1ccccc1)C2CC2 9f52ab7ea1a459ab7455c2343e8d9308 [0,1,0,1,0,0|2,0,0]=4 9950 B13R2.444 C[C@@H](Nc1ccccc1)C2CC2 799bdd408bc60a8de32fe53344c97899 [0,1,0,1,0,0|2,0,0]=4 9951 B13R2.444 C[C@H](Nc1ccccc1)C2CC2 df9af1d872dd0c81b4b119302c5a2bfd [0,1,0,1,0,0|2,0,0]=4 9952 B13R2.690 CN(CC1CC1)c2ccccc2 52c95350830ca837805f53a7d831b0cd [0,1,0,1,0,0|2,0,0]=4 9953 B13R2.377 CC1CC1Nc2ccccc2F 73fe8236b6c238cddff5b223a645ea98 [0,1,0,1,0,0|2,0,0]=4 9954 B13R2.377 Cc1ccccc1NC2CC2C 09d878ade43953c226f1d280cce62851 [0,1,0,1,0,0|2,0,0]=4 9955 B13R2.377 Fc1ccccc1N[C@@H]2C[C@H]2F dd36e2af7bfe324ce4076ec67a9216c3 [0,1,0,1,0,0|2,0,0]=4 9956 B13R2.377 Fc1ccccc1N[C@H]2C[C@@H]2F ad1ebb4797e0891eeb6a4a1dc1bdafc0 [0,1,0,1,0,0|2,0,0]=4 9957 B13R2.377 Fc1ccccc1N[C@H]2C[C@H]2F fde174b694e8f342d2787d8ec2ef1a5e [0,1,0,1,0,0|2,0,0]=4 9958 B13R2.3587 Brc1ccccc1CNC2CC2 554145834f7a81c85b56501a7eb86320 [0,1,0,1,0,0|2,0,0]=4 9959 B13R2.3587 Brc1ccccc1COC2CC2 0387ea74140a9d22c20e4f9dca461182 [0,1,0,1,0,0|2,0,0]=4 9960 B13R2.3587 Brc1ccccc1NCC2CC2 ecb17ebf203318ba53e91af9dcc7ef88 [0,1,0,1,0,0|2,0,0]=4 9961 B13R2.3587 Cc1ccccc1CNC2CC2 7b95b24612f598dbbbe7812e5b56b73c [0,1,0,1,0,0|2,0,0]=4 9962 B13R2.3587 Cc1ccccc1COC2CC2 c0635c73960ab228d156a3263d1f8ea4 [0,1,0,1,0,0|2,0,0]=4 9963 B13R2.3587 Cc1ccccc1NCC2CC2 bdc18272f333d69bdc5d279ff77269b8 [0,1,0,1,0,0|2,0,0]=4 9964 B13R2.3587 Cc1ccccc1OCC2CC2 f7fb48d76041b094b0e7eb2ba96d06ab [0,1,0,1,0,0|2,0,0]=4 9965 B13R2.3587 Clc1ccccc1CNC2CC2 8f5542ae83e7ce26b653a9ccd8d8cf09 [0,1,0,1,0,0|2,0,0]=4 9966 B13R2.3587 Clc1ccccc1COC2CC2 f7c8a318444098ea95c6220db9287ad3 [0,1,0,1,0,0|2,0,0]=4 9967 B13R2.3587 Clc1ccccc1NCC2CC2 f9e23dd65e3a2a2ca7b9ccedfe334e06 [0,1,0,1,0,0|2,0,0]=4 9968 B13R2.3587 Clc1ccccc1OCC2CC2 f008a379ebd6c64cd3ce8bd8a71b6d82 [0,1,0,1,0,0|2,0,0]=4 9969 B13R2.3587 Fc1ccccc1CNC2CC2 013b947027bb3aa99b42dcd9f53e4cfc [0,1,0,1,0,0|2,0,0]=4 9970 B13R2.3587 Fc1ccccc1COC2CC2 623ae5e807d4a554f8a08c72462367de [0,1,0,1,0,0|2,0,0]=4 9971 B13R2.3587 Fc1ccccc1NCC2CC2 643532b2890cba9b6d4e86c3f98190ce [0,1,0,1,0,0|2,0,0]=4 9972 B13R2.3587 Fc1ccccc1OCC2CC2 45110cbc3d1b584dac4a53a114ab04ef [0,1,0,1,0,0|2,0,0]=4 9973 B13R2.3587 Ic1ccccc1CNC2CC2 9340be8fffcc4111928db2f1a218a071 [0,1,0,1,0,0|2,0,0]=4 9974 B13R2.3587 Ic1ccccc1COC2CC2 d9e8b774d69add1a3c4f45fe8a9b7d23 [0,1,0,1,0,0|2,0,0]=4 9975 B13R2.3587 Ic1ccccc1NCC2CC2 894e01de872d724c75db94186bbc5376 [0,1,0,1,0,0|2,0,0]=4 9976 B13R2.3587 Ic1ccccc1OCC2CC2 f1115151a36d11b9dab732ac8ea67030 [0,1,0,1,0,0|2,0,0]=4 9977 B13R2.3587 Sc1ccccc1COC2CC2 f6a966f47a0a2cb2f68e501756943b90 [0,1,0,1,0,0|2,0,0]=4 9978 B13R2.3587 Sc1ccccc1NCC2CC2 accf74b6d163dee196dbd4a206a08554 [0,1,0,1,0,0|2,0,0]=4 9979 B13R2.153 Cc1cccc(c1)NC2CC2C 6bea79ef13b6742280e4618a3c4c8e7a [0,1,0,1,0,0|2,0,0]=4 9980 B13R2.153 Cc1cccc(c1)N[C@@H]2C[C@H]2F 508b6a473fd76b17a312abc3fbbd8b46 [0,1,0,1,0,0|2,0,0]=4 9981 B13R2.153 Cc1cccc(c1)N[C@H]2C[C@@H]2F 78cc73ce9c9f42747c7f89b307b3c942 [0,1,0,1,0,0|2,0,0]=4 9982 B13R2.153 Cc1cccc(c1)N[C@H]2C[C@H]2F d12bf0d7ed9a856c09c8762f4031eff2 [0,1,0,1,0,0|2,0,0]=4 9983 B13R2.153 Fc1cccc(c1)N[C@@H]2C[C@H]2F 9074905361c56aefe642529c0a9c6748 [0,1,0,1,0,0|2,0,0]=4 9984 B13R2.153 Fc1cccc(c1)N[C@H]2C[C@@H]2F f631a58618c5a86766ef7371e59d765b [0,1,0,1,0,0|2,0,0]=4 9985 B13R2.153 Fc1cccc(c1)N[C@H]2C[C@H]2F 1cdaf02bafcbb548820dc09e6a4d0789 [0,1,0,1,0,0|2,0,0]=4 9986 B13R2.153 Oc1cccc(c1)N[C@@H]2C[C@H]2F 81ce029692511ef58e6c318377ee9f8d [0,1,0,1,0,0|2,0,0]=4 9987 B13R2.153 Oc1cccc(c1)N[C@H]2C[C@@H]2F 03f9f8112b5a599b676697815f5b6617 [0,1,0,1,0,0|2,0,0]=4 9988 B13R2.153 Oc1cccc(c1)N[C@H]2C[C@H]2F 44f7edecdb0148badfc0cc26828c8a82 [0,1,0,1,0,0|2,0,0]=4 9989 B13R2.5331 Brc1cccc(c1)CNC2CC2 f1f308eee460257a2716423a42edb86d [0,1,0,1,0,0|2,0,0]=4 9990 B13R2.5331 Brc1cccc(c1)COC2CC2 bc25e841f3f258c0f5d1958eca4b0945 [0,1,0,1,0,0|2,0,0]=4 9991 B13R2.5331 Brc1cccc(c1)NCC2CC2 921677c955657de47e2aaf6272da38a3 [0,1,0,1,0,0|2,0,0]=4 9992 B13R2.5331 Brc1cccc(c1)OCC2CC2 d2f0362764f4451d5469a1b6e65b6f4e [0,1,0,1,0,0|2,0,0]=4 9993 B13R2.5331 Cc1cccc(c1)CNC2CC2 0f7f1082cae530b2e798592232ce960f [0,1,0,1,0,0|2,0,0]=4 9994 B13R2.5331 Cc1cccc(c1)COC2CC2 660d8e0a21e90065593cb40b072de604 [0,1,0,1,0,0|2,0,0]=4 9995 B13R2.5331 Cc1cccc(c1)NCC2CC2 f59001fb7d427fbdd2c5c9eb4c5ecf93 [0,1,0,1,0,0|2,0,0]=4 9996 B13R2.5331 Cc1cccc(c1)OCC2CC2 38e5c792c629987e61ca6ad57099dcfa [0,1,0,1,0,0|2,0,0]=4 9997 B13R2.5331 Clc1cccc(c1)CNC2CC2 7960f44a10213787af1c09e11566a3e2 [0,1,0,1,0,0|2,0,0]=4 9998 B13R2.5331 Clc1cccc(c1)COC2CC2 a9c025c7f8307171adb165fce44218a9 [0,1,0,1,0,0|2,0,0]=4 9999 B13R2.5331 Clc1cccc(c1)NCC2CC2 924f2df18f7e61ff9579cb116540f94f [0,1,0,1,0,0|2,0,0]=4 10000 B13R2.5331 Clc1cccc(c1)OCC2CC2 4c43ccff23b5218e0b185a1207a4f9c3 [0,1,0,1,0,0|2,0,0]=4 10001 B13R2.5331 Fc1cccc(c1)CNC2CC2 38336cbb255c99239cbaf8d1960fe402 [0,1,0,1,0,0|2,0,0]=4 10002 B13R2.5331 Fc1cccc(c1)COC2CC2 d1b1244c49651faf6869794c4ebb873f [0,1,0,1,0,0|2,0,0]=4 10003 B13R2.5331 Fc1cccc(c1)NCC2CC2 bda290414b4b839f6caf3242218b7cc1 [0,1,0,1,0,0|2,0,0]=4 10004 B13R2.5331 Fc1cccc(c1)OCC2CC2 82d52d20221d1146f3d855fb6da36a81 [0,1,0,1,0,0|2,0,0]=4 10005 B13R2.5331 Ic1cccc(c1)CNC2CC2 73bbcb4730b3c22cca2f3fda76e50050 [0,1,0,1,0,0|2,0,0]=4 10006 B13R2.5331 Ic1cccc(c1)COC2CC2 69e757453938dc5df13558b486b9a09b [0,1,0,1,0,0|2,0,0]=4 10007 B13R2.5331 Ic1cccc(c1)NCC2CC2 58e082c9a2ca3f3f3f6911d4dd8e3a07 [0,1,0,1,0,0|2,0,0]=4 10008 B13R2.5331 Ic1cccc(c1)OCC2CC2 3b59edece84b58e12c33fd4a2366bbaa [0,1,0,1,0,0|2,0,0]=4 10009 B13R2.5331 Sc1cccc(c1)NCC2CC2 225c9360c4042e5583d69c83b71fee54 [0,1,0,1,0,0|2,0,0]=4 10010 B13R2.5331 Sc1cccc(c1)OCC2CC2 95f64d88bd4528dd923625cdd374a4ab [0,1,0,1,0,0|2,0,0]=4 10011 B9R1.12 CCCNc1cccs1 dddbeb0cebfad93e2ee450a927f1f846 [1,0,0,0,1,0|2,0,0]=4 10012 B9R1.12 CCCNc1ccoc1 cc4f6f51569c182aca4da58e5f019c78 [1,0,0,0,1,0|2,0,0]=4 10013 B9R1.12 CCCNc1ccsc1 a70237f11ed81d43b5ff787e5b6c83f9 [1,0,0,0,1,0|2,0,0]=4 10014 B9R1.12 CCCOc1ccco1 892ad9a1c4eda1b2e579e57ab16386c6 [1,0,0,0,1,0|2,0,0]=4 10015 B9R1.12 CCCOc1cccs1 08634ab81341ae1b1178430949f9ac0f [1,0,0,0,1,0|2,0,0]=4 10016 B9R1.12 CCCOc1ccsc1 09284982954b71ce4e3ef57411744ecc [1,0,0,0,1,0|2,0,0]=4 10017 B9R1.12 CCNCc1cc[nH]c1 5f34bb16d580f8126d210a7f1c922122 [1,0,0,0,1,0|2,0,0]=4 10018 B9R1.12 CCNCc1ccc[nH]1 d148947c496d04ba3fda3d28b4738aad [1,0,0,0,1,0|2,0,0]=4 10019 B9R1.12 CCNCc1ccco1 4817cc97570de733e3d59f88500c3b37 [1,0,0,0,1,0|2,0,0]=4 10020 B9R1.12 CCNCc1cccs1 4bb993aa1ef7b62c5d2b7781bf586f7d [1,0,0,0,1,0|2,0,0]=4 10021 B9R1.12 CCNCc1ccoc1 790b339bd93664fda272fb5f895d2be9 [1,0,0,0,1,0|2,0,0]=4 10022 B9R1.12 CCNCc1ccsc1 8d2a00279cff0e97c4d4139ed8f7ead4 [1,0,0,0,1,0|2,0,0]=4 10023 B9R1.12 CCOCc1cc[nH]c1 59d617c736c503e8fe59f893e6c21bac [1,0,0,0,1,0|2,0,0]=4 10024 B9R1.12 CCOCc1ccc[nH]1 0b5c52ca398d6e6823ab9d1f4fb92621 [1,0,0,0,1,0|2,0,0]=4 10025 B9R1.12 CCOCc1ccco1 e774f039f2ee21ec2e9d047bdeb979aa [1,0,0,0,1,0|2,0,0]=4 10026 B9R1.12 CCOCc1cccs1 8766881c6db57c6784fc6c93385667d4 [1,0,0,0,1,0|2,0,0]=4 10027 B9R1.12 CCOCc1ccsc1 386d4e7246ff291707b3e218c5edbe51 [1,0,0,0,1,0|2,0,0]=4 10028 B9R1.12 OCCNc1ccco1 133a22307e236e8d6e7724cd612f28fd [1,0,0,0,1,0|2,0,0]=4 10029 B9R1.12 OCCNc1cccs1 2ba78ef34c75ea3069c9d7a18a33b4b5 [1,0,0,0,1,0|2,0,0]=4 10030 B9R1.12 OCCNc1ccoc1 57b3dbe9a8463690570ac98cb9dbd904 [1,0,0,0,1,0|2,0,0]=4 10031 B9R1.12 OCCNc1ccsc1 0f9832f0a4c7ccbac5bb22dfab5dcad2 [1,0,0,0,1,0|2,0,0]=4 10032 B9R1.12 OCNCc1cc[nH]c1 f5a137e18f15de138541ca934254f440 [1,0,0,0,1,0|2,0,0]=4 10033 B9R1.12 OCNCc1ccc[nH]1 b011ce93b48fe889bae376897837b402 [1,0,0,0,1,0|2,0,0]=4 10034 B9R1.12 OCNCc1ccco1 65cac21f3029c35a0c20d324fb578c01 [1,0,0,0,1,0|2,0,0]=4 10035 B9R1.12 OCNCc1cccs1 2d672a9efcaba2b89f20e3b8a4fffaa8 [1,0,0,0,1,0|2,0,0]=4 10036 B9R1.12 OCNCc1ccoc1 9c7027d5d74585d7a26015dc4962abeb [1,0,0,0,1,0|2,0,0]=4 10037 B9R1.12 OCNCc1ccsc1 e98282527dce2dcf482e445dc6ab3297 [1,0,0,0,1,0|2,0,0]=4 10038 B13R1.337 C/C(=C/CNCc1ccccc1)/I 46810acf132f78a6b99690cdf4b9aca2 [0,0,0,0,0,2|1,0,1]=4 10039 B13R1.337 C/C(=C/COCc1ccccc1)/Cl 1a6bd15a40cefe46357eafce25c63e80 [0,0,0,0,0,2|1,0,1]=4 10040 B13R1.337 C/C(=C/COCc1ccccc1)/I 4877cf473278110790d2bac7cf778df9 [0,0,0,0,0,2|1,0,1]=4 10041 B13R1.337 C/C(=C\CNCc1ccccc1)/Cl 50af1b098fb1d8d04ecd2187bab1bbbe [0,0,0,0,0,2|1,0,1]=4 10042 B13R1.337 C/C(=C\COCc1ccccc1)/Cl 26d23693cfbe09ff19e73efb558a1108 [0,0,0,0,0,2|1,0,1]=4 10043 B13R1.337 C=C(C)CCCNc1ccccc1 f728f8a1b605411bc015a737be6f7656 [0,0,0,0,0,2|1,0,1]=4 10044 B13R1.337 C=C(C)CCNCc1ccccc1 245d7e932f268ca289e225d2bf588b51 [0,0,0,0,0,2|1,0,1]=4 10045 B13R1.337 C=C(C)CCOCc1ccccc1 f1f833f7ffe7ac0efc7e8e372d42a942 [0,0,0,0,0,2|1,0,1]=4 10046 B13R1.337 C=C(C)CNCCc1ccccc1 ad4abafd80b4630bfb329df93c6ebf89 [0,0,0,0,0,2|1,0,1]=4 10047 B13R1.337 C=C(C)CNCSc1ccccc1 db12925feb47d794c1640a4fa489274f [0,0,0,0,0,2|1,0,1]=4 10048 B13R1.337 C=C(C)COCCc1ccccc1 bb47dba412913fd69c05f208256c3165 [0,0,0,0,0,2|1,0,1]=4 10049 B13R1.337 CC(=CCCNc1ccccc1)C 1e4e94a2e327d30d7b19eaf49c2320df [0,0,0,0,0,2|1,0,1]=4 10050 B13R1.337 CC(=CCNCc1ccccc1)C 63d1470bd86ce9bb4e85b2dccb67d6e9 [0,0,0,0,0,2|1,0,1]=4 10051 B13R1.337 CC(=CCNCc1ccccc1)Cl 5006e93fa40b0cf37049bbe9c45b12d5 [0,0,0,0,0,2|1,0,1]=4 10052 B13R1.337 CC(=CCNCc1ccccc1)I 79603e80e1ae5d2285f52273b853c715 [0,0,0,0,0,2|1,0,1]=4 10053 B13R1.337 CC(=CCOCc1ccccc1)C dc5428f5af33b602923aed19bb2b52fd [0,0,0,0,0,2|1,0,1]=4 10054 B13R1.337 CC(=CCOCc1ccccc1)Cl 12d7f2ab27601656c26938bb43705bd3 [0,0,0,0,0,2|1,0,1]=4 10055 B13R1.337 CC(=CCOCc1ccccc1)I 9085b09f13322162d51c643bfa4b38d8 [0,0,0,0,0,2|1,0,1]=4 10056 B13R1.337 CC(=O)CCCNc1ccccc1 4ae31353e66fee474138ce1ee3f6c9df [0,0,0,0,0,2|0,0,2]=4 10057 B13R1.337 CC(=O)CCNCc1ccccc1 545f125e7fb7bd7de6143e9ac44bc8db [0,0,0,0,0,2|0,0,2]=4 10058 B13R1.337 CC(=O)CCOCc1ccccc1 cd809ee0733413cdafcbf7a64d37b288 [0,0,0,0,0,2|0,0,2]=4 10059 B13R1.337 CC(=O)CNCCc1ccccc1 a0e5ecc2a075f9e99967492b413c2b22 [0,0,0,0,0,2|0,0,2]=4 10060 B13R1.337 CC(=O)CNCSc1ccccc1 c45142829315e6238a9840c24966736e [0,0,0,0,0,2|0,0,2]=4 10061 B13R1.337 CC(=O)COCCc1ccccc1 b21215f0294db45e86870204260f53f2 [0,0,0,0,0,2|0,0,2]=4 10062 B13R1.337 CC(=O)NCCCc1ccccc1 4cae49b29a0d5e4aca63abcd8931e637 [0,0,0,0,0,2|0,0,2]=4 10063 B13R1.337 CC(=O)NCCNc1ccccc1 9fe3a3b17be53badb53fa3480b6904f5 [0,0,0,0,0,2|0,0,2]=4 10064 B13R1.337 CC(=O)NCCOc1ccccc1 2a851f694c8810e62a6bcd967df0637e [0,0,0,0,0,2|0,0,2]=4 10065 B13R1.337 CC(=O)NCOCc1ccccc1 1af0909d000886beedd618909e7c680f [0,0,0,0,0,2|0,0,2]=4 10066 B13R1.337 CC(=O)OCCNc1ccccc1 b45490ca09ffd27e7573c391e8bb3de0 [0,0,0,0,0,2|0,0,2]=4 10067 B13R1.337 CC(=O)OCNCc1ccccc1 c2b51a2674b9598bf0d452eb18a9952b [0,0,0,0,0,2|0,0,2]=4 10068 B13R1.337 CC(=O)OCOCc1ccccc1 35cc5582b027264c8a1b89253e9fdfe4 [0,0,0,0,0,2|0,0,2]=4 10069 B13R1.337 CC(=O)SCCNc1ccccc1 e2e324e877235d3892885dc7afb2268f [0,0,0,0,0,2|0,0,2]=4 10070 B13R1.337 CC(C)/C=C/CNc1ccccc1 8c6e3a95c5246c3797ad03a392c77e07 [0,0,0,0,0,2|1,0,1]=4 10071 B13R1.337 CC(C)CCCNc1ccccc1 c82a8703c7f6bacdc28ba024d517baa2 [0,0,0,0,0,2|1,0,0]=3 10072 B13R1.337 CC(C)CCCNc1ccccn1 51be2530c79b637398d9a91ae21bb834 [0,0,0,0,0,2|2,0,0]=4 10073 B13R1.337 CC(C)CCCNc1cccnc1 9beb5791787630d5f828c17422f51de5 [0,0,0,0,0,2|2,0,0]=4 10074 B13R1.337 CC(C)CCCNc1ccncc1 efbcf79d50e46c69ae6342f34e663e3f [0,0,0,0,0,2|2,0,0]=4 10075 B13R1.337 CC(C)CCCOc1ccccn1 e6375a1c81cd42ff6185fcba1c54b2ce [0,0,0,0,0,2|2,0,0]=4 10076 B13R1.337 CC(C)CCCOc1cccnc1 b3cdd758bbf1b7b529bc9dc2c26ef73c [0,0,0,0,0,2|2,0,0]=4 10077 B13R1.337 CC(C)CCCOc1ccncc1 9d4a6b44dd113b85f64db07d599d8996 [0,0,0,0,0,2|2,0,0]=4 10078 B13R1.337 CC(C)CCNCc1ccccc1 1e688087bf103ef5abb70549de5710ec [0,0,0,0,0,2|1,0,0]=3 10079 B13R1.337 CC(C)CCNCc1ccccn1 9942edf39eabe74b173023ccd1d8f680 [0,0,0,0,0,2|2,0,0]=4 10080 B13R1.337 CC(C)CCNCc1cccnc1 efe87d76a5cef2c9c040362dd810c863 [0,0,0,0,0,2|2,0,0]=4 10081 B13R1.337 CC(C)CCNCc1ccncc1 5db284470637968f1e608b9a64808708 [0,0,0,0,0,2|2,0,0]=4 10082 B13R1.337 CC(C)CCOCc1ccccc1 b9a2e4d50d414109e50fcb33258261ee [0,0,0,0,0,2|1,0,0]=3 10083 B13R1.337 CC(C)CCOCc1ccccn1 02c5facde60119427fc0e1bd134b071a [0,0,0,0,0,2|2,0,0]=4 10084 B13R1.337 CC(C)CCOCc1cccnc1 16559d4279cb702f2adce6f17203371a [0,0,0,0,0,2|2,0,0]=4 10085 B13R1.337 CC(C)CCOCc1ccncc1 518cab7758e231497cea7b026594978a [0,0,0,0,0,2|2,0,0]=4 10086 B13R1.337 CC(C)CNCCc1ccccc1 f16bae1bab4fffecad912c27055afc90 [0,0,0,0,0,2|1,0,0]=3 10087 B13R1.337 CC(C)CNCCc1ccccn1 17637b2f9e470becdabf7d0ea22c2cf0 [0,0,0,0,0,2|2,0,0]=4 10088 B13R1.337 CC(C)CNCCc1cccnc1 22f87dd52166184eb0378453aefb4118 [0,0,0,0,0,2|2,0,0]=4 10089 B13R1.337 CC(C)CNCCc1ccncc1 2269dbc99675a360552f4f58db1d1235 [0,0,0,0,0,2|2,0,0]=4 10090 B13R1.337 CC(C)CNCSc1ccccc1 3bc8641eae9466bc9857e5eda44bb5a4 [0,0,0,0,0,2|1,0,0]=3 10091 B13R1.337 CC(C)COCCc1ccccc1 9d79219b725a9770020e16740c174e35 [0,0,0,0,0,2|1,0,0]=3 10092 B13R1.337 CC(C)COCCc1ccccn1 9d35d874685cdfba0dfc7eb62abfa758 [0,0,0,0,0,2|2,0,0]=4 10093 B13R1.337 CC(C)COCCc1cccnc1 11c129e0cd29e06939cfb59230be4c91 [0,0,0,0,0,2|2,0,0]=4 10094 B13R1.337 CC(C)COCCc1ccncc1 a9a6e0c94b48739f9c88c187b5c30a97 [0,0,0,0,0,2|2,0,0]=4 10095 B13R1.337 CC(C)NC/C=C/c1ccccc1 650e2502202206547bc8b586be942ac6 [0,0,0,0,0,2|1,0,1]=4 10096 B13R1.337 CC(C)NCCCc1ccccc1 552e4f45cfe8a6dda608f5fb032f73f5 [0,0,0,0,0,2|1,0,0]=3 10097 B13R1.337 CC(C)NCCCc1ccccn1 a8386b45f11ad90cbb757483cb418377 [0,0,0,0,0,2|2,0,0]=4 10098 B13R1.337 CC(C)NCCCc1cccnc1 2684fde524abf85db53dd47d9a680d69 [0,0,0,0,0,2|2,0,0]=4 10099 B13R1.337 CC(C)NCCCc1ccncc1 5420d04b42736bb78b0a40b031f462cb [0,0,0,0,0,2|2,0,0]=4 10100 B13R1.337 CC(C)NCCOc1ccccc1 10d8ac155aa864d48319886f0fea4451 [0,0,0,0,0,2|1,0,0]=3 10101 B13R1.337 CC(C)NCCOc1ccccn1 a25543bbbe2bc7a2e4754fa8488035ef [0,0,0,0,0,2|2,0,0]=4 10102 B13R1.337 CC(C)NCCOc1cccnc1 b7807a667df2ff0b77a7e6ea67099a39 [0,0,0,0,0,2|2,0,0]=4 10103 B13R1.337 CC(C)OC/C=C/c1ccccc1 175986ea08535dbd50c336823e82002e [0,0,0,0,0,2|1,0,1]=4 10104 B13R1.337 CC(C)OC/C=C\c1ccccc1 65688c92674b9a28e53770a446bee9c2 [0,0,0,0,0,2|1,0,1]=4 10105 B13R1.337 CC(C)OCC=Cc1ccccc1 e9f4346329c26116ef05811f27bf0c7a [0,0,0,0,0,2|1,0,1]=4 10106 B13R1.337 CC(C)OCCCc1ccccc1 742e1fa75290dae4f0a256e8c200b37d [0,0,0,0,0,2|1,0,0]=3 10107 B13R1.337 CC(C)OCCCc1ccccn1 6eeb08edbb5f5925e676c222bd387982 [0,0,0,0,0,2|2,0,0]=4 10108 B13R1.337 CC(C)OCCCc1cccnc1 20e92cdf46c9d84448abe9ffff585999 [0,0,0,0,0,2|2,0,0]=4 10109 B13R1.337 CC(C)OCCCc1ccncc1 051d6e76b19db36a23d6e3c4faaba141 [0,0,0,0,0,2|2,0,0]=4 10110 B13R1.337 CC(C)OCCNc1ccccc1 483fd2d96e61553e8b02b8934f11250e [0,0,0,0,0,2|1,0,0]=3 10111 B13R1.337 CC(C)OCCNc1ccccn1 05ccd8f0e80fb60acb36ef09daa50e4c [0,0,0,0,0,2|2,0,0]=4 10112 B13R1.337 CC(C)OCCNc1cccnc1 987330188f20583068772fcfc0cf6db9 [0,0,0,0,0,2|2,0,0]=4 10113 B13R1.337 CC(C)OCCNc1ccncc1 908f6c35e913eb4b3fd6a34868a509db [0,0,0,0,0,2|2,0,0]=4 10114 B13R1.337 CC(C)OCCOc1ccccc1 3ab0ec4af6feae154b17be9e6b5c16cd [0,0,0,0,0,2|1,0,0]=3 10115 B13R1.337 CC(C)OCCOc1ccccn1 15a043a8564039dcea38d63f39ca7fd3 [0,0,0,0,0,2|2,0,0]=4 10116 B13R1.337 CC(C)OCCOc1cccnc1 2d7956874bda28e266f75e62908fb0a7 [0,0,0,0,0,2|2,0,0]=4 10117 B13R1.337 CC(C)OCCOc1ccncc1 cefb381f9bb60132f11c98711233da25 [0,0,0,0,0,2|2,0,0]=4 10118 B13R1.337 CC(C)OCCSc1ccccc1 722f04b041065aeddd094dbf7e69a654 [0,0,0,0,0,2|1,0,0]=3 10119 B13R1.337 CC(C)OCCSc1ccccn1 07f22cebab9dbc11acd202f64078829c [0,0,0,0,0,2|2,0,0]=4 10120 B13R1.337 CC(C)OCNCc1ccccc1 f4f4760fb0314459d5763a2b5fdca637 [0,0,0,0,0,2|1,0,0]=3 10121 B13R1.337 CC(C)OCNCc1ccccn1 908285ef105057afe587f0e67538473c [0,0,0,0,0,2|2,0,0]=4 10122 B13R1.337 CC(C)OCNCc1cccnc1 4167a7523254f1fd6ac2f22ce2e93097 [0,0,0,0,0,2|2,0,0]=4 10123 B13R1.337 CC(C)OCNCc1ccncc1 21e38426719e3848c1e1ec43b44fd43a [0,0,0,0,0,2|2,0,0]=4 10124 B13R1.337 CC(C)OCOCc1ccccn1 38b356543f964c28272545fcd9a7fef2 [0,0,0,0,0,2|2,0,0]=4 10125 B13R1.337 CC(C)OCOCc1cccnc1 b9be0ce1be6051ec313ab10eaf69ef62 [0,0,0,0,0,2|2,0,0]=4 10126 B13R1.337 CC(C)OCOCc1ccncc1 4f077f2ac3521eb20fe68ec50aa75aff [0,0,0,0,0,2|2,0,0]=4 10127 B13R1.337 CC(C)OCSCc1ccccc1 4dec8c95093f89c50131d4e494f4bdf2 [0,0,0,0,0,2|1,0,0]=3 10128 B13R1.337 CC(C)SCCNc1ccccc1 1320f99840214bec06e020d16be0842d [0,0,0,0,0,2|1,0,0]=3 10129 B13R1.337 CC(C)SCCNc1ccccn1 2cbd9d542df55dfcad82936006bcfe74 [0,0,0,0,0,2|2,0,0]=4 10130 B13R1.337 CC(C)SCCNc1cccnc1 5dd3c16317f1fed3ea417d86181c60a2 [0,0,0,0,0,2|2,0,0]=4 10131 B13R1.337 CC(C)SCCNc1ccncc1 66ae9ea2f20c42b85c5ddd67efdb09d7 [0,0,0,0,0,2|2,0,0]=4 10132 B13R1.337 CC(C)SCCOc1ccccn1 44bf8e93af6f7957a676af90cc056d74 [0,0,0,0,0,2|2,0,0]=4 10133 B13R1.337 CC(C)SCCOc1cccnc1 34ac034e4f6a895c60c0921210564e38 [0,0,0,0,0,2|2,0,0]=4 10134 B13R1.337 CC(C)SCCOc1ccncc1 ed7738fd518d9d0f2ee46ce137b8ce96 [0,0,0,0,0,2|2,0,0]=4 10135 B13R1.337 CC(F)COCCc1ccccc1 b88b84139ff28c4dba49e80922dfc527 [0,0,0,0,0,2|1,0,0]=3 10136 B13R1.337 CC(F)COCCc1ccccn1 cd3269008528377c2532be03a6c22b7a [0,0,0,0,0,2|2,0,0]=4 10137 B13R1.337 CC(F)COCCc1cccnc1 a755aebc088fdff610f1783889cf27e7 [0,0,0,0,0,2|2,0,0]=4 10138 B13R1.337 CC(F)COCCc1ccncc1 cd4acabb96c814c8dc3b9633b607d5b6 [0,0,0,0,0,2|2,0,0]=4 10139 B13R1.337 CC(O)CCCNc1ccccc1 e1481daff7134e6c32163687714ef7b4 [0,0,0,0,0,2|0,0,0]=2 10140 B13R1.337 CC(O)CCCNc1ccccn1 c41566a209329c15500b283f331d8db0 [0,0,0,0,0,2|1,0,0]=3 10141 B13R1.337 CC(O)CCCNc1cccnc1 b3f77fcb0af3672be4c1835eee34c474 [0,0,0,0,0,2|1,0,0]=3 10142 B13R1.337 CC(O)CCCNc1cccnn1 d8da3ccc95849701178c988a9f3d160b [0,0,0,0,0,2|2,0,0]=4 10143 B13R1.337 CC(O)CCCNc1ccncc1 cf7e61fbe26384720758599e8ec390f8 [0,0,0,0,0,2|1,0,0]=3 10144 B13R1.337 CC(O)CCCNc1ccncn1 a252883a2329c3162c2c7d191baa2957 [0,0,0,0,0,2|2,0,0]=4 10145 B13R1.337 CC(O)CCCNc1ccnnc1 e249560aa2a7b351bf31d0791b381290 [0,0,0,0,0,2|2,0,0]=4 10146 B13R1.337 CC(O)CCCNc1cnccn1 9ae2ae5c2da50c7a26c76ce4db864734 [0,0,0,0,0,2|2,0,0]=4 10147 B13R1.337 CC(O)CCCNc1cncnc1 ba67e8caece05f235788f36a407d55ab [0,0,0,0,0,2|2,0,0]=4 10148 B13R1.337 CC(O)CCCNc1ncccn1 dc1fa47d554b9fdc2545e72f2e644cf5 [0,0,0,0,0,2|2,0,0]=4 10149 B13R1.337 CC(O)CCNCc1ccccc1 cfa220d842ce3cae8909bfde7ef82284 [0,0,0,0,0,2|0,0,0]=2 10150 B13R1.337 CC(O)CCNCc1ccccn1 4dce02551de73786b0164f0a70a73f58 [0,0,0,0,0,2|1,0,0]=3 10151 B13R1.337 CC(O)CCNCc1cccnc1 b67c6453b0bd7c3134aa8790d323a7c0 [0,0,0,0,0,2|1,0,0]=3 10152 B13R1.337 CC(O)CCNCc1cccnn1 872e8755ec8aec46cc830f0665c2e3e4 [0,0,0,0,0,2|2,0,0]=4 10153 B13R1.337 CC(O)CCNCc1ccncc1 54be9c9c1b32120dceed8636a5c31518 [0,0,0,0,0,2|1,0,0]=3 10154 B13R1.337 CC(O)CCNCc1ccncn1 3a9d440402dca51e2eaab080523db965 [0,0,0,0,0,2|2,0,0]=4 10155 B13R1.337 CC(O)CCNCc1ccnnc1 fa11d5897ffb5553ac831afeb4cff3ec [0,0,0,0,0,2|2,0,0]=4 10156 B13R1.337 CC(O)CCNCc1cnccn1 8e14bd477ef82ebecb66bb93e437140a [0,0,0,0,0,2|2,0,0]=4 10157 B13R1.337 CC(O)CCNCc1cncnc1 3aa25c702404640347b9a845d61ee2bf [0,0,0,0,0,2|2,0,0]=4 10158 B13R1.337 CC(O)CCNCc1ncccn1 b46072601f00c239b3d1454b0ddfea03 [0,0,0,0,0,2|2,0,0]=4 10159 B13R1.337 CC(O)CNCCc1ccccc1 a17feeb1b67999943657abdea68adf32 [0,0,0,0,0,2|0,0,0]=2 10160 B13R1.337 CC(O)CNCCc1ccccn1 268379154892fe1c09468e2e1eb13e7d [0,0,0,0,0,2|1,0,0]=3 10161 B13R1.337 CC(O)CNCCc1cccnc1 af7cb075f6747b955e6b90bdab6d87e1 [0,0,0,0,0,2|1,0,0]=3 10162 B13R1.337 CC(O)CNCCc1ccncc1 160e3ad61e755edd52a9c93cf0d47bd8 [0,0,0,0,0,2|1,0,0]=3 10163 B13R1.337 CC(O)CNCCc1ccncn1 636d8c7331d1903b896a4690e240bb03 [0,0,0,0,0,2|2,0,0]=4 10164 B13R1.337 CC(O)CNCCc1cnccn1 64f3ee1722d99542cbf5153094d93b92 [0,0,0,0,0,2|2,0,0]=4 10165 B13R1.337 CC(O)CNCCc1ncccn1 465a59b48716cba53879f5b1916c0b82 [0,0,0,0,0,2|2,0,0]=4 10166 B13R1.337 CC(S)COCCc1ccccc1 1401e2c2628cc7296975b60d2c489fa0 [0,0,0,0,0,2|0,1,0]=3 10167 B13R1.337 CC(S)COCCc1ccccn1 664565a46f29b2f4ac51dffb1ebf890b [0,0,0,0,0,2|1,1,0]=4 10168 B13R1.337 CC(S)COCCc1cccnc1 dff381eb74c162404a00ef74a13d93e8 [0,0,0,0,0,2|1,1,0]=4 10169 B13R1.337 CC(S)COCCc1ccncc1 88b324a0d11297a1d788a4e0d9113a20 [0,0,0,0,0,2|1,1,0]=4 10170 B13R1.337 CN(C)CCCNc1ccccc1 64b213a8b2410fa9ad1808ec1488194d [0,0,0,0,0,2|2,0,0]=4 10171 B13R1.337 CN(C)CCNCc1ccccc1 5d59de0a5362f9dd0332c7bbac95b919 [0,0,0,0,0,2|2,0,0]=4 10172 B13R1.337 CN(C)CCOCc1ccccc1 a35121ed4de0a81e5c46c843404814ef [0,0,0,0,0,2|2,0,0]=4 10173 B13R1.337 CN(C)CNCCc1ccccc1 477e27f88e5b75781486036a407834e3 [0,0,0,0,0,2|2,0,0]=4 10174 B13R1.337 CN(C)COCCc1ccccc1 388ebe28b60edfd4e1da7289ebe68ac0 [0,0,0,0,0,2|2,0,0]=4 10175 B13R1.337 CS(=O)CCCNc1ccccc1 5bd148ec84ef6a74c697b085445b3e7b [0,0,0,0,0,2|1,0,1]=4 10176 B13R1.337 CS(=O)CCNCc1ccccc1 a1f5c0843bfd86fcf8a010417b2f4251 [0,0,0,0,0,2|1,0,1]=4 10177 B13R1.337 CS(=O)CCOCc1ccccc1 1ecc10915ad29850bfa7b422fb3bb544 [0,0,0,0,0,2|1,0,1]=4 10178 B13R1.337 C[C@@H](F)COCCc1ccccc1 324a42257d14510e2a4b2220aecdbdf4 [0,0,0,0,0,2|1,0,0]=3 10179 B13R1.337 C[C@@H](F)COCCc1ccccn1 7453a04e7a585ea113c0565c71541bf4 [0,0,0,0,0,2|2,0,0]=4 10180 B13R1.337 C[C@@H](F)COCCc1cccnc1 07a8e36e0b8179cbb4b33dfa1d419a7c [0,0,0,0,0,2|2,0,0]=4 10181 B13R1.337 C[C@@H](F)COCCc1ccncc1 ecf42f71bbb702e1f109917230b13e4f [0,0,0,0,0,2|2,0,0]=4 10182 B13R1.337 C[C@@H](O)CCNCc1ccccc1 9f24edf605181e24106c0c6050c94c8d [0,0,0,0,0,2|0,0,0]=2 10183 B13R1.337 C[C@@H](O)CCNCc1ccccn1 5d455c49f6b415415e0d28e092776cb7 [0,0,0,0,0,2|1,0,0]=3 10184 B13R1.337 C[C@@H](O)CCNCc1cccnc1 c159199acccb7a1c441cf22ff19a36b0 [0,0,0,0,0,2|1,0,0]=3 10185 B13R1.337 C[C@@H](O)CCNCc1cccnn1 bc757afd36a36166733d0ca76e1de3b4 [0,0,0,0,0,2|2,0,0]=4 10186 B13R1.337 C[C@@H](O)CCNCc1ccncn1 c4501d3ff0e652bbf4935a19f7baf378 [0,0,0,0,0,2|2,0,0]=4 10187 B13R1.337 C[C@@H](O)CCNCc1cncnc1 d13b9e737bbf2b430ec3bc2d7c886ef7 [0,0,0,0,0,2|2,0,0]=4 10188 B13R1.337 C[C@@H](O)CCNCc1ncccn1 974d574121f79928cc4f9a22008493ee [0,0,0,0,0,2|2,0,0]=4 10189 B13R1.337 C[C@@H](O)CNCCc1ccccc1 35b5f13fb946c3a825fbd6735657a24e [0,0,0,0,0,2|0,0,0]=2 10190 B13R1.337 C[C@@H](O)CNCCc1ccccn1 c43c4f83289564e6983603813bd4d4e1 [0,0,0,0,0,2|1,0,0]=3 10191 B13R1.337 C[C@@H](O)CNCCc1cccnc1 a0ff3134a7a37d756db8079baf9632e2 [0,0,0,0,0,2|1,0,0]=3 10192 B13R1.337 C[C@@H](O)CNCCc1ccncc1 adeffa3c3ce831339aa9ef3c7b63077a [0,0,0,0,0,2|1,0,0]=3 10193 B13R1.337 C[C@@H](O)CNCCc1ccncn1 4aa048efb581cd38391af2edc6774c30 [0,0,0,0,0,2|2,0,0]=4 10194 B13R1.337 C[C@@H](O)CNCCc1cnccn1 8d8b96a2d833909f5f17d7f7c0eba13c [0,0,0,0,0,2|2,0,0]=4 10195 B13R1.337 C[C@@H](O)CNCCc1ncccn1 ace14c999cb66483264788dbc9feba8a [0,0,0,0,0,2|2,0,0]=4 10196 B13R1.337 C[C@H](F)COCCc1ccccc1 479d61bd28093766e98c2d08317df7a7 [0,0,0,0,0,2|1,0,0]=3 10197 B13R1.337 C[C@H](F)COCCc1ccccn1 b9e4cc640150acb06e931d7d17239af3 [0,0,0,0,0,2|2,0,0]=4 10198 B13R1.337 C[C@H](F)COCCc1cccnc1 fe3d6b5f6977d4a4409a5164ab864fb0 [0,0,0,0,0,2|2,0,0]=4 10199 B13R1.337 C[C@H](F)COCCc1ccncc1 04620e32be78ac17aee61b4397f76dfd [0,0,0,0,0,2|2,0,0]=4 10200 B13R1.337 C[C@H](O)CCNCc1ccccc1 01aee1d49778ff0afdde520c75c72c5a [0,0,0,0,0,2|0,0,0]=2 10201 B13R1.337 C[C@H](O)CCNCc1ccccn1 60298be12bf14aca760f8f9698717ae5 [0,0,0,0,0,2|1,0,0]=3 10202 B13R1.337 C[C@H](O)CCNCc1cccnc1 dae5c606c3c2e43d7ac0fe2eded2d19a [0,0,0,0,0,2|1,0,0]=3 10203 B13R1.337 C[C@H](O)CCNCc1cccnn1 fb90a4b3e920f4b404984b3948f0f14b [0,0,0,0,0,2|2,0,0]=4 10204 B13R1.337 C[C@H](O)CCNCc1ccncn1 ac470d26b7dfe670b1358587edad7c04 [0,0,0,0,0,2|2,0,0]=4 10205 B13R1.337 C[C@H](O)CCNCc1cncnc1 68935eec5f205e71925a6d46b6b2f695 [0,0,0,0,0,2|2,0,0]=4 10206 B13R1.337 C[C@H](O)CCNCc1ncccn1 a1473982a5ff5fa3a685bab22129127f [0,0,0,0,0,2|2,0,0]=4 10207 B13R1.337 C[C@H](O)CNCCc1ccccc1 92faadc7c13ae1e992b2047adf854f5f [0,0,0,0,0,2|0,0,0]=2 10208 B13R1.337 C[C@H](O)CNCCc1ccccn1 9c39f185c01f63da527f0b24dc64f54d [0,0,0,0,0,2|1,0,0]=3 10209 B13R1.337 C[C@H](O)CNCCc1cccnc1 7d3a8b9b49e9cc647d2aac8305771e67 [0,0,0,0,0,2|1,0,0]=3 10210 B13R1.337 C[C@H](O)CNCCc1ccncc1 8c91587a15c177eeb482086722d3f61d [0,0,0,0,0,2|1,0,0]=3 10211 B13R1.337 C[C@H](O)CNCCc1ccncn1 c3b3ab063265bbcbd886595b8f12ef8e [0,0,0,0,0,2|2,0,0]=4 10212 B13R1.337 C[C@H](O)CNCCc1cnccn1 9afaae6e02c417f60391f337027c0117 [0,0,0,0,0,2|2,0,0]=4 10213 B13R1.337 C[C@H](O)CNCCc1ncccn1 9faf7e3aa8e56fb54831024650ced5ba [0,0,0,0,0,2|2,0,0]=4 10214 B13R1.337 FC(F)CCNCc1ccccc1 8a60d07046cd8a4e396f8a0931200c41 [0,0,0,0,0,2|2,0,0]=4 10215 B13R1.337 FC(F)CCOCc1ccccc1 94aece52affa4e34c61374b813f119d3 [0,0,0,0,0,2|2,0,0]=4 10216 B13R1.337 FC(F)CNCCc1ccccc1 7c4c7aadfd7d14ebc7d8f343f8ddb805 [0,0,0,0,0,2|2,0,0]=4 10217 B13R1.337 FC(F)COCCc1ccccc1 eb2ce10dcef858e0bcb39c29d76e88e5 [0,0,0,0,0,2|2,0,0]=4 10218 B13R1.337 FC(F)OCCNc1ccccc1 cd2d8000c16755ab727336f65bd89da7 [0,0,0,0,0,2|2,0,0]=4 10219 B13R1.337 O=C(O)CCCNc1ccccc1 c341304056a21d581d2b2d5cf779ca15 [0,0,0,0,0,2|1,0,1]=4 10220 B13R1.337 O=C(O)CCNCc1ccccc1 2e6db0f04a98dca6b0938be2778df47d [0,0,0,0,0,2|1,0,1]=4 10221 B13R1.337 O=C(O)CCOCc1ccccc1 fc616de8f6751676366ace4ab81d0334 [0,0,0,0,0,2|1,0,1]=4 10222 B13R1.337 O=C(O)CNCCc1ccccc1 95f0c52ce2f583e4ac1fb9e6bba60c4f [0,0,0,0,0,2|1,0,1]=4 10223 B13R1.337 O=C(O)CNCSc1ccccc1 a6386f86723a3070635044541611d34b [0,0,0,0,0,2|1,0,1]=4 10224 B13R1.337 O=C(O)COCCc1ccccc1 58181bdc4dd33e1cf2f1ca35558ce121 [0,0,0,0,0,2|1,0,1]=4 10225 B13R1.337 O=S(O)CCNCc1ccccc1 bc9b2387939338cf9bdc9a6c70ea6694 [0,0,0,0,0,2|2,0,0]=4 10226 B13R1.337 O=S(O)COCCc1ccccc1 a2eb62494a7f852a8cec380431bf587b [0,0,0,0,0,2|2,0,0]=4