0 B15R1.311 C#CC(C)(C)NCC(=O)c1ccccc1 c2ddb089808bc912e2e708c8b761cf14 [0,0,0,0,0,0|1,0,3]=4 1 B15R1.311 C#CC(C)(C)NCC(C)c1ccccc1 5257a4c8c467501c00d899afaeded954 [0,0,0,0,0,0|2,0,1]=3 2 B15R1.311 C#CC(C)(C)NCC(F)c1ccccc1 12ade06281fae8862e91a5329fd5d2aa [0,0,0,0,0,0|2,0,1]=3 3 B15R1.311 C#CC(C)(C)NCC(O)c1ccccc1 23cfdd63f507870782df124a9e295067 [0,0,0,0,0,0|1,0,1]=2 4 B15R1.311 C#CC(C)(C)NCC(O)c1cnccn1 6c6d17759f5a3a8f553980f1efa18565 [0,0,0,0,0,0|3,0,1]=4 5 B15R1.311 C#CC(C)(C)NCS(=O)c1ccccc1 f795bfcc7e96234fd255d547279220ec [0,0,0,0,0,0|2,0,2]=4 6 B15R1.311 C#CC(C)(C)NC[C@@H](C)c1ccccc1 bda2b185994df2d47f4313092257ea9f [0,0,0,0,0,0|2,0,1]=3 7 B15R1.311 C#CC(C)(C)NC[C@@H](O)c1ccccc1 fa3d19874865c848a7696abc1f688083 [0,0,0,0,0,0|1,0,1]=2 8 B15R1.311 C#CC(C)(C)NC[C@H](O)c1ccccc1 0ff223880a642ea7e960565205e122e6 [0,0,0,0,0,0|1,0,1]=2 9 B15R1.311 C=C(CNC(C)(C)CF)c1ccccc1 d548ceaeb866be8bbfd82ce133862d2f [0,0,0,0,0,0|2,0,1]=3 10 B15R1.311 C=C(CNC(C)(C)CO)c1ccccc1 5815cabbc58c7f39170046fde96e11da [0,0,0,0,0,0|1,0,1]=2 11 B15R1.311 CC(C)(C#N)NCC(=O)c1ccccc1 28a1fff553da6447cf9f750a0fad63a5 [0,0,0,0,0,0|1,0,3]=4 12 B15R1.311 CC(C)(C#N)NCC(O)c1ccccc1 f274f7f890b3b2782b526ad1e19d2043 [0,0,0,0,0,0|1,0,1]=2 13 B15R1.311 CC(C)(C#N)NCC(O)c1cnccn1 eb37152b931af94c0c4c611084d87ba3 [0,0,0,0,0,0|3,0,1]=4 14 B15R1.311 CC(C)(CF)NCC(=O)c1ccccc1 9097c7f3798fea5bda4b739f12238f25 [0,0,0,0,0,0|1,0,2]=3 15 B15R1.311 CC(C)(CF)NCC(=O)c1ccccn1 d6ede216f1ff97f26eddb18ac8b40b0a [0,0,0,0,0,0|2,0,2]=4 16 B15R1.311 CC(C)(CF)NCC(=O)c1cccnc1 585d80da2adae65d6050c5c313717fd5 [0,0,0,0,0,0|2,0,2]=4 17 B15R1.311 CC(C)(CF)NCC(F)c1ccccc1 f0729d6f5fd2c45dfe6deb4396951865 [0,0,0,0,0,0|2,0,0]=2 18 B15R1.311 CC(C)(CF)NCC(O)c1ccccc1 edbfe67401b3664663220b60b61f0310 [0,0,0,0,0,0|1,0,0]=1 19 B15R1.311 CC(C)(CF)NCC(O)c1cnccn1 58b6bc2b101e994d585b394175c366c7 [0,0,0,0,0,0|3,0,0]=3 20 B15R1.311 CC(C)(CO)CNC(=O)c1ccccc1 09e2e3e3515e21cb6ba4d3558dd7a277 [0,0,0,0,0,0|2,0,2]=4 21 B15R1.311 CC(C)(CO)NCC(=O)c1ccccc1 6fcee3c62412942c798edcbaa86d1d3b [0,0,0,0,0,0|0,0,2]=2 22 B15R1.311 CC(C)(CO)NCC(=O)c1ccccn1 0b6847f51d32daa5ceea5e8d9a8935a6 [0,0,0,0,0,0|1,0,2]=3 23 B15R1.311 CC(C)(CO)NCC(=O)c1cccnc1 71dda37f4d7dbbf7cee1ebe72cba8145 [0,0,0,0,0,0|1,0,2]=3 24 B15R1.311 CC(C)(CO)NCC(=O)c1ccncn1 138bd8715035abf81d21182c7afc4e92 [0,0,0,0,0,0|2,0,2]=4 25 B15R1.311 CC(C)(CO)NCC(=O)c1cnccn1 a4c851bb99e593fbfca848f2e9020579 [0,0,0,0,0,0|2,0,2]=4 26 B15R1.311 CC(C)(CO)NCC(F)c1ccccc1 7abf3dbf026bb6b847bdb0be086b8e34 [0,0,0,0,0,0|1,0,0]=1 27 B15R1.311 CC(C)(CO)NCC(O)c1ccccc1 0b2755cc6f677a01df820d11657bd64f [0,0,0,0,0,0|0,0,0]=0 28 B15R1.311 CC(C)(CO)NCC(O)c1cnccn1 5e283cd8e73723522c64f2023af7ced8 [0,0,0,0,0,0|2,0,0]=2 29 B15R1.311 CC(C)(CO)NCS(=O)c1ccccc1 765c7779ee474473a6504ab568e2d995 [0,0,0,0,0,0|1,0,1]=2 30 B15R1.311 CC(C)(CO)NC[C@@H](O)c1ccccc1 1c541745d36060b04b4539fb897071e7 [0,0,0,0,0,0|0,0,0]=0 31 B15R1.311 CC(C)(CO)NC[C@H](O)c1ccccc1 88f92664a0029bda7677dbb221397d8e [0,0,0,0,0,0|0,0,0]=0 32 B15R1.311 CC(CNC(C)(C)C#N)c1ccccc1 3fa95934f9edec7af8cfb3ab99a75230 [0,0,0,0,0,0|2,0,1]=3 33 B15R1.311 CC(CNC(C)(C)CF)c1ccccc1 708c23d56b39c779d55b7bde8da83da1 [0,0,0,0,0,0|2,0,0]=2 34 B15R1.311 CC(CNC(C)(C)CO)c1ccccc1 2c85adc2e2c4a0638b4e0adb97bdf129 [0,0,0,0,0,0|1,0,0]=1 35 B15R1.311 CC(NCC(C)(C)CO)c1ccccn1 5052695a9392c748fc06c3c6a5408826 [0,0,0,0,0,0|4,0,0]=4 36 B15R1.311 CC(NCC(C)(C)CO)c1cccnc1 2e6217d99d63624cca89f9af14e94484 [0,0,0,0,0,0|4,0,0]=4 37 B15R1.311 CC(NCC(C)(C)CO)c1ccncc1 447b5fd2a7f9cb490dea0c7babd87758 [0,0,0,0,0,0|4,0,0]=4 38 B15R1.311 CCC(C)(C)CCN(C)c1ccccc1 d04de0f9e034b33d269f18a575cbc84d [0,0,0,0,0,0|4,0,0]=4 39 B15R1.311 CCC(C)(C)NCC(=O)c1ccccn1 b8cfa50074e520b6e81179cfdd493cc7 [0,0,0,0,0,0|2,0,2]=4 40 B15R1.311 CCC(C)(C)NCC(=O)c1cccnc1 d9e35c8552c7697b8c96fdcd0101e654 [0,0,0,0,0,0|2,0,2]=4 41 B15R1.311 CCC(C)(C)NCC(O)c1cnccn1 eec0be7674055d826dcdb1b11042f5c3 [0,0,0,0,0,0|3,0,0]=3 42 B15R1.311 C[C@@H](NCC(C)(C)CO)c1ccccn1 66e31248dcad1222da335e8ca0770cb7 [0,0,0,0,0,0|4,0,0]=4 43 B15R1.311 C[C@@H](NCC(C)(C)CO)c1cccnc1 04b7c226356ee01853a18fc3b45018e5 [0,0,0,0,0,0|4,0,0]=4 44 B15R1.311 C[C@@H](NCC(C)(C)CO)c1ccncc1 a72709f7f81aa2173c2c66017ab67cda [0,0,0,0,0,0|4,0,0]=4 45 B15R1.311 C[C@H](CNC(C)(C)C#N)c1ccccc1 dbf1caa7d3b79fae2559ad900fd9d175 [0,0,0,0,0,0|2,0,1]=3 46 B15R1.311 C[C@H](CNC(C)(C)CF)c1ccccc1 23f61057b02c9c3562c7b3932ba25f24 [0,0,0,0,0,0|2,0,0]=2 47 B15R1.311 C[C@H](CNC(C)(C)CO)c1ccccc1 1b9894387d720cec8f7e367da47d0509 [0,0,0,0,0,0|1,0,0]=1 48 B15R1.311 C[C@H](NCC(C)(C)CO)c1ccccn1 f0f810340d7f83554c6bfacd39128077 [0,0,0,0,0,0|4,0,0]=4 49 B15R1.311 C[C@H](NCC(C)(C)CO)c1cccnc1 78e893d21f32d906cf5424301bf99d29 [0,0,0,0,0,0|4,0,0]=4 50 B15R1.311 C[C@H](NCC(C)(C)CO)c1ccncc1 b7798231752da4fb8dfe792b9ffab3cd [0,0,0,0,0,0|4,0,0]=4 51 B14R1.163 C#CC(C)NCC(C)c1ccccc1 ff6031a7d88e81ca1eed19ae7cd14adb [1,0,0,0,0,0|2,0,1]=4 52 B14R1.163 C#CC(C)NCC(F)c1ccccc1 443831b6a8e37030906dfb683883567d [1,0,0,0,0,0|2,0,1]=4 53 B14R1.163 C#CC(C)NCC(O)c1ccccc1 56feb5e526dcf695facb634e87fcbe81 [1,0,0,0,0,0|1,0,1]=3 54 B14R1.163 C#CC(C)NCC(O)c1ccncc1 0aef79ac3ea165f2b51cae8bdd50c401 [1,0,0,0,0,0|2,0,1]=4 55 B14R1.163 C#CC(C)NC[C@@H](C)c1ccccc1 f9586dcef1a91f93a1d7b9877054dfea [1,0,0,0,0,0|2,0,1]=4 56 B14R1.163 C#CC(C)NC[C@@H](O)c1ccccc1 353ef7c9fc7a2cd77305cae8f0c7d91a [1,0,0,0,0,0|1,0,1]=3 57 B14R1.163 C#CC(C)NC[C@H](O)c1ccccc1 84aedcfaee07a9ac5f83ea6317be9a18 [1,0,0,0,0,0|1,0,1]=3 58 B14R1.163 C#C[C@@H](C)NCC(C)c1ccccc1 d69195396a4f54defae98934229eac78 [1,0,0,0,0,0|2,0,1]=4 59 B14R1.163 C#C[C@@H](C)NCC(F)c1ccccc1 4a5d850a039adb9045d0cd0597256691 [1,0,0,0,0,0|2,0,1]=4 60 B14R1.163 C#C[C@@H](C)NCC(O)c1ccccc1 b87a542b77b053a8449343ba1ad9fb01 [1,0,0,0,0,0|1,0,1]=3 61 B14R1.163 C#C[C@@H](C)NC[C@@H](C)c1ccccc1 f21b3aafacd1dd39fb7600475d41de29 [1,0,0,0,0,0|2,0,1]=4 62 B14R1.163 C#C[C@@H](C)NC[C@@H](O)c1ccccc1 8e62adcf0c80f774ac530e7532040f52 [1,0,0,0,0,0|1,0,1]=3 63 B14R1.163 C#C[C@@H](C)NC[C@H](O)c1ccccc1 0624f1d3e38de8db2d12d1ab13314206 [1,0,0,0,0,0|1,0,1]=3 64 B14R1.163 C#C[C@H](C)NCC(C)c1ccccc1 c40f73024457e4f869051e306fd437de [1,0,0,0,0,0|2,0,1]=4 65 B14R1.163 C#C[C@H](C)NCC(F)c1ccccc1 1edb5760c4d48d973d403a26d59ab143 [1,0,0,0,0,0|2,0,1]=4 66 B14R1.163 C#C[C@H](C)NCC(O)c1ccccc1 c2d3e9b3440af20f4ee0348e927226cd [1,0,0,0,0,0|1,0,1]=3 67 B14R1.163 C#C[C@H](C)NC[C@@H](C)c1ccccc1 b06f5d27213e404d377fa37c57d72464 [1,0,0,0,0,0|2,0,1]=4 68 B14R1.163 C#C[C@H](C)NC[C@@H](O)c1ccccc1 2f09b2486c17fb9b3b0d2fcf81bd2982 [1,0,0,0,0,0|1,0,1]=3 69 B14R1.163 C#C[C@H](C)NC[C@H](O)c1ccccc1 562ea29143842ccb960f1725b29a14bd [1,0,0,0,0,0|1,0,1]=3 70 B14R1.163 C=CC(C)NCC(C)c1ccccc1 548c84cdf49d86b75ccfcd7ba048116a [1,0,0,0,0,0|2,0,1]=4 71 B14R1.163 C=CC(C)NCC(F)c1ccccc1 47c92858c072fe3a5db71cf916c742d0 [1,0,0,0,0,0|2,0,1]=4 72 B14R1.163 C=CC(C)NCC(O)c1ccccc1 dc252c1dc42f8b1ec71d07e76f20be80 [1,0,0,0,0,0|1,0,1]=3 73 B14R1.163 C=CC(C)NCC(O)c1ccccn1 82fbc2a295df30a58ab574b844700e00 [1,0,0,0,0,0|2,0,1]=4 74 B14R1.163 C=CC(C)NCC(O)c1cccnc1 e46d9f3f83fe1149df77908ff08585f1 [1,0,0,0,0,0|2,0,1]=4 75 B14R1.163 C=CC(C)NCC(O)c1ccncc1 eef1df7d73d72c8feef0395d91674df8 [1,0,0,0,0,0|2,0,1]=4 76 B14R1.163 C=CC(C)NC[C@@H](C)c1ccccc1 6ad4094866da01051220d5250a0f4eff [1,0,0,0,0,0|2,0,1]=4 77 B14R1.163 C=CC(C)NC[C@@H](O)c1ccccc1 84a20c2ee32a41a16e68f9eeee45a118 [1,0,0,0,0,0|1,0,1]=3 78 B14R1.163 C=CC(C)NC[C@H](C)c1ccccc1 9f5584dc2a731fb0a251ea230ad1a99b [1,0,0,0,0,0|2,0,1]=4 79 B14R1.163 C=CC(C)NC[C@H](O)c1ccccc1 1cbfa080c71e5b3b6819322bbc9fcf34 [1,0,0,0,0,0|1,0,1]=3 80 B14R1.163 CC(C#N)NCC(C)c1ccccc1 4e0433866e733b4f0789e849428bd774 [1,0,0,0,0,0|2,0,1]=4 81 B14R1.163 CC(C#N)NCC(F)c1ccccc1 ef1c2a0b5210787b3387201f3dcead3e [1,0,0,0,0,0|2,0,1]=4 82 B14R1.163 CC(C#N)NCC(O)c1ccccc1 f535fe6cd1017890b1c7ecf57fa231d6 [1,0,0,0,0,0|1,0,1]=3 83 B14R1.163 CC(C#N)NCC(O)c1ccncc1 ee8405fa90e2250d04b094156d2b7278 [1,0,0,0,0,0|2,0,1]=4 84 B14R1.163 CC(C#N)NC[C@@H](C)c1ccccc1 c55d8bf03b225e2fba8996f68f8d1a54 [1,0,0,0,0,0|2,0,1]=4 85 B14R1.163 CC(C=O)NCC(C)c1ccccc1 7ef5b2a4fe14a278997db19e1e99f9b4 [1,0,0,0,0,0|1,0,2]=4 86 B14R1.163 CC(C=O)NCC(O)c1ccccc1 f29ae7fa0a201901264677175de1df7a [1,0,0,0,0,0|0,0,2]=3 87 B14R1.163 CC(C=O)NCC(O)c1ccccn1 b0970f2a8dc2370f51bc21c8af8b1d84 [1,0,0,0,0,0|1,0,2]=4 88 B14R1.163 CC(C=O)NCC(O)c1cccnc1 4b72216de9d4cb5c9844723f869a149f [1,0,0,0,0,0|1,0,2]=4 89 B14R1.163 CC(C=O)NCC(O)c1ccncc1 d7f59d3e3d9de5b2af1a9e2d70633231 [1,0,0,0,0,0|1,0,2]=4 90 B14R1.163 CC(C=O)NC[C@@H](C)c1ccccc1 44ff40765a656dd03671cc9c570d5614 [1,0,0,0,0,0|1,0,2]=4 91 B14R1.163 CC(C=O)NC[C@@H](O)c1ccccc1 954942188014e3f19fd95e20d12285b2 [1,0,0,0,0,0|0,0,2]=3 92 B14R1.163 CC(C=O)NC[C@H](C)c1ccccc1 7e9725bcb72cfbce44be7624df628f08 [1,0,0,0,0,0|1,0,2]=4 93 B14R1.163 CC(C=O)NC[C@H](O)c1ccccc1 7d089167d4c3e9c93ca3d4bd7d80367d [1,0,0,0,0,0|0,0,2]=3 94 B14R1.163 CC(CF)OCC(C)c1ccccc1 e20c200f08e0ed09e264e433cc5b81da [1,0,0,0,0,0|3,0,0]=4 95 B14R1.163 CC(CF)OCC(F)c1ccccc1 c67ba62b0e66b608998435f28213f1ec [1,0,0,0,0,0|3,0,0]=4 96 B14R1.163 CC(CF)OC[C@@H](C)c1ccccc1 a961d100bcca720ffeaa6480754f6e4c [1,0,0,0,0,0|3,0,0]=4 97 B14R1.163 CC(CNC(=O)CO)c1ccccc1 513f8fa30e72fa070f1a2173106d366c [1,0,0,0,0,0|2,0,1]=4 98 B14R1.163 CC(CN[C@@H](C)CO)c1ccccc1 0aa9e1abbbe97b3c8c6e34e645fb3336 [1,0,0,0,0,0|1,0,0]=2 99 B14R1.163 CC(CN[C@H](C)C=O)c1ccccc1 0524c7fe5ac481ad6537345480c87514 [1,0,0,0,0,0|1,0,2]=4 100 B14R1.163 CC(CN[C@H](C)CO)c1ccccc1 e47fcf6b2f5458f9752fcf943d55bf13 [1,0,0,0,0,0|1,0,0]=2 101 B14R1.163 CC(CO)CNC(C)c1ccccc1 b8c5048740af8c2f6ba5a04a035ac405 [1,0,0,0,0,0|3,0,0]=4 102 B14R1.163 CC(CO)CN[C@@H](C)c1ccccc1 9ac5deb9f592b5e73fb2ad4bf8101fb6 [1,0,0,0,0,0|3,0,0]=4 103 B14R1.163 CC(CO)CN[C@H](C)c1ccccc1 4bd1ba34d73afb307ef023ff070f3eb8 [1,0,0,0,0,0|3,0,0]=4 104 B14R1.163 CC(CO)NCC(=O)c1ccccc1 9d5924ab5cef9651e1ab671d49adcb5c [1,0,0,0,0,0|0,0,2]=3 105 B14R1.163 CC(CO)NCC(=O)c1ccccn1 8ecc5a4de94252fa8eb7f722888a13b1 [1,0,0,0,0,0|1,0,2]=4 106 B14R1.163 CC(CO)NCC(=O)c1cccnc1 60e9008cd66d8a1077c4a004e44289ff [1,0,0,0,0,0|1,0,2]=4 107 B14R1.163 CC(CO)NCC(C)c1ccccc1 cf020665ed61f04a7b053009edf19f23 [1,0,0,0,0,0|1,0,0]=2 108 B14R1.163 CC(CO)NCC(F)c1ccccc1 84230841585cc2d0bcf1ea69afbb3787 [1,0,0,0,0,0|1,0,0]=2 109 B14R1.163 CC(CO)NCC(O)c1ccccc1 b1bf557f2dee94917553147239377916 [1,0,0,0,0,0|0,0,0]=1 110 B14R1.163 CC(CO)NCC(O)c1ccccn1 3ed2c1e98812da8a2a60f2c5b5b02e58 [1,0,0,0,0,0|1,0,0]=2 111 B14R1.163 CC(CO)NCC(O)c1cccnc1 309b625e8b2235f042410e4860916bcf [1,0,0,0,0,0|1,0,0]=2 112 B14R1.163 CC(CO)NCC(O)c1ccncc1 46116d125ee1106cd79e438fc485342b [1,0,0,0,0,0|1,0,0]=2 113 B14R1.163 CC(CO)NCC(O)c1cnccn1 b85531b668be338d106ed2c908227c07 [1,0,0,0,0,0|2,0,0]=3 114 B14R1.163 CC(CO)NCS(=O)c1ccccc1 282f02469d5f800c11a771cd5236c5ac [1,0,0,0,0,0|1,0,1]=3 115 B14R1.163 CC(CO)NC[C@@H](C)c1ccccc1 26f474a61f8016f869ff5afedbffb76f [1,0,0,0,0,0|1,0,0]=2 116 B14R1.163 CC(CO)NC[C@H](C)c1ccccc1 f93c647e9d0dc721951fa55b71a7bcaa [1,0,0,0,0,0|1,0,0]=2 117 B14R1.163 CC(CO[C@H](C)CS)c1ccccc1 d64fcd3f27768910913bc26fd119984a [1,0,0,0,0,0|2,1,0]=4 118 B14R1.163 CC(CS)OCC(C)c1ccccc1 ba85529b9e131a14ef6c300ab556182f [1,0,0,0,0,0|2,1,0]=4 119 B14R1.163 CC(CS)OC[C@@H](C)c1ccccc1 95579ab2241e1024e7ca2367d16565d2 [1,0,0,0,0,0|2,1,0]=4 120 B14R1.163 CC(NC[C@@H](C)CO)c1ccccc1 54b4f4dc24d3d8db7b10f6d4a48ac58e [1,0,0,0,0,0|3,0,0]=4 121 B14R1.163 CC(NC[C@H](C)CO)c1ccccc1 86761362b54f42de6f98a8a433eb747b [1,0,0,0,0,0|3,0,0]=4 122 B14R1.163 CCC(=O)NCC(O)c1ccccc1 c9526a72497209f48a597c7d60af94e7 [1,0,0,0,0,0|2,0,1]=4 123 B14R1.163 CCC(=O)NC[C@@H](O)c1ccccc1 47366ce2c6c09a9ee27cb2a3eb7cdaef [1,0,0,0,0,0|2,0,1]=4 124 B14R1.163 CCC(=O)NC[C@H](O)c1ccccc1 c7118b1e16f16c00ed8b7a20b0d097ba [1,0,0,0,0,0|2,0,1]=4 125 B14R1.163 CCC(C)NCC(=O)c1ccccc1 c360ef7237919d45b124258a5267b7b7 [1,0,0,0,0,0|1,0,2]=4 126 B14R1.163 CCC(C)NCC(O)c1ccccn1 2b8a9669d29b77524742128af1dced12 [1,0,0,0,0,0|2,0,0]=3 127 B14R1.163 CCC(C)NCC(O)c1cccnc1 4b796b69fd72012f2f4edd8219dc28d5 [1,0,0,0,0,0|2,0,0]=3 128 B14R1.163 CCC(C)NCC(O)c1ccncc1 684e69e00f3bcea1189d773dbb8aea77 [1,0,0,0,0,0|2,0,0]=3 129 B14R1.163 CCC(C)NCC(O)c1cnccn1 85b9ea7a8043877c7da24d4a2e24d946 [1,0,0,0,0,0|3,0,0]=4 130 B14R1.163 CCC(C)OCC(C)c1ccccc1 69b7883cc3ce1ccddc196ce6b7e4e66b [1,0,0,0,0,0|3,0,0]=4 131 B14R1.163 CCC(C)OC[C@@H](C)c1ccccc1 8c7ef06481567246c537c50db0c4ac7f [1,0,0,0,0,0|3,0,0]=4 132 B14R1.163 CCC(C)OC[C@H](C)c1ccccc1 e4b9a6515ff13e453b76e31ac04aa67b [1,0,0,0,0,0|3,0,0]=4 133 B14R1.163 CCN(C)CCC(O)c1ccccc1 c873531775e8025319efbdc506925490 [1,0,0,0,0,0|3,0,0]=4 134 B14R1.163 CCN(C)CC[C@@H](O)c1ccccc1 985e343e7bde3e24f4ce7dcc21b946c1 [1,0,0,0,0,0|3,0,0]=4 135 B14R1.163 CCN(C)CC[C@H](O)c1ccccc1 23fd3c1f466d98461e26332b7dc43f18 [1,0,0,0,0,0|3,0,0]=4 136 B14R1.163 CC[C@@H](C)NCC(O)c1cnccn1 480fec37e356e21778f052102dda924a [1,0,0,0,0,0|3,0,0]=4 137 B14R1.163 CC[C@@H](C)OCC(C)c1ccccc1 d1674e5315aa54e8761d22cf0fc2896b [1,0,0,0,0,0|3,0,0]=4 138 B14R1.163 CC[C@@H](C)OC[C@@H](C)c1ccccc1 36101bf12b3fde398b4630fa8685ce45 [1,0,0,0,0,0|3,0,0]=4 139 B14R1.163 CC[C@H](C)NCC(O)c1cnccn1 468ae0db41ceba765528d265c494f34c [1,0,0,0,0,0|3,0,0]=4 140 B14R1.163 CC[C@H](C)OCC(C)c1ccccc1 cce50b840d6d4c9e5d690eb69b906f0d [1,0,0,0,0,0|3,0,0]=4 141 B14R1.163 CC[C@H](C)OC[C@@H](C)c1ccccc1 a7c27defab7f5946273a20e24e687dbc [1,0,0,0,0,0|3,0,0]=4 142 B14R1.163 CN(CF)CCC(O)c1ccccc1 dc8aa9c9aef5cd8f2267ba94f9e63b7d [1,0,0,0,0,0|3,0,0]=4 143 B14R1.163 CN(CF)CC[C@@H](O)c1ccccc1 292bc31b6bc8e89b6d51d6f2dfa2d52d [1,0,0,0,0,0|3,0,0]=4 144 B14R1.163 CN(CF)CC[C@H](O)c1ccccc1 abebc8a6c426bd16b8cda847ddb5bcee [1,0,0,0,0,0|3,0,0]=4 145 B14R1.163 CN(CO)CCC(O)c1ccccc1 ae9001a6ad76fbcf0f6242a2d6681911 [1,0,0,0,0,0|2,0,0]=3 146 B14R1.163 CN(CO)CC[C@@H](O)c1ccccc1 e43c798f83653fdf7813105b622a760b [1,0,0,0,0,0|2,0,0]=3 147 B14R1.163 CN(CO)CC[C@H](O)c1ccccc1 407e7ad75db6abfad40c65e33fb2db57 [1,0,0,0,0,0|2,0,0]=3 148 B14R1.163 C[C@@H](CNC(=O)CO)c1ccccc1 3c89d4917c8e64898d591738ab12af44 [1,0,0,0,0,0|2,0,1]=4 149 B14R1.163 C[C@@H](CO)CN[C@@H](C)c1ccccc1 8f09c76bfac0d5d87a58450941e68706 [1,0,0,0,0,0|3,0,0]=4 150 B14R1.163 C[C@@H](CO)CN[C@H](C)c1ccccc1 e87a0d9c5c67388f69fb32607c5b731c [1,0,0,0,0,0|3,0,0]=4 151 B14R1.163 C[C@@H](CO)NCC(=O)c1ccccc1 3c7bb7dc8db1d92feb5320a34f8da4ec [1,0,0,0,0,0|0,0,2]=3 152 B14R1.163 C[C@@H](CO)NCC(=O)c1ccccn1 1cfa0c6405cf4b965c2cfc46a6bfa89a [1,0,0,0,0,0|1,0,2]=4 153 B14R1.163 C[C@@H](CO)NCC(=O)c1cccnc1 86138298367b556f69ea894dd4fbf9e9 [1,0,0,0,0,0|1,0,2]=4 154 B14R1.163 C[C@@H](CO)NCC(F)c1ccccc1 4750b0a573fe67f057d5acb7eaadd976 [1,0,0,0,0,0|1,0,0]=2 155 B14R1.163 C[C@@H](CO)NCC(O)c1ccccc1 ec76497c5ae897e784684ce9927bc93b [1,0,0,0,0,0|0,0,0]=1 156 B14R1.163 C[C@@H](CO)NCC(O)c1ccccn1 86bb45c92042ac5d87448f0fd7e51346 [1,0,0,0,0,0|1,0,0]=2 157 B14R1.163 C[C@@H](CO)NCC(O)c1cccnc1 14cf6a0941731fc24f81d41c05469a95 [1,0,0,0,0,0|1,0,0]=2 158 B14R1.163 C[C@@H](CO)NCC(O)c1ccncc1 3abae748a8fb5d91b4b620188e2cffb8 [1,0,0,0,0,0|1,0,0]=2 159 B14R1.163 C[C@@H](CO)NCC(O)c1cnccn1 6775c57e8a1ffc330dc4a31bd6faf605 [1,0,0,0,0,0|2,0,0]=3 160 B14R1.163 C[C@@H](CO)NCS(=O)c1ccccc1 b4fcc3a3b3cdca4ce862dedc53d15d9e [1,0,0,0,0,0|1,0,1]=3 161 B14R1.163 C[C@H](C=O)NCC(O)c1ccccc1 63bc11291429700586d605edea0c9ced [1,0,0,0,0,0|0,0,2]=3 162 B14R1.163 C[C@H](C=O)NCC(O)c1ccccn1 d0a7736465bf23b62097bac666994ec4 [1,0,0,0,0,0|1,0,2]=4 163 B14R1.163 C[C@H](C=O)NCC(O)c1cccnc1 73bc4c6e00c95ef79cf4037c52b99679 [1,0,0,0,0,0|1,0,2]=4 164 B14R1.163 C[C@H](C=O)NCC(O)c1ccncc1 0e134623c8f57656721df57bb8e054d7 [1,0,0,0,0,0|1,0,2]=4 165 B14R1.163 C[C@H](C=O)NC[C@@H](C)c1ccccc1 8556042827887db7ff467e86901ee096 [1,0,0,0,0,0|1,0,2]=4 166 B14R1.163 C[C@H](C=O)NC[C@@H](O)c1ccccc1 51807f10afac146b712d4cfa0070c44e [1,0,0,0,0,0|0,0,2]=3 167 B14R1.163 C[C@H](C=O)NC[C@H](C)c1ccccc1 bfe10083f895e5dab530db469d8b8e35 [1,0,0,0,0,0|1,0,2]=4 168 B14R1.163 C[C@H](C=O)NC[C@H](O)c1ccccc1 e8d7621340b19f82d4cf8830f97aa13d [1,0,0,0,0,0|0,0,2]=3 169 B14R1.163 C[C@H](CNC(=O)CO)c1ccccc1 20a46cca56013cf0e95520a30c61ff04 [1,0,0,0,0,0|2,0,1]=4 170 B14R1.163 C[C@H](CN[C@@H](C)CO)c1ccccc1 25a4febad3952d247aec9ba59d562203 [1,0,0,0,0,0|1,0,0]=2 171 B14R1.163 C[C@H](CO)CN[C@@H](C)c1ccccc1 4c21eb856623e27bd8daef0bd1a07196 [1,0,0,0,0,0|3,0,0]=4 172 B14R1.163 C[C@H](CO)CN[C@H](C)c1ccccc1 d17fbbfaa1f5482e08e19bb5086193ae [1,0,0,0,0,0|3,0,0]=4 173 B14R1.163 C[C@H](CO)NCC(=O)c1ccccc1 69261d55f6d635b3d96cb9ee36059693 [1,0,0,0,0,0|0,0,2]=3 174 B14R1.163 C[C@H](CO)NCC(=O)c1ccccn1 3bdd3e0180cda1ad05e83c60f798ba68 [1,0,0,0,0,0|1,0,2]=4 175 B14R1.163 C[C@H](CO)NCC(=O)c1cccnc1 4790a685d754ea2a2437520d97f4aec2 [1,0,0,0,0,0|1,0,2]=4 176 B14R1.163 C[C@H](CO)NCC(F)c1ccccc1 732050733bfcb991af0d779c8e849ac3 [1,0,0,0,0,0|1,0,0]=2 177 B14R1.163 C[C@H](CO)NCC(O)c1ccccc1 30e8a9d4ae11c838db549f5800460473 [1,0,0,0,0,0|0,0,0]=1 178 B14R1.163 C[C@H](CO)NCC(O)c1ccccn1 25cdbacabf333ea9c236a57570394678 [1,0,0,0,0,0|1,0,0]=2 179 B14R1.163 C[C@H](CO)NCC(O)c1cccnc1 41ea21e0e435e486dfeb943058fd106b [1,0,0,0,0,0|1,0,0]=2 180 B14R1.163 C[C@H](CO)NCC(O)c1ccncc1 cd8978cd51353a0496398b384c57c72d [1,0,0,0,0,0|1,0,0]=2 181 B14R1.163 C[C@H](CO)NCC(O)c1cnccn1 0b27c3fb25c211c8881038ea4db51216 [1,0,0,0,0,0|2,0,0]=3 182 B14R1.163 C[C@H](CO)NCS(=O)c1ccccc1 fe84edd6a58b5af4dee9d1a255445b6f [1,0,0,0,0,0|1,0,1]=3 183 B14R1.163 C[C@H](CO)NC[C@@H](C)c1ccccc1 a7cdcb3392cde08201aeb4d24fdc9e19 [1,0,0,0,0,0|1,0,0]=2 184 B14R1.163 C[C@H](CS)OC[C@@H](C)c1ccccc1 867a5f249f727bd1a06aa9c76f1d7c85 [1,0,0,0,0,0|2,1,0]=4 185 B14R1.163 O=C(CF)NCC(O)c1ccccc1 f022b17fb107b8e702377e56472d0754 [1,0,0,0,0,0|2,0,1]=4 186 B14R1.163 O=C(CF)NC[C@@H](O)c1ccccc1 7248d446818dea1b05105432b7cdce24 [1,0,0,0,0,0|2,0,1]=4 187 B14R1.163 O=C(CF)NC[C@H](O)c1ccccc1 fbce5534f687a15076ffa8be79468393 [1,0,0,0,0,0|2,0,1]=4 188 B14R1.163 O=C(CO)NCC(O)c1ccccc1 7266b2005f3ea2bf082dc86a9e65ea44 [1,0,0,0,0,0|1,0,1]=3 189 B14R1.163 O=C(CO)NCC(O)c1ccccn1 81022ec83db28aa663143d88b631fedd [1,0,0,0,0,0|2,0,1]=4 190 B14R1.163 O=C(CO)NCC(O)c1cccnc1 5a1146e7f6effb3d7219020ad37ec482 [1,0,0,0,0,0|2,0,1]=4 191 B14R1.163 O=C(CO)NCC(O)c1ccncc1 74ed0ae0d180994f36fe97cfe1044b48 [1,0,0,0,0,0|2,0,1]=4 192 B14R1.163 O=C(CO)NC[C@@H](O)c1ccccc1 6cf09922b27a6a83474d8deca911e24d [1,0,0,0,0,0|1,0,1]=3 193 B14R1.163 O=C(CO)NC[C@H](O)c1ccccc1 fdeff83f4b0fa51bfbb9d31e2b42efc9 [1,0,0,0,0,0|1,0,1]=3 194 B14R1.292 C#CC(C)(C)NCCc1ccccc1 ea26e53f1de3ec51aa1b26ec47a7008a [1,0,0,0,0,0|1,0,1]=3 195 B14R1.292 C#CC(C)(C)NCCc1ccccn1 0554a8c5b006c96f926172b7c0b276c0 [1,0,0,0,0,0|2,0,1]=4 196 B14R1.292 C#CC(C)(C)NCCc1cccnc1 3fc859a33d8239358e2ff34020c67d57 [1,0,0,0,0,0|2,0,1]=4 197 B14R1.292 C#CC(C)(C)NCCc1ccncc1 a0b709f5a5f8d4f576987fd3ee0e8804 [1,0,0,0,0,0|2,0,1]=4 198 B14R1.292 CC(C)(C#N)NCCc1ccccc1 67c8c75438295f8e8478e40991d60445 [1,0,0,0,0,0|1,0,1]=3 199 B14R1.292 CC(C)(C#N)NCCc1ccccn1 f21466dcfb688105b2d1efc70b58c603 [1,0,0,0,0,0|2,0,1]=4 200 B14R1.292 CC(C)(C#N)NCCc1cccnc1 2454848da7e8f95c17f8f52bc664e33e [1,0,0,0,0,0|2,0,1]=4 201 B14R1.292 CC(C)(C#N)NCCc1ccncc1 a06a48f3ffb2a483a6f1b3a2803bd88c [1,0,0,0,0,0|2,0,1]=4 202 B14R1.292 CC(C)(CF)CNCc1ccccc1 6218ec5c641fbd9d21cb62d67f370357 [1,0,0,0,0,0|3,0,0]=4 203 B14R1.292 CC(C)(CF)COCc1ccccc1 b7a606a2a9da549d58e3f1fc33fd7998 [1,0,0,0,0,0|3,0,0]=4 204 B14R1.292 CC(C)(CF)NCCc1ccccc1 976a8f53c868b903e999b609e7befed4 [1,0,0,0,0,0|1,0,0]=2 205 B14R1.292 CC(C)(CF)NCCc1ccccn1 c9f37780ff1a27e405a99e8183268f65 [1,0,0,0,0,0|2,0,0]=3 206 B14R1.292 CC(C)(CF)NCCc1cccnc1 0f27dad6e702fb7859a7c26ac707a85c [1,0,0,0,0,0|2,0,0]=3 207 B14R1.292 CC(C)(CF)NCCc1ccncc1 8db58df4d1c3fd777291e4c7fa514b9f [1,0,0,0,0,0|2,0,0]=3 208 B14R1.292 CC(C)(CO)CNCc1ccccc1 3c15fa8e64360447a959a0099804b140 [1,0,0,0,0,0|2,0,0]=3 209 B14R1.292 CC(C)(CO)CNCc1ccccn1 cf9231c12f813360d6d403b142e08fbb [1,0,0,0,0,0|3,0,0]=4 210 B14R1.292 CC(C)(CO)CNCc1cccnc1 d4bc47489ddc409bf322a9f3ebcd08cc [1,0,0,0,0,0|3,0,0]=4 211 B14R1.292 CC(C)(CO)CNCc1ccncc1 c644c77fa2d779e9c925dddc345fceb0 [1,0,0,0,0,0|3,0,0]=4 212 B14R1.292 CC(C)(CO)NCCc1ccccc1 499a2354c158ca42e2a368e0538e8ce5 [1,0,0,0,0,0|0,0,0]=1 213 B14R1.292 CC(C)(CO)NCCc1ccccn1 cada2992ee8883dc8f53be0e00c0daae [1,0,0,0,0,0|1,0,0]=2 214 B14R1.292 CC(C)(CO)NCCc1cccnc1 90e30d3991b3cb524988721b47e5e919 [1,0,0,0,0,0|1,0,0]=2 215 B14R1.292 CC(C)(CO)NCCc1ccncc1 ac67b4aa8b8c9a52938fde243a88f48e [1,0,0,0,0,0|1,0,0]=2 216 B14R1.292 CC(C)(CO)NCSc1ccccc1 276ee7c32d6f157e5f767632dbf60875 [1,0,0,0,0,0|1,0,0]=2 217 B14R1.292 CCC(C)(C)CCNc1ccccc1 53980aa4856521d7244702b5ecc6930a [1,0,0,0,0,0|3,0,0]=4 218 B14R1.292 CCC(C)(C)CNCc1ccccc1 f1f090b0474fad76557b986448a95621 [1,0,0,0,0,0|3,0,0]=4 219 B14R1.292 CCC(C)(C)NCCc1ccccn1 b5d2128afb2dd128c5539640972e1004 [1,0,0,0,0,0|2,0,0]=3 220 B14R1.292 CCC(C)(C)NCCc1cccnc1 026597dad39e155f52619b320cf56204 [1,0,0,0,0,0|2,0,0]=3 221 B14R1.292 CCC(C)(C)NCCc1ccncc1 98281e941fea3b970fdf3e24d019c041 [1,0,0,0,0,0|2,0,0]=3 222 B14R1.3098 C=C(CNC(C)(C)C)c1ccccc1 939f6b5a635b788495c748892f3983b4 [1,0,0,0,0,0|1,0,1]=3 223 B14R1.3098 CC(C)(C)NCC(=O)c1ccccc1 d004916a81656e4c8a9e45ffc04b5d96 [1,0,0,0,0,0|0,0,2]=3 224 B14R1.3098 CC(C)(C)NCC(=O)c1ccccn1 479f8281d6abc4d3bba577e11e5d0b9f [1,0,0,0,0,0|1,0,2]=4 225 B14R1.3098 CC(C)(C)NCC(=O)c1cccnc1 346fb8e096d826ab9e526d89c7b6fa8e [1,0,0,0,0,0|1,0,2]=4 226 B14R1.3098 CC(C)(C)NCC(O)c1ccccc1 a236bba4c63ad9aa45ea4e9fa401fb4d [1,0,0,0,0,0|0,0,0]=1 227 B14R1.3098 CC(C)(C)NCC(O)c1cnccn1 276ec5a71e96a1eb77e58174ca4c39c7 [1,0,0,0,0,0|2,0,0]=3 228 B14R1.3098 CC(NCC(C)(C)C)c1ccccc1 fe567bb014b36595763f5711b99b30f4 [1,0,0,0,0,0|3,0,0]=4 229 B14R1.3098 CC(NCC(C)(C)O)c1ccccc1 133627c50fb40ad3f35853a1056e7a3c [1,0,0,0,0,0|3,0,0]=4 230 B14R1.3098 CC(OCC(C)(C)C)c1ccccc1 e9a8fd5ed4168011fb0e0882244e23bc [1,0,0,0,0,0|3,0,0]=4 231 B14R1.3098 CC(OCC(C)(C)O)c1ccccc1 4ccc51a421aab9c104197b4b5a13af30 [1,0,0,0,0,0|3,0,0]=4 232 B14R1.3098 CN(CCC(C)(C)C)c1ccccc1 c229dd43afad08a599e8bfd5c626a843 [1,0,0,0,0,0|3,0,0]=4 233 B14R1.3098 CN(CCC(C)(C)O)c1ccccc1 3622ab1811437927ce7e9bfc7f3655ae [1,0,0,0,0,0|3,0,0]=4 234 B14R1.3098 C[C@@H](NCC(C)(C)C)c1ccccc1 eeb078785fe66aedf181fa68e97332cb [1,0,0,0,0,0|3,0,0]=4 235 B14R1.3098 C[C@@H](NCC(C)(C)O)c1ccccc1 38597139ed9ede3792a880cab14b6ca4 [1,0,0,0,0,0|3,0,0]=4 236 B14R1.3098 C[C@@H](OCC(C)(C)C)c1ccccc1 0ae7aefd23adcc2c4d836ec5880a879f [1,0,0,0,0,0|3,0,0]=4 237 B14R1.3098 C[C@@H](OCC(C)(C)O)c1ccccc1 5bab6fcaa4006250cb797b7d5874f31e [1,0,0,0,0,0|3,0,0]=4 238 B14R1.3098 C[C@H](NCC(C)(C)C)c1ccccc1 4a01c696873f04522de0bf4b48dafac5 [1,0,0,0,0,0|3,0,0]=4 239 B14R1.3098 C[C@H](NCC(C)(C)O)c1ccccc1 2ef40820a3186f4ebc178d2ca289851f [1,0,0,0,0,0|3,0,0]=4 240 B14R1.3098 C[C@H](OCC(C)(C)C)c1ccccc1 5352c3de3e5d3b013ec82707789b5bf8 [1,0,0,0,0,0|3,0,0]=4 241 B14R1.3098 C[C@H](OCC(C)(C)O)c1ccccc1 83b2d312d9c4a8df9506620da5e31120 [1,0,0,0,0,0|3,0,0]=4 242 B16R1.335 C#CC(C)(C)NCC(F)c1ccc(cc1)Br d86076dbeba2ef026ce0d3b82c2f47fa [0,1,0,0,0,0|2,0,1]=4 243 B16R1.335 C#CC(C)(C)NCC(O)c1ccc(cc1)Br 1aca4c72b04711c00c2b36b6b7f3c7ef [0,1,0,0,0,0|1,0,1]=3 244 B16R1.335 C#CC(C)(C)NCC(O)c1ccc(cc1)Cl e93e1af41d25591b26a99d91fd450846 [0,1,0,0,0,0|1,0,1]=3 245 B16R1.335 C#CC(C)(C)NC[C@@H](O)c1ccc(cc1)Br d0b077b8054b9162a957171bb06d4a2a [0,1,0,0,0,0|1,0,1]=3 246 B16R1.335 C#CC(C)(C)NC[C@@H](O)c1ccc(cc1)C 1d3c71739e09e557f71b6f570bb71366 [0,1,0,0,0,0|1,0,1]=3 247 B16R1.335 C#CC(C)(C)NC[C@@H](O)c1ccc(cc1)Cl 7823a7a5afd8f5f38e48782e107a01c2 [0,1,0,0,0,0|1,0,1]=3 248 B16R1.335 C#CC(C)(C)NC[C@@H](O)c1ccc(cc1)F 616605e513a9338e9155ac47a55f0663 [0,1,0,0,0,0|1,0,1]=3 249 B16R1.335 C#CC(C)(C)NC[C@H](O)c1ccc(cc1)Br 97900376d209e8639e7b0c3bdc5e0c55 [0,1,0,0,0,0|1,0,1]=3 250 B16R1.335 C#CC(C)(C)NC[C@H](O)c1ccc(cc1)Cl 5705f62e21553c0a86d444b6d043ca6c [0,1,0,0,0,0|1,0,1]=3 251 B16R1.335 C#CC(C)(C)NC[C@H](O)c1ccc(cc1)F 1f53de31330a9e10c769040328fd4621 [0,1,0,0,0,0|1,0,1]=3 252 B16R1.335 CC(C)(C#N)NCC(F)c1ccc(cc1)Br 6e34e4025447e9b1a17b5e1395d89529 [0,1,0,0,0,0|2,0,1]=4 253 B16R1.335 CC(C)(C#N)NCC(O)c1ccc(cc1)Br d38f9c454fca90d9a9bad9c0f51ba920 [0,1,0,0,0,0|1,0,1]=3 254 B16R1.335 CC(C)(C#N)NCC(O)c1ccc(cc1)Cl 252e9fb38a3138315894b810dc95c63a [0,1,0,0,0,0|1,0,1]=3 255 B16R1.335 CC(C)(C#N)NC[C@@H](O)c1ccc(cc1)Br a2488d22892b83b84b2b1559615bf603 [0,1,0,0,0,0|1,0,1]=3 256 B16R1.335 CC(C)(C#N)NC[C@@H](O)c1ccc(cc1)F 98627ad32b76212038fd4996a3b0492d [0,1,0,0,0,0|1,0,1]=3 257 B16R1.335 CC(C)(C#N)NC[C@H](O)c1ccc(cc1)Br afe2d53c51de5ac579c5bd876303da27 [0,1,0,0,0,0|1,0,1]=3 258 B16R1.335 CC(C)(C#N)NC[C@H](O)c1ccc(cc1)Cl 25b794791f5103ddb33a8b31adb0f6cc [0,1,0,0,0,0|1,0,1]=3 259 B16R1.335 CC(C)(C#N)NC[C@H](O)c1ccc(cc1)F 27d6e35a151d24fe55bb5da45aa6415b [0,1,0,0,0,0|1,0,1]=3 260 B16R1.335 CC(C)(CF)NCC(=O)c1ccc(cc1)Br 463df663fd0a30bcfd26178e4391df74 [0,1,0,0,0,0|1,0,2]=4 261 B16R1.335 CC(C)(CF)NCC(=O)c1ccc(cc1)Cl 7e5486529cabb7a75d2065cda3a4882b [0,1,0,0,0,0|1,0,2]=4 262 B16R1.335 CC(C)(CF)NCC(=O)c1ccc(cc1)F d9bc507f6f7d7fc8dd3d585a84183866 [0,1,0,0,0,0|1,0,2]=4 263 B16R1.335 CC(C)(CF)NCC(=O)c1ccc(cc1)I 10c57513a47766a8e5022d0d4dcfe1e6 [0,1,0,0,0,0|1,0,2]=4 264 B16R1.335 CC(C)(CF)NCC(O)c1ccc(cc1)Br 2069d5c5efeebc99b605d4372a97fb04 [0,1,0,0,0,0|1,0,0]=2 265 B16R1.335 CC(C)(CF)NCC(O)c1ccc(cc1)Cl 869df9991d08da86e90d43c68fad95b2 [0,1,0,0,0,0|1,0,0]=2 266 B16R1.335 CC(C)(CF)NC[C@@H](O)c1ccc(cc1)Br b984814ef37d42d0ddf6411a21c07206 [0,1,0,0,0,0|1,0,0]=2 267 B16R1.335 CC(C)(CF)NC[C@@H](O)c1ccc(cc1)F 871a19aebb168469c11593201b20af0e [0,1,0,0,0,0|1,0,0]=2 268 B16R1.335 CC(C)(CF)NC[C@H](O)c1ccc(cc1)Br feac3a06836a5a1a394cd282d6e045e7 [0,1,0,0,0,0|1,0,0]=2 269 B16R1.335 CC(C)(CF)NC[C@H](O)c1ccc(cc1)Cl 2dc838b5b761c727682a66a483a463b6 [0,1,0,0,0,0|1,0,0]=2 270 B16R1.335 CC(C)(CF)NC[C@H](O)c1ccc(cc1)F 03aca664ac746bedfca3f118896f6391 [0,1,0,0,0,0|1,0,0]=2 271 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(cc1)Br c90a2ec56a2f46905a71654781615987 [0,1,0,0,0,0|0,0,2]=3 272 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(cc1)Cl 66953da8619ecf1c703d8f89be2d243d [0,1,0,0,0,0|0,0,2]=3 273 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(cc1)F 8a36aa0752903962c4baf93c243f90fd [0,1,0,0,0,0|0,0,2]=3 274 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(cc1)I 1c5419d971ebf642ebdd9d557de2af26 [0,1,0,0,0,0|0,0,2]=3 275 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(cn1)Br f6d0a64b87fb799621be3648d2665a76 [0,1,0,0,0,0|1,0,2]=4 276 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(cn1)Cl 32ebaffd2dafed06decec2b27b489450 [0,1,0,0,0,0|1,0,2]=4 277 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(cn1)F 675e41a05cddb5c07b2b58a497410721 [0,1,0,0,0,0|1,0,2]=4 278 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(nc1)Br 351b80de582cfa56419742ed3508266a [0,1,0,0,0,0|1,0,2]=4 279 B16R1.335 CC(C)(CO)NCC(=O)c1ccc(nc1)Cl cb55d57ba1cbf46e06030f644db0853c [0,1,0,0,0,0|1,0,2]=4 280 B16R1.335 CC(C)(CO)NCC(F)c1ccc(cc1)Br ee0072181b5d24e523dfd1178da99ec4 [0,1,0,0,0,0|1,0,0]=2 281 B16R1.335 CC(C)(CO)NCC(O)c1ccc(cc1)Br d6acac756269625d6b99b7fdcca72c21 [0,1,0,0,0,0|0,0,0]=1 282 B16R1.335 CC(C)(CO)NCC(O)c1ccc(cc1)Cl d6d672773686ef8c71007751064c3b58 [0,1,0,0,0,0|0,0,0]=1 283 B16R1.335 CC(C)(CO)NC[C@@H](O)c1ccc(cc1)Br ad4e8164cceed17c322898baf12a1e57 [0,1,0,0,0,0|0,0,0]=1 284 B16R1.335 CC(C)(CO)NC[C@@H](O)c1ccc(cc1)F 8bf3e576f38e791139b071911cf526b2 [0,1,0,0,0,0|0,0,0]=1 285 B16R1.335 CC(C)(CO)NC[C@H](O)c1ccc(cc1)Br 6073d30b7f991c37b9b30d515ad482b1 [0,1,0,0,0,0|0,0,0]=1 286 B16R1.335 CC(C)(CO)NC[C@H](O)c1ccc(cc1)Cl c601f978c582b79e0e314292b4da4813 [0,1,0,0,0,0|0,0,0]=1 287 B16R1.335 CC(C)(CO)NC[C@H](O)c1ccc(cc1)F b475d522891a242b15bfec4cf78e60c0 [0,1,0,0,0,0|0,0,0]=1 288 B16R1.335 CC(NCC(C)(C)CO)c1ccc(cc1)Br 82ea62686bc8410650fd4d17bcf8644c [0,1,0,0,0,0|3,0,0]=4 289 B16R1.335 CC(NCC(C)(C)CO)c1ccc(cc1)F a1fd3fa140fe790ec55d705ee952fbb4 [0,1,0,0,0,0|3,0,0]=4 290 B16R1.335 CC(NCC(C)(C)CO)c1ccc(cc1)I 1cff852f258bc839733c98da75dab5f0 [0,1,0,0,0,0|3,0,0]=4 291 B16R1.335 CCC(C)(C)NCC(=O)c1ccc(cc1)F 7bad25f809d026c71ae1ee9ee3a2530d [0,1,0,0,0,0|1,0,2]=4 292 B16R1.335 CCC(C)(C)NCC(=O)c1ccc(cc1)I cf074746bf8a151fda118d3fe54f3e90 [0,1,0,0,0,0|1,0,2]=4 293 B16R1.335 CCC(C)(C)NC[C@H](O)c1ccc(cc1)F d449f11058bab48378e2b8e0bd55c3de [0,1,0,0,0,0|1,0,0]=2 294 B16R1.335 C[C@@H](NCC(C)(C)CO)c1ccc(cc1)Br f106ef39e088bd10c72089ae1a40a79e [0,1,0,0,0,0|3,0,0]=4 295 B16R1.335 C[C@@H](NCC(C)(C)CO)c1ccc(cc1)F 8ad87e9632dcab4340ff9234f8217aa2 [0,1,0,0,0,0|3,0,0]=4 296 B16R1.335 C[C@@H](NCC(C)(C)CO)c1ccc(cc1)I a946ab555a01642add36f09b4b25b58c [0,1,0,0,0,0|3,0,0]=4 297 B16R1.335 C[C@H](NCC(C)(C)CO)c1ccc(cc1)Br 4edfb26f06a5e3324ee787efddf78de3 [0,1,0,0,0,0|3,0,0]=4 298 B16R1.335 C[C@H](NCC(C)(C)CO)c1ccc(cc1)F 8425df04b67eb9c8651173c1b2a1affd [0,1,0,0,0,0|3,0,0]=4 299 B16R1.335 C[C@H](NCC(C)(C)CO)c1ccc(cc1)I 95d252e266282416d3f1c5820c7e9009 [0,1,0,0,0,0|3,0,0]=4 300 B16R1.335 Cc1ccc(cc1)C(=O)CNC(C)(C)CF 365e44451ca3b8095a0b9b6b1a4f4f01 [0,1,0,0,0,0|1,0,2]=4 301 B16R1.335 Cc1ccc(cc1)C(=O)CNC(C)(C)CO f5bfdac822f753a6cac30475ffafe415 [0,1,0,0,0,0|0,0,2]=3 302 B16R1.335 Cc1ccc(cc1)C(C)NCC(C)(C)CO 178a6a517fcf99c5c8b2257b40ef5c9c [0,1,0,0,0,0|3,0,0]=4 303 B16R1.335 Cc1ccc(cc1)[C@@H](C)NCC(C)(C)CO edca2886389011f541a18845f553da25 [0,1,0,0,0,0|3,0,0]=4 304 B16R1.335 Cc1ccc(cc1)[C@H](C)NCC(C)(C)CO 63b9a9cee1bbd758083fd97d9cb34b57 [0,1,0,0,0,0|3,0,0]=4 305 B16R1.335 Cc1ccc(cc1)[C@H](O)CNC(C)(C)C#N ac568bfa97cdec7d4aad8da7021865bb [0,1,0,0,0,0|1,0,1]=3 306 B16R1.335 Cc1ccc(cc1)[C@H](O)CNC(C)(C)CO fa469ab91416222f36dd33029837b9b7 [0,1,0,0,0,0|0,0,0]=1 307 B16R1.335 Cc1ccc(cn1)C(=O)CNC(C)(C)CO 2529e05ea6fc1182d15ce198d945fe8f [0,1,0,0,0,0|1,0,2]=4 308 B16R1.335 Cc1ccc(nc1)C(=O)CNC(C)(C)CO 634dd6de6c5f01ab2b2c0b6c22819088 [0,1,0,0,0,0|1,0,2]=4 309 B16R1.336 C#CC(C)(C)NCC(O)c1cccc(c1)Cl 459d82c15fcf86a13a9c295e643ac2b5 [0,1,0,0,0,0|1,0,1]=3 310 B16R1.336 C#CC(C)(C)NC[C@H](O)c1cccc(c1)Cl 5d65a387ffe3d755228ae48c9469e5c6 [0,1,0,0,0,0|1,0,1]=3 311 B16R1.336 CC(C)(C#N)NCC(O)c1cccc(c1)Cl 52504250435cfd1008c234f585d4ba33 [0,1,0,0,0,0|1,0,1]=3 312 B16R1.336 CC(C)(C#N)NC[C@H](O)c1cccc(c1)Cl 0f1ee523e2cf0ddcf8ce2823f31aa652 [0,1,0,0,0,0|1,0,1]=3 313 B16R1.336 CC(C)(CF)NCC(=O)c1cccc(c1)Cl 7beb444248f8978fede0fc931527cdac [0,1,0,0,0,0|1,0,2]=4 314 B16R1.336 CC(C)(CF)NCC(=O)c1cccc(c1)F c3922c450e47c152bab69dd97c26ddba [0,1,0,0,0,0|1,0,2]=4 315 B16R1.336 CC(C)(CF)NCC(=O)c1cccc(c1)I 719418d68de625b9d784df75b5e5c659 [0,1,0,0,0,0|1,0,2]=4 316 B16R1.336 CC(C)(CF)NC[C@H](O)c1cccc(c1)Cl 5956baf5b9078c5190294ff35e46c2e9 [0,1,0,0,0,0|1,0,0]=2 317 B16R1.336 CC(C)(CO)NCC(=O)c1cc(ccn1)Cl f4f2a0406eb5c5933fd7152cc04ea560 [0,1,0,0,0,0|1,0,2]=4 318 B16R1.336 CC(C)(CO)NCC(=O)c1cccc(c1)Br ec02e92d33d2849485cf8620c7057018 [0,1,0,0,0,0|0,0,2]=3 319 B16R1.336 CC(C)(CO)NCC(=O)c1cccc(c1)Cl 068c08a617540bce6a9b938899452c88 [0,1,0,0,0,0|0,0,2]=3 320 B16R1.336 CC(C)(CO)NCC(=O)c1cccc(c1)F 4b5b93aa0f5d9d3dd8f3be7dd9ff9216 [0,1,0,0,0,0|0,0,2]=3 321 B16R1.336 CC(C)(CO)NCC(=O)c1cccc(c1)I 277c1327f2a6df0d7dd1c43ba355972b [0,1,0,0,0,0|0,0,2]=3 322 B16R1.336 CC(C)(CO)NCC(=O)c1cccc(n1)Br 2f9cff94e11c5e7e37483c881da2dcff [0,1,0,0,0,0|1,0,2]=4 323 B16R1.336 CC(C)(CO)NCC(=O)c1ccnc(c1)Cl 9377b79776e40c74a9066f1350d6a1d9 [0,1,0,0,0,0|1,0,2]=4 324 B16R1.336 CC(C)(CO)NCC(=O)c1ccnc(c1)F 388d1b2f0cba566bb89da9d225cf66dd [0,1,0,0,0,0|1,0,2]=4 325 B16R1.336 CC(C)(CO)NC[C@H](O)c1cccc(c1)Cl 7bfc120c8b0b656a2f744d8b2b296c9b [0,1,0,0,0,0|0,0,0]=1 326 B16R1.336 CC(NCC(C)(C)CO)c1cccc(c1)Br 577d70687581aa25b5e778b5fd34a346 [0,1,0,0,0,0|3,0,0]=4 327 B16R1.336 CC(NCC(C)(C)CO)c1cccc(c1)Cl 9dbe167a76dd496958e766831f9ef806 [0,1,0,0,0,0|3,0,0]=4 328 B16R1.336 CC(NCC(C)(C)CO)c1cccc(c1)F 69692e3832a2f4a7eba983900db20ad3 [0,1,0,0,0,0|3,0,0]=4 329 B16R1.336 CCC(C)(C)NCC(=O)c1cccc(c1)Cl 6405bc482939645a6d452ebc02bb7f4d [0,1,0,0,0,0|1,0,2]=4 330 B16R1.336 CCC(C)(C)NCC(=O)c1cccc(c1)F 66c208de369de474fa82eb4d1f030211 [0,1,0,0,0,0|1,0,2]=4 331 B16R1.336 CCC(C)(C)NCC(=O)c1cccc(c1)I 0cef3ee0a7769a09c3d7b9096eb235fe [0,1,0,0,0,0|1,0,2]=4 332 B16R1.336 CCC(C)(C)NC[C@H](O)c1cccc(c1)Cl 6db6b613b6efdfc6d7c9fed3f880edd4 [0,1,0,0,0,0|1,0,0]=2 333 B16R1.336 C[C@@H](NCC(C)(C)CO)c1cccc(c1)Br 9e326c06d97f24d22eab0f384ce73276 [0,1,0,0,0,0|3,0,0]=4 334 B16R1.336 C[C@@H](NCC(C)(C)CO)c1cccc(c1)Cl d36b1e598f207f94756e165718fb4143 [0,1,0,0,0,0|3,0,0]=4 335 B16R1.336 C[C@@H](NCC(C)(C)CO)c1cccc(c1)F a60ffaf01f72c72764e1a5389f824686 [0,1,0,0,0,0|3,0,0]=4 336 B16R1.336 C[C@H](NCC(C)(C)CO)c1cccc(c1)Br 5c903022161a6a9bda81622521074f6e [0,1,0,0,0,0|3,0,0]=4 337 B16R1.336 C[C@H](NCC(C)(C)CO)c1cccc(c1)Cl 81a237d4d3f5fbc584902e8dd254b221 [0,1,0,0,0,0|3,0,0]=4 338 B16R1.336 C[C@H](NCC(C)(C)CO)c1cccc(c1)F 532bf6b22e4bf0ba25a0a83ba31cc915 [0,1,0,0,0,0|3,0,0]=4 339 B16R1.336 C[C@H](NCC(C)(C)CO)c1cccc(c1)I 622988a1db0047443a84fb31d06788e2 [0,1,0,0,0,0|3,0,0]=4 340 B16R1.336 Cc1cccc(c1)C(=O)CNC(C)(C)CF 8e3edb34b0ad26a832fdb2f8dd51a6c7 [0,1,0,0,0,0|1,0,2]=4 341 B16R1.336 Cc1cccc(c1)C(=O)CNC(C)(C)CO f4773796ccbd5dea8d20ebff4b2d0b12 [0,1,0,0,0,0|0,0,2]=3 342 B16R1.336 Cc1cccc(c1)C(C)NCC(C)(C)CO 5fc7d40a2781c4c3af7966a7d7bbbeb7 [0,1,0,0,0,0|3,0,0]=4 343 B16R1.336 Cc1cccc(c1)[C@@H](C)NCC(C)(C)CO b9a4957340c7d62a3a09d30aea663284 [0,1,0,0,0,0|3,0,0]=4 344 B16R1.336 Cc1cccc(c1)[C@H](C)NCC(C)(C)CO faed56908b5b3bf7f7574d450a746da6 [0,1,0,0,0,0|3,0,0]=4 345 B16R1.336 Cc1cccc(n1)C(=O)CNC(C)(C)CO 20520e39bf3e9470d72ab76075df46ea [0,1,0,0,0,0|1,0,2]=4 346 B16R1.344 C=C(CN(C)C(C)(C)CC)c1ccccc1 b76322a7209928644deb969a324537a4 [0,1,0,0,0,0|2,0,1]=4 347 B16R1.344 C=C(CN(C)C(C)(C)CO)c1ccccc1 a436d40485cb22bd7a25c85d492fe05d [0,1,0,0,0,0|1,0,1]=3 348 B16R1.344 CC(CN(C)C(C)(C)CO)c1ccccc1 fa5c6ee9e255394cdc7cebf34a140f34 [0,1,0,0,0,0|1,0,0]=2 349 B16R1.344 CCC(C)(C)N(C)CC(=O)c1ccccc1 caa66b104520a20c4fcbc057b69e5e74 [0,1,0,0,0,0|1,0,2]=4 350 B16R1.344 CCC(C)(C)N(C)CC(C)c1ccccc1 a2942fc2e9c22cf430163d61e8e9ef56 [0,1,0,0,0,0|2,0,0]=3 351 B16R1.344 CCC(C)(C)N(C)CC(F)c1ccccc1 6ebe70264a1593ab86fbd0320ab3f6b7 [0,1,0,0,0,0|2,0,0]=3 352 B16R1.344 CCC(C)(C)N(C)CC(O)c1ccccc1 dad3aff149cfc7b71e3fbcbeb955ce11 [0,1,0,0,0,0|1,0,0]=2 353 B16R1.344 CCC(C)(C)N(C)CC(O)c1cnccn1 14e8a934f42c0200ab56a510f7db332f [0,1,0,0,0,0|3,0,0]=4 354 B16R1.344 CCC(C)(C)N(C)C[C@@H](C)c1ccccc1 fb2ef257350b35dd82d5663f8cc547b8 [0,1,0,0,0,0|2,0,0]=3 355 B16R1.344 CN(CC(=O)c1ccccc1)C(C)(C)CO c7644102885367d84ee6a3aa9abe1240 [0,1,0,0,0,0|0,0,2]=3 356 B16R1.344 CN(CC(=O)c1ccccn1)C(C)(C)CO ba721c7e0d4ee92397e8b39fef241240 [0,1,0,0,0,0|1,0,2]=4 357 B16R1.344 CN(CC(=O)c1cccnc1)C(C)(C)CO 9228b076b2e79c3d648e423b5ef58112 [0,1,0,0,0,0|1,0,2]=4 358 B16R1.344 CN(CC(F)c1ccccc1)C(C)(C)CO 6d1415203cd9eb864aa2458401d54ced [0,1,0,0,0,0|1,0,0]=2 359 B16R1.344 CN(CC(O)c1ccccc1)C(C)(C)CO dacd741f22bc3c726a59981a037f1e57 [0,1,0,0,0,0|0,0,0]=1 360 B16R1.344 CN(CC(O)c1cnccn1)C(C)(C)CO be64948ee4a9c10117a17ca3164ecd86 [0,1,0,0,0,0|2,0,0]=3 361 B16R1.344 CN(CS(=O)c1ccccc1)C(C)(C)CO 6b704d3f6078a7a4cd466b36571a6ca2 [0,1,0,0,0,0|1,0,1]=3 362 B16R1.344 CN(C[C@@H](O)c1ccccc1)C(C)(C)CO ad0d702cf4ee6637cf4d55d7b5d73094 [0,1,0,0,0,0|0,0,0]=1 363 B16R1.344 CN(C[C@H](O)c1ccccc1)C(C)(C)CO 8c2eb4e21080af1885043ea86e68b355 [0,1,0,0,0,0|0,0,0]=1 364 B16R1.344 C[C@H](CN(C)C(C)(C)CO)c1ccccc1 09eecbad87d529a98d15c12c0bcce4b8 [0,1,0,0,0,0|1,0,0]=2 365 B16R1.347 C=C(C(=O)NC(C)(C)CO)c1ccccc1 e98c1b173dc77158f4d4d3e4c69ae81b [0,1,0,0,0,0|1,0,2]=4 366 B16R1.347 CC(C(=O)NC(C)(C)CO)c1ccccc1 d4874ff02c6ab646f700e9b868af27aa [0,1,0,0,0,0|1,0,1]=3 367 B16R1.347 CC(C(=O)NC(C)(C)CO)c1cccnc1 851e017c8093ab99026444d5125e7301 [0,1,0,0,0,0|2,0,1]=4 368 B16R1.347 CC(C)(C#N)NC(=O)C(O)c1ccccc1 3ff88d349db8ea09ae523b002e6a32b8 [0,1,0,0,0,0|1,0,2]=4 369 B16R1.347 CC(C)(C#N)NC(=O)[C@@H](O)c1ccccc1 29eb11b4117fc06de66a370a62959554 [0,1,0,0,0,0|1,0,2]=4 370 B16R1.347 CC(C)(C#N)NC(=O)[C@H](O)c1ccccc1 b7ccaedfff862f5bd833be2c040b6f4d [0,1,0,0,0,0|1,0,2]=4 371 B16R1.347 CC(C)(CF)NC(=O)C(O)c1ccccc1 91487169e4a0dac3962cb008f7ed6a5d [0,1,0,0,0,0|1,0,1]=3 372 B16R1.347 CC(C)(CF)NC(=O)C(O)c1cccnc1 1343f57d7684e2d2e26083474346cbef [0,1,0,0,0,0|2,0,1]=4 373 B16R1.347 CC(C)(CF)NC(=O)C(O)c1ccncc1 711f32f14d135bf6b7b333c62d1c6909 [0,1,0,0,0,0|2,0,1]=4 374 B16R1.347 CC(C)(CF)NC(=O)[C@@H](O)c1ccccc1 83a0253bbfe1d6cf6d1638e975d9ab07 [0,1,0,0,0,0|1,0,1]=3 375 B16R1.347 CC(C)(CF)NC(=O)[C@H](O)c1ccccc1 f0ee9ed95166cafc5a1ad60234d38195 [0,1,0,0,0,0|1,0,1]=3 376 B16R1.347 CC(C)(CO)NC(=O)C(=O)c1ccccc1 f6892876165682a552426795030e8d85 [0,1,0,0,0,0|0,0,3]=4 377 B16R1.347 CC(C)(CO)NC(=O)C(F)c1ccccc1 0d121ca90d434e1e000721453e85b602 [0,1,0,0,0,0|1,0,1]=3 378 B16R1.347 CC(C)(CO)NC(=O)C(O)c1ccccc1 704678ab25a90247b14c9cba9946148e [0,1,0,0,0,0|0,0,1]=2 379 B16R1.347 CC(C)(CO)NC(=O)C(O)c1cccnc1 d55e319b5218b4c82ef3624bfe63f6ac [0,1,0,0,0,0|1,0,1]=3 380 B16R1.347 CC(C)(CO)NC(=O)C(O)c1ccncc1 816d0437a06936877adbf4f10d1f588e [0,1,0,0,0,0|1,0,1]=3 381 B16R1.347 CC(C)(CO)NC(=O)[C@@H](O)c1ccccc1 e441c5a893885534c0c090de7a310c74 [0,1,0,0,0,0|0,0,1]=2 382 B16R1.347 CC(C)(CO)NC(=O)[C@H](F)c1ccccc1 18123e790744848ef6e8dfb4e32765fa [0,1,0,0,0,0|1,0,1]=3 383 B16R1.347 CC(C)(CO)NC(=O)[C@H](O)c1ccccc1 6821224ef1f7191cc5088d4168c2ea78 [0,1,0,0,0,0|0,0,1]=2 384 B16R1.347 CCC(C)(C)NC(=O)C(O)c1cccnc1 7dad70622430eec1b93fd5276136a798 [0,1,0,0,0,0|2,0,1]=4 385 B16R1.347 CCC(C)(C)NC(=O)C(O)c1ccncc1 68c7716941fdb5556b58781d603e897c [0,1,0,0,0,0|2,0,1]=4 386 B16R1.347 C[C@@H](C(=O)NC(C)(C)CO)c1ccccc1 681722cec229af2c9bf3a2fa663a1809 [0,1,0,0,0,0|1,0,1]=3 387 B16R1.347 C[C@H](C(=O)NC(C)(C)CO)c1ccccc1 f2fecfeac237224a90796a6aa57b2bb5 [0,1,0,0,0,0|1,0,1]=3 388 B16R1.3098 C#CC(C)(CC)NCC(C)c1ccccc1 d556354c740c083b34c3c2081896c0a3 [0,1,0,0,0,0|2,0,1]=4 389 B16R1.3098 C#CC(C)(CC)NCC(O)c1ccccc1 c25037a97588511e4154aa6191aa11c4 [0,1,0,0,0,0|1,0,1]=3 390 B16R1.3098 C#CC(C)(CC)NC[C@@H](C)c1ccccc1 be1c114daf06329b175239721567be2a [0,1,0,0,0,0|2,0,1]=4 391 B16R1.3098 C=C(CNC(C)(CC)CC)c1ccccc1 44b638e042f5cbcad95657e0b7edfc24 [0,1,0,0,0,0|2,0,1]=4 392 B16R1.3098 C=C(CNC(C)(CC)CO)c1ccccc1 c441da4ce468316ec8fd3d924d6b1f68 [0,1,0,0,0,0|1,0,1]=3 393 B16R1.3098 C=C(CNC(C)(CO)CO)c1ccccc1 6a87a97a66a2cda16c1fb85c85ac785a [0,1,0,0,0,0|1,0,1]=3 394 B16R1.3098 CC(CO)(CO)NCC(=O)c1ccccc1 01a9fec8664d0ace5fb7b62a09ef055d [0,1,0,0,0,0|0,0,2]=3 395 B16R1.3098 CC(CO)(CO)NCC(=O)c1ccccn1 6dd646664ffcb19ee99db7056a4d2ff5 [0,1,0,0,0,0|1,0,2]=4 396 B16R1.3098 CC(CO)(CO)NCC(=O)c1cccnc1 bc404aebef9b70c54b8d89f591dcbe52 [0,1,0,0,0,0|1,0,2]=4 397 B16R1.3098 CC(CO)(CO)NCC(O)c1ccccc1 134282bfb28a009c7775213484dc7da8 [0,1,0,0,0,0|0,0,0]=1 398 B16R1.3098 CC(CO)(CO)NCC(O)c1cnccn1 b85042c8137d55999530fb765016c3fc [0,1,0,0,0,0|2,0,0]=3 399 B16R1.3098 CCC(C)(CC)NCC(=O)c1ccccc1 6669a19dbdf9c937a907293125533353 [0,1,0,0,0,0|1,0,2]=4 400 B16R1.3098 CCC(C)(CC)NCC(O)c1cnccn1 ec2f45243e330e7a1a7077cee4f85382 [0,1,0,0,0,0|3,0,0]=4 401 B16R1.3098 CCC(C)(CO)NCC(=O)c1ccccc1 e217073f57d2a71f23c9d3a510d4ea4a [0,1,0,0,0,0|0,0,2]=3 402 B16R1.3098 CCC(C)(CO)NCC(=O)c1ccccn1 e4293cedea7c1f8a959e4b4deba56c3e [0,1,0,0,0,0|1,0,2]=4 403 B16R1.3098 CCC(C)(CO)NCC(=O)c1cccnc1 4163403df98666f9d531908229956817 [0,1,0,0,0,0|1,0,2]=4 404 B16R1.3098 CCC(C)(CO)NCC(O)c1cnccn1 16abecbff1a1598e69296bf201f42ea5 [0,1,0,0,0,0|2,0,0]=3 405 B16R1.10308 C#CC(C)(C)NCC(C)(C)c1ccccc1 ba6eb0cb9fc9323c963064def6056f4a [0,1,0,0,0,0|2,0,1]=4 406 B16R1.10308 C#CC(C)(C)NCC(F)(F)c1ccccc1 4d5d40a95e61e076fc2758d4c8c146a2 [0,1,0,0,0,0|2,0,1]=4 407 B16R1.10308 CC(C)(C#N)NCC(F)(F)c1ccccc1 dee2175fdae33062c479f4607cedbbe3 [0,1,0,0,0,0|2,0,1]=4 408 B16R1.10308 CC(C)(CF)NCC(C)(C)c1ccccc1 55625e2b64c1530d1c4f43177daee75d [0,1,0,0,0,0|2,0,0]=3 409 B16R1.10308 CC(C)(CF)NCC(F)(F)c1ccccc1 b82d1613bb51a527cd6b1f04ca4e7154 [0,1,0,0,0,0|2,0,0]=3 410 B16R1.10308 CC(C)(CF)NCS(=O)(=O)c1ccccc1 6d86f9190f7054bb8d224cd3d1e9ab45 [0,1,0,0,0,0|2,0,1]=4 411 B16R1.10308 CC(C)(CO)NCC(C)(C)c1ccccc1 6af5fed9301fa4db1cd79be6a3573acc [0,1,0,0,0,0|1,0,0]=2 412 B16R1.10308 CC(C)(CO)NCC(F)(F)c1ccccc1 21238aaa2b54362801bea1b266248d88 [0,1,0,0,0,0|1,0,0]=2 413 B16R1.10308 CC(C)(CO)NCS(=O)(=O)c1ccccc1 39be7d021a1975445714cf3ed9d79ddf [0,1,0,0,0,0|1,0,1]=3 414 B16R1.10467 C#CC(C)(C)NCC(O)c1ccccc1Cl 34c2212bfdeecc9bfc8b76572677e711 [0,1,0,0,0,0|1,0,1]=3 415 B16R1.10467 CC(C)(CF)NCC(=O)c1ccccc1Cl 0e04449768973209bf1e169c7e6aee15 [0,1,0,0,0,0|1,0,2]=4 416 B16R1.10467 CC(C)(CF)NCC(=O)c1ccccc1F 29f83edf028dd9b15ac73245a5e99fd9 [0,1,0,0,0,0|1,0,2]=4 417 B16R1.10467 CC(C)(CF)NCC(=O)c1ccccc1I c01d223bd3037c401a59038b9f413132 [0,1,0,0,0,0|1,0,2]=4 418 B16R1.10467 CC(C)(CO)NCC(=O)c1ccccc1Cl 50d74b2ff3518bf9b0709d808af9ba9d [0,1,0,0,0,0|0,0,2]=3 419 B16R1.10467 CC(C)(CO)NCC(=O)c1ccccc1F e0e744e5b170d6edffd47836707ed4a2 [0,1,0,0,0,0|0,0,2]=3 420 B16R1.10467 CC(C)(CO)NCC(=O)c1ccccc1I 0903bb186260571aac2827cbbeb09887 [0,1,0,0,0,0|0,0,2]=3 421 B16R1.10467 CC(C)(CO)NCC(=O)c1cccnc1Cl 56ea716af655b7aa6754908982f66e84 [0,1,0,0,0,0|1,0,2]=4 422 B16R1.10467 CC(C)(CO)NCC(=O)c1ncccc1F c487c566945a5e6cbc89601d26bf6f82 [0,1,0,0,0,0|1,0,2]=4 423 B16R1.10467 CC(C)(CO)NCC(O)c1ccccc1Cl fa8df0f76f52480baa7f5944a0174613 [0,1,0,0,0,0|0,0,0]=1 424 B16R1.10467 CC(NCC(C)(C)CO)c1ccccc1Cl 9710705cb1aa8a2dde3509daa35064e5 [0,1,0,0,0,0|3,0,0]=4 425 B16R1.10467 CC(NCC(C)(C)CO)c1ccccc1F 474a0f7631166e88987deec5e291a405 [0,1,0,0,0,0|3,0,0]=4 426 B16R1.10467 C[C@@H](NCC(C)(C)CO)c1ccccc1Cl 038b9604ac39ff936007ab217fbca438 [0,1,0,0,0,0|3,0,0]=4 427 B16R1.10467 C[C@@H](NCC(C)(C)CO)c1ccccc1F 2ee85a96daea5e9d8e4ce18bec2e822b [0,1,0,0,0,0|3,0,0]=4 428 B16R1.10467 C[C@H](NCC(C)(C)CO)c1ccccc1Cl af73984a61d7eaa5595e781714df4bcd [0,1,0,0,0,0|3,0,0]=4 429 B16R1.10467 C[C@H](NCC(C)(C)CO)c1ccccc1F 6698d0663c1b3d21dc6c99157a6849a4 [0,1,0,0,0,0|3,0,0]=4 430 B16R1.10467 Cc1ccccc1C(=O)CNC(C)(C)CF 39045559063246ef2216122ae070185e [0,1,0,0,0,0|1,0,2]=4 431 B16R1.10467 Cc1ccccc1C(=O)CNC(C)(C)CO c241a7b996a5ebbf00951e1ccce1ad63 [0,1,0,0,0,0|0,0,2]=3 432 B16R1.10467 Cc1ccccc1C(C)NCC(C)(C)CO 488bff1bc4e220915a84e0cfe6a0e1ed [0,1,0,0,0,0|3,0,0]=4 433 B16R1.10467 Cc1ccccc1[C@@H](C)NCC(C)(C)CO 0ce447dc87d2521a9cd2c746fd7634ca [0,1,0,0,0,0|3,0,0]=4 434 B16R1.10467 Cc1ccccc1[C@H](C)NCC(C)(C)CO 2a485bf2f4c55e68bce4aaa31872805e [0,1,0,0,0,0|3,0,0]=4 435 B16R1.10467 Cc1cccnc1C(=O)CNC(C)(C)CO b4b6b83decddffb91fc97ff94a1f20d3 [0,1,0,0,0,0|1,0,2]=4 436 B16R1.12439 C=C(CNC(C)(C)C(=O)O)c1ccccc1 d60c50290d6f0534b7b5fa11b473fb0b [0,1,0,0,0,0|1,0,2]=4 437 B16R1.12439 C=C(CNC(C)(C)C(C)C)c1ccccc1 570a895613debddfeabb5e351612e613 [0,1,0,0,0,0|2,0,1]=4 438 B16R1.12439 CC(=O)C(C)(C)NCC(C)c1ccccc1 de3ed20fc8ac559abeb6ae0616961891 [0,1,0,0,0,0|1,0,2]=4 439 B16R1.12439 CC(=O)C(C)(C)NCC(F)c1ccccc1 28118b2f73438b33b7719f93bf14a17e [0,1,0,0,0,0|1,0,2]=4 440 B16R1.12439 CC(=O)C(C)(C)NCC(O)c1ccccc1 2a0799c1c7f9ed077e5c5ec9d6f6fdcf [0,1,0,0,0,0|0,0,2]=3 441 B16R1.12439 CC(=O)C(C)(C)NC[C@@H](C)c1ccccc1 22c157cc948cd16333bd19b45823d759 [0,1,0,0,0,0|1,0,2]=4 442 B16R1.12439 CC(=O)C(C)(C)NC[C@@H](O)c1ccccc1 28b80418caf6b83cd39c4c9fdeeb1018 [0,1,0,0,0,0|0,0,2]=3 443 B16R1.12439 CC(=O)C(C)(C)NC[C@H](O)c1ccccc1 6982d2c6f40ab085657f4163ebe624a9 [0,1,0,0,0,0|0,0,2]=3 444 B16R1.12439 CC(C)(NCC(=O)c1ccccc1)C(=O)O 7550cd6f04990272b024d070071d0c2f [0,1,0,0,0,0|0,0,3]=4 445 B16R1.12439 CC(C)(NCC(F)c1ccccc1)C(=O)N c80d6db840d101c02b9425f9c18f505d [0,1,0,0,0,0|1,0,2]=4 446 B16R1.12439 CC(C)(NCC(F)c1ccccc1)C(=O)O 31d9457c15bf5604f2cdbcd648cc337a [0,1,0,0,0,0|1,0,1]=3 447 B16R1.12439 CC(C)(NCC(O)c1ccccc1)C(=O)N 7fb118d8931155051ccd64c250452e63 [0,1,0,0,0,0|0,0,2]=3 448 B16R1.12439 CC(C)(NCC(O)c1ccccc1)C(=O)O 87e5909a54eccce503103f5255bac84d [0,1,0,0,0,0|0,0,1]=2 449 B16R1.12439 CC(C)(NCC(O)c1cnccn1)C(=O)O 5afb9e8f222967cc16c9e3607aa8888d [0,1,0,0,0,0|2,0,1]=4 450 B16R1.12439 CC(C)(NCS(=O)c1ccccc1)C(=O)O 83b1bb67b75e7bf14dbc4359607542a8 [0,1,0,0,0,0|1,0,2]=4 451 B16R1.12439 CC(C)(NC[C@@H](O)c1ccccc1)C(=O)N af4119c9d11d8c7348d085e4a03f8622 [0,1,0,0,0,0|0,0,2]=3 452 B16R1.12439 CC(C)(NC[C@@H](O)c1ccccc1)C(=O)O cf0c76afe0d010d2c9afff928ef1c848 [0,1,0,0,0,0|0,0,1]=2 453 B16R1.12439 CC(C)(NC[C@H](O)c1ccccc1)C(=O)N 528411dcd06b2d303c7256034f8b0a56 [0,1,0,0,0,0|0,0,2]=3 454 B16R1.12439 CC(C)(NC[C@H](O)c1ccccc1)C(=O)O 65d8b9800a042037ceafc093c7802739 [0,1,0,0,0,0|0,0,1]=2 455 B16R1.12439 CC(C)C(C)(C)NCC(=O)c1ccccc1 7c41838429b3eb9c31fdbfa9e54d2149 [0,1,0,0,0,0|1,0,2]=4 456 B16R1.12439 CC(C)C(C)(C)NCC(O)c1ccccc1 988881bf285dfefa431f59068b2f251d [0,1,0,0,0,0|1,0,0]=2 457 B16R1.12439 CC(C)C(C)(C)NCC(O)c1cnccn1 e247d205f51c8cedff1388f06e5619d6 [0,1,0,0,0,0|3,0,0]=4 458 B16R1.12439 CC(C)C(C)(C)NC[C@@H](C)c1ccccc1 27f0c1fc3add3c749d0d6095e693c48a [0,1,0,0,0,0|2,0,0]=3 459 B16R1.12439 CC(CNC(C)(C)C(=O)N)c1ccccc1 b684b44be92bbf66d4b7f7fa852fde0f [0,1,0,0,0,0|1,0,2]=4 460 B16R1.12439 CC(CNC(C)(C)C(=O)O)c1ccccc1 d7ec692d03ca3cd09b17240b5c2ad956 [0,1,0,0,0,0|1,0,1]=3 461 B16R1.12439 CC(CNC(C)(C)C(C)C)c1ccccc1 1572562a2c61f31ac0cadfbf9dca0401 [0,1,0,0,0,0|2,0,0]=3 462 B16R1.12439 CC(CNC(C)(C)C(C)O)c1ccccc1 ef75b1eabd091a71bd73a9ef23b89881 [0,1,0,0,0,0|1,0,0]=2 463 B16R1.12439 CC(O)C(C)(C)NCC(=O)c1ccccc1 223cd0e6b81babe878c452ab5ba547a2 [0,1,0,0,0,0|0,0,2]=3 464 B16R1.12439 CC(O)C(C)(C)NCC(=O)c1ccccn1 853cf297fc345ca9d6ec8c208a251f44 [0,1,0,0,0,0|1,0,2]=4 465 B16R1.12439 CC(O)C(C)(C)NCC(=O)c1cccnc1 caf26866004be96384f9ef87eccb27c8 [0,1,0,0,0,0|1,0,2]=4 466 B16R1.12439 CC(O)C(C)(C)NCC(O)c1cnccn1 1f3c2846b89f055846241a1a29be81c5 [0,1,0,0,0,0|2,0,0]=3 467 B16R1.12439 CC(O)C(C)(C)NC[C@@H](C)c1ccccc1 f834ad7128cac9b91cafb2719cb31bc0 [0,1,0,0,0,0|1,0,0]=2 468 B16R1.12439 C[C@H](CNC(C)(C)C(=O)N)c1ccccc1 d2757caa5a147e97fdd2c9569590b9c3 [0,1,0,0,0,0|1,0,2]=4 469 B16R1.12439 C[C@H](CNC(C)(C)C(=O)O)c1ccccc1 48d59c16a058b64818dce2b9bd907ff1 [0,1,0,0,0,0|1,0,1]=3 470 B16R1.13675 C=C(CNC(C)(C)CCO)c1ccccc1 1f011fdaeddc8f342a41fc61c9271dd6 [0,1,0,0,0,0|1,0,1]=3 471 B16R1.13675 C=C(CNC(C)(C)CSC)c1ccccc1 6500beef2d33b3da9536d9691d95f7e2 [0,1,0,0,0,0|1,1,1]=4 472 B16R1.13675 CC(C)(CCO)NCC(=O)c1ccccc1 4f311da75ebcdc100bd8ca7c098211ed [0,1,0,0,0,0|0,0,2]=3 473 B16R1.13675 CC(C)(CCO)NCC(=O)c1ccccn1 573e5136f8667ec175123ad1b1b783c5 [0,1,0,0,0,0|1,0,2]=4 474 B16R1.13675 CC(C)(CCO)NCC(=O)c1cccnc1 254815f16579fa3377d056f7699a2456 [0,1,0,0,0,0|1,0,2]=4 475 B16R1.13675 CC(C)(CCO)NCC(F)c1ccccc1 c6a66c89cb5fec0c90697b98e7f2ef6b [0,1,0,0,0,0|1,0,0]=2 476 B16R1.13675 CC(C)(CCO)NCC(O)c1ccccc1 3a2d4906645f301a01bf166a00d48ca6 [0,1,0,0,0,0|0,0,0]=1 477 B16R1.13675 CC(C)(CCO)NCC(O)c1cnccn1 a053490762bafd541c140ee7d7f160f9 [0,1,0,0,0,0|2,0,0]=3 478 B16R1.13675 CC(C)(CCO)NCS(=O)c1ccccc1 3a4ed8604de3063826cd665c989df494 [0,1,0,0,0,0|1,0,1]=3 479 B16R1.13675 CC(C)(CCO)NC[C@@H](O)c1ccccc1 8e45eab7ddd228ea52ce3ac8811061b4 [0,1,0,0,0,0|0,0,0]=1 480 B16R1.13675 CC(C)(CCO)NC[C@H](O)c1ccccc1 6a8e9ea2cc40982e824c1d063b15e41e [0,1,0,0,0,0|0,0,0]=1 481 B16R1.13675 CC(CNC(C)(C)CCO)c1ccccc1 401a2f435ebe2c32f11cb8f036f3c1f6 [0,1,0,0,0,0|1,0,0]=2 482 B16R1.13675 COCC(C)(C)NCC(=O)c1ccccc1 feda86034aa40e04c48efa61806ae5ba [0,1,0,0,0,0|0,0,2]=3 483 B16R1.13675 COCC(C)(C)NCC(=O)c1ccccn1 4005fb1c0ac795943ff031a6e1a77756 [0,1,0,0,0,0|1,0,2]=4 484 B16R1.13675 COCC(C)(C)NCC(=O)c1cccnc1 2943d5883bd66cf71dcd84bd4a564675 [0,1,0,0,0,0|1,0,2]=4 485 B16R1.13675 COCC(C)(C)NCC(O)c1ccccc1 e8c13f1a59c8e79ae115aba1d7a7f253 [0,1,0,0,0,0|0,0,0]=1 486 B16R1.13675 COCC(C)(C)NCC(O)c1cnccn1 5408f7e1224f93535a85365fa95ffbcc [0,1,0,0,0,0|2,0,0]=3 487 B16R1.13675 CSCC(C)(C)NCC(=O)c1ccccc1 b4ea884ddfa5420940b4bc37d280de4f [0,1,0,0,0,0|0,1,2]=4 488 B16R1.13675 CSCC(C)(C)NCC(C)c1ccccc1 55683a8ce3cb2b403334283fad006941 [0,1,0,0,0,0|1,1,0]=3 489 B16R1.13675 CSCC(C)(C)NCC(F)c1ccccc1 35dc871ea710f637b8dd1f364cb35769 [0,1,0,0,0,0|1,1,0]=3 490 B16R1.13675 CSCC(C)(C)NCC(O)c1ccccc1 304479c50bde09f498635b1c193f61e4 [0,1,0,0,0,0|0,1,0]=2 491 B16R1.13675 CSCC(C)(C)NCC(O)c1cnccn1 6d49fd1b5bd698ad9d153a5c06691b25 [0,1,0,0,0,0|2,1,0]=4 492 B16R1.13675 CSCC(C)(C)NCS(=O)c1ccccc1 691ebeb9843f005e5ea8a0aab5433cce [0,1,0,0,0,0|1,1,1]=4 493 B16R1.13675 CSCC(C)(C)NC[C@@H](C)c1ccccc1 484e836e8a897d000da34f5e6396408c [0,1,0,0,0,0|1,1,0]=3 494 B16R1.13675 C[C@H](CNC(C)(C)CCO)c1ccccc1 3b83addf41c82e591a3eff86d8a2a501 [0,1,0,0,0,0|1,0,0]=2 495 B16R1.14311 C=CC(NCC(C)(C)CO)c1ccccc1 57902046b924e4a37c8541da9b366054 [0,1,0,0,0,0|3,0,0]=4 496 B16R1.14311 C=C[C@@H](NCC(C)(C)CO)c1ccccc1 6599d2f53efe5dab0d9db8f06ec8df45 [0,1,0,0,0,0|3,0,0]=4 497 B16R1.14311 C=C[C@H](NCC(C)(C)CO)c1ccccc1 504ab039061dab5bb6b0d81ca140314f [0,1,0,0,0,0|3,0,0]=4 498 B16R1.14311 CC(C)(CO)CNC(C#N)c1ccccc1 e6476785297da32b7ce13ba66f87b16a [0,1,0,0,0,0|3,0,0]=4 499 B16R1.14311 CC(C)(CO)CNC(C=O)c1ccccc1 c25d02b7cce8f74a6dfb507985b9b307 [0,1,0,0,0,0|2,0,1]=4 500 B16R1.14311 CC(C)(CO)CNC(CO)c1ccccc1 7f5c0a38dfc828e3504ca9df91127194 [0,1,0,0,0,0|2,0,0]=3 501 B16R1.14311 CC(C)(CO)CNC(CO)c1ccccn1 c2a82eebe8ff5155403380fc2600e202 [0,1,0,0,0,0|3,0,0]=4 502 B16R1.14311 CC(C)(CO)CNC(CO)c1cccnc1 ce4afa30aed71f2e4568b8fdd7d91aae [0,1,0,0,0,0|3,0,0]=4 503 B16R1.14311 CC(C)(CO)CNC(CO)c1ccncc1 ab9a53445ca00093c865bacb168f7505 [0,1,0,0,0,0|3,0,0]=4 504 B16R1.14311 CC(C)(CO)CN[C@@H](CF)c1ccccc1 77e660ff48fd8478ade586c5cdf7f260 [0,1,0,0,0,0|3,0,0]=4 505 B16R1.14311 CC(C)(CO)CN[C@@H](CO)c1ccccc1 223eeb8699c8e2b9babf342af798896b [0,1,0,0,0,0|2,0,0]=3 506 B16R1.14311 CC(C)(CO)CN[C@@H](CO)c1cccnc1 9fd785f7436b044e80ca53ed0d2e0099 [0,1,0,0,0,0|3,0,0]=4 507 B16R1.14311 CC(C)(CO)CN[C@H](CO)c1ccccc1 9a73a4d820cd3f10b024c95d63276c13 [0,1,0,0,0,0|2,0,0]=3 508 B16R1.14311 CC(C)(CO)CN[C@H](CO)c1cccnc1 ecb8ad5819cd17b063fb242ed3c6da50 [0,1,0,0,0,0|3,0,0]=4 509 B16R1.14311 CC(C)(CO)CN[C@H](CO)c1ccncc1 4c305f7ae9aec399affcabb9690345e6 [0,1,0,0,0,0|3,0,0]=4 510 B16R1.14311 CCC(NCC(C)(C)CO)c1ccccc1 5d85de10a2e63de9b0ce1ba67f65e21d [0,1,0,0,0,0|3,0,0]=4 511 B16R1.14311 CC[C@@H](NCC(C)(C)CO)c1ccccc1 e91750d5f59f7df818db7916afeafc0a [0,1,0,0,0,0|3,0,0]=4 512 B16R1.14311 CC[C@H](NCC(C)(C)CO)c1ccccc1 9b2913f152c6a45b7f551bc33ccdb4bc [0,1,0,0,0,0|3,0,0]=4 513 B16R2.3883 CC(C)(CO)CN1CC1c2ccccc2 4c3b46e404de6061b00b40bee6102e12 [0,0,0,1,0,0|3,0,0]=4 514 B16R2.3883 CC(C)(CO)CN1C[C@@H]1c2ccccc2 7358b3d358227dfd8f1a978df2bea4d3 [0,0,0,1,0,0|3,0,0]=4 515 B16R2.8201 CC(c1ccccc1)N2CC(C2)(C)CO 9850539c78223f76b3f5ed6fda50655d [0,0,0,1,0,0|3,0,0]=4 516 B16R2.8201 C[C@@H](c1ccccc1)N2CC(C2)(C)CO af82c2631644e2ea9038daa0df6154b9 [0,0,0,1,0,0|3,0,0]=4 517 B16R2.8201 C[C@H](c1ccccc1)N2CC(C2)(C)CO 1fd53effce716755d7328dc5f89974aa [0,0,0,1,0,0|3,0,0]=4 518 B16R2.8275 C#CC1(CC1)NCC(C)c2ccccc2 5876c45c855e2f243e0ea8b1c688b3cf [0,0,0,1,0,0|2,0,1]=4 519 B16R2.8275 C#CC1(CC1)NCC(F)c2ccccc2 994936bfd40a14698d3bfdf6de6f1d7d [0,0,0,1,0,0|2,0,1]=4 520 B16R2.8275 C#CC1(CC1)NCC(O)c2ccccc2 1a6b262f528a9958eeb4a324a58cf842 [0,0,0,1,0,0|1,0,1]=3 521 B16R2.8275 C#CC1(CC1)NC[C@@H](C)c2ccccc2 bdde70f1f0dddf676fe1609b2a0e2746 [0,0,0,1,0,0|2,0,1]=4 522 B16R2.8275 C=C(CNC1(CC1)CO)c2ccccc2 a14352f4de0a3092a6c4f6730977ae13 [0,0,0,1,0,0|1,0,1]=3 523 B16R2.8275 CC(CNC1(CC1)C#N)c2ccccc2 d2a8d34619461789bd356b09224f30ef [0,0,0,1,0,0|2,0,1]=4 524 B16R2.8275 CC(CNC1(CC1)CO)c2ccccc2 97b627bf0a7ced551aa492dd16c50f9f [0,0,0,1,0,0|1,0,0]=2 525 B16R2.8275 C[C@H](CNC1(CC1)C#N)c2ccccc2 550e2a8795d4f5e10aaf6bf601c8d3f8 [0,0,0,1,0,0|2,0,1]=4 526 B16R2.8275 C[C@H](CNC1(CC1)CO)c2ccccc2 2b965fae5ca5c18648d622aa30da1310 [0,0,0,1,0,0|1,0,0]=2 527 B16R2.8275 N#CC1(CC1)NCC(O)c2ccccc2 432fc4c20071a7e0db9de9475db115b2 [0,0,0,1,0,0|1,0,1]=3 528 B16R2.8275 O=C(CNC1(CC1)CO)c2ccccc2 151aa3d17fb8ec076e27201f59001449 [0,0,0,1,0,0|0,0,2]=3 529 B16R2.8275 O=C(CNC1(CC1)CO)c2ccccn2 b7bf7f2c802613cbe66497a9849b620a [0,0,0,1,0,0|1,0,2]=4 530 B16R2.8275 O=C(CNC1(CC1)CO)c2cccnc2 6b9f3b92869af174e11869b1435e3483 [0,0,0,1,0,0|1,0,2]=4 531 B16R2.8275 O=S(CNC1(CC1)CO)c2ccccc2 1667dc2e6824521be497042daa07cbe0 [0,0,0,1,0,0|1,0,1]=3 532 B16R2.8275 OCC1(CC1)NCC(F)c2ccccc2 125c8e395abc9791e92f85688a3548c9 [0,0,0,1,0,0|1,0,0]=2 533 B16R2.8275 OCC1(CC1)NCC(O)c2ccccc2 ef5414011313d9c90a458a018957605e [0,0,0,1,0,0|0,0,0]=1 534 B16R2.8275 OCC1(CC1)NCC(O)c2cnccn2 b5b97ebc73a72cd2ee634e164a105e14 [0,0,0,1,0,0|2,0,0]=3 535 B16R2.8275 OCC1(CC1)NC[C@@H](O)c2ccccc2 3659aafe66bf9980012d126988edd0b0 [0,0,0,1,0,0|0,0,0]=1 536 B16R2.8275 OCC1(CC1)NC[C@H](O)c2ccccc2 938c744a1d95e76870464477967eea4c [0,0,0,1,0,0|0,0,0]=1 537 B16R2.147299 C=C(CNC1(CCC1)C)c2ccccc2 4091c5cc55fe66d6ffb98c9dfa717a3b [0,0,0,1,0,0|2,0,1]=4 538 B16R2.147299 C=C(CNC1(CSC1)C)c2ccccc2 b9d7b6870e9120441c223b52b40bbe55 [0,0,0,1,0,0|1,1,1]=4 539 B16R2.147299 CC(CNC1(CCC1)C)c2ccccc2 3decb73dc3a3584e35b7304ab5e492aa [0,0,0,1,0,0|2,0,0]=3 540 B16R2.147299 CC(CNC1(COC1)C)c2ccccc2 0e3d694cbf646b4f369901c087f0e775 [0,0,0,1,0,0|1,0,0]=2 541 B16R2.147299 CC(CNC1(CSC1)C)c2ccccc2 25753df86301491a8113d7556a8eac97 [0,0,0,1,0,0|1,1,0]=3 542 B16R2.147299 CC(NCC1(COC1)C)c2ccccc2 6b15c4e3ddc3ae5a9df9bd25206880cc [0,0,0,1,0,0|3,0,0]=4 543 B16R2.147299 CC(OCC1(COC1)C)c2ccccc2 4d897940638fc92d81aedfe10b8e0367 [0,0,0,1,0,0|3,0,0]=4 544 B16R2.147299 CC1(CCC1)NCC(=O)c2ccccc2 210e53da3a176d9a5c47a1a54730e1b0 [0,0,0,1,0,0|1,0,2]=4 545 B16R2.147299 CC1(CCC1)NCC(F)c2ccccc2 ca9f28f64438512f7f0ba04831c9ba61 [0,0,0,1,0,0|2,0,0]=3 546 B16R2.147299 CC1(CCC1)NCC(O)c2ccccc2 266698fd2e601cc20988ac6423441190 [0,0,0,1,0,0|1,0,0]=2 547 B16R2.147299 CC1(CCC1)NCC(O)c2cnccn2 02f845094400b5b7deade6fe88dc9dd2 [0,0,0,1,0,0|3,0,0]=4 548 B16R2.147299 CC1(CCC1)NCS(=O)c2ccccc2 cc58c4fe7da23c237d034b9705b147da [0,0,0,1,0,0|2,0,1]=4 549 B16R2.147299 CC1(CCC1)NC[C@@H](O)c2ccccc2 fcf1c0d4fd359123ec32423a67b95ce0 [0,0,0,1,0,0|1,0,0]=2 550 B16R2.147299 CC1(CCC1)NC[C@H](O)c2ccccc2 1f3df8d90282886c6e4152a1373dc0d6 [0,0,0,1,0,0|1,0,0]=2 551 B16R2.147299 CC1(COC1)NCC(=O)c2ccccc2 b9f03440d2f254e90e835d9e8814e0f5 [0,0,0,1,0,0|0,0,2]=3 552 B16R2.147299 CC1(COC1)NCC(=O)c2ccccn2 196fd105f4377746abab8a1218834e21 [0,0,0,1,0,0|1,0,2]=4 553 B16R2.147299 CC1(COC1)NCC(=O)c2cccnc2 dad0f8a1f4db9839ec8ae4fddb7a3ed3 [0,0,0,1,0,0|1,0,2]=4 554 B16R2.147299 CC1(COC1)NCC(F)c2ccccc2 51c058194c64b6c075ec692faceb0895 [0,0,0,1,0,0|1,0,0]=2 555 B16R2.147299 CC1(COC1)NCC(O)c2ccccc2 c85f54c9d6a6fe925bc14706527a4013 [0,0,0,1,0,0|0,0,0]=1 556 B16R2.147299 CC1(COC1)NCC(O)c2cnccn2 c55b677ba6bbdc37206a8f26183ddd2c [0,0,0,1,0,0|2,0,0]=3 557 B16R2.147299 CC1(CSC1)NCC(=O)c2ccccc2 8a44a14f9ca2163f086e88f4fc3a9e29 [0,0,0,1,0,0|0,1,2]=4 558 B16R2.147299 CC1(CSC1)NCC(F)c2ccccc2 cbe7d9bf163140673e4763f8105fa7d8 [0,0,0,1,0,0|1,1,0]=3 559 B16R2.147299 CC1(CSC1)NCC(O)c2ccccc2 ef32770778e1c4025250b414889336d2 [0,0,0,1,0,0|0,1,0]=2 560 B16R2.147299 CC1(CSC1)NCC(O)c2cnccn2 2e5927bf61147f30b56ae3d23ab9ed88 [0,0,0,1,0,0|2,1,0]=4 561 B16R2.147299 CC1(CSC1)NCS(=O)c2ccccc2 8ff199bf89a9e1b1a2fa6650f9ffb25d [0,0,0,1,0,0|1,1,1]=4 562 B16R2.147299 CC1(CSC1)NC[C@@H](O)c2ccccc2 1b02500e39123e879490dc2c412db0d1 [0,0,0,1,0,0|0,1,0]=2 563 B16R2.147299 CC1(CSC1)NC[C@H](O)c2ccccc2 46754a2e82708d4758a2c8deb4ff2c62 [0,0,0,1,0,0|0,1,0]=2 564 B16R2.147299 C[C@@H](NCC1(COC1)C)c2ccccc2 899b88e4aaa5574e8a4e784ff8154b2b [0,0,0,1,0,0|3,0,0]=4 565 B16R2.147299 C[C@@H](OCC1(COC1)C)c2ccccc2 0614c91f77d00876aef184289b7bc494 [0,0,0,1,0,0|3,0,0]=4 566 B16R2.147299 C[C@H](CNC1(CCC1)C)c2ccccc2 7ae34f03c32f09541d84b7c3c2e196db [0,0,0,1,0,0|2,0,0]=3 567 B16R2.147299 C[C@H](CNC1(COC1)C)c2ccccc2 5e16b0feeb868571df2d76c19070e3b3 [0,0,0,1,0,0|1,0,0]=2 568 B16R2.147299 C[C@H](CNC1(CSC1)C)c2ccccc2 926b78c7b7c04126a416e981894c6f14 [0,0,0,1,0,0|1,1,0]=3 569 B16R2.147299 C[C@H](NCC1(COC1)C)c2ccccc2 139d347cc5d1ffebf8a3d7d562eaf1bc [0,0,0,1,0,0|3,0,0]=4 570 B16R2.147299 C[C@H](OCC1(COC1)C)c2ccccc2 9eb84d26ab81f11a1b71a05108cc0b96 [0,0,0,1,0,0|3,0,0]=4 571 B14R1.290 CC(C)(CF)NC(=O)c1ccccc1 84855feec6594250eb1fa0748b41c88b [0,0,0,0,1,0|1,0,2]=4 572 B14R1.290 CC(C)(CO)NC(=O)c1ccccc1 2e317e829a96ae3ad088e593c7d2e9e8 [0,0,0,0,1,0|0,0,2]=3 573 B14R1.290 CC(C)(CO)NC(=O)c1ccccn1 2b81ce44973562b5c8e615663f4cd22f [0,0,0,0,1,0|1,0,2]=4 574 B14R1.290 CC(C)(CO)NC(=O)c1cccnc1 162cbb43a618fadd1b74b080ff59dfbe [0,0,0,0,1,0|1,0,2]=4 575 B14R1.290 CC(C)(CO)NC(=O)c1ccncc1 9b221aaf131d06d06641f996929a81c0 [0,0,0,0,1,0|1,0,2]=4 576 B14R1.290 CCC(C)(C)NC(=O)c1ccccc1 9297896aed8981e8b05990ceec8bca03 [0,0,0,0,1,0|1,0,2]=4 577 B14R1.290 CN(CC(C)(C)CO)c1ccccc1 94e2dc11d9a6a4b7e24a455067709d9b [0,0,0,0,1,0|2,0,0]=3 578 B14R1.290 CN(CC(C)(C)CO)c1ccccn1 2f7a075b782912d5741da064792fa139 [0,0,0,0,1,0|3,0,0]=4 579 B14R1.290 CN(CC(C)(C)CO)c1cccnc1 acc9b824105872d5e84ae65681ddd709 [0,0,0,0,1,0|3,0,0]=4 580 B14R1.290 CN(CC(C)(C)CO)c1ccncc1 cebab8e0e7435f958d02cfad4097ebb5 [0,0,0,0,1,0|3,0,0]=4 581 B14R1.301 CC(C)(CO)NCC(=O)c1ccco1 afc6aef48379d1467c3e0b5fb266ef8d [0,0,0,0,1,0|1,0,2]=4 582 B14R1.301 CC(C)(CO)NCC(=O)c1cccs1 78e3912c1c710c921b5b36a481961246 [0,0,0,0,1,0|1,0,2]=4 583 B14R1.301 CC(C)(CO)NCC(=O)c1ccsc1 602373ec5db7c2a8a30503e5e2e37abb [0,0,0,0,1,0|1,0,2]=4 584 B16R1.355 C#CC(C)(C)NCCC(C)c1ccccc1 c44153f4f1e325bb4b1a94cf7909226b [0,0,0,0,0,1|2,0,1]=4 585 B16R1.355 C#CC(C)(C)NCCC(O)c1ccccc1 99846682447275113470d3113c155e89 [0,0,0,0,0,1|1,0,1]=3 586 B16R1.355 C#CC(C)(C)NCC[C@@H](O)c1ccccc1 b2e90cfb23d01fa52a2d4d5447a2801d [0,0,0,0,0,1|1,0,1]=3 587 B16R1.355 C#CC(C)(C)NCC[C@H](O)c1ccccc1 f961495a1401280496153b80180f207c [0,0,0,0,0,1|1,0,1]=3 588 B16R1.355 C=C(CNCC(C)(C)CF)c1ccccc1 ad2b185c26b29d8c553624d76ad3abea [0,0,0,0,0,1|2,0,1]=4 589 B16R1.355 C=C(CNCC(C)(C)CO)c1ccccc1 bf985ebeb6b30ce2d2976520b89fc6cc [0,0,0,0,0,1|1,0,1]=3 590 B16R1.355 CC(C)(C#N)CNCC(F)c1ccccc1 36b2c79f5d64bdceac72d6a6bd62505c [0,0,0,0,0,1|2,0,1]=4 591 B16R1.355 CC(C)(C#N)CNCC(O)c1ccccc1 a5c686fea5b33c1766000ef40e500f81 [0,0,0,0,0,1|1,0,1]=3 592 B16R1.355 CC(C)(C#N)CNCC(O)c1ccccn1 1ac0d2d6a060ac5b2a18404f522747c9 [0,0,0,0,0,1|2,0,1]=4 593 B16R1.355 CC(C)(C#N)CNCC(O)c1cccnc1 179357d063589d20b586ecfaa2d523b7 [0,0,0,0,0,1|2,0,1]=4 594 B16R1.355 CC(C)(C#N)CNCC(O)c1ccncc1 e88151eda6b27e75829473917e640b31 [0,0,0,0,0,1|2,0,1]=4 595 B16R1.355 CC(C)(C#N)NCCC(O)c1ccccc1 819980ce325b7d764f05a5ce53a6c164 [0,0,0,0,0,1|1,0,1]=3 596 B16R1.355 CC(C)(C#N)NCC[C@@H](O)c1ccccc1 ad282f7bc0658f77a36d427ae6f4a2fd [0,0,0,0,0,1|1,0,1]=3 597 B16R1.355 CC(C)(C#N)NCC[C@H](O)c1ccccc1 98b37b20272f6e51f2dc51dcfb3e74cf [0,0,0,0,0,1|1,0,1]=3 598 B16R1.355 CC(C)(CF)CNCC(=O)c1ccccc1 86af244a0d6272c9d9d05c89f54348fd [0,0,0,0,0,1|1,0,2]=4 599 B16R1.355 CC(C)(CF)CNCC(F)c1ccccc1 6689c2aefd96aa7d04192f503f4e2104 [0,0,0,0,0,1|2,0,0]=3 600 B16R1.355 CC(C)(CF)CNCC(O)c1ccccc1 b67ca7e59747820186b4c5b73fbdab8e [0,0,0,0,0,1|1,0,0]=2 601 B16R1.355 CC(C)(CF)CNCC(O)c1cnccn1 5b5b15cd8cb5fbdfa77f89b18a475043 [0,0,0,0,0,1|3,0,0]=4 602 B16R1.355 CC(C)(CF)CNCS(=O)c1ccccc1 98cea0e4ebafc293b519114b30bc2c1e [0,0,0,0,0,1|2,0,1]=4 603 B16R1.355 CC(C)(CF)NCOC(=O)c1ccccc1 d97d57cb591857923d46ea81c2698aa2 [0,0,0,0,0,1|1,0,2]=4 604 B16R1.355 CC(C)(CO)CNCC(=O)c1ccccc1 cfa3d345f416c8e5a0f8b12ea3439b25 [0,0,0,0,0,1|0,0,2]=3 605 B16R1.355 CC(C)(CO)CNCC(=O)c1ccccn1 9ee5a5af34d38fdfdc628330362f957b [0,0,0,0,0,1|1,0,2]=4 606 B16R1.355 CC(C)(CO)CNCC(=O)c1cccnc1 89eebb5d14abc81d7c09adbe6e260564 [0,0,0,0,0,1|1,0,2]=4 607 B16R1.355 CC(C)(CO)CNCC(F)c1ccccc1 352a58c4f2bf3bb6a07690c52ed0d996 [0,0,0,0,0,1|1,0,0]=2 608 B16R1.355 CC(C)(CO)CNCC(O)c1ccccc1 753daf443127d0af1502db4f6cfc10a7 [0,0,0,0,0,1|0,0,0]=1 609 B16R1.355 CC(C)(CO)CNCC(O)c1ccccn1 0da0f269c6addfa975311aeeb3a92647 [0,0,0,0,0,1|1,0,0]=2 610 B16R1.355 CC(C)(CO)CNCC(O)c1cccnc1 b0dc2297818f2b28aa1d8d3de902a57c [0,0,0,0,0,1|1,0,0]=2 611 B16R1.355 CC(C)(CO)CNCC(O)c1ccncc1 ba276ea191352c0efa41c489ac7fea3a [0,0,0,0,0,1|1,0,0]=2 612 B16R1.355 CC(C)(CO)CNCC(O)c1cnccn1 034d6e28c80adcd5fc9267910a12b166 [0,0,0,0,0,1|2,0,0]=3 613 B16R1.355 CC(C)(CO)NCCC(=O)c1ccccc1 0de1dacfd2f3b6f9e7873e5735749616 [0,0,0,0,0,1|0,0,2]=3 614 B16R1.355 CC(C)(CO)NCCC(O)c1ccccc1 e5812ce9d4adccede85d3d5a3ecb13a0 [0,0,0,0,0,1|0,0,0]=1 615 B16R1.355 CC(C)(CO)NCC[C@@H](O)c1ccccc1 61e1ea3ab343c6bcf72dc724eeba89dc [0,0,0,0,0,1|0,0,0]=1 616 B16R1.355 CC(C)(CO)NCC[C@H](O)c1ccccc1 b1a7881d7423db48e4eefb150dd2159d [0,0,0,0,0,1|0,0,0]=1 617 B16R1.355 CC(C)(CO)NCOC(=O)c1ccccc1 ea5bf1421842b7c58190eb55f97443de [0,0,0,0,0,1|0,0,2]=3 618 B16R1.355 CC(CCNC(C)(C)C#N)c1ccccc1 66e32a6b4a5936b8c3787d9255a6bc85 [0,0,0,0,0,1|2,0,1]=4 619 B16R1.355 CC(CCNC(C)(C)CO)c1ccccc1 ce90610665addef1cbe5b1d10f52bcf0 [0,0,0,0,0,1|1,0,0]=2 620 B16R1.355 CC(CNCC(C)(C)C#N)c1ccccc1 783bf86e04a30022c9a8f9597e03ded5 [0,0,0,0,0,1|2,0,1]=4 621 B16R1.355 CC(CNCC(C)(C)CF)c1ccccc1 0a9a7bca832fe5c8c72eaa861c79039c [0,0,0,0,0,1|2,0,0]=3 622 B16R1.355 CC(CNCC(C)(C)CO)c1ccccc1 5a57736e61c220bdeeda877494c544a8 [0,0,0,0,0,1|1,0,0]=2 623 B16R1.355 CC(CNCC(F)(F)CO)c1ccccc1 b22978abcf46c2f9a2d433a86b796f48 [0,0,0,0,0,1|3,0,0]=4 624 B16R1.355 CC(COCC(C)(C)CF)c1ccccc1 cc8e570cf8e45f4c3a521387f1bea524 [0,0,0,0,0,1|3,0,0]=4 625 B16R1.355 CCC(C)(C)CCNC(C)c1ccccc1 85c336a95d2a621acda55af5476dc3d3 [0,0,0,0,0,1|3,0,0]=4 626 B16R1.355 CCC(C)(C)CCN[C@@H](C)c1ccccc1 4babd9a1874ffaeba1e7dd5c8dd19291 [0,0,0,0,0,1|3,0,0]=4 627 B16R1.355 CCC(C)(C)CCN[C@H](C)c1ccccc1 b1b20c2b4393132b0003c8efb2a2dd75 [0,0,0,0,0,1|3,0,0]=4 628 B16R1.355 CCC(C)(C)CCOC(C)c1ccccc1 c1f35c6b99886f9b0097a8d047c81eb5 [0,0,0,0,0,1|3,0,0]=4 629 B16R1.355 CCC(C)(C)CCO[C@@H](C)c1ccccc1 6143153d0f80577219030c472fd868af [0,0,0,0,0,1|3,0,0]=4 630 B16R1.355 CCC(C)(C)CCO[C@H](C)c1ccccc1 30d4afd80899fa7a627304b47da48d27 [0,0,0,0,0,1|3,0,0]=4 631 B16R1.355 CCC(C)(C)CNCC(=O)c1ccccc1 45496d7849c9484cca8785284dd00999 [0,0,0,0,0,1|1,0,2]=4 632 B16R1.355 CCC(C)(C)CNCC(O)c1cnccn1 e2df057e00f34a55ff608e08a718268e [0,0,0,0,0,1|3,0,0]=4 633 B16R1.355 CCC(C)(C)NCCN(C)c1ccccc1 9b6c7be36c1a1ffd4275cc373d148f05 [0,0,0,0,0,1|3,0,0]=4 634 B16R1.355 CN(CCNC(C)(C)CF)c1ccccc1 0ed385c7dff536c5856111667f35d40b [0,0,0,0,0,1|3,0,0]=4 635 B16R1.355 CN(CCNC(C)(C)CO)c1ccccc1 d0a80395d3b345f8d32f9973f651999a [0,0,0,0,0,1|2,0,0]=3 636 B16R1.355 COC(C)(C)CNCC(C)c1ccccc1 0ca04f210c4a54ea5e129568a09d548c [0,0,0,0,0,1|3,0,0]=4 637 B16R1.355 COC(C)(C)CNCC(F)c1ccccc1 1c6da7bd2d5c718d05381e2b8042d9c0 [0,0,0,0,0,1|3,0,0]=4 638 B16R1.355 COC(C)(C)CNCC(O)c1ccccc1 4028768701a5b293d05b9f0389dff13a [0,0,0,0,0,1|2,0,0]=3 639 B16R1.355 COC(C)(C)CNCC(O)c1ccccn1 aa86341079f0e22147c77f0eeeb3b9b2 [0,0,0,0,0,1|3,0,0]=4 640 B16R1.355 COC(C)(C)CNCC(O)c1cccnc1 e2e085a0a83db2615ad9fcab6d2e97f5 [0,0,0,0,0,1|3,0,0]=4 641 B16R1.355 COC(C)(C)CNCC(O)c1ccncc1 6534ff4d9dfcaa41faedf9943cf09b15 [0,0,0,0,0,1|3,0,0]=4 642 B16R1.355 COC(C)(C)CNC[C@@H](C)c1ccccc1 97c4edd11a8dc6f0964bd1687887dc4c [0,0,0,0,0,1|3,0,0]=4 643 B16R1.355 C[C@@H](CNCC(C)(C)CO)c1ccccc1 2efffe7f3a3024a9fe8d2c35879cb2c4 [0,0,0,0,0,1|1,0,0]=2 644 B16R1.355 C[C@H](CNCC(C)(C)C#N)c1ccccc1 c39ef26d2d74fe9bc4e788e272e0228e [0,0,0,0,0,1|2,0,1]=4 645 B16R1.355 C[C@H](CNCC(C)(C)CF)c1ccccc1 7576e43e91e4923fb5c68b2799fde161 [0,0,0,0,0,1|2,0,0]=3 646 B16R1.355 C[C@H](CNCC(C)(C)CO)c1ccccc1 5610fd0677387ee8d19ce82a7137ce77 [0,0,0,0,0,1|1,0,0]=2 647 B16R1.355 C[C@H](CNCC(F)(F)CO)c1ccccc1 f376f926d99641a4ee35eba5c64af9d3 [0,0,0,0,0,1|3,0,0]=4 648 B16R1.355 C[C@H](COCC(C)(C)CF)c1ccccc1 8da55902b6f0d975e2177411e60d2ed3 [0,0,0,0,0,1|3,0,0]=4 649 B16R1.355 OCC(F)(F)CNCC(F)c1ccccc1 59b04f2406cbd619a75fb2ea77d243e0 [0,0,0,0,0,1|3,0,0]=4 650 B16R1.355 OCC(F)(F)CNCC(O)c1ccccc1 13ed22a467bc45eb5c5eb2de2d01b661 [0,0,0,0,0,1|2,0,0]=3 651 B16R1.360 C#CC(C)(C)NCC(O)Cc1ccccc1 1106e6602be0003dc29263e82bf4f9ea [0,0,0,0,0,1|1,0,1]=3 652 B16R1.360 C#CC(C)(C)NC[C@@H](O)Cc1ccccc1 ef62a6b0b314c40efeb93cd935954426 [0,0,0,0,0,1|1,0,1]=3 653 B16R1.360 CC(C)(CF)NCC(=O)Cc1ccccc1 8604616ae652f70394415c110f72c8fe [0,0,0,0,0,1|1,0,2]=4 654 B16R1.360 CC(C)(CF)NCC(=O)Oc1ccccc1 f94593d192605ed99c2f0e73714a0492 [0,0,0,0,0,1|1,0,2]=4 655 B16R1.360 CC(C)(CO)NCC(=O)Cc1ccccc1 185cf79f58599fac6c9d87f4f86a0b7b [0,0,0,0,0,1|0,0,2]=3 656 B16R1.360 CC(C)(CO)NCC(=O)Nc1ccccc1 9c5e5c7d507a3bc84ea476a0542e9fee [0,0,0,0,0,1|0,0,2]=3 657 B16R1.360 CC(C)(CO)NCC(=O)Nc1ccccn1 a3a6e3a570d8e7d8494070b92e1055a5 [0,0,0,0,0,1|1,0,2]=4 658 B16R1.360 CC(C)(CO)NCC(=O)Nc1ccncc1 ed1159845f0427edbed78912437bf210 [0,0,0,0,0,1|1,0,2]=4 659 B16R1.360 CC(C)(CO)NCC(=O)Oc1ccccc1 bf1e3872141aedaac5903e789ccca572 [0,0,0,0,0,1|0,0,2]=3 660 B16R1.360 CC(C)(CO)NCC(O)Cc1ccccc1 0ee037f59b6311dc95a708f11a62a5e5 [0,0,0,0,0,1|0,0,0]=1 661 B16R1.360 CC(C)(CO)NC[C@@H](O)Cc1ccccc1 710bac1087a61735e568516d8d6be095 [0,0,0,0,0,1|0,0,0]=1 662 B13R1.24 C#CCNCC(O)c1ccccc1 afa6fa5ca3081967ccb997fe705cc38b [2,0,0,0,0,0|1,0,1]=4 663 B13R1.24 C#CCNC[C@@H](O)c1ccccc1 d6b3419b55e45804f1d59ae98d25b79b [2,0,0,0,0,0|1,0,1]=4 664 B13R1.24 C#CCNC[C@H](O)c1ccccc1 4f33ea3b3b460ac5590bf8f9cf9b6cf6 [2,0,0,0,0,0|1,0,1]=4 665 B13R1.24 C=C(CNCCO)c1ccccc1 16fe9e8143270f45529b13ec424ecd13 [2,0,0,0,0,0|1,0,1]=4 666 B13R1.24 C=CCNCC(O)c1ccccc1 8a35af8d17b4b23aa37be42bb7c9d7da [2,0,0,0,0,0|1,0,1]=4 667 B13R1.24 C=CCNC[C@@H](O)c1ccccc1 d169a800c8ea662a0ff9c59ff398721c [2,0,0,0,0,0|1,0,1]=4 668 B13R1.24 C=CCNC[C@H](O)c1ccccc1 dbe7329dc0d67db2ae4cf944ac67373c [2,0,0,0,0,0|1,0,1]=4 669 B13R1.24 CC(CNCCBr)c1ccccc1 bf40bf3fe2d21f3c581769dcee162cd2 [2,0,0,0,0,0|2,0,0]=4 670 B13R1.24 CC(CNCCF)c1ccccc1 7e6fcac42049d640d2996b526815a648 [2,0,0,0,0,0|2,0,0]=4 671 B13R1.24 CC(CNCCI)c1ccccc1 809c8b497618c97249044faebb603602 [2,0,0,0,0,0|2,0,0]=4 672 B13R1.24 CC(CNCCO)c1ccccc1 94b2c9ef07b25f704078b27481cae9d7 [2,0,0,0,0,0|1,0,0]=3 673 B13R1.24 CC(CNCCS)c1ccccc1 694eb601575463f3d630b1250827a8a6 [2,0,0,0,0,0|1,1,0]=4 674 B13R1.24 CCCNCC(C)c1ccccc1 5b9cbaa046214e464daaab40bbcd3312 [2,0,0,0,0,0|2,0,0]=4 675 B13R1.24 CCCNCC(F)c1ccccc1 449b2015434bbd5b2836355939132d1a [2,0,0,0,0,0|2,0,0]=4 676 B13R1.24 CCCNCC(O)c1ccccc1 d38eaae1b19c710adc21500685b8cd9a [2,0,0,0,0,0|1,0,0]=3 677 B13R1.24 CCCNCC(O)c1ccccn1 19ce185a02a8a1325d6c69f94c6b75db [2,0,0,0,0,0|2,0,0]=4 678 B13R1.24 CCCNCC(O)c1cccnc1 ae0ac118e936f7cb2d5ebc8e1d7b2bec [2,0,0,0,0,0|2,0,0]=4 679 B13R1.24 CCCNCC(O)c1ccncc1 77561eb712726d224e80da4ffd36fa24 [2,0,0,0,0,0|2,0,0]=4 680 B13R1.24 CCCNC[C@@H](C)c1ccccc1 2308071747b02f56b924597b3ca017fa [2,0,0,0,0,0|2,0,0]=4 681 B13R1.24 CCCNC[C@@H](O)c1ccccc1 ba1c94e938904bb5f8f256428bfd49c0 [2,0,0,0,0,0|1,0,0]=3 682 B13R1.24 CCCNC[C@H](C)c1ccccc1 a93645e2df2d6a08f03c1dad967aea05 [2,0,0,0,0,0|2,0,0]=4 683 B13R1.24 CCCNC[C@H](O)c1ccccc1 100bd33b1479296525e93adedc4476d6 [2,0,0,0,0,0|1,0,0]=3 684 B13R1.24 COCNCC(O)c1ccccc1 065ed39397a57935c54004af38914e1d [2,0,0,0,0,0|2,0,0]=4 685 B13R1.24 COCNC[C@@H](O)c1ccccc1 99f245690db50bc87571291f7a525272 [2,0,0,0,0,0|2,0,0]=4 686 B13R1.24 COCNC[C@H](O)c1ccccc1 f07ee66c3ed1bc3a22b8d380d72f19ab [2,0,0,0,0,0|2,0,0]=4 687 B13R1.24 CSCNCC(O)c1ccccc1 510d27c64a6763f59907d1415781445d [2,0,0,0,0,0|2,0,0]=4 688 B13R1.24 CSCNC[C@@H](O)c1ccccc1 846e48584412a12fbb2838d0dab12dc8 [2,0,0,0,0,0|2,0,0]=4 689 B13R1.24 CSCNC[C@H](O)c1ccccc1 610ded1cda0391fbd3f816ce595d11db [2,0,0,0,0,0|2,0,0]=4 690 B13R1.24 C[C@@H](CNCCF)c1ccccc1 f80f5e9c9fa4d04cbb54f3fb3e6f7bb6 [2,0,0,0,0,0|2,0,0]=4 691 B13R1.24 C[C@@H](CNCCO)c1ccccc1 1f27c1e40a5781f555c0013d3f72bc8c [2,0,0,0,0,0|1,0,0]=3 692 B13R1.24 C[C@@H](CNCCS)c1ccccc1 841a623e2b9fa226364a37948b51e918 [2,0,0,0,0,0|1,1,0]=4 693 B13R1.24 C[C@H](CNCCBr)c1ccccc1 94329264b3e0f8607112d3544dc3a4dd [2,0,0,0,0,0|2,0,0]=4 694 B13R1.24 C[C@H](CNCCF)c1ccccc1 2b984b754dfcda5cb1f2b232f72ccbf4 [2,0,0,0,0,0|2,0,0]=4 695 B13R1.24 C[C@H](CNCCI)c1ccccc1 35dc7c64f97f43d550f904b1c7152fee [2,0,0,0,0,0|2,0,0]=4 696 B13R1.24 C[C@H](CNCCO)c1ccccc1 95217ad922337e4b6f106b8b81119245 [2,0,0,0,0,0|1,0,0]=3 697 B13R1.24 C[C@H](CNCCS)c1ccccc1 c5d3a1119e994926c63b3fd0f972c506 [2,0,0,0,0,0|1,1,0]=4 698 B13R1.24 FC(CNCCBr)c1ccccc1 ffbd02c1ec22ab19b84180ae596b7e25 [2,0,0,0,0,0|2,0,0]=4 699 B13R1.24 FC(CNCCI)c1ccccc1 e9a2b55380dec5a7dfed2f2b59b84230 [2,0,0,0,0,0|2,0,0]=4 700 B13R1.24 FC(CNCCS)c1ccccc1 e953c2b26e038196e82835882e1cbb43 [2,0,0,0,0,0|1,1,0]=4 701 B13R1.24 FCCNCC(F)c1ccccc1 cf2604b7778e986fbff9472a0d62c960 [2,0,0,0,0,0|2,0,0]=4 702 B13R1.24 N#CCNCC(O)c1ccccc1 db17acf792398d601d32f16c6f939c56 [2,0,0,0,0,0|1,0,1]=4 703 B13R1.24 N#CCNC[C@@H](O)c1ccccc1 f51380211917b5780125ad007bc10884 [2,0,0,0,0,0|1,0,1]=4 704 B13R1.24 N#CCNC[C@H](O)c1ccccc1 d5f7f6e77d0e65ae9057ea5f368ec8bf [2,0,0,0,0,0|1,0,1]=4 705 B13R1.24 O=C(CNCCO)c1ccccc1 60fc64e7dfba65baef92157ef0478d91 [2,0,0,0,0,0|0,0,2]=4 706 B13R1.24 O=CCNCC(O)c1ccccc1 f246a0990a3fdf412d15425a8336366a [2,0,0,0,0,0|0,0,2]=4 707 B13R1.24 O=CCNC[C@@H](O)c1ccccc1 af3276fcb590452e8b5cae33679c8070 [2,0,0,0,0,0|0,0,2]=4 708 B13R1.24 O=CCNC[C@H](O)c1ccccc1 3b491d2cb4349b824b5d86c70adae302 [2,0,0,0,0,0|0,0,2]=4 709 B13R1.24 O=S(CNCCO)c1ccccc1 21f18b039d87e4b92740168838eac34d [2,0,0,0,0,0|1,0,1]=4 710 B13R1.24 OC(CNCCBr)c1ccccc1 896601dbc217c1c45c8f685191b44a7f [2,0,0,0,0,0|1,0,0]=3 711 B13R1.24 OC(CNCCF)c1ccccc1 31a6285c54121b191791d804c462964b [2,0,0,0,0,0|1,0,0]=3 712 B13R1.24 OC(CNCCF)c1ccccn1 ef21b6161cf4dccf28de43da46d8c8bc [2,0,0,0,0,0|2,0,0]=4 713 B13R1.24 OC(CNCCF)c1cccnc1 ca9e1c35a52a363f695fc7765299e636 [2,0,0,0,0,0|2,0,0]=4 714 B13R1.24 OC(CNCCF)c1ccncc1 bf559639a64f7b9fd59b7beb9b707eb9 [2,0,0,0,0,0|2,0,0]=4 715 B13R1.24 OC(CNCCI)c1ccccc1 09fc842e23ff6591276d0bf34e258b9a [2,0,0,0,0,0|1,0,0]=3 716 B13R1.24 OC(CNCCS)c1ccccc1 b1791679d5e010ccd60596c52ed24116 [2,0,0,0,0,0|0,1,0]=3 717 B13R1.24 OC(CNCCS)c1ccccn1 7e568a4cc675c8a94fc7d3a16df98996 [2,0,0,0,0,0|1,1,0]=4 718 B13R1.24 OC(CNCCS)c1cccnc1 42c5b740a672816640be74ef4141c552 [2,0,0,0,0,0|1,1,0]=4 719 B13R1.24 OC(CNCCS)c1ccncc1 7e9a0d7e8cb971015ef7ac72a8d6b893 [2,0,0,0,0,0|1,1,0]=4 720 B13R1.24 OCCNCC(F)c1ccccc1 c80ba370153a87927244587c4f7cd93d [2,0,0,0,0,0|1,0,0]=3 721 B13R1.24 OCCNCC(O)c1ccccc1 acf4a9260f4ea573a1af24dca8fdcfb9 [2,0,0,0,0,0|0,0,0]=2 722 B13R1.24 OCCNCC(O)c1ccccn1 66101ccb618d3c93993ec8b835d8d2c3 [2,0,0,0,0,0|1,0,0]=3 723 B13R1.24 OCCNCC(O)c1cccnc1 7e9f0e67e596d0a8f0ee45ad709766a3 [2,0,0,0,0,0|1,0,0]=3 724 B13R1.24 OCCNCC(O)c1ccncc1 adcf40806236ef36310e31e9b79cab61 [2,0,0,0,0,0|1,0,0]=3 725 B13R1.24 OCCNCC(O)c1cnccn1 19b114ded2ee1ac7c8b9d31a7991fff0 [2,0,0,0,0,0|2,0,0]=4 726 B13R1.24 OCCNC[C@@H](O)c1ccccc1 2db31fd01bec3e4b9cd289e5820eab50 [2,0,0,0,0,0|0,0,0]=2 727 B13R1.24 OCCNC[C@H](O)c1ccccc1 e4e021aba2fa7e6ada44e3621e0c2a23 [2,0,0,0,0,0|0,0,0]=2 728 B13R1.24 OCNCCC(O)c1ccccc1 4ee45296d60f4d0bf5cad0061fc06381 [2,0,0,0,0,0|2,0,0]=4 729 B13R1.24 OCNCC[C@@H](O)c1ccccc1 3a782370b23e7457c065c9fd6b4d51fe [2,0,0,0,0,0|2,0,0]=4 730 B13R1.24 OCNCC[C@H](O)c1ccccc1 ca2c26a32a78f6014b8840a23956c5eb [2,0,0,0,0,0|2,0,0]=4 731 B13R1.24 O[C@@H](CNCCF)c1ccccc1 694f7c9308bd34297b9ff90f9cec952b [2,0,0,0,0,0|1,0,0]=3 732 B13R1.24 O[C@@H](CNCCS)c1ccccc1 d6a7f9c6e6a3d1be1b02cb86b9baad2d [2,0,0,0,0,0|0,1,0]=3 733 B13R1.24 O[C@H](CNCCF)c1ccccc1 774bdce8e92b2e0c9ab91c9c2c882957 [2,0,0,0,0,0|1,0,0]=3 734 B13R1.24 O[C@H](CNCCS)c1ccccc1 4e112c01042cd269c0529c1eaad18a78 [2,0,0,0,0,0|0,1,0]=3 735 B13R1.45 CC(=O)NCC(O)c1ccccc1 338fd8ffb5a5b3263ec1b7d66185bbe1 [2,0,0,0,0,0|0,0,2]=4 736 B13R1.45 CC(=O)NC[C@@H](O)c1ccccc1 63185760d23ecc3a7db9fda738b2ead6 [2,0,0,0,0,0|0,0,2]=4 737 B13R1.45 CC(=O)NC[C@H](O)c1ccccc1 1a789d2dbdb75e4d6d04d7189c08238f [2,0,0,0,0,0|0,0,2]=4 738 B13R1.45 CC(C)NCC(=O)c1ccccc1 e4ded4d81dacb28522b7b23f367a5817 [2,0,0,0,0,0|0,0,2]=4 739 B13R1.45 CC(C)NCC(O)c1ccccn1 b8e7bb67a47895ae90dd5feb96033573 [2,0,0,0,0,0|1,0,0]=3 740 B13R1.45 CC(C)NCC(O)c1cccnc1 3c3a14a062dfddc6f0ca412ad3efbcba [2,0,0,0,0,0|1,0,0]=3 741 B13R1.45 CC(C)NCC(O)c1ccncc1 4ae4c0fe61339ec9e186d35b4bbdc248 [2,0,0,0,0,0|1,0,0]=3 742 B13R1.45 CC(C)OCC(C)c1ccccc1 ec931c631196ee710bfc24252b11b1e8 [2,0,0,0,0,0|2,0,0]=4 743 B13R1.45 CC(C)OC[C@@H](C)c1ccccc1 dc86bab03a7acc808db6858717777ba4 [2,0,0,0,0,0|2,0,0]=4 744 B13R1.718 C#CC(C)NCCc1ccccc1 2c8d145f05d337c5583fb92a59a977f3 [2,0,0,0,0,0|1,0,1]=4 745 B13R1.718 C#C[C@@H](C)NCCc1ccccc1 f689b53bc0096babd332bbdd9b580f5c [2,0,0,0,0,0|1,0,1]=4 746 B13R1.718 C#C[C@H](C)NCCc1ccccc1 c2c8a94b54a28eae255c4c75946be3f5 [2,0,0,0,0,0|1,0,1]=4 747 B13R1.718 C=CC(C)NCCc1ccccc1 85c7749c79d31c16f0650eadc1b41e4c [2,0,0,0,0,0|1,0,1]=4 748 B13R1.718 CC(C#N)NCCc1ccccc1 e419384d24d209b8092563a987296f12 [2,0,0,0,0,0|1,0,1]=4 749 B13R1.718 CC(C=O)NCCc1ccccc1 369aedf3fd977678630d6ac85371f8c9 [2,0,0,0,0,0|0,0,2]=4 750 B13R1.718 CC(CF)OCCc1ccccc1 10dacae2642b054565528321a819e915 [2,0,0,0,0,0|2,0,0]=4 751 B13R1.718 CC(CO)CCNc1ccccc1 4d37090ae4c8c4516bf50e1daccfb4da [2,0,0,0,0,0|2,0,0]=4 752 B13R1.718 CC(CO)CNCc1ccccc1 a8ab15a9d308f0c4a33f134b0e8343dd [2,0,0,0,0,0|2,0,0]=4 753 B13R1.718 CC(CO)NCCc1ccccc1 ca980b8870daab798e4fdf7c12f222e9 [2,0,0,0,0,0|0,0,0]=2 754 B13R1.718 CC(CO)NCCc1ccccn1 016681df2dd6b7fa7d2d6f6091d9a476 [2,0,0,0,0,0|1,0,0]=3 755 B13R1.718 CC(CO)NCCc1cccnc1 66415843859f5efa935aff361795b6fd [2,0,0,0,0,0|1,0,0]=3 756 B13R1.718 CC(CO)NCCc1ccncc1 6b31f55a76d9ebd1d00a42f94e0e8e2c [2,0,0,0,0,0|1,0,0]=3 757 B13R1.718 CC(CO)NCCc1ccncn1 65188cd7b2de51d7a1e2def632ccaff8 [2,0,0,0,0,0|2,0,0]=4 758 B13R1.718 CC(CO)NCCc1cnccn1 73d6fc96f1eb2ae273fae8a465357133 [2,0,0,0,0,0|2,0,0]=4 759 B13R1.718 CC(CO)NCCc1ncccn1 7b51814b0fe098513330a54213fd41c2 [2,0,0,0,0,0|2,0,0]=4 760 B13R1.718 CC(CS)OCCc1ccccc1 c835925d704a2473612a5e1bc4083289 [2,0,0,0,0,0|1,1,0]=4 761 B13R1.718 CCC(C)NCCc1ccccc1 04fedbf0cb6009843db62b814f469f4d [2,0,0,0,0,0|1,0,0]=3 762 B13R1.718 CCC(C)NCCc1ccccn1 fe6d040ea3832d34e25d3609e9efc0a1 [2,0,0,0,0,0|2,0,0]=4 763 B13R1.718 CCC(C)NCCc1cccnc1 d811ad79d3d6c5c6d4bf56938672c80c [2,0,0,0,0,0|2,0,0]=4 764 B13R1.718 CCC(C)NCCc1ccncc1 b506ba27a728915626c9aa4cc38d5704 [2,0,0,0,0,0|2,0,0]=4 765 B13R1.718 CCC(C)OCCc1ccccc1 ebd850bb8f2f6a99345d946634614b34 [2,0,0,0,0,0|2,0,0]=4 766 B13R1.718 CC[C@@H](C)NCCc1ccccc1 e9d3e12ce5c5fe10ecfef40b36bd9295 [2,0,0,0,0,0|1,0,0]=3 767 B13R1.718 CC[C@@H](C)NCCc1ccccn1 f7ebab828ca2f6be9c3b33aa3dd6dbe7 [2,0,0,0,0,0|2,0,0]=4 768 B13R1.718 CC[C@@H](C)NCCc1cccnc1 f3c3da2070322882317bc4767bc887bc [2,0,0,0,0,0|2,0,0]=4 769 B13R1.718 CC[C@@H](C)NCCc1ccncc1 a2eaf66e025a64954325e257f25941ff [2,0,0,0,0,0|2,0,0]=4 770 B13R1.718 CC[C@@H](C)OCCc1ccccc1 2f036ce5b90828a6d2f870c2a2025003 [2,0,0,0,0,0|2,0,0]=4 771 B13R1.718 CC[C@H](C)NCCc1ccccc1 5bd761bea609e39e2c4848d512bd6573 [2,0,0,0,0,0|1,0,0]=3 772 B13R1.718 CC[C@H](C)NCCc1ccccn1 a4d51fae7d9f29581ff83fc8e65c4b23 [2,0,0,0,0,0|2,0,0]=4 773 B13R1.718 CC[C@H](C)NCCc1cccnc1 6563b6f6ef2abf876373103666f50882 [2,0,0,0,0,0|2,0,0]=4 774 B13R1.718 CC[C@H](C)NCCc1ccncc1 210ce4c420b08f79902b74c8b0b4b94e [2,0,0,0,0,0|2,0,0]=4 775 B13R1.718 CC[C@H](C)OCCc1ccccc1 fd47c0386d3a87c182e4a46502f572e0 [2,0,0,0,0,0|2,0,0]=4 776 B13R1.718 C[C@@H](CO)CCNc1ccccc1 64eab2116b6261f4048d30e4ad5a6f62 [2,0,0,0,0,0|2,0,0]=4 777 B13R1.718 C[C@@H](CO)CNCc1ccccc1 e2f2b6480afeb47c9d182f8bf342ee78 [2,0,0,0,0,0|2,0,0]=4 778 B13R1.718 C[C@@H](CO)NCCc1ccccc1 becda43359cccf2ad88f7b4db8f3be9f [2,0,0,0,0,0|0,0,0]=2 779 B13R1.718 C[C@@H](CO)NCCc1ccccn1 c5e8ea5ea171b001729be6671a15f573 [2,0,0,0,0,0|1,0,0]=3 780 B13R1.718 C[C@@H](CO)NCCc1cccnc1 959e4c544713f5ced725b3787e09baec [2,0,0,0,0,0|1,0,0]=3 781 B13R1.718 C[C@@H](CO)NCCc1ccncc1 4fbdd4730545a2fdae0a78943abc2829 [2,0,0,0,0,0|1,0,0]=3 782 B13R1.718 C[C@@H](CO)NCCc1ccncn1 556a6fd3f7d1ab8df0e152362be7fdcc [2,0,0,0,0,0|2,0,0]=4 783 B13R1.718 C[C@@H](CO)NCCc1cnccn1 e84ccfa1728f099cb7891e7e0f4d3d3c [2,0,0,0,0,0|2,0,0]=4 784 B13R1.718 C[C@@H](CO)NCCc1ncccn1 a0835faeb1584612b1e59046e6b4284a [2,0,0,0,0,0|2,0,0]=4 785 B13R1.718 C[C@H](C=O)NCCc1ccccc1 bd6dd098fe0df74c78dc8f01b3196352 [2,0,0,0,0,0|0,0,2]=4 786 B13R1.718 C[C@H](CO)CNCc1ccccc1 92800f4bfb7229bb709a604d05a50f8b [2,0,0,0,0,0|2,0,0]=4 787 B13R1.718 C[C@H](CO)NCCc1ccccc1 2a41261301307fce936b23ca5418cc20 [2,0,0,0,0,0|0,0,0]=2 788 B13R1.718 C[C@H](CO)NCCc1ccccn1 f1fd243df6dff79c3d86e824cd42de64 [2,0,0,0,0,0|1,0,0]=3 789 B13R1.718 C[C@H](CO)NCCc1cccnc1 597b5bcde8acf778ebcd850be9e87531 [2,0,0,0,0,0|1,0,0]=3 790 B13R1.718 C[C@H](CO)NCCc1ccncc1 3c1a4be16840e397d027caee72a9f740 [2,0,0,0,0,0|1,0,0]=3 791 B13R1.718 C[C@H](CO)NCCc1ccncn1 9ded89c7e7d824d2cde957ef08f0e8bc [2,0,0,0,0,0|2,0,0]=4 792 B13R1.718 C[C@H](CO)NCCc1cnccn1 927018b36306906d825ae8b4a6f80f2c [2,0,0,0,0,0|2,0,0]=4 793 B13R1.718 C[C@H](CO)NCCc1ncccn1 c09fbb0ad15a00496c0336c73e74df4b [2,0,0,0,0,0|2,0,0]=4 794 B13R1.718 C[C@H](CS)OCCc1ccccc1 f9b1b9175172eabe9502e1f20520b92a [2,0,0,0,0,0|1,1,0]=4 795 B13R1.718 O=C(CO)NCCc1ccccc1 f13a088047fed9c1f5f150212711bedf [2,0,0,0,0,0|1,0,1]=4 796 B13R1.3523 CC(C)(C)CCNc1ccccc1 e4eb5853055cf692dd43a46b2d2d1231 [2,0,0,0,0,0|2,0,0]=4 797 B13R1.3523 CC(C)(C)CNCc1ccccc1 120dce255af61d3f27a86b6df5546e6d [2,0,0,0,0,0|2,0,0]=4 798 B13R1.3523 CC(C)(C)COCc1ccccc1 88c36added3761c571c82c9bcdd32e34 [2,0,0,0,0,0|2,0,0]=4 799 B13R1.3523 CC(C)(C)NCCc1ccccc1 3f7d750835adb5f58961ed6ea0ec8491 [2,0,0,0,0,0|0,0,0]=2 800 B13R1.3523 CC(C)(C)NCCc1ccccn1 0a3eb93443b7ba9219a6e04606787e1e [2,0,0,0,0,0|1,0,0]=3 801 B13R1.3523 CC(C)(C)NCCc1cccnc1 f11b814fe579295504e41ed4d0da0924 [2,0,0,0,0,0|1,0,0]=3 802 B13R1.3523 CC(C)(C)NCCc1ccncc1 e66a3ed3b9e911ce8084125c90bd36f9 [2,0,0,0,0,0|1,0,0]=3 803 B13R1.3523 CC(C)(O)CCNc1ccccc1 c4f5ba88bd1187928d72373d155556e0 [2,0,0,0,0,0|2,0,0]=4 804 B13R1.3523 CC(C)(O)CNCc1ccccc1 ac03deab52d134fd4f2ecc3aba4f9893 [2,0,0,0,0,0|2,0,0]=4 805 B13R1.3523 CC(C)(O)COCc1ccccc1 61e7e7507275b8dcd72c7dd1f7a3ecee [2,0,0,0,0,0|2,0,0]=4 806 B15R1.89 C=C(CNC(C)CCO)c1ccccc1 e967cdc476fa68b871adbbf48d7aa0bf [1,1,0,0,0,0|1,0,1]=4 807 B15R1.89 C=C(CN[C@@H](C)CCO)c1ccccc1 3fe6a8b2579871cf0ca326e6003a1601 [1,1,0,0,0,0|1,0,1]=4 808 B15R1.89 C=C(CN[C@H](C)CCO)c1ccccc1 ca084e048935791c926d480381a80f65 [1,1,0,0,0,0|1,0,1]=4 809 B15R1.89 CC(CC#N)NCC(C)c1ccccc1 df872db0df00832c726e0ae1a309fbf8 [1,1,0,0,0,0|2,0,0]=4 810 B15R1.89 CC(CC#N)NCC(F)c1ccccc1 7c977efafdd68c1034e34cb270713738 [1,1,0,0,0,0|2,0,0]=4 811 B15R1.89 CC(CC#N)NCC(O)c1ccccc1 4003063e867b96202f6574fddb7c0171 [1,1,0,0,0,0|1,0,0]=3 812 B15R1.89 CC(CC#N)NCC(O)c1ccccn1 6c3897f3a99237cb9593d71f290ed7eb [1,1,0,0,0,0|2,0,0]=4 813 B15R1.89 CC(CC#N)NCC(O)c1cccnc1 93c25c9f18e5f4be9681a39eee9e92b7 [1,1,0,0,0,0|2,0,0]=4 814 B15R1.89 CC(CC#N)NCC(O)c1ccncc1 a03c332ca8799ab99d6692b3cd931319 [1,1,0,0,0,0|2,0,0]=4 815 B15R1.89 CC(CC#N)NC[C@@H](C)c1ccccc1 4d6c859e22d15c1e561fa446a3b690c7 [1,1,0,0,0,0|2,0,0]=4 816 B15R1.89 CC(CC#N)NC[C@@H](O)c1ccccc1 1d87f4bbf41342c75b953042a7a25546 [1,1,0,0,0,0|1,0,0]=3 817 B15R1.89 CC(CC#N)NC[C@H](C)c1ccccc1 58507e843a19f6dbba930ddce9fec1c3 [1,1,0,0,0,0|2,0,0]=4 818 B15R1.89 CC(CC#N)NC[C@H](O)c1ccccc1 d43593ec0e221cb5328f7467f721669e [1,1,0,0,0,0|1,0,0]=3 819 B15R1.89 CC(CCO)NCC(=O)c1ccccc1 1722ba932400f48651c5ab38f1cb6510 [1,1,0,0,0,0|0,0,2]=4 820 B15R1.89 CC(CCO)NCC(C)c1ccccc1 95ee6fbbb78fcbcf9859fbee0681e081 [1,1,0,0,0,0|1,0,0]=3 821 B15R1.89 CC(CCO)NCC(F)c1ccccc1 adccc9a66456d0689b896ab741966bf4 [1,1,0,0,0,0|1,0,0]=3 822 B15R1.89 CC(CCO)NCC(O)c1ccccc1 9df83a1282aa598e73059541b2d7e6ee [1,1,0,0,0,0|0,0,0]=2 823 B15R1.89 CC(CCO)NCC(O)c1ccccn1 194fe117f8e657a360c6c3b7ced67fab [1,1,0,0,0,0|1,0,0]=3 824 B15R1.89 CC(CCO)NCC(O)c1cccnc1 883656e66a25491cd91e93be867e816f [1,1,0,0,0,0|1,0,0]=3 825 B15R1.89 CC(CCO)NCC(O)c1ccncc1 18db166c2b10e10ebece2511379c40d7 [1,1,0,0,0,0|1,0,0]=3 826 B15R1.89 CC(CCO)NCC(O)c1cnccn1 070bbc8bfa74320231af0782ce30523c [1,1,0,0,0,0|2,0,0]=4 827 B15R1.89 CC(CCO)NC[C@@H](C)c1ccccc1 45776d01a088d0395dd9176d7bb73c35 [1,1,0,0,0,0|1,0,0]=3 828 B15R1.89 CC(CN[C@@H](C)CCO)c1ccccc1 58a6fec083bc2ea89c8cffb9aab72667 [1,1,0,0,0,0|1,0,0]=3 829 B15R1.89 CC(CN[C@H](C)CCO)c1ccccc1 513078548c21f83130897ffad61b9f54 [1,1,0,0,0,0|1,0,0]=3 830 B15R1.89 CCCC(C)NCC(C)c1ccccc1 64efd963b086ac0cf09e96bc0e09b74f [1,1,0,0,0,0|2,0,0]=4 831 B15R1.89 CCCC(C)NCC(O)c1ccccc1 ef6f6a3a3576df7d2e92820853a9cb8e [1,1,0,0,0,0|1,0,0]=3 832 B15R1.89 CCCC(C)NCC(O)c1ccccn1 35d3271b37ecb13a091b45828175344e [1,1,0,0,0,0|2,0,0]=4 833 B15R1.89 CCCC(C)NCC(O)c1cccnc1 a2ea4bf57502b17655aef958c9d64fad [1,1,0,0,0,0|2,0,0]=4 834 B15R1.89 CCCC(C)NCC(O)c1ccncc1 e4860de03c0c951e45c1a738d7e659d7 [1,1,0,0,0,0|2,0,0]=4 835 B15R1.89 CCCC(C)NC[C@@H](C)c1ccccc1 0f2906ceb2e36a1151c79c6d7372f91f [1,1,0,0,0,0|2,0,0]=4 836 B15R1.89 CCC[C@H](C)NCC(C)c1ccccc1 522b63ae2f9f760147c36d82b8eb9163 [1,1,0,0,0,0|2,0,0]=4 837 B15R1.89 CCC[C@H](C)NCC(O)c1ccccc1 64ea65c07e0e5c167716850e6193604c [1,1,0,0,0,0|1,0,0]=3 838 B15R1.89 CCC[C@H](C)NC[C@@H](C)c1ccccc1 94c7a69adafd54bac7084403c64528ca [1,1,0,0,0,0|2,0,0]=4 839 B15R1.89 CN(CCO)CCC(O)c1ccccc1 558737f773c6f9720f51d06f3b83b5fa [1,1,0,0,0,0|2,0,0]=4 840 B15R1.89 CN(CCO)CC[C@@H](O)c1ccccc1 29a629897f9c04f29fd417dd9384d180 [1,1,0,0,0,0|2,0,0]=4 841 B15R1.89 CN(CCO)CC[C@H](O)c1ccccc1 dabba8b3a34feab43669124bf500c438 [1,1,0,0,0,0|2,0,0]=4 842 B15R1.89 COCC(=O)NCC(O)c1ccccc1 2cd6424f557cb95314a993ace192e204 [1,1,0,0,0,0|1,0,1]=4 843 B15R1.89 COCC(=O)NC[C@@H](O)c1ccccc1 91d175bed65b56698ca4ddc06116d32c [1,1,0,0,0,0|1,0,1]=4 844 B15R1.89 COCC(=O)NC[C@H](O)c1ccccc1 f8d8d905fd436c819574162639c13607 [1,1,0,0,0,0|1,0,1]=4 845 B15R1.89 COCC(C)NCC(=O)c1ccccc1 a012ec3c9cc6a2a04d82e36eefdcdffe [1,1,0,0,0,0|0,0,2]=4 846 B15R1.89 COCC(C)NCC(C)c1ccccc1 09a4242f6053b0471f5f162c0e9ad346 [1,1,0,0,0,0|1,0,0]=3 847 B15R1.89 COCC(C)NCC(F)c1ccccc1 e7f95952ff6251661ff3f9b8f0ed4497 [1,1,0,0,0,0|1,0,0]=3 848 B15R1.89 COCC(C)NCC(O)c1ccccc1 ea34a0ca7a4d6410ce0cece7d5aafa61 [1,1,0,0,0,0|0,0,0]=2 849 B15R1.89 COCC(C)NCC(O)c1ccccn1 d39090c69d1f879a08eb638d61fdbe0d [1,1,0,0,0,0|1,0,0]=3 850 B15R1.89 COCC(C)NCC(O)c1cccnc1 807a4d2a47be07d8704f4dd288a58feb [1,1,0,0,0,0|1,0,0]=3 851 B15R1.89 COCC(C)NCC(O)c1ccncc1 913f34a145e81ace15c453508e632147 [1,1,0,0,0,0|1,0,0]=3 852 B15R1.89 COCC(C)NCC(O)c1cnccn1 aa96613329110061f7f95921b9e1a6fc [1,1,0,0,0,0|2,0,0]=4 853 B15R1.89 COCC(C)NC[C@@H](C)c1ccccc1 d88c5616b1e09121f1fd72eac048905c [1,1,0,0,0,0|1,0,0]=3 854 B15R1.89 COCC(C)NC[C@@H](O)c1ccccc1 1d9b4ea5898ae631a9339d06b2b8e61d [1,1,0,0,0,0|0,0,0]=2 855 B15R1.89 COCC(C)NC[C@H](C)c1ccccc1 6a472f1cc443118664bbbcafb4784e95 [1,1,0,0,0,0|1,0,0]=3 856 B15R1.89 COCC(C)NC[C@H](O)c1ccccc1 a2942a2329dbc723d46c5262c1a05e68 [1,1,0,0,0,0|0,0,0]=2 857 B15R1.89 COCC(C)OCC(C)c1ccccc1 82e2ec27f32e058dd43acf69491ce815 [1,1,0,0,0,0|2,0,0]=4 858 B15R1.89 COCC(C)OC[C@@H](C)c1ccccc1 d97302a4180f35dc7ae8de8ef22e40ed [1,1,0,0,0,0|2,0,0]=4 859 B15R1.89 COCC(C)OC[C@H](C)c1ccccc1 a67760140e6caf88f70317dcef3373a0 [1,1,0,0,0,0|2,0,0]=4 860 B15R1.89 COCN(C)CCC(O)c1ccccc1 b8580b04e2b65420cd8a79b6f78820c7 [1,1,0,0,0,0|2,0,0]=4 861 B15R1.89 COCN(C)CC[C@@H](O)c1ccccc1 8c675b23082e3252864c15d9282dbee2 [1,1,0,0,0,0|2,0,0]=4 862 B15R1.89 COCN(C)CC[C@H](O)c1ccccc1 80d779313ba14b09f711a1945d5ff4f9 [1,1,0,0,0,0|2,0,0]=4 863 B15R1.89 COC[C@@H](C)NCC(=O)c1ccccc1 46a7f661fe0009ca3db2601c69e5517a [1,1,0,0,0,0|0,0,2]=4 864 B15R1.89 COC[C@@H](C)NCC(C)c1ccccc1 5455ba03de5a808ac7f7fae788670122 [1,1,0,0,0,0|1,0,0]=3 865 B15R1.89 COC[C@@H](C)NCC(F)c1ccccc1 06292a990790e19d3ee64dfd2046fc42 [1,1,0,0,0,0|1,0,0]=3 866 B15R1.89 COC[C@@H](C)NCC(O)c1ccccc1 673d9fd7e40b8bca719f85c1ab1f3a0d [1,1,0,0,0,0|0,0,0]=2 867 B15R1.89 COC[C@@H](C)NCC(O)c1cnccn1 b2e286c9e51df607148f66150cb3ed8f [1,1,0,0,0,0|2,0,0]=4 868 B15R1.89 COC[C@@H](C)NC[C@@H](C)c1ccccc1 df93d600566f3779674043dd127eea7d [1,1,0,0,0,0|1,0,0]=3 869 B15R1.89 COC[C@@H](C)OCC(C)c1ccccc1 15e57991f5efcf3949577b9075a40755 [1,1,0,0,0,0|2,0,0]=4 870 B15R1.89 COC[C@@H](C)OC[C@@H](C)c1ccccc1 e70ac0ef3829846c372de47f0ea300f8 [1,1,0,0,0,0|2,0,0]=4 871 B15R1.89 COC[C@H](C)NCC(=O)c1ccccc1 8a989ebabc3d056016c4c8e1d9ba92c3 [1,1,0,0,0,0|0,0,2]=4 872 B15R1.89 COC[C@H](C)NCC(C)c1ccccc1 b32c612e283a44dfee0e58a67c6cb83c [1,1,0,0,0,0|1,0,0]=3 873 B15R1.89 COC[C@H](C)NCC(F)c1ccccc1 b66767fc44009b6a852fb60252e6a498 [1,1,0,0,0,0|1,0,0]=3 874 B15R1.89 COC[C@H](C)NCC(O)c1ccccc1 1b55ad01f0b646df803a841ad320b7cb [1,1,0,0,0,0|0,0,0]=2 875 B15R1.89 COC[C@H](C)NCC(O)c1cnccn1 57309e93194ef402884a39347a2a14d1 [1,1,0,0,0,0|2,0,0]=4 876 B15R1.89 COC[C@H](C)NC[C@@H](C)c1ccccc1 cc762dce1d90f30fb282184e65c05337 [1,1,0,0,0,0|1,0,0]=3 877 B15R1.89 COC[C@H](C)OCC(C)c1ccccc1 54c24fe680299fbf77654cc201791e67 [1,1,0,0,0,0|2,0,0]=4 878 B15R1.89 COC[C@H](C)OC[C@@H](C)c1ccccc1 86374b1b0d2d7b43fe6a66a9f0fd5688 [1,1,0,0,0,0|2,0,0]=4 879 B15R1.89 C[C@@H](CCO)NCC(=O)c1ccccc1 21359469d352aa0e42b63a8eccacdf6e [1,1,0,0,0,0|0,0,2]=4 880 B15R1.89 C[C@@H](CCO)NCC(F)c1ccccc1 617d965a8a062f701342c14d715b0ca2 [1,1,0,0,0,0|1,0,0]=3 881 B15R1.89 C[C@@H](CCO)NCC(O)c1ccccc1 624f15e2e1e6f52a16b38299e583483b [1,1,0,0,0,0|0,0,0]=2 882 B15R1.89 C[C@@H](CCO)NCC(O)c1cnccn1 df408483cf3ad19f39d1ade886bf9fc9 [1,1,0,0,0,0|2,0,0]=4 883 B15R1.89 C[C@H](CCO)NCC(=O)c1ccccc1 69f72f09d51951604d472fc823108758 [1,1,0,0,0,0|0,0,2]=4 884 B15R1.89 C[C@H](CCO)NCC(F)c1ccccc1 9445f5c511329a90d77c0639e2c2be5a [1,1,0,0,0,0|1,0,0]=3 885 B15R1.89 C[C@H](CCO)NCC(O)c1ccccc1 ae64fc50ab0dd80b6724b67ec3d204c9 [1,1,0,0,0,0|0,0,0]=2 886 B15R1.89 C[C@H](CCO)NCC(O)c1cnccn1 e20f6f9b5ec9ead9936fd457412660e5 [1,1,0,0,0,0|2,0,0]=4 887 B15R1.89 C[C@H](CCO)NC[C@@H](C)c1ccccc1 8681cb98758b7321d3ee0d88e25d7b04 [1,1,0,0,0,0|1,0,0]=3 888 B15R1.89 C[C@H](CN[C@@H](C)CCO)c1ccccc1 ff377a7b38e4bf8969d1975be8402812 [1,1,0,0,0,0|1,0,0]=3 889 B15R1.89 NOCC(=O)NCC(O)c1ccccc1 ce896c0320b3018fcabb6f50dec4e9e6 [1,1,0,0,0,0|1,0,1]=4 890 B15R1.89 NOCC(=O)NC[C@@H](O)c1ccccc1 78f1dc0a7a6a1ec412f35f17453ec5ae [1,1,0,0,0,0|1,0,1]=4 891 B15R1.89 NOCC(=O)NC[C@H](O)c1ccccc1 87d0a6f2ff92f38736215991643a3684 [1,1,0,0,0,0|1,0,1]=4 892 B15R1.89 O=C(CCO)NCC(O)c1ccccc1 2f065cfa0225d947f286993ed66f87e1 [1,1,0,0,0,0|1,0,1]=4 893 B15R1.89 O=C(CCO)NC[C@@H](O)c1ccccc1 f0fcc1c8d3d1992b8dd4b1f93d81f485 [1,1,0,0,0,0|1,0,1]=4 894 B15R1.89 O=C(CCO)NC[C@H](O)c1ccccc1 fe01cdfd2db7bba1471465866c054770 [1,1,0,0,0,0|1,0,1]=4 895 B15R1.132 C#CC(C)NCC(O)c1ccc(cc1)Br 929871b825c5bc3f8c519d2d09f5ec30 [1,1,0,0,0,0|1,0,1]=4 896 B15R1.132 C#CC(C)NCC(O)c1ccc(cc1)Cl 3ec0e48d7a666d1c694af82ab72e5e81 [1,1,0,0,0,0|1,0,1]=4 897 B15R1.132 C#CC(C)NC[C@@H](O)c1ccc(cc1)Br cd0f389a2e76051f989f41e7a9be8fcb [1,1,0,0,0,0|1,0,1]=4 898 B15R1.132 C#CC(C)NC[C@@H](O)c1ccc(cc1)C de23f121baaca8b61685b85ebfa5fdc9 [1,1,0,0,0,0|1,0,1]=4 899 B15R1.132 C#CC(C)NC[C@@H](O)c1ccc(cc1)Cl a40367d7d47ea9ee17bfee8f66b5f47b [1,1,0,0,0,0|1,0,1]=4 900 B15R1.132 C#CC(C)NC[C@@H](O)c1ccc(cc1)F 7bb2acf1aa171b5cc53a48b2112f395b [1,1,0,0,0,0|1,0,1]=4 901 B15R1.132 C#CC(C)NC[C@H](O)c1ccc(cc1)Br bd51007d2bbefc52525778ab42bc0aea [1,1,0,0,0,0|1,0,1]=4 902 B15R1.132 C#CC(C)NC[C@H](O)c1ccc(cc1)Cl 35ff3ca4601d45f97cf15bddfce3c868 [1,1,0,0,0,0|1,0,1]=4 903 B15R1.132 C#CC(C)NC[C@H](O)c1ccc(cc1)F 6d3d8dd9d7787baaf36bb4f04d3c5d97 [1,1,0,0,0,0|1,0,1]=4 904 B15R1.132 C#C[C@@H](C)NCC(O)c1ccc(cc1)Br 638f89ee7ecc1994218d838bdef6bc06 [1,1,0,0,0,0|1,0,1]=4 905 B15R1.132 C#C[C@@H](C)NCC(O)c1ccc(cc1)Cl e994bed5f0074923e56fe9807c83523c [1,1,0,0,0,0|1,0,1]=4 906 B15R1.132 C#C[C@@H](C)NC[C@@H](O)c1ccc(cc1)Br 22e90c2a9751eb5074972c161b8dd28f [1,1,0,0,0,0|1,0,1]=4 907 B15R1.132 C#C[C@@H](C)NC[C@@H](O)c1ccc(cc1)C 9210940c3660c75bb965b5ea0338b219 [1,1,0,0,0,0|1,0,1]=4 908 B15R1.132 C#C[C@@H](C)NC[C@@H](O)c1ccc(cc1)Cl 7e84ae508577e4d4d1fbd52a0352d4e6 [1,1,0,0,0,0|1,0,1]=4 909 B15R1.132 C#C[C@@H](C)NC[C@@H](O)c1ccc(cc1)F e0d7cf0d84ff41051b9f01ab0d4c0251 [1,1,0,0,0,0|1,0,1]=4 910 B15R1.132 C#C[C@@H](C)NC[C@H](O)c1ccc(cc1)Br 5b8252c7f64fbcce6b01772b02b525c7 [1,1,0,0,0,0|1,0,1]=4 911 B15R1.132 C#C[C@@H](C)NC[C@H](O)c1ccc(cc1)Cl 1c306249a70425368a5b251dac052f04 [1,1,0,0,0,0|1,0,1]=4 912 B15R1.132 C#C[C@@H](C)NC[C@H](O)c1ccc(cc1)F 192a8c6fced43aa8eba71480a8aae828 [1,1,0,0,0,0|1,0,1]=4 913 B15R1.132 C#C[C@H](C)NCC(O)c1ccc(cc1)Br 50dbdd69cc5034e7d679a38cb0da93c8 [1,1,0,0,0,0|1,0,1]=4 914 B15R1.132 C#C[C@H](C)NCC(O)c1ccc(cc1)Cl e78a67aaa424b486aae1e830be8fdf73 [1,1,0,0,0,0|1,0,1]=4 915 B15R1.132 C#C[C@H](C)NC[C@@H](O)c1ccc(cc1)Br 03f895bb15695672df08dd8d79898f71 [1,1,0,0,0,0|1,0,1]=4 916 B15R1.132 C#C[C@H](C)NC[C@@H](O)c1ccc(cc1)C 5ae869fe0cf83401df78898ab5019487 [1,1,0,0,0,0|1,0,1]=4 917 B15R1.132 C#C[C@H](C)NC[C@@H](O)c1ccc(cc1)Cl 1ba10e501ed69041981aa1b08c43e291 [1,1,0,0,0,0|1,0,1]=4 918 B15R1.132 C#C[C@H](C)NC[C@@H](O)c1ccc(cc1)F 9b24439d82cf108250021b8d104353aa [1,1,0,0,0,0|1,0,1]=4 919 B15R1.132 C#C[C@H](C)NC[C@H](O)c1ccc(cc1)Br 65859fdcdd87179358d2a39f7f586996 [1,1,0,0,0,0|1,0,1]=4 920 B15R1.132 C#C[C@H](C)NC[C@H](O)c1ccc(cc1)Cl c601a7114b12fb0c64e14d6e439f2150 [1,1,0,0,0,0|1,0,1]=4 921 B15R1.132 C#C[C@H](C)NC[C@H](O)c1ccc(cc1)F d1e586234aba0dd8931aff73d9bf6487 [1,1,0,0,0,0|1,0,1]=4 922 B15R1.132 C=CC(C)NCC(O)c1ccc(cc1)Br 3fd330be840ef25ab3e4cd3224f0f644 [1,1,0,0,0,0|1,0,1]=4 923 B15R1.132 C=CC(C)NCC(O)c1ccc(cc1)C dd35031d5bfc41582f32798cb27b3647 [1,1,0,0,0,0|1,0,1]=4 924 B15R1.132 C=CC(C)NCC(O)c1ccc(cc1)Cl 639637a5b633dbcca70aba4c70bde157 [1,1,0,0,0,0|1,0,1]=4 925 B15R1.132 C=CC(C)NCC(O)c1ccc(cc1)F 57e6437c313ea7e3bc08756d8f2693de [1,1,0,0,0,0|1,0,1]=4 926 B15R1.132 C=CC(C)NC[C@@H](O)c1ccc(cc1)Br 6f7c5dc1a778133f7b421db6cfaf386f [1,1,0,0,0,0|1,0,1]=4 927 B15R1.132 C=CC(C)NC[C@@H](O)c1ccc(cc1)C 4fb4c805d3cc45763667e5ded60f5279 [1,1,0,0,0,0|1,0,1]=4 928 B15R1.132 C=CC(C)NC[C@@H](O)c1ccc(cc1)Cl 9e3c5bc211557a548de70ce6a3017449 [1,1,0,0,0,0|1,0,1]=4 929 B15R1.132 C=CC(C)NC[C@@H](O)c1ccc(cc1)F 771caa319ab04c47d01019b501ae610c [1,1,0,0,0,0|1,0,1]=4 930 B15R1.132 C=CC(C)NC[C@H](O)c1ccc(cc1)Br 5f9e89a8163c6eb1a715a8456c0f54a7 [1,1,0,0,0,0|1,0,1]=4 931 B15R1.132 C=CC(C)NC[C@H](O)c1ccc(cc1)Cl 5ea64e28bcb42d283747da9411cc9191 [1,1,0,0,0,0|1,0,1]=4 932 B15R1.132 C=CC(C)NC[C@H](O)c1ccc(cc1)F 84fc404989f17b586cba0a3cf056b8fb [1,1,0,0,0,0|1,0,1]=4 933 B15R1.132 CC(C#N)NCC(O)c1ccc(cc1)Br 5baaf7db78044cdb5ae48070a46221c4 [1,1,0,0,0,0|1,0,1]=4 934 B15R1.132 CC(C#N)NCC(O)c1ccc(cc1)Cl 0dc7376d196f7a623b78b005224f7994 [1,1,0,0,0,0|1,0,1]=4 935 B15R1.132 CC(C#N)NC[C@@H](O)c1ccc(cc1)Br 81caef6aea57fcc357a78a052da8b7ec [1,1,0,0,0,0|1,0,1]=4 936 B15R1.132 CC(C#N)NC[C@@H](O)c1ccc(cc1)F d17b8429732d00053f5fbf8656121c0f [1,1,0,0,0,0|1,0,1]=4 937 B15R1.132 CC(C#N)NC[C@H](O)c1ccc(cc1)Br 56da1480a473abebc56dc7bbeb214949 [1,1,0,0,0,0|1,0,1]=4 938 B15R1.132 CC(C#N)NC[C@H](O)c1ccc(cc1)Cl b852b81bd7ae9b74b2d7115b4b38c42b [1,1,0,0,0,0|1,0,1]=4 939 B15R1.132 CC(C#N)NC[C@H](O)c1ccc(cc1)F 4d5a279eb124a6bb22c89d18eed4a76e [1,1,0,0,0,0|1,0,1]=4 940 B15R1.132 CC(C=O)NCC(O)c1ccc(cc1)Br 5cb93ec61ff1fcfa1bad8c2b9815d8fc [1,1,0,0,0,0|0,0,2]=4 941 B15R1.132 CC(C=O)NCC(O)c1ccc(cc1)Cl 4eb05bb711a1d87f2d9c5a397146eb20 [1,1,0,0,0,0|0,0,2]=4 942 B15R1.132 CC(C=O)NCC(O)c1ccc(cc1)F c8d9f34dc4c8581d9a9c81e115da97a7 [1,1,0,0,0,0|0,0,2]=4 943 B15R1.132 CC(CO)NCC(=O)c1ccc(cc1)Br ffbd58e7b6e890e10b1a2489075660a9 [1,1,0,0,0,0|0,0,2]=4 944 B15R1.132 CC(CO)NCC(=O)c1ccc(cc1)Cl 34c282141b9deb82def2860916f12df2 [1,1,0,0,0,0|0,0,2]=4 945 B15R1.132 CC(CO)NCC(=O)c1ccc(cc1)F e37a6bb8b53232d725803f0141728905 [1,1,0,0,0,0|0,0,2]=4 946 B15R1.132 CC(CO)NCC(=O)c1ccc(cc1)I f8d7365572cde20ae1c8106e37e27985 [1,1,0,0,0,0|0,0,2]=4 947 B15R1.132 CC(CO)NCC(C)c1ccc(cc1)Br 7be73fee58de7e9d3e9a5080a72c4e61 [1,1,0,0,0,0|1,0,0]=3 948 B15R1.132 CC(CO)NCC(F)c1ccc(cc1)Br ed8ed911b6c66223d3e7a959b35b12e7 [1,1,0,0,0,0|1,0,0]=3 949 B15R1.132 CC(CO)NCC(O)c1ccc(cc1)Br d306fa5811bf8320c396535c93925e4a [1,1,0,0,0,0|0,0,0]=2 950 B15R1.132 CC(CO)NCC(O)c1ccc(cc1)Cl a9fa3ec169c5a1aff7bfa5e481af82f2 [1,1,0,0,0,0|0,0,0]=2 951 B15R1.132 CC(CO)NC[C@@H](O)c1ccc(cc1)F 66fb730ef265b0b86eb9fe79a91e9dab [1,1,0,0,0,0|0,0,0]=2 952 B15R1.132 CC(CO)NC[C@H](O)c1ccc(cc1)Cl c235c88d3f1081c8d37ed5de42f317a0 [1,1,0,0,0,0|0,0,0]=2 953 B15R1.132 CC(CO)NC[C@H](O)c1ccc(cc1)F 0705b6dc26992e87b4506cee499251b1 [1,1,0,0,0,0|0,0,0]=2 954 B15R1.132 CCC(C)NCC(C)c1ccc(cc1)Br 4fdadade0d065950eb2e80cae924bd3f [1,1,0,0,0,0|2,0,0]=4 955 B15R1.132 CCC(C)NCC(F)c1ccc(cc1)Br 4c3387f8320d0889036a17e0bfba9258 [1,1,0,0,0,0|2,0,0]=4 956 B15R1.132 CCC(C)NCC(O)c1ccc(cc1)Br c211dcb6bccf0de72e4cef249cb934d1 [1,1,0,0,0,0|1,0,0]=3 957 B15R1.132 CCC(C)NCC(O)c1ccc(cc1)Cl 9d9f4d87db9bc86792e848d751e38ea9 [1,1,0,0,0,0|1,0,0]=3 958 B15R1.132 CCC(C)NC[C@@H](O)c1ccc(cc1)Br 99beb76c03d188584d43be4e784a6504 [1,1,0,0,0,0|1,0,0]=3 959 B15R1.132 CCC(C)NC[C@H](O)c1ccc(cc1)Br 50b1dcfe925057d06503f9f4b536088b [1,1,0,0,0,0|1,0,0]=3 960 B15R1.132 CCC(C)NC[C@H](O)c1ccc(cc1)Cl fad05955bde2250c2d7f2bf0fc8f5e6a [1,1,0,0,0,0|1,0,0]=3 961 B15R1.132 CCC(C)NC[C@H](O)c1ccc(cc1)F a9250f53d29b037b14bef14910a5c15d [1,1,0,0,0,0|1,0,0]=3 962 B15R1.132 CC[C@@H](C)NCC(F)c1ccc(cc1)Br e023ec87d732f939064cc148b022e039 [1,1,0,0,0,0|2,0,0]=4 963 B15R1.132 CC[C@@H](C)NCC(O)c1ccc(cc1)Br 0eb04bb91fe395d155415dac60e67806 [1,1,0,0,0,0|1,0,0]=3 964 B15R1.132 CC[C@@H](C)NCC(O)c1ccc(cc1)Cl b4ed3c732dce8bf70574ad3e3177d035 [1,1,0,0,0,0|1,0,0]=3 965 B15R1.132 CC[C@@H](C)NC[C@@H](O)c1ccc(cc1)Br 11eb240a654e48fd0a33a4ab0dd84883 [1,1,0,0,0,0|1,0,0]=3 966 B15R1.132 CC[C@@H](C)NC[C@H](O)c1ccc(cc1)Br f46c74bf29bcb25d442a50789bb5b3e2 [1,1,0,0,0,0|1,0,0]=3 967 B15R1.132 CC[C@@H](C)NC[C@H](O)c1ccc(cc1)Cl 02edc74d270a2fc7a2fbf136078e0734 [1,1,0,0,0,0|1,0,0]=3 968 B15R1.132 CC[C@@H](C)NC[C@H](O)c1ccc(cc1)F fda7f6c89f91260abaa7f5979d23734a [1,1,0,0,0,0|1,0,0]=3 969 B15R1.132 CC[C@H](C)NCC(F)c1ccc(cc1)Br 4507ba8ff857987a4110998d20f4a2f3 [1,1,0,0,0,0|2,0,0]=4 970 B15R1.132 CC[C@H](C)NCC(O)c1ccc(cc1)Br c0464b91e3b0513cb9ac8e415f9f8de4 [1,1,0,0,0,0|1,0,0]=3 971 B15R1.132 CC[C@H](C)NCC(O)c1ccc(cc1)Cl f2e8ae6ecd3809ddf05ac8662f1831c7 [1,1,0,0,0,0|1,0,0]=3 972 B15R1.132 CC[C@H](C)NC[C@@H](O)c1ccc(cc1)Br 1c0bd610afda7b086e12983a35a957ba [1,1,0,0,0,0|1,0,0]=3 973 B15R1.132 CC[C@H](C)NC[C@H](O)c1ccc(cc1)Br 2cae51e0c84d400b0021bb6ff825116d [1,1,0,0,0,0|1,0,0]=3 974 B15R1.132 CC[C@H](C)NC[C@H](O)c1ccc(cc1)Cl fa3c28e33b9155dc0e4d7dd66b5a7a0f [1,1,0,0,0,0|1,0,0]=3 975 B15R1.132 CC[C@H](C)NC[C@H](O)c1ccc(cc1)F 11ccd9a289fbbb1c856046f1858f7c91 [1,1,0,0,0,0|1,0,0]=3 976 B15R1.132 C[C@@H](CO)NCC(=O)c1ccc(cc1)Br d61023de7f651fba0a34fb2f3a333850 [1,1,0,0,0,0|0,0,2]=4 977 B15R1.132 C[C@@H](CO)NCC(=O)c1ccc(cc1)Cl 215c7a4701bb8b25ac059d34a3696542 [1,1,0,0,0,0|0,0,2]=4 978 B15R1.132 C[C@@H](CO)NCC(=O)c1ccc(cc1)F 6e3c2de723ded5de20aeba3890b3ef10 [1,1,0,0,0,0|0,0,2]=4 979 B15R1.132 C[C@@H](CO)NCC(=O)c1ccc(cc1)I eef1c65d39aa25b62d8ffe428b6fbd5f [1,1,0,0,0,0|0,0,2]=4 980 B15R1.132 C[C@@H](CO)NCC(F)c1ccc(cc1)Br d5abb052836bc6fcc1f14a89c233f2cd [1,1,0,0,0,0|1,0,0]=3 981 B15R1.132 C[C@@H](CO)NCC(O)c1ccc(cc1)Cl 4b74b4e07871408afc76b48ac43f9b2b [1,1,0,0,0,0|0,0,0]=2 982 B15R1.132 C[C@@H](CO)NC[C@@H](O)c1ccc(cc1)F c35f3b483b4472f0bf71a030955d7918 [1,1,0,0,0,0|0,0,0]=2 983 B15R1.132 C[C@@H](CO)NC[C@H](O)c1ccc(cc1)Cl 791ce880611801d309ab020d48198223 [1,1,0,0,0,0|0,0,0]=2 984 B15R1.132 C[C@@H](CO)NC[C@H](O)c1ccc(cc1)F 0b401b474e885c3bf5d1cef9fca7823b [1,1,0,0,0,0|0,0,0]=2 985 B15R1.132 C[C@H](C=O)NCC(O)c1ccc(cc1)Br 76effeacf61478f53c0db32a94ece79a [1,1,0,0,0,0|0,0,2]=4 986 B15R1.132 C[C@H](C=O)NCC(O)c1ccc(cc1)Cl e82cb58ba4930c4f6e3eb2eec8b0f41f [1,1,0,0,0,0|0,0,2]=4 987 B15R1.132 C[C@H](C=O)NCC(O)c1ccc(cc1)F 845fd07b4fb8fe57cbb254a11ef59fff [1,1,0,0,0,0|0,0,2]=4 988 B15R1.132 C[C@H](CO)NCC(=O)c1ccc(cc1)Br 551ed819558af3eb2d1204fd0a682825 [1,1,0,0,0,0|0,0,2]=4 989 B15R1.132 C[C@H](CO)NCC(=O)c1ccc(cc1)Cl be3845a6adeb42305257fcea63cd2a8f [1,1,0,0,0,0|0,0,2]=4 990 B15R1.132 C[C@H](CO)NCC(=O)c1ccc(cc1)F 62d982997aa5e74a9f319ca7faef5918 [1,1,0,0,0,0|0,0,2]=4 991 B15R1.132 C[C@H](CO)NCC(=O)c1ccc(cc1)I df8adca42f67ce9383dd307734191764 [1,1,0,0,0,0|0,0,2]=4 992 B15R1.132 C[C@H](CO)NCC(F)c1ccc(cc1)Br fe3833da3491cc97e5829cb44db93a74 [1,1,0,0,0,0|1,0,0]=3 993 B15R1.132 C[C@H](CO)NCC(O)c1ccc(cc1)Cl d7df48dca4ac47aeafb002185ae55814 [1,1,0,0,0,0|0,0,0]=2 994 B15R1.132 C[C@H](CO)NC[C@@H](O)c1ccc(cc1)F 7026546efcc2713ac6908eb8d367f898 [1,1,0,0,0,0|0,0,0]=2 995 B15R1.132 C[C@H](CO)NC[C@H](O)c1ccc(cc1)Cl cbf1ce570cc7f9a612150a4ec63330a7 [1,1,0,0,0,0|0,0,0]=2 996 B15R1.132 C[C@H](CO)NC[C@H](O)c1ccc(cc1)F 7e44f66630508bbeacdbd576c2ec8bba [1,1,0,0,0,0|0,0,0]=2 997 B15R1.132 Cc1ccc(cc1)C(=O)CNC(C)CO 04fd324949c3d784572af9a8f2b458c8 [1,1,0,0,0,0|0,0,2]=4 998 B15R1.132 Cc1ccc(cc1)C(=O)CN[C@@H](C)CO 56234076d5d05fb39df29be1dc39599b [1,1,0,0,0,0|0,0,2]=4 999 B15R1.132 Cc1ccc(cc1)C(=O)CN[C@H](C)CO 817ecdbfa0a04d09fac625f6b3e533b2 [1,1,0,0,0,0|0,0,2]=4 1000 B15R1.132 Cc1ccc(cc1)C(O)CNC(=O)CO 3e6f10cb20b3cf791e1526bcb3fc40e5 [1,1,0,0,0,0|1,0,1]=4 1001 B15R1.132 Cc1ccc(cc1)C(O)CNC(C)C=O a77526d2e1f436ac7c5f0856e0ff127a [1,1,0,0,0,0|0,0,2]=4 1002 B15R1.132 Cc1ccc(cc1)C(O)CN[C@H](C)C=O 96cd9fcf0c6bdd935c18a63aea65729a [1,1,0,0,0,0|0,0,2]=4 1003 B15R1.132 Cc1ccc(cc1)[C@H](O)CNC(C)C#N 8309ec5e675f6710117e25e93623c2a3 [1,1,0,0,0,0|1,0,1]=4 1004 B15R1.132 O=C(CO)NCC(O)c1ccc(cc1)Br 7950789051d38a789c214a3df5671d08 [1,1,0,0,0,0|1,0,1]=4 1005 B15R1.132 O=C(CO)NCC(O)c1ccc(cc1)Cl 77f29ba1986ddfddf9697baaff570d4c [1,1,0,0,0,0|1,0,1]=4 1006 B15R1.132 O=C(CO)NCC(O)c1ccc(cc1)F b056eaada25c9c2d897bd8f082b7dbc1 [1,1,0,0,0,0|1,0,1]=4 1007 B15R1.132 O=C(CO)NCC(O)c1ccc(cc1)O f8bbb869ac29d19c1906864b562814a8 [1,1,0,0,0,0|1,0,1]=4 1008 B15R1.133 C#CC(C)NCC(O)c1cccc(c1)Cl 90114dc687012830762f51c8bbd219ef [1,1,0,0,0,0|1,0,1]=4 1009 B15R1.133 C#CC(C)NC[C@H](O)c1cccc(c1)Cl 6aa471017a6f41c2a0d738116512665e [1,1,0,0,0,0|1,0,1]=4 1010 B15R1.133 C#C[C@@H](C)NCC(O)c1cccc(c1)Cl ad9274dc9f79a4a552b4e7887a0c3be6 [1,1,0,0,0,0|1,0,1]=4 1011 B15R1.133 C#C[C@@H](C)NC[C@H](O)c1cccc(c1)Cl 1e2983c5978231b639a136fc0b7c6a5c [1,1,0,0,0,0|1,0,1]=4 1012 B15R1.133 C#C[C@H](C)NCC(O)c1cccc(c1)Cl cb91beedcd7b4adba12064c61121e858 [1,1,0,0,0,0|1,0,1]=4 1013 B15R1.133 C#C[C@H](C)NC[C@H](O)c1cccc(c1)Cl 5742e09c5bb954c5dfb856824509927c [1,1,0,0,0,0|1,0,1]=4 1014 B15R1.133 C=CC(C)NCC(O)c1cccc(c1)Cl 5314f2264b7370528b97649ef3ea6bac [1,1,0,0,0,0|1,0,1]=4 1015 B15R1.133 C=CC(C)NC[C@H](O)c1cccc(c1)Cl 77810a0b6f2db62e5982347ee1a178d3 [1,1,0,0,0,0|1,0,1]=4 1016 B15R1.133 CC(C#N)NC[C@H](O)c1cccc(c1)Cl 126c18f27b290c38978115075c32dac7 [1,1,0,0,0,0|1,0,1]=4 1017 B15R1.133 CC(C=O)NCC(O)c1cccc(c1)Cl 582a474e30885dcac0170e083729681a [1,1,0,0,0,0|0,0,2]=4 1018 B15R1.133 CC(CO)NCC(=O)c1cccc(c1)Br 487fc1c098921f402fb318699fb54639 [1,1,0,0,0,0|0,0,2]=4 1019 B15R1.133 CC(CO)NCC(=O)c1cccc(c1)Cl dd29206420a310edf9f4f16751377342 [1,1,0,0,0,0|0,0,2]=4 1020 B15R1.133 CC(CO)NCC(=O)c1cccc(c1)F 86aba381ef96513ad1bc06b4034e46bb [1,1,0,0,0,0|0,0,2]=4 1021 B15R1.133 CC(CO)NCC(=O)c1cccc(c1)I 95b10e0cf857199cd23f7cd9c4135dbb [1,1,0,0,0,0|0,0,2]=4 1022 B15R1.133 CC(CO)NCC(O)c1cccc(c1)Cl 1d245c7bed65b3450fe95c00940a7f82 [1,1,0,0,0,0|0,0,0]=2 1023 B15R1.133 CC(CO)NC[C@H](O)c1cccc(c1)Cl 851a66f417ecca743bdba50de6c777b2 [1,1,0,0,0,0|0,0,0]=2 1024 B15R1.133 CCC(C)NC[C@H](O)c1cccc(c1)Cl 4a2e2225f90e90debae959e00c7bfaef [1,1,0,0,0,0|1,0,0]=3 1025 B15R1.133 CC[C@@H](C)NC[C@H](O)c1cccc(c1)Cl c0c2ea24766a3389b8ef8c7d09e462c4 [1,1,0,0,0,0|1,0,0]=3 1026 B15R1.133 CC[C@H](C)NC[C@H](O)c1cccc(c1)Cl 514ba0d0bd618433f3ee790bebf547e4 [1,1,0,0,0,0|1,0,0]=3 1027 B15R1.133 C[C@@H](CO)NCC(=O)c1cccc(c1)Br e4d6f20e5f13beec14785a7434254611 [1,1,0,0,0,0|0,0,2]=4 1028 B15R1.133 C[C@@H](CO)NCC(=O)c1cccc(c1)Cl a71f6589b815c97c10cdb81fe28971bd [1,1,0,0,0,0|0,0,2]=4 1029 B15R1.133 C[C@@H](CO)NCC(=O)c1cccc(c1)F f83e2c22f1bc61276d83ed137c052b12 [1,1,0,0,0,0|0,0,2]=4 1030 B15R1.133 C[C@@H](CO)NCC(=O)c1cccc(c1)I 4ab36511d94594170b8834bb616fefe2 [1,1,0,0,0,0|0,0,2]=4 1031 B15R1.133 C[C@@H](CO)NCC(O)c1cccc(c1)Cl 3e027dee78f4f64f6ed5e9e7a938d468 [1,1,0,0,0,0|0,0,0]=2 1032 B15R1.133 C[C@@H](CO)NC[C@H](O)c1cccc(c1)Cl cfd9843e9b508ffaea933afffbccea89 [1,1,0,0,0,0|0,0,0]=2 1033 B15R1.133 C[C@H](C=O)NCC(O)c1cccc(c1)Cl a9dbbc489d135a18d0127ffc0a46ca32 [1,1,0,0,0,0|0,0,2]=4 1034 B15R1.133 C[C@H](CO)NCC(=O)c1cccc(c1)Br fc73fa844cbe83ca40f2534c56dbe71c [1,1,0,0,0,0|0,0,2]=4 1035 B15R1.133 C[C@H](CO)NCC(=O)c1cccc(c1)Cl 6dd45828a8a73833b0959820a42e6bf9 [1,1,0,0,0,0|0,0,2]=4 1036 B15R1.133 C[C@H](CO)NCC(=O)c1cccc(c1)F 6173fbdce964abab6a624b570caf56a1 [1,1,0,0,0,0|0,0,2]=4 1037 B15R1.133 C[C@H](CO)NCC(=O)c1cccc(c1)I 48f804f79b6fadd07fb4afc0537217a7 [1,1,0,0,0,0|0,0,2]=4 1038 B15R1.133 C[C@H](CO)NCC(O)c1cccc(c1)Cl e0063ef76edb89e1d137feb212444f07 [1,1,0,0,0,0|0,0,0]=2 1039 B15R1.133 C[C@H](CO)NC[C@H](O)c1cccc(c1)Cl 5918ed6dd6f9ffd600a25c1b2d854d4c [1,1,0,0,0,0|0,0,0]=2 1040 B15R1.133 Cc1cccc(c1)C(=O)CNC(C)CO b7342c1a952a346dce21ba9164d9c1ca [1,1,0,0,0,0|0,0,2]=4 1041 B15R1.133 Cc1cccc(c1)C(=O)CN[C@@H](C)CO aa901df00f1cd17811dcc8a2e84197c7 [1,1,0,0,0,0|0,0,2]=4 1042 B15R1.133 Cc1cccc(c1)C(=O)CN[C@H](C)CO 3f3dac943ec5cd45c8a33cdd3ff01fef [1,1,0,0,0,0|0,0,2]=4 1043 B15R1.133 O=C(CO)NCC(O)c1cccc(c1)Cl a5d9f67ca4ed4d97d795bef47f010e2b [1,1,0,0,0,0|1,0,1]=4 1044 B15R1.500 C=C(CNC(C)C(C)O)c1ccccc1 b787770c89285029b1b1b343afe75fbc [1,1,0,0,0,0|1,0,1]=4 1045 B15R1.500 CC(C)C(C)NCC(F)c1ccccc1 25ae52b37810c7d4774775ba0e9e7254 [1,1,0,0,0,0|2,0,0]=4 1046 B15R1.500 CC(C)C(C)NCC(O)c1ccccc1 07833f24e752091ba280366b7e262774 [1,1,0,0,0,0|1,0,0]=3 1047 B15R1.500 CC(C)C(C)NCC(O)c1ccccn1 b2e4dfc1b0eb57e60b34d66be35f020d [1,1,0,0,0,0|2,0,0]=4 1048 B15R1.500 CC(C)C(C)NCC(O)c1cccnc1 1f8acba109077446bea776a1a76653b9 [1,1,0,0,0,0|2,0,0]=4 1049 B15R1.500 CC(C)C(C)NCC(O)c1ccncc1 aca3e686463c2428c265096937481546 [1,1,0,0,0,0|2,0,0]=4 1050 B15R1.500 CC(C)C(C)NC[C@@H](C)c1ccccc1 26ffa78c05310a6c139188b8cadd6f02 [1,1,0,0,0,0|2,0,0]=4 1051 B15R1.500 CC(C)[C@@H](C)NCC(F)c1ccccc1 8e2bcbc385094cab4fab8076951a6fc1 [1,1,0,0,0,0|2,0,0]=4 1052 B15R1.500 CC(C)[C@@H](C)NCC(O)c1ccccc1 80baeda0d3d8308ab414d8767f64989f [1,1,0,0,0,0|1,0,0]=3 1053 B15R1.500 CC(C)[C@@H](C)NC[C@@H](C)c1ccccc1 d9ed7f2abfcb65f9e779e88297c203ea [1,1,0,0,0,0|2,0,0]=4 1054 B15R1.500 CC(C)[C@H](C)NCC(F)c1ccccc1 66caa3a4fb827f598d5106f687b268a0 [1,1,0,0,0,0|2,0,0]=4 1055 B15R1.500 CC(C)[C@H](C)NCC(O)c1ccccc1 5069ad056fb441c7f862a0ccea0e0fa9 [1,1,0,0,0,0|1,0,0]=3 1056 B15R1.500 CC(C)[C@H](C)NC[C@@H](C)c1ccccc1 3d8c0df9edea05e60f7fd5de8efd6877 [1,1,0,0,0,0|2,0,0]=4 1057 B15R1.500 CC(CNC(C)C(C)C)c1ccccc1 9448f2aff92fc31d796a46fff0f9171b [1,1,0,0,0,0|2,0,0]=4 1058 B15R1.500 CC(CNC(C)C(C)O)c1ccccc1 4304bb5bb628e24db00c28405625cc09 [1,1,0,0,0,0|1,0,0]=3 1059 B15R1.500 CC(CN[C@@H](C)C(=O)O)c1ccccc1 0637af331c9b880a503dcfd2bb7eb5d8 [1,1,0,0,0,0|1,0,1]=4 1060 B15R1.500 CC(CN[C@@H](C)C(C)C)c1ccccc1 8bccfc60518a1f9b6f5c24f0f5c0f56a [1,1,0,0,0,0|2,0,0]=4 1061 B15R1.500 CC(CN[C@@H](C)C(F)F)c1ccccc1 93f5506ba7815a5fae9a55331904a5d2 [1,1,0,0,0,0|2,0,0]=4 1062 B15R1.500 CC(CN[C@H](C)C(=O)O)c1ccccc1 75edaee3c1be9113d7f221b5da77df0f [1,1,0,0,0,0|1,0,1]=4 1063 B15R1.500 CC(CN[C@H](C)C(C)C)c1ccccc1 54aae2b2ead754e7aafe879059ef8bec [1,1,0,0,0,0|2,0,0]=4 1064 B15R1.500 CC(CN[C@H](C)C(F)F)c1ccccc1 40997e1379c45461d8efd71c79561914 [1,1,0,0,0,0|2,0,0]=4 1065 B15R1.500 CC(NCC(C)c1ccccc1)C(=O)O 6267671bf911b3ab8696601f834a8bd7 [1,1,0,0,0,0|1,0,1]=4 1066 B15R1.500 CC(NCC(F)c1ccccc1)C(=O)O 3d6d4b07f31eec7c7e64273c7e60f2bb [1,1,0,0,0,0|1,0,1]=4 1067 B15R1.500 CC(NCC(O)c1ccccc1)C(=O)N a65f58ef34bb16cc01b67003884026e4 [1,1,0,0,0,0|0,0,2]=4 1068 B15R1.500 CC(NCC(O)c1ccccc1)C(=O)O 270d29aa588fb84a507b0079b548d3c3 [1,1,0,0,0,0|0,0,1]=3 1069 B15R1.500 CC(NCC(O)c1ccccn1)C(=O)O f58e9785e3f2250463a2388bcd0c0dcd [1,1,0,0,0,0|1,0,1]=4 1070 B15R1.500 CC(NCC(O)c1cccnc1)C(=O)O a97f0380ff77dcf3fdf09d00a6853807 [1,1,0,0,0,0|1,0,1]=4 1071 B15R1.500 CC(NCC(O)c1ccncc1)C(=O)O 3e2038b19dd56e3eeaffd2ddd3d16784 [1,1,0,0,0,0|1,0,1]=4 1072 B15R1.500 CC(NC[C@@H](C)c1ccccc1)C(=O)O 9446353fc54ab1bbb3099939e00bae92 [1,1,0,0,0,0|1,0,1]=4 1073 B15R1.500 CC(NC[C@@H](O)c1ccccc1)C(=O)O b1bc0b213e447174b943d42c6c1a88c6 [1,1,0,0,0,0|0,0,1]=3 1074 B15R1.500 CC(NC[C@H](O)c1ccccc1)C(=O)O 50d40c17fb5c5a6cc4d9c1373dd36bb8 [1,1,0,0,0,0|0,0,1]=3 1075 B15R1.500 CC(O)C(C)NCC(=O)c1ccccc1 84e957d9cbd9d603db26739b47f69392 [1,1,0,0,0,0|0,0,2]=4 1076 B15R1.500 CC(O)C(C)NCC(F)c1ccccc1 272a429ac5b1f7c24d3f57cbfbef8ca2 [1,1,0,0,0,0|1,0,0]=3 1077 B15R1.500 CC(O)C(C)NCC(O)c1ccccc1 92b8d8a77c1311bd07cea05ce43a2361 [1,1,0,0,0,0|0,0,0]=2 1078 B15R1.500 CC(O)C(C)NCC(O)c1cnccn1 545d088f1aa4ea7e07141fbc37558ecd [1,1,0,0,0,0|2,0,0]=4 1079 B15R1.500 CC(O)C(C)NC[C@@H](C)c1ccccc1 e4cfe6404f48428cb14d59cbb01111e4 [1,1,0,0,0,0|1,0,0]=3 1080 B15R1.500 C[C@@H](NCC(F)c1ccccc1)C(=O)O 3a6b8a72ee656d769cbf8fd9024091e4 [1,1,0,0,0,0|1,0,1]=4 1081 B15R1.500 C[C@@H](NCC(F)c1ccccc1)C(F)F 449637ff131298dd3a3f318eb547893a [1,1,0,0,0,0|2,0,0]=4 1082 B15R1.500 C[C@@H](NCC(O)c1ccccc1)C(=O)N 6d51a148aef5705c4e0f2e074c5966e9 [1,1,0,0,0,0|0,0,2]=4 1083 B15R1.500 C[C@@H](NCC(O)c1ccccc1)C(=O)O 95e19e02d9598c39c78a1a0a5953d32f [1,1,0,0,0,0|0,0,1]=3 1084 B15R1.500 C[C@@H](NCC(O)c1ccccc1)C(F)F 751ee86c927fd0cf60bd2a7fa93a92a3 [1,1,0,0,0,0|1,0,0]=3 1085 B15R1.500 C[C@@H](NCC(O)c1ccccn1)C(=O)O d80a2420fb4b22e51f3300b5be848c95 [1,1,0,0,0,0|1,0,1]=4 1086 B15R1.500 C[C@@H](NCC(O)c1cccnc1)C(=O)O d1c4735ae4b96ef7441afe6ea9e9c892 [1,1,0,0,0,0|1,0,1]=4 1087 B15R1.500 C[C@@H](NCC(O)c1ccncc1)C(=O)O 3afbcd761d944583e8a5dc22f09267de [1,1,0,0,0,0|1,0,1]=4 1088 B15R1.500 C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)O a900a3578d35dd48f62efd4d21e9fa0e [1,1,0,0,0,0|0,0,1]=3 1089 B15R1.500 C[C@@H](NC[C@H](O)c1ccccc1)C(=O)O 67f4e5caba9ca509c6f5057bd033dfd1 [1,1,0,0,0,0|0,0,1]=3 1090 B15R1.500 C[C@H](CN[C@@H](C)C(F)F)c1ccccc1 92f6031031eee272c0ccea2c6646152b [1,1,0,0,0,0|2,0,0]=4 1091 B15R1.500 C[C@H](CN[C@H](C)C(=O)O)c1ccccc1 d74f278b18857507d6479756dd459b4e [1,1,0,0,0,0|1,0,1]=4 1092 B15R1.500 C[C@H](CN[C@H](C)C(F)F)c1ccccc1 d55ac340e03d422aff160b48a4588420 [1,1,0,0,0,0|2,0,0]=4 1093 B15R1.500 C[C@H](NCC(F)c1ccccc1)C(=O)O 8aaeeac9ee13be3452cb5ae8e628be2c [1,1,0,0,0,0|1,0,1]=4 1094 B15R1.500 C[C@H](NCC(F)c1ccccc1)C(F)F e7efcd3241909296f87b9fb048ac1ef1 [1,1,0,0,0,0|2,0,0]=4 1095 B15R1.500 C[C@H](NCC(O)c1ccccc1)C(=O)N d635ee46bd1d86a6e533377068fdb1cf [1,1,0,0,0,0|0,0,2]=4 1096 B15R1.500 C[C@H](NCC(O)c1ccccc1)C(=O)O a96a919c49d21007f0b4069228cd69e2 [1,1,0,0,0,0|0,0,1]=3 1097 B15R1.500 C[C@H](NCC(O)c1ccccc1)C(F)F 9255f0028350ae9ee61890f136f7d3e5 [1,1,0,0,0,0|1,0,0]=3 1098 B15R1.500 C[C@H](NCC(O)c1ccccn1)C(=O)O 098c0b4f7309740658f45096359d7e37 [1,1,0,0,0,0|1,0,1]=4 1099 B15R1.500 C[C@H](NCC(O)c1cccnc1)C(=O)O c748d50d7dc849b37ab74a5c5458f772 [1,1,0,0,0,0|1,0,1]=4 1100 B15R1.500 C[C@H](NCC(O)c1ccncc1)C(=O)O 66f146d72ed7c086db32412ef46f4025 [1,1,0,0,0,0|1,0,1]=4 1101 B15R1.500 C[C@H](NC[C@@H](C)c1ccccc1)C(=O)O 392ed64dff7befba6899dc99e02ec13d [1,1,0,0,0,0|1,0,1]=4 1102 B15R1.500 C[C@H](NC[C@@H](O)c1ccccc1)C(=O)O 747cceb49f888d9afa1cd3c0e1d7611e [1,1,0,0,0,0|0,0,1]=3 1103 B15R1.500 C[C@H](NC[C@H](O)c1ccccc1)C(=O)O 794b7bae37a7e0a1a225da8008b77cbd [1,1,0,0,0,0|0,0,1]=3 1104 B15R1.500 O=C(NCC(O)c1ccccc1)C(O)O 7c4c7d9b5a240382b4f95e9817fa4370 [1,1,0,0,0,0|1,0,1]=4 1105 B15R1.500 O=C(NC[C@@H](O)c1ccccc1)C(O)O 8d9cbb4f6b25ea4e3428e8d53204eee2 [1,1,0,0,0,0|1,0,1]=4 1106 B15R1.500 O=C(NC[C@H](O)c1ccccc1)C(O)O d4ca87a8ea8cc79f0a5ef39f23e3110a [1,1,0,0,0,0|1,0,1]=4 1107 B15R1.500 O=C(O)C(O)NCC(O)c1ccccc1 208387b9985705877989efcc0b28a41f [1,1,0,0,0,0|1,0,1]=4 1108 B15R1.500 O=C(O)C(O)NC[C@@H](O)c1ccccc1 2a4f1cbb37db3fbcfe5fae36ed5aa6e1 [1,1,0,0,0,0|1,0,1]=4 1109 B15R1.500 O=C(O)C(O)NC[C@H](O)c1ccccc1 637365a3b50df7f2b30aea35008e0c11 [1,1,0,0,0,0|1,0,1]=4 1110 B15R1.652 C=C(CNC(CO)CO)c1ccccc1 7cacd8525c1b7ab4b97997638c78516f [1,1,0,0,0,0|1,0,1]=4 1111 B15R1.652 C=C[C@@H](CO)NCC(C)c1ccccc1 3726a0d335a4db068cc95977aea64dd2 [1,1,0,0,0,0|1,0,1]=4 1112 B15R1.652 C=C[C@@H](CO)NCC(F)c1ccccc1 09c456c6229b66e53f41b8d6a21a6068 [1,1,0,0,0,0|1,0,1]=4 1113 B15R1.652 C=C[C@@H](CO)NCC(O)c1ccccc1 5d3f3e8b7a19a975307058196c8eea40 [1,1,0,0,0,0|0,0,1]=3 1114 B15R1.652 C=C[C@@H](CO)NC[C@@H](C)c1ccccc1 a40d71f649ae8df80b2e60b87a9e20c9 [1,1,0,0,0,0|1,0,1]=4 1115 B15R1.652 C=C[C@@H](CO)NC[C@@H](O)c1ccccc1 bafd4c925b9397f36bf8e4dc43b3fe07 [1,1,0,0,0,0|0,0,1]=3 1116 B15R1.652 C=C[C@@H](CO)NC[C@H](O)c1ccccc1 2b7dde83f44a930615723c7b1d9487d7 [1,1,0,0,0,0|0,0,1]=3 1117 B15R1.652 CC(CNC(CO)CO)c1ccccc1 8d2d98e220d25d1f413cc33cb6caa025 [1,1,0,0,0,0|1,0,0]=3 1118 B15R1.652 CC(COC(CO)CO)c1ccccc1 13127e821068dd12f7a8408858c56ab1 [1,1,0,0,0,0|2,0,0]=4 1119 B15R1.652 CCC(C=O)NCC(O)c1ccccc1 ebc03a901016fd14397d3fe0289f5547 [1,1,0,0,0,0|0,0,2]=4 1120 B15R1.652 CCC(C=O)NC[C@@H](O)c1ccccc1 5f660345b2d0d5348c2f0950fec2dae7 [1,1,0,0,0,0|0,0,2]=4 1121 B15R1.652 CCC(C=O)NC[C@H](O)c1ccccc1 33822ec90704cb6279572789c4af4b4a [1,1,0,0,0,0|0,0,2]=4 1122 B15R1.652 CCC(CC)NCC(C)c1ccccc1 680309147281353c4a8159780ddc7068 [1,1,0,0,0,0|2,0,0]=4 1123 B15R1.652 CCC(CC)NCC(F)c1ccccc1 60521391d1c36853d89c21d8df2e90b4 [1,1,0,0,0,0|2,0,0]=4 1124 B15R1.652 CCC(CC)NCC(O)c1ccccc1 3fffe4473bf9b2c7fa4ff54bbdde58e3 [1,1,0,0,0,0|1,0,0]=3 1125 B15R1.652 CCC(CC)NCC(O)c1ccccn1 8436d8e873d5c4b3ab2303219b9f9583 [1,1,0,0,0,0|2,0,0]=4 1126 B15R1.652 CCC(CC)NCC(O)c1cccnc1 277739b878605f4582264915e4c57032 [1,1,0,0,0,0|2,0,0]=4 1127 B15R1.652 CCC(CC)NCC(O)c1ccncc1 106bb2c0f40a3eaad6c838fe49daf10e [1,1,0,0,0,0|2,0,0]=4 1128 B15R1.652 CCC(CC)NC[C@@H](C)c1ccccc1 0ce810bab2c437b7fa0ccd87e445c9d7 [1,1,0,0,0,0|2,0,0]=4 1129 B15R1.652 CCC(CC)NC[C@@H](O)c1ccccc1 5296b3128175b9168b34dc140a7ffedb [1,1,0,0,0,0|1,0,0]=3 1130 B15R1.652 CCC(CC)NC[C@H](C)c1ccccc1 e805ae008106f2de8d06dee387d3ee6d [1,1,0,0,0,0|2,0,0]=4 1131 B15R1.652 CCC(CC)NC[C@H](O)c1ccccc1 6176820891ea12db4824aa014379444b [1,1,0,0,0,0|1,0,0]=3 1132 B15R1.652 CCC(CO)NCC(=O)c1ccccc1 85f86a01915a7417e5d37b9d4d7bce7d [1,1,0,0,0,0|0,0,2]=4 1133 B15R1.652 CCC(CO)NCC(C)c1ccccc1 f7d7a12f379df2cc9f3b7c92c71b8938 [1,1,0,0,0,0|1,0,0]=3 1134 B15R1.652 CCC(CO)NCC(F)c1ccccc1 1840c36a707b9d17eb6995c377435968 [1,1,0,0,0,0|1,0,0]=3 1135 B15R1.652 CCC(CO)NCC(O)c1ccccc1 a6430b89e4f78b39da2890cc68594c7e [1,1,0,0,0,0|0,0,0]=2 1136 B15R1.652 CCC(CO)NCC(O)c1ccccn1 17460fca68529c752498f70d24491bf1 [1,1,0,0,0,0|1,0,0]=3 1137 B15R1.652 CCC(CO)NCC(O)c1cccnc1 b5f3f304f6c6e7b4efcd1fa1d76d8a32 [1,1,0,0,0,0|1,0,0]=3 1138 B15R1.652 CCC(CO)NCC(O)c1ccncc1 50d4c3deb7179da86606239427de5d94 [1,1,0,0,0,0|1,0,0]=3 1139 B15R1.652 CCC(CO)NCC(O)c1cnccn1 4797c42fc9083022db7393723eb5d9bc [1,1,0,0,0,0|2,0,0]=4 1140 B15R1.652 CCC(CO)NC[C@@H](C)c1ccccc1 733bd48d9522807ee51a1c74c396ec93 [1,1,0,0,0,0|1,0,0]=3 1141 B15R1.652 CCC(CO)NC[C@@H](O)c1ccccc1 2c21cbf64f8f02c0f27897093e674e05 [1,1,0,0,0,0|0,0,0]=2 1142 B15R1.652 CCC(CO)NC[C@H](C)c1ccccc1 405145dc6bb6efc6d9ff8f43a431054d [1,1,0,0,0,0|1,0,0]=3 1143 B15R1.652 CCC(CO)NC[C@H](O)c1ccccc1 c97fbae7b60ff67cfdaad286cdb2a312 [1,1,0,0,0,0|0,0,0]=2 1144 B15R1.652 CC[C@@H](CO)NCC(=O)c1ccccc1 94d2c05103b50f192ddc87152a92c720 [1,1,0,0,0,0|0,0,2]=4 1145 B15R1.652 CC[C@@H](CO)NCC(C)c1ccccc1 1e6e22fdc5b8c084bde1b9d6f9a8d8a2 [1,1,0,0,0,0|1,0,0]=3 1146 B15R1.652 CC[C@@H](CO)NCC(F)c1ccccc1 d0773623de21ebbcfbe8b51f5859f05e [1,1,0,0,0,0|1,0,0]=3 1147 B15R1.652 CC[C@@H](CO)NCC(O)c1ccccc1 293a306fc722125ec471614ac1121794 [1,1,0,0,0,0|0,0,0]=2 1148 B15R1.652 CC[C@@H](CO)NCC(O)c1cnccn1 7e033ed82a9d615887088f84014d93a9 [1,1,0,0,0,0|2,0,0]=4 1149 B15R1.652 CC[C@@H](CO)NC[C@@H](C)c1ccccc1 045a48132e1cbbe02fd5ce5fb0619299 [1,1,0,0,0,0|1,0,0]=3 1150 B15R1.652 CC[C@H](CO)NCC(=O)c1ccccc1 14819a93f3b737c0ddf0e2fca11b7e02 [1,1,0,0,0,0|0,0,2]=4 1151 B15R1.652 CC[C@H](CO)NCC(C)c1ccccc1 4a057645772c889b181d342ce1072954 [1,1,0,0,0,0|1,0,0]=3 1152 B15R1.652 CC[C@H](CO)NCC(F)c1ccccc1 d54ce7a9ff63de63b2aa29621532f277 [1,1,0,0,0,0|1,0,0]=3 1153 B15R1.652 CC[C@H](CO)NCC(O)c1ccccc1 eb0ecefd18e277aa1e49966879a9c951 [1,1,0,0,0,0|0,0,0]=2 1154 B15R1.652 CC[C@H](CO)NCC(O)c1cnccn1 003bf23e1368616fce2a27f24a9d8c8d [1,1,0,0,0,0|2,0,0]=4 1155 B15R1.652 CC[C@H](CO)NC[C@@H](C)c1ccccc1 2c87109f2add58551e685f40ff639a9a [1,1,0,0,0,0|1,0,0]=3 1156 B15R1.652 C[C@@H](COC(CO)CO)c1ccccc1 f71e573d4a57b4da001db946e38b8877 [1,1,0,0,0,0|2,0,0]=4 1157 B15R1.652 C[C@H](CNC(CO)CO)c1ccccc1 a39ed66cd6f6487d014e8f847adc3aef [1,1,0,0,0,0|1,0,0]=3 1158 B15R1.652 C[C@H](COC(CO)CO)c1ccccc1 40964ea5675c0082329eda549997193c [1,1,0,0,0,0|2,0,0]=4 1159 B15R1.652 O=C(CNC(CO)CO)c1ccccc1 43c9aca24bed309936fff9ce202f92b2 [1,1,0,0,0,0|0,0,2]=4 1160 B15R1.652 O=S(CNC(CO)CO)c1ccccc1 7558ff2a4df44df54dd9c241561ff0ee [1,1,0,0,0,0|1,0,1]=4 1161 B15R1.652 OCC(CO)NCC(F)c1ccccc1 e4ea457e2200b87adf53b54dcae40bea [1,1,0,0,0,0|1,0,0]=3 1162 B15R1.652 OCC(CO)NCC(O)c1ccccc1 d27fab953c675766b4eede936a9017ec [1,1,0,0,0,0|0,0,0]=2 1163 B15R1.652 OCC(CO)NCC(O)c1ccccn1 639167a140709c497cdfd8470ba8519a [1,1,0,0,0,0|1,0,0]=3 1164 B15R1.652 OCC(CO)NCC(O)c1cccnc1 cd02f4594d2fedbb24111ddc3c856771 [1,1,0,0,0,0|1,0,0]=3 1165 B15R1.652 OCC(CO)NCC(O)c1ccncc1 86cb7ef0f5266db2d4f407691cae5f33 [1,1,0,0,0,0|1,0,0]=3 1166 B15R1.652 OCC(CO)NCC(O)c1cnccn1 bc24417aa544eb4a11d90ab3325da9fa [1,1,0,0,0,0|2,0,0]=4 1167 B15R1.652 OCC(CO)NC[C@@H](O)c1ccccc1 e50cdc26a457c192a65bc34810411612 [1,1,0,0,0,0|0,0,0]=2 1168 B15R1.652 OCC(CO)NC[C@H](O)c1ccccc1 95ef65c3e8fc0b4461d836aeced67d3c [1,1,0,0,0,0|0,0,0]=2 1169 B15R1.947 C=CC(C)N(C)CC(O)c1ccccc1 cd230fdfef8ef9555535bb3cea2042a0 [1,1,0,0,0,0|1,0,1]=4 1170 B15R1.947 C=CC(C)N(C)C[C@H](O)c1ccccc1 b478db405ebe6d406aa6fb06f3cf8d99 [1,1,0,0,0,0|1,0,1]=4 1171 B15R1.947 CC(C=O)N(C)CC(O)c1ccccc1 5f7d4ae7c93728b224bc3a36e41fa4a3 [1,1,0,0,0,0|0,0,2]=4 1172 B15R1.947 CC(C=O)N(C)C[C@H](O)c1ccccc1 a095b2d3365f0aec111fd9e963df59b3 [1,1,0,0,0,0|0,0,2]=4 1173 B15R1.947 CC(CO)N(C)CC(O)c1ccccc1 6f55d38db87cb10ae40a764431afa308 [1,1,0,0,0,0|0,0,0]=2 1174 B15R1.947 CC(CO)N(C)CC(O)c1ccncc1 3adc9e3afc267eee0ecc8b368da39052 [1,1,0,0,0,0|1,0,0]=3 1175 B15R1.947 CC(CO)N(C)CC(O)c1cnccn1 adfaa600292fe9502c2b48e353af250c [1,1,0,0,0,0|2,0,0]=4 1176 B15R1.947 CC(CO)N(C)CS(=O)c1ccccc1 be3ff57812488c9f25cad8f9bf5c0de8 [1,1,0,0,0,0|1,0,1]=4 1177 B15R1.947 CC(CO)N(C)C[C@H](O)c1ccccc1 6181eb316318284e4399cff6e9306b72 [1,1,0,0,0,0|0,0,0]=2 1178 B15R1.947 CCC(C)N(C)CC(O)c1ccccc1 6ff47933ce3b7e40dddc8d35b52c254e [1,1,0,0,0,0|1,0,0]=3 1179 B15R1.947 CCC(C)N(C)CC(O)c1ccncc1 7cf117f9068dd06173b972fa954aa82e [1,1,0,0,0,0|2,0,0]=4 1180 B15R1.947 CCC(C)N(C)C[C@H](O)c1ccccc1 3783e00ef0c44e93df743280a741e59a [1,1,0,0,0,0|1,0,0]=3 1181 B15R1.947 CN(CC(O)c1ccccc1)C(=O)CO 85059b516c268230b8630295ab0aa5b0 [1,1,0,0,0,0|1,0,1]=4 1182 B15R1.947 CN(C[C@H](O)c1ccccc1)C(=O)CO 48d221172ba93ca3bade2a7c28ac52d4 [1,1,0,0,0,0|1,0,1]=4 1183 B15R1.947 C[C@@H](CO)N(C)CC(O)c1ccccc1 93971573e4200eaa072bb3d4b4f1ebe1 [1,1,0,0,0,0|0,0,0]=2 1184 B15R1.947 C[C@@H](CO)N(C)CC(O)c1ccncc1 1b16a588ef6758d3e593cd606980a39f [1,1,0,0,0,0|1,0,0]=3 1185 B15R1.947 C[C@@H](CO)N(C)CC(O)c1cnccn1 d036d1df88e3bc1a7987dc872524e6c9 [1,1,0,0,0,0|2,0,0]=4 1186 B15R1.947 C[C@@H](CO)N(C)CS(=O)c1ccccc1 3cb3f4de604ab43b88681b87502b1ee6 [1,1,0,0,0,0|1,0,1]=4 1187 B15R1.947 C[C@@H](CO)N(C)C[C@H](O)c1ccccc1 762a0a6fb2d73a8477bf749fa4477857 [1,1,0,0,0,0|0,0,0]=2 1188 B15R1.947 C[C@H](C=O)N(C)CC(O)c1ccccc1 1e46c514c7045e906e6c446c8107e9b5 [1,1,0,0,0,0|0,0,2]=4 1189 B15R1.947 C[C@H](C=O)N(C)C[C@H](O)c1ccccc1 0cd7c99cb1e56298d5e62b5c1e1af6bc [1,1,0,0,0,0|0,0,2]=4 1190 B15R1.947 C[C@H](CO)N(C)CC(O)c1ccccc1 1f33ce4c2f775c94dd0b6c2c9b436e8c [1,1,0,0,0,0|0,0,0]=2 1191 B15R1.947 C[C@H](CO)N(C)CC(O)c1ccncc1 194bf1b1f34fb3933cb2f5d70ea97c9e [1,1,0,0,0,0|1,0,0]=3 1192 B15R1.947 C[C@H](CO)N(C)CC(O)c1cnccn1 78c9803b1f9801a1b99f281e53705fe1 [1,1,0,0,0,0|2,0,0]=4 1193 B15R1.947 C[C@H](CO)N(C)CS(=O)c1ccccc1 cb5765ab7862332e342fd65b4838fa24 [1,1,0,0,0,0|1,0,1]=4 1194 B15R1.947 C[C@H](CO)N(C)C[C@H](O)c1ccccc1 886ae5817ebe4b5a498739e178717651 [1,1,0,0,0,0|0,0,0]=2 1195 B15R1.950 CC(C(=O)N[C@@H](C)CO)c1ccccc1 f1b569315b4eafee5dd0c5b09bd40a2b [1,1,0,0,0,0|1,0,1]=4 1196 B15R1.950 CC(C(=O)N[C@H](C)CO)c1ccccc1 23375d1491ee76bf1f616ce1892d4758 [1,1,0,0,0,0|1,0,1]=4 1197 B15R1.950 CC(CO)NC(=O)C(C)c1ccccc1 0049220a968ae3ecce6ee7b40c1d56f6 [1,1,0,0,0,0|1,0,1]=4 1198 B15R1.950 CC(CO)NC(=O)C(F)c1ccccc1 23ef519a558156caf3223fa0983fbe9a [1,1,0,0,0,0|1,0,1]=4 1199 B15R1.950 CC(CO)NC(=O)C(O)c1ccccc1 b584674c30ac8f1b6a50cdf1ebb13a02 [1,1,0,0,0,0|0,0,1]=3 1200 B15R1.950 CC(CO)NC(=O)C(O)c1cccnc1 569f539ae9096422df20c88a2096428f [1,1,0,0,0,0|1,0,1]=4 1201 B15R1.950 CC(CO)NC(=O)C(O)c1ccncc1 e19706ac6eed660f236c90367d0036be [1,1,0,0,0,0|1,0,1]=4 1202 B15R1.950 CC(CO)NC(=O)[C@@H](C)c1ccccc1 dc4817d8538f68961a501a47816f87e2 [1,1,0,0,0,0|1,0,1]=4 1203 B15R1.950 CC(CO)NC(=O)[C@@H](O)c1ccccc1 e2fb2e0283a92e9af13668b9d5e77e98 [1,1,0,0,0,0|0,0,1]=3 1204 B15R1.950 CC(CO)NC(=O)[C@H](C)c1ccccc1 692a7c4013fe30eda41aab65b3da11f2 [1,1,0,0,0,0|1,0,1]=4 1205 B15R1.950 CC(CO)NC(=O)[C@H](F)c1ccccc1 087d4d847829d4b08cf0764bf958c940 [1,1,0,0,0,0|1,0,1]=4 1206 B15R1.950 CC(CO)NC(=O)[C@H](O)c1ccccc1 e503e94945fc49e9626598908126e1fe [1,1,0,0,0,0|0,0,1]=3 1207 B15R1.950 CCC(C)NC(=O)C(O)c1ccccc1 3a4094a3445cd9d0611d4621b0045a1d [1,1,0,0,0,0|1,0,1]=4 1208 B15R1.950 CCC(C)NC(=O)[C@@H](O)c1ccccc1 40ab901978974830b3a650337ec57bef [1,1,0,0,0,0|1,0,1]=4 1209 B15R1.950 CCC(C)NC(=O)[C@H](O)c1ccccc1 f1743f1965a04e5eab2b7416ccc3be9c [1,1,0,0,0,0|1,0,1]=4 1210 B15R1.950 CC[C@@H](C)NC(=O)C(O)c1ccccc1 3610dbd0aa05eca068f048b3b29ea855 [1,1,0,0,0,0|1,0,1]=4 1211 B15R1.950 CC[C@@H](C)NC(=O)[C@@H](O)c1ccccc1 26d28695e0f200a05dd3477a3948de7a [1,1,0,0,0,0|1,0,1]=4 1212 B15R1.950 CC[C@@H](C)NC(=O)[C@H](O)c1ccccc1 50db31e354648b5da758da913ef54651 [1,1,0,0,0,0|1,0,1]=4 1213 B15R1.950 CC[C@H](C)NC(=O)C(O)c1ccccc1 661b25ee18fd8064dd97791dba5f4d8a [1,1,0,0,0,0|1,0,1]=4 1214 B15R1.950 CC[C@H](C)NC(=O)[C@@H](O)c1ccccc1 fdc8a0f5ea0ff81d07eab59016a5678f [1,1,0,0,0,0|1,0,1]=4 1215 B15R1.950 CC[C@H](C)NC(=O)[C@H](O)c1ccccc1 aa6472e269985ca785f0ae90409f3cb7 [1,1,0,0,0,0|1,0,1]=4 1216 B15R1.950 C[C@@H](CO)NC(=O)C(F)c1ccccc1 e3cc90010a4d6d9313a50ebd4b197426 [1,1,0,0,0,0|1,0,1]=4 1217 B15R1.950 C[C@@H](CO)NC(=O)C(O)c1ccccc1 1291cf69a4fc698c0bc142804faef066 [1,1,0,0,0,0|0,0,1]=3 1218 B15R1.950 C[C@@H](CO)NC(=O)C(O)c1cccnc1 d62a9cde86b41a11d7a53293787cf864 [1,1,0,0,0,0|1,0,1]=4 1219 B15R1.950 C[C@@H](CO)NC(=O)C(O)c1ccncc1 48fab497665437133ebb4b40dba13791 [1,1,0,0,0,0|1,0,1]=4 1220 B15R1.950 C[C@@H](CO)NC(=O)[C@@H](O)c1ccccc1 35e7052012fd062d1e273e5e2e19b2a4 [1,1,0,0,0,0|0,0,1]=3 1221 B15R1.950 C[C@@H](CO)NC(=O)[C@H](C)c1ccccc1 52bcadc6d1efecfe5d699c7fe0ba9f1d [1,1,0,0,0,0|1,0,1]=4 1222 B15R1.950 C[C@@H](CO)NC(=O)[C@H](F)c1ccccc1 dcc31c503577d845e972b035109d017f [1,1,0,0,0,0|1,0,1]=4 1223 B15R1.950 C[C@@H](CO)NC(=O)[C@H](O)c1ccccc1 6ef4fb4152a7b638a4741eb6920fc903 [1,1,0,0,0,0|0,0,1]=3 1224 B15R1.950 C[C@H](C(=O)N[C@@H](C)CO)c1ccccc1 c305c0c5663aa6960406420400d7db29 [1,1,0,0,0,0|1,0,1]=4 1225 B15R1.950 C[C@H](CO)NC(=O)C(F)c1ccccc1 146ea55dd05317c0a01609b001988f24 [1,1,0,0,0,0|1,0,1]=4 1226 B15R1.950 C[C@H](CO)NC(=O)C(O)c1ccccc1 686d4ae2f4959e745875cac93d3141f1 [1,1,0,0,0,0|0,0,1]=3 1227 B15R1.950 C[C@H](CO)NC(=O)C(O)c1cccnc1 6f144cd34829ae9138c08a5141916a0c [1,1,0,0,0,0|1,0,1]=4 1228 B15R1.950 C[C@H](CO)NC(=O)C(O)c1ccncc1 324ac76015c1d59229f8a12b2a13cd66 [1,1,0,0,0,0|1,0,1]=4 1229 B15R1.950 C[C@H](CO)NC(=O)[C@@H](C)c1ccccc1 0fff138b27dd8cab5f82c7da4fa637ea [1,1,0,0,0,0|1,0,1]=4 1230 B15R1.950 C[C@H](CO)NC(=O)[C@@H](O)c1ccccc1 106f661e68de8da90ae17325c7998971 [1,1,0,0,0,0|0,0,1]=3 1231 B15R1.950 C[C@H](CO)NC(=O)[C@H](C)c1ccccc1 19f32d4321ec6c7cf6db94db0d9d9320 [1,1,0,0,0,0|1,0,1]=4 1232 B15R1.950 C[C@H](CO)NC(=O)[C@H](F)c1ccccc1 4748d706667a72783f2ba9e0c3383687 [1,1,0,0,0,0|1,0,1]=4 1233 B15R1.950 C[C@H](CO)NC(=O)[C@H](O)c1ccccc1 b8ece3c56768c9053215d4e4b6cfcb32 [1,1,0,0,0,0|0,0,1]=3 1234 B15R1.1094 C=CC(C)NCC(C)(O)c1ccccc1 fb20cec8a6c4ba3756cdd0b191029d9f [1,1,0,0,0,0|1,0,1]=4 1235 B15R1.1094 CC(C=O)NCC(C)(O)c1ccccc1 ec3c7aeb35983e5cf6f3a409792ce90b [1,1,0,0,0,0|0,0,2]=4 1236 B15R1.1094 CC(CO)NCC(C)(C)c1ccccn1 ee4d65e460563d8868150c79eb347ffb [1,1,0,0,0,0|2,0,0]=4 1237 B15R1.1094 CC(CO)NCC(C)(C)c1ccncc1 2151b0f8792eff3352d5c9eb9bbd28c3 [1,1,0,0,0,0|2,0,0]=4 1238 B15R1.1094 CC(CO)NCC(C)(O)c1cccnc1 92052a2d780463f8fc1734c747e256a9 [1,1,0,0,0,0|1,0,0]=3 1239 B15R1.1094 CC(CO)NCC(F)(F)c1ccccc1 5e52ffc9c35fb5f99570760cecd95494 [1,1,0,0,0,0|1,0,0]=3 1240 B15R1.1094 CC(CO)NCC(F)(F)c1ccccn1 ee05ad1bc3c388a37a4ae46d3ab6776d [1,1,0,0,0,0|2,0,0]=4 1241 B15R1.1094 CC(CO)NCS(=O)(=O)c1ccccc1 eff6d469a52d3815d385570eb41e9a93 [1,1,0,0,0,0|1,0,1]=4 1242 B15R1.1094 CC(O)(CNC(=O)CO)c1ccccc1 26e5dd9e0ce9fcf7ec3bbe0c1369c628 [1,1,0,0,0,0|1,0,1]=4 1243 B15R1.1094 CCC(C)NCC(C)(O)c1cccnc1 0197b7e8c75be9a2dfd6e552dfd4accb [1,1,0,0,0,0|2,0,0]=4 1244 B15R1.1094 C[C@@H](CO)NCC(C)(C)c1ccccn1 120e7ec76304eed4fdd9194e4a81562f [1,1,0,0,0,0|2,0,0]=4 1245 B15R1.1094 C[C@@H](CO)NCC(C)(C)c1ccncc1 9de4733b90f446ce400cffe374e9b53d [1,1,0,0,0,0|2,0,0]=4 1246 B15R1.1094 C[C@@H](CO)NCC(C)(O)c1cccnc1 6a8f8c3698f33fa0a234e03b8768915c [1,1,0,0,0,0|1,0,0]=3 1247 B15R1.1094 C[C@@H](CO)NCC(F)(F)c1ccccc1 68cc73ddd10056788f5d998689415d29 [1,1,0,0,0,0|1,0,0]=3 1248 B15R1.1094 C[C@@H](CO)NCC(F)(F)c1ccccn1 58e645cec67208d8e485de6ef08c2096 [1,1,0,0,0,0|2,0,0]=4 1249 B15R1.1094 C[C@@H](CO)NCS(=O)(=O)c1ccccc1 b55d5dedfd5b344cfc7308b1efcd8847 [1,1,0,0,0,0|1,0,1]=4 1250 B15R1.1094 C[C@H](C=O)NCC(C)(O)c1ccccc1 24953d823212d5c69e11bafe995fb045 [1,1,0,0,0,0|0,0,2]=4 1251 B15R1.1094 C[C@H](CO)NCC(C)(C)c1ccccn1 cc6670fe5ae4385ddd2499d045ffa81e [1,1,0,0,0,0|2,0,0]=4 1252 B15R1.1094 C[C@H](CO)NCC(C)(C)c1ccncc1 3be27d5db92c465211874a053996d1f9 [1,1,0,0,0,0|2,0,0]=4 1253 B15R1.1094 C[C@H](CO)NCC(C)(O)c1cccnc1 4aabef65470eff07d8b2c134ae8dc3bd [1,1,0,0,0,0|1,0,0]=3 1254 B15R1.1094 C[C@H](CO)NCC(F)(F)c1ccccc1 3a94f30877a3537cdc7f2b0c4d7d8706 [1,1,0,0,0,0|1,0,0]=3 1255 B15R1.1094 C[C@H](CO)NCC(F)(F)c1ccccn1 a315e0dc582b1af25464bf734fa8999d [1,1,0,0,0,0|2,0,0]=4 1256 B15R1.1094 C[C@H](CO)NCS(=O)(=O)c1ccccc1 a21e7cb35e97b88590035c59a179b111 [1,1,0,0,0,0|1,0,1]=4 1257 B15R1.1097 C=CC(C)NCC(CO)c1ccccc1 6991dd0f47b0d6f1d79a927dacf8486a [1,1,0,0,0,0|1,0,1]=4 1258 B15R1.1097 CC(C=O)NCC(CO)c1ccccc1 9be28a8ab890dadbfd79e876f44abdf5 [1,1,0,0,0,0|0,0,2]=4 1259 B15R1.1097 CC(CO)CNC(CO)c1ccccc1 6370c4de012b581e49da69ea1e361d38 [1,1,0,0,0,0|2,0,0]=4 1260 B15R1.1097 CC(CO)CN[C@@H](CO)c1ccccc1 7e50e0fc25155767db862f600b7018b9 [1,1,0,0,0,0|2,0,0]=4 1261 B15R1.1097 CC(CO)CN[C@H](CO)c1ccccc1 7adb96c1c6c538352931fe2203291c97 [1,1,0,0,0,0|2,0,0]=4 1262 B15R1.1097 CC(CO)NCC(CO)c1ccccc1 aafb976575e653dc8cd6920fc2584770 [1,1,0,0,0,0|0,0,0]=2 1263 B15R1.1097 CCC(C)NCC(CO)c1ccccc1 32490267c162a8763763979b06de55d1 [1,1,0,0,0,0|1,0,0]=3 1264 B15R1.1097 CCC(C)OCC(OC)c1ccccc1 7ed2674eb59bff2ad07c7323770ca316 [1,1,0,0,0,0|2,0,0]=4 1265 B15R1.1097 CCC(C)OC[C@H](OC)c1ccccc1 00cb7448e04fa9058a523f3d848feee0 [1,1,0,0,0,0|2,0,0]=4 1266 B15R1.1097 C[C@@H](CO)CNC(CO)c1ccccc1 ba47d5877bc5022412979638cb59154e [1,1,0,0,0,0|2,0,0]=4 1267 B15R1.1097 C[C@@H](CO)CN[C@@H](CO)c1ccccc1 1a35bf9d7c27d6838c0e77203e623656 [1,1,0,0,0,0|2,0,0]=4 1268 B15R1.1097 C[C@@H](CO)CN[C@H](CO)c1ccccc1 87eca96aa607fadf3845a5c26d591e7c [1,1,0,0,0,0|2,0,0]=4 1269 B15R1.1097 C[C@@H](CO)NCC(CO)c1ccccc1 c2632c42a01708c528ea4aefbe66f585 [1,1,0,0,0,0|0,0,0]=2 1270 B15R1.1097 C[C@H](C=O)NCC(CO)c1ccccc1 8193060277130d82bf3834f6decd158c [1,1,0,0,0,0|0,0,2]=4 1271 B15R1.1097 C[C@H](CO)CNC(CO)c1ccccc1 fd117ac4b09a6f3aa9209f072a2ed869 [1,1,0,0,0,0|2,0,0]=4 1272 B15R1.1097 C[C@H](CO)CN[C@@H](CO)c1ccccc1 f24290554f5c82aa0ecb499f45009009 [1,1,0,0,0,0|2,0,0]=4 1273 B15R1.1097 C[C@H](CO)CN[C@H](CO)c1ccccc1 0ff0c90b03f514073e4d6fbc8ea0bfd8 [1,1,0,0,0,0|2,0,0]=4 1274 B15R1.1097 C[C@H](CO)NCC(CO)c1ccccc1 f5856852aaf3d60a4b4b649813de04c1 [1,1,0,0,0,0|0,0,0]=2 1275 B15R1.1097 O=C(CO)NCC(CO)c1ccccc1 d8c789d8b1f90ad16150cace0e51e65a [1,1,0,0,0,0|1,0,1]=4 1276 B15R1.5815 C#CC(C)NCC(O)c1ccccc1Cl 50790208f109f3549b585d045bed7303 [1,1,0,0,0,0|1,0,1]=4 1277 B15R1.5815 C#C[C@@H](C)NCC(O)c1ccccc1Cl 3ba85059cec31d4b7a573e69804b32ad [1,1,0,0,0,0|1,0,1]=4 1278 B15R1.5815 C#C[C@H](C)NCC(O)c1ccccc1Cl 542b60b863f53d2e99a18d3103a85d0d [1,1,0,0,0,0|1,0,1]=4 1279 B15R1.5815 C=CC(C)NCC(O)c1ccccc1Cl d6f15c439a39cc3d4930003add9c7bdc [1,1,0,0,0,0|1,0,1]=4 1280 B15R1.5815 C=CC(C)NCC(O)c1ccccc1F 5e389bb59fc5fa9b904afb2193bc1bc8 [1,1,0,0,0,0|1,0,1]=4 1281 B15R1.5815 CC(C#N)NCC(O)c1ccccc1Cl 11b37831e241a69f63b4adb27d6829f2 [1,1,0,0,0,0|1,0,1]=4 1282 B15R1.5815 CC(C=O)NCC(O)c1ccccc1Br caa8443a0bff2612dc767ba45ab94525 [1,1,0,0,0,0|0,0,2]=4 1283 B15R1.5815 CC(C=O)NCC(O)c1ccccc1Cl 9d900c65de7b7822907effb3ae0c8d01 [1,1,0,0,0,0|0,0,2]=4 1284 B15R1.5815 CC(C=O)NCC(O)c1ccccc1F 51b6697f9402855f6a9365993755dbf4 [1,1,0,0,0,0|0,0,2]=4 1285 B15R1.5815 CC(CO)NCC(=O)c1ccccc1Cl 291c8ef360b539e0f588e9c98f849345 [1,1,0,0,0,0|0,0,2]=4 1286 B15R1.5815 CC(CO)NCC(=O)c1ccccc1F db584a552aad7602f3bad1bc3a225810 [1,1,0,0,0,0|0,0,2]=4 1287 B15R1.5815 CC(CO)NCC(=O)c1ccccc1I 6c4d5627d149eb193cdb808f3bcb68ff [1,1,0,0,0,0|0,0,2]=4 1288 B15R1.5815 CC(CO)NCC(O)c1ccccc1Cl fb43c43203d1d20e730afe9cc16321ae [1,1,0,0,0,0|0,0,0]=2 1289 B15R1.5815 C[C@@H](CO)NCC(=O)c1ccccc1Cl 5d073d2036c280cc0ab49100817c1519 [1,1,0,0,0,0|0,0,2]=4 1290 B15R1.5815 C[C@@H](CO)NCC(=O)c1ccccc1F 87c253128d9d9ae1c985eb71159115f0 [1,1,0,0,0,0|0,0,2]=4 1291 B15R1.5815 C[C@@H](CO)NCC(=O)c1ccccc1I 20eddf16a493a9c35a7178dc9c759fd5 [1,1,0,0,0,0|0,0,2]=4 1292 B15R1.5815 C[C@@H](CO)NCC(O)c1ccccc1Cl b43a37cef50f12c78b85d165f3e4a6f0 [1,1,0,0,0,0|0,0,0]=2 1293 B15R1.5815 C[C@H](C=O)NCC(O)c1ccccc1Br a7c358abecbb9a3700c5e4d4643cbfbb [1,1,0,0,0,0|0,0,2]=4 1294 B15R1.5815 C[C@H](C=O)NCC(O)c1ccccc1Cl 02e9f42e961112be8549cdf0cf21de0b [1,1,0,0,0,0|0,0,2]=4 1295 B15R1.5815 C[C@H](C=O)NCC(O)c1ccccc1F f0b439bb1802694a055ef17051a34249 [1,1,0,0,0,0|0,0,2]=4 1296 B15R1.5815 C[C@H](CO)NCC(=O)c1ccccc1Cl eaa872a683b90ddd7e5d20028289bc09 [1,1,0,0,0,0|0,0,2]=4 1297 B15R1.5815 C[C@H](CO)NCC(=O)c1ccccc1F 08bc94d5715d3715e34e9fc28ea41cfd [1,1,0,0,0,0|0,0,2]=4 1298 B15R1.5815 C[C@H](CO)NCC(=O)c1ccccc1I 94f6c130428942d30ff6ef869b118657 [1,1,0,0,0,0|0,0,2]=4 1299 B15R1.5815 C[C@H](CO)NCC(O)c1ccccc1Cl 7af1c028eba5eea285d5318d49543b9a [1,1,0,0,0,0|0,0,0]=2 1300 B15R1.5815 Cc1ccccc1C(=O)CNC(C)CO 2bd4b5daadcdc775800a66458aaae816 [1,1,0,0,0,0|0,0,2]=4 1301 B15R1.5815 Cc1ccccc1C(=O)CN[C@@H](C)CO 3002d4091bde06f1ea04cc99df7fecc0 [1,1,0,0,0,0|0,0,2]=4 1302 B15R1.5815 Cc1ccccc1C(=O)CN[C@H](C)CO cff1229c4a6fc78820d0ebfe9e19d9dc [1,1,0,0,0,0|0,0,2]=4 1303 B15R1.5815 O=C(CO)NCC(O)c1ccccc1Br 697cc2d168b31529c79b82b86583ab03 [1,1,0,0,0,0|1,0,1]=4 1304 B15R1.5815 O=C(CO)NCC(O)c1ccccc1Cl 783e2ed2bf5ad18e4f2d8f1d187a1d82 [1,1,0,0,0,0|1,0,1]=4 1305 B15R1.5815 O=C(CO)NCC(O)c1ccccc1F 98d701aca76d3bbfd33db042970c535b [1,1,0,0,0,0|1,0,1]=4 1306 B15R1.8 C#CC(C)(C)NCCc1ccc(cc1)Br ace68c56f969f5f50d344725cf758000 [1,1,0,0,0,0|1,0,1]=4 1307 B15R1.8 C#CC(C)(C)NCCc1ccc(cc1)C 8d1d691b615b2df43ffcb135ea137003 [1,1,0,0,0,0|1,0,1]=4 1308 B15R1.8 C#CC(C)(C)NCCc1ccc(cc1)Cl 5d94fecc56aef0193b1de407d658baec [1,1,0,0,0,0|1,0,1]=4 1309 B15R1.8 C#CC(C)(C)NCCc1ccc(cc1)F b99806f4ccc69545b401e1a6d27bfda6 [1,1,0,0,0,0|1,0,1]=4 1310 B15R1.8 C#CC(C)(C)NCCc1ccc(cc1)I eb8ce638991667a51713410c989b7da1 [1,1,0,0,0,0|1,0,1]=4 1311 B15R1.8 CC(C)(C#N)NCCc1ccc(cc1)Br 7f233dd53374fb6f15372576ee669985 [1,1,0,0,0,0|1,0,1]=4 1312 B15R1.8 CC(C)(C#N)NCCc1ccc(cc1)Cl 65659bd3ec1112fc1188ee576a1a33e2 [1,1,0,0,0,0|1,0,1]=4 1313 B15R1.8 CC(C)(C#N)NCCc1ccc(cc1)F 9902e01d0aff70919e18d16f1aece201 [1,1,0,0,0,0|1,0,1]=4 1314 B15R1.8 CC(C)(C#N)NCCc1ccc(cc1)I 4fed9cd663a986591b8d8ac039c2f618 [1,1,0,0,0,0|1,0,1]=4 1315 B15R1.8 CC(C)(CF)NCCc1ccc(cc1)Cl 7d7a6c47174cef1ee35c2bcbc294d7d8 [1,1,0,0,0,0|1,0,0]=3 1316 B15R1.8 CC(C)(CF)NCCc1ccc(cc1)F a046ae6e6982b6c5b43c1cf1a60cb851 [1,1,0,0,0,0|1,0,0]=3 1317 B15R1.8 CC(C)(CF)NCCc1ccc(cc1)I 35f8b97b3ce5c04f7366ff33d509f80e [1,1,0,0,0,0|1,0,0]=3 1318 B15R1.8 CC(C)(CO)CNCc1ccc(cc1)Br 5db04ec2e3a840fdbcc8bee6fdf8bceb [1,1,0,0,0,0|2,0,0]=4 1319 B15R1.8 CC(C)(CO)CNCc1ccc(cc1)Cl 8c0fea2ebf2a367d61158f13a5121156 [1,1,0,0,0,0|2,0,0]=4 1320 B15R1.8 CC(C)(CO)CNCc1ccc(cc1)F 4e2f1f10f964d9b55dd908f8aef497bb [1,1,0,0,0,0|2,0,0]=4 1321 B15R1.8 CC(C)(CO)CNCc1ccc(cc1)I b6847f10ba586b226f471a5e95c88f61 [1,1,0,0,0,0|2,0,0]=4 1322 B15R1.8 CC(C)(CO)NCCc1ccc(cc1)Cl 0ee3bbd5744a4ca086d504ec2aff769f [1,1,0,0,0,0|0,0,0]=2 1323 B15R1.8 CC(C)(CO)NCCc1ccc(cc1)F 080a94d259813fdf48cbd9bdb2596ae0 [1,1,0,0,0,0|0,0,0]=2 1324 B15R1.8 CC(C)(CO)NCCc1ccc(cc1)I 6137a9c0449ec86e28869eb2360962af [1,1,0,0,0,0|0,0,0]=2 1325 B15R1.8 CCC(C)(C)NCCc1ccc(cc1)F f5af90e70c8c3f4e63226f7de18b49e4 [1,1,0,0,0,0|1,0,0]=3 1326 B15R1.8 CCC(C)(C)NCCc1ccc(cc1)I 9890ba37b0f283472e02a83ef2c2177d [1,1,0,0,0,0|1,0,0]=3 1327 B15R1.8 Cc1ccc(cc1)CCNC(C)(C)C#N 1be9daafc1db920c017e368c5fc2d30b [1,1,0,0,0,0|1,0,1]=4 1328 B15R1.8 Cc1ccc(cc1)CCNC(C)(C)CF 08d96a191e7b461c9f5c73b9eae0fbca [1,1,0,0,0,0|1,0,0]=3 1329 B15R1.8 Cc1ccc(cc1)CCNC(C)(C)CO 3eeb686ee39f4938fddd658dce76a2e6 [1,1,0,0,0,0|0,0,0]=2 1330 B15R1.8 Cc1ccc(cc1)CNCC(C)(C)CO e99f52a04a58d463ccf321cb94e3a2da [1,1,0,0,0,0|2,0,0]=4 1331 B15R1.301 C#CC(C)(C)NCCc1cccc(c1)Br 0f6a89c53f5f8fb62f597f3ac7b467c8 [1,1,0,0,0,0|1,0,1]=4 1332 B15R1.301 C#CC(C)(C)NCCc1cccc(c1)C a0e453b3a02326e396966511e5d26ac5 [1,1,0,0,0,0|1,0,1]=4 1333 B15R1.301 C#CC(C)(C)NCCc1cccc(c1)Cl 01145fd82fdbc60fdb3642b01a7da412 [1,1,0,0,0,0|1,0,1]=4 1334 B15R1.301 C#CC(C)(C)NCCc1cccc(c1)F b4d5bb4342afa214181aed3200f0bd2c [1,1,0,0,0,0|1,0,1]=4 1335 B15R1.301 CC(C)(C#N)NCCc1cccc(c1)Br 87184f61c13311763c065f5251e69372 [1,1,0,0,0,0|1,0,1]=4 1336 B15R1.301 CC(C)(C#N)NCCc1cccc(c1)Cl 9d43450775ad68676a10a1b185d0f807 [1,1,0,0,0,0|1,0,1]=4 1337 B15R1.301 CC(C)(C#N)NCCc1cccc(c1)F 6684b53284c79119fcddd575eab810fd [1,1,0,0,0,0|1,0,1]=4 1338 B15R1.301 CC(C)(CF)NCCc1cccc(c1)Br 24271e71f6f5204be4a8c4521479798c [1,1,0,0,0,0|1,0,0]=3 1339 B15R1.301 CC(C)(CF)NCCc1cccc(c1)Cl 17aef31b7d289b734948ed410948e871 [1,1,0,0,0,0|1,0,0]=3 1340 B15R1.301 CC(C)(CF)NCCc1cccc(c1)F 5377dc3700f05df55b632d6e31a73657 [1,1,0,0,0,0|1,0,0]=3 1341 B15R1.301 CC(C)(CO)CNCc1cccc(c1)Br fc5219ee153b6f998a8450902eeaaccf [1,1,0,0,0,0|2,0,0]=4 1342 B15R1.301 CC(C)(CO)CNCc1cccc(c1)Cl ece1cb25c7a3cfdd58f007640a2ad084 [1,1,0,0,0,0|2,0,0]=4 1343 B15R1.301 CC(C)(CO)CNCc1cccc(c1)F 71076738ed6030e2f53ce4b9fb675afe [1,1,0,0,0,0|2,0,0]=4 1344 B15R1.301 CC(C)(CO)CNCc1cccc(c1)I 94d3ab9ad88e8e7ee01560b095a5290f [1,1,0,0,0,0|2,0,0]=4 1345 B15R1.301 CC(C)(CO)NCCc1cccc(c1)Br 2516e0f2c1ea4282066179aa3a34f396 [1,1,0,0,0,0|0,0,0]=2 1346 B15R1.301 CC(C)(CO)NCCc1cccc(c1)Cl edb76529d410df76a10bb4787319fde1 [1,1,0,0,0,0|0,0,0]=2 1347 B15R1.301 CC(C)(CO)NCCc1cccc(c1)F cbad4116742b3be6681e38d6e9b5c86e [1,1,0,0,0,0|0,0,0]=2 1348 B15R1.301 CC(C)(CO)NCCc1cncc(n1)Cl 6f46cd042e282f94b4cc02fcbd57ab5f [1,1,0,0,0,0|2,0,0]=4 1349 B15R1.301 CCC(C)(C)NCCc1cccc(c1)C cf4c608314b3f18ece31e56eba777ce3 [1,1,0,0,0,0|1,0,0]=3 1350 B15R1.301 CCC(C)(C)NCCc1cccc(c1)Cl 2c1376f9290351dea870d702fe7e2240 [1,1,0,0,0,0|1,0,0]=3 1351 B15R1.301 CCC(C)(C)NCCc1cccc(c1)F e2769b2ad1332432d2aa2e456f8d0603 [1,1,0,0,0,0|1,0,0]=3 1352 B15R1.301 Cc1cccc(c1)CCNC(C)(C)C#N 9c8002c7cff9e4ae2dfb9bb4559c85b2 [1,1,0,0,0,0|1,0,1]=4 1353 B15R1.301 Cc1cccc(c1)CCNC(C)(C)CF 6e02f43af866a25252ae6b4683866440 [1,1,0,0,0,0|1,0,0]=3 1354 B15R1.301 Cc1cccc(c1)CCNC(C)(C)CO c7db36c3ae000dd4a8979ddb2acfcc17 [1,1,0,0,0,0|0,0,0]=2 1355 B15R1.301 Cc1cccc(c1)CNCC(C)(C)CO 45a7d8d8eb0322c0be41a3bf13ca29ec [1,1,0,0,0,0|2,0,0]=4 1356 B15R1.339 CC(C)(CO)NC(=O)Cc1ccccn1 3e15db591b35e666f3502cf06295eb26 [1,1,0,0,0,0|1,0,1]=4 1357 B15R1.339 CC(C)(CO)NC(=O)Cc1cccnc1 567270c4fe0a4fc6d5e3bde6e6093477 [1,1,0,0,0,0|1,0,1]=4 1358 B15R1.339 CC(C)(CO)NC(=O)Cc1ccncc1 467382080efc5b447841f8d7a04157cd [1,1,0,0,0,0|1,0,1]=4 1359 B15R1.339 CC(C)(CO)NC(=S)Nc1ccccc1 d8fc46fb56ff1bb3c03969921707e754 [1,1,0,0,0,0|1,0,1]=4 1360 B15R1.339 CN(Cc1ccccc1)CC(C)(C)CO 049e2a3274d7adf0f27f294c63ffb618 [1,1,0,0,0,0|2,0,0]=4 1361 B15R1.348 CCC(C)(C)N(C)CCc1ccccc1 132b49a9a8e635a8a2e87c8b8242ee63 [1,1,0,0,0,0|1,0,0]=3 1362 B15R1.348 CCC(C)(C)N(C)CCc1ccccn1 646d20f42ec1956c57f1f94014d92a74 [1,1,0,0,0,0|2,0,0]=4 1363 B15R1.348 CCC(C)(C)N(C)CCc1cccnc1 e817c9b5b41e77a5c8d403548c730854 [1,1,0,0,0,0|2,0,0]=4 1364 B15R1.348 CCC(C)(C)N(C)CCc1ccncc1 0e50bc4fdca415095aad91eb6d4cebef [1,1,0,0,0,0|2,0,0]=4 1365 B15R1.348 CN(CCc1ccccc1)C(C)(C)CO d23ba7776c53283d7176347ba617cec8 [1,1,0,0,0,0|0,0,0]=2 1366 B15R1.348 CN(CCc1ccccn1)C(C)(C)CO 39d2aa079f2b4823f66291cc825499e0 [1,1,0,0,0,0|1,0,0]=3 1367 B15R1.348 CN(CCc1cccnc1)C(C)(C)CO 0a715e39159d09431e84fe3f2f9c45bd [1,1,0,0,0,0|1,0,0]=3 1368 B15R1.348 CN(CCc1ccncc1)C(C)(C)CO d726befaabb4b120ae1c695ebb5718e4 [1,1,0,0,0,0|1,0,0]=3 1369 B15R1.3091 C#CC(C)(CC)NCCc1ccccc1 df6966ae17c89fdc55a46186e6d4c416 [1,1,0,0,0,0|1,0,1]=4 1370 B15R1.3091 CC(CO)(CO)NCCc1ccccc1 332acf3cdbfc48fcda0bb5a9f4b320d8 [1,1,0,0,0,0|0,0,0]=2 1371 B15R1.3091 CC(CO)(CO)NCCc1ccccn1 d7267f2d0206745b14889353def23c81 [1,1,0,0,0,0|1,0,0]=3 1372 B15R1.3091 CC(CO)(CO)NCCc1cccnc1 799f827c171653a54c5521a1c6689d6d [1,1,0,0,0,0|1,0,0]=3 1373 B15R1.3091 CC(CO)(CO)NCCc1ccncc1 093002e0cccfa32e6a2f7867bdf0f874 [1,1,0,0,0,0|1,0,0]=3 1374 B15R1.3091 CCC(C)(CC)NCCc1ccccc1 6c1450850c8df129d46e8ec1cdd524c1 [1,1,0,0,0,0|1,0,0]=3 1375 B15R1.3091 CCC(C)(CC)NCCc1ccccn1 6319a2748bc9dfe84223f2036ede213e [1,1,0,0,0,0|2,0,0]=4 1376 B15R1.3091 CCC(C)(CC)NCCc1cccnc1 9f3050eeb6c6e8952ce207a484548d3d [1,1,0,0,0,0|2,0,0]=4 1377 B15R1.3091 CCC(C)(CC)NCCc1ccncc1 fa364701f380b3e863499b1ada6e1842 [1,1,0,0,0,0|2,0,0]=4 1378 B15R1.3091 CCC(C)(CO)NCCc1ccccn1 3c5c0a99d7d95f954ae19e00dfa6da26 [1,1,0,0,0,0|1,0,0]=3 1379 B15R1.3091 CCC(C)(CO)NCCc1cccnc1 6ea99e9c04af9181db0707d351ba6dca [1,1,0,0,0,0|1,0,0]=3 1380 B15R1.3091 CCC(C)(CO)NCCc1ccncc1 cd7c7be6e2a3d3bef4986b3d0a3b1122 [1,1,0,0,0,0|1,0,0]=3 1381 B15R1.7696 C#CC(C)(C)NCCc1ccccc1C 099177824c9444c3d0b37c498431d613 [1,1,0,0,0,0|1,0,1]=4 1382 B15R1.7696 C#CC(C)(C)NCCc1ccccc1Cl da52fe48cde3898ff181d5b8909e9fba [1,1,0,0,0,0|1,0,1]=4 1383 B15R1.7696 C#CC(C)(C)NCCc1ccccc1F f3617037a01b730a373ef5f345ed7216 [1,1,0,0,0,0|1,0,1]=4 1384 B15R1.7696 C#CC(C)(C)NCCc1ccccc1I 66baf7b7a448dff502d11494d03ee8bf [1,1,0,0,0,0|1,0,1]=4 1385 B15R1.7696 CC(C)(C#N)NCCc1ccccc1Cl 74ecb3b14d0726f37fb05916f87a8bd0 [1,1,0,0,0,0|1,0,1]=4 1386 B15R1.7696 CC(C)(C#N)NCCc1ccccc1F 082ea62a1233d153765a1c46c29e96cf [1,1,0,0,0,0|1,0,1]=4 1387 B15R1.7696 CC(C)(C#N)NCCc1ccccc1I dee02748a56f2fbbe0563abce00f5992 [1,1,0,0,0,0|1,0,1]=4 1388 B15R1.7696 CC(C)(CF)NCCc1ccccc1F db0d4c2a73f617edf389c6e82ee15aa2 [1,1,0,0,0,0|1,0,0]=3 1389 B15R1.7696 CC(C)(CO)CNCc1ccccc1Br 190d3c6babff4510a7fba4e4b6442054 [1,1,0,0,0,0|2,0,0]=4 1390 B15R1.7696 CC(C)(CO)CNCc1ccccc1Cl 01ad82fb164450c70099fa5847c8a56f [1,1,0,0,0,0|2,0,0]=4 1391 B15R1.7696 CC(C)(CO)CNCc1ccccc1F 90234fa96bc9c1e13caa02aeb50864c9 [1,1,0,0,0,0|2,0,0]=4 1392 B15R1.7696 CC(C)(CO)CNCc1ccccc1I 9cec95610533495f5343783227f99309 [1,1,0,0,0,0|2,0,0]=4 1393 B15R1.7696 CC(C)(CO)NCCc1ccccc1F d9e998b8daff232ba390d7bae15561d5 [1,1,0,0,0,0|0,0,0]=2 1394 B15R1.7696 CC(C)(CO)NCCc1ccccc1I 8905e3968d99b38437823e7a3f2d2817 [1,1,0,0,0,0|0,0,0]=2 1395 B15R1.7696 Cc1ccccc1CCNC(C)(C)C#N f12961de6d13c8fb20aeb1208e307745 [1,1,0,0,0,0|1,0,1]=4 1396 B15R1.7696 Cc1ccccc1CCNC(C)(C)CO d072d932a3aa3352ff6628f58eb9ac95 [1,1,0,0,0,0|0,0,0]=2 1397 B15R1.7696 Cc1ccccc1CNCC(C)(C)CO 415cc1999342b36ae53a0d5c2572f52a [1,1,0,0,0,0|2,0,0]=4 1398 B15R1.9012 CC(=O)C(C)(C)NCCc1ccccc1 61dda096d23b0960ce9301027bc20349 [1,1,0,0,0,0|0,0,2]=4 1399 B15R1.9012 CC(C)(NCCc1ccccc1)C(=O)N bd8fb87756b5b9271c79197905f091f9 [1,1,0,0,0,0|0,0,2]=4 1400 B15R1.9012 CC(C)(NCCc1ccccc1)C(=O)O f04a5a2507c63f9f22bd3bd8a3ac864d [1,1,0,0,0,0|0,0,1]=3 1401 B15R1.9012 CC(C)(NCCc1ccccn1)C(=O)O b106ea75c0ce1585a8d6a896f11a6377 [1,1,0,0,0,0|1,0,1]=4 1402 B15R1.9012 CC(C)(NCCc1cccnc1)C(=O)O 92bc8425f9aa1e93f4bfe78d0dd273d7 [1,1,0,0,0,0|1,0,1]=4 1403 B15R1.9012 CC(C)(NCCc1ccncc1)C(=O)O 24a252ee1aa35a56eaf0eedbec8aca27 [1,1,0,0,0,0|1,0,1]=4 1404 B15R1.9012 CC(C)(NCSc1ccccc1)C(=O)O e3aa725562f71428cc9a3adb04e3b8df [1,1,0,0,0,0|1,0,1]=4 1405 B15R1.9012 CC(C)C(C)(C)NCCc1ccccc1 595f09d039b87f88cc7816707d9473da [1,1,0,0,0,0|1,0,0]=3 1406 B15R1.9012 CC(C)C(C)(C)NCCc1ccccn1 4044d34b5d06b42bf9d85519d0feb237 [1,1,0,0,0,0|2,0,0]=4 1407 B15R1.9012 CC(C)C(C)(C)NCCc1cccnc1 bf95783349911004cc1f2a16bed027eb [1,1,0,0,0,0|2,0,0]=4 1408 B15R1.9012 CC(C)C(C)(C)NCCc1ccncc1 6dbf9a4abd3b98d5eb877d5aee3a9af2 [1,1,0,0,0,0|2,0,0]=4 1409 B15R1.9012 CC(O)C(C)(C)CNCc1ccccc1 9413b7498deee945ec5cfbeafa6444d8 [1,1,0,0,0,0|2,0,0]=4 1410 B15R1.9012 CC(O)C(C)(C)NCCc1ccccc1 d365e857a975e40f2d3fa451f2f23038 [1,1,0,0,0,0|0,0,0]=2 1411 B15R1.9012 CC(O)C(C)(C)NCCc1ccccn1 000a8271467350d1067d588fa671b795 [1,1,0,0,0,0|1,0,0]=3 1412 B15R1.9012 CC(O)C(C)(C)NCCc1cccnc1 bc4e41e11fc1ef09403ed4ff1f1f7dde [1,1,0,0,0,0|1,0,0]=3 1413 B15R1.9012 CC(O)C(C)(C)NCCc1ccncc1 b2ae8f0fe72e163f34aaefe042a4e603 [1,1,0,0,0,0|1,0,0]=3 1414 B15R1.9539 CC(C)(CCO)NCCc1ccccc1 624703da58ada22a73ad295e14e5a3a0 [1,1,0,0,0,0|0,0,0]=2 1415 B15R1.9539 CC(C)(CCO)NCCc1ccccn1 5cc05eac6691e468cbda6020edc90cf6 [1,1,0,0,0,0|1,0,0]=3 1416 B15R1.9539 CC(C)(CCO)NCCc1cccnc1 4fc269147104619894adeec8689702d9 [1,1,0,0,0,0|1,0,0]=3 1417 B15R1.9539 CC(C)(CCO)NCCc1ccncc1 ab788773f612e335aaabd553bc5cce8b [1,1,0,0,0,0|1,0,0]=3 1418 B15R1.9539 CC(C)(CCO)NCSc1ccccc1 70e037367a65755c8cc4fc8174b4fccf [1,1,0,0,0,0|1,0,0]=3 1419 B15R1.9539 COCC(C)(C)COCc1ccccc1 8dbc74d27f98cd547444cbae268fb63f [1,1,0,0,0,0|2,0,0]=4 1420 B15R1.9539 COCC(C)(C)NCCc1ccccc1 75cf8601addb62702a765186221c63ab [1,1,0,0,0,0|0,0,0]=2 1421 B15R1.9539 COCC(C)(C)NCCc1ccccn1 47122a724a58310b347c2a37a53a65a4 [1,1,0,0,0,0|1,0,0]=3 1422 B15R1.9539 COCC(C)(C)NCCc1cccnc1 555042535bab05d49fad775f28ab40e6 [1,1,0,0,0,0|1,0,0]=3 1423 B15R1.9539 COCC(C)(C)NCCc1ccncc1 a8205edefe3994c4c9398984a2c9678f [1,1,0,0,0,0|1,0,0]=3 1424 B15R1.9539 CSCC(C)(C)NCCc1ccccc1 84328d5c20338bcc66edcb562c6c1da1 [1,1,0,0,0,0|0,1,0]=3 1425 B15R1.9539 CSCC(C)(C)NCCc1ccccn1 56e443f69c5ccef9d4985f197cff161b [1,1,0,0,0,0|1,1,0]=4 1426 B15R1.9539 CSCC(C)(C)NCCc1cccnc1 4e020fb1a7740042cedf4387817cb781 [1,1,0,0,0,0|1,1,0]=4 1427 B15R1.9539 CSCC(C)(C)NCCc1ccncc1 6040ad10e214215e74b07912c32505c7 [1,1,0,0,0,0|1,1,0]=4 1428 B15R1.892 CC(C)(C)NCC(=O)c1ccc(cc1)Br 85a311d9060be6877508dde7f22202e4 [1,1,0,0,0,0|0,0,2]=4 1429 B15R1.892 CC(C)(C)NCC(=O)c1ccc(cc1)Cl b9c3581f7c24153f364281076a3b5438 [1,1,0,0,0,0|0,0,2]=4 1430 B15R1.892 CC(C)(C)NCC(=O)c1ccc(cc1)F beda64ffbfc28a614492ff5193caa76c [1,1,0,0,0,0|0,0,2]=4 1431 B15R1.892 CC(C)(C)NCC(=O)c1ccc(cc1)I 9e7c4aed6df610d02bc24e39c06775c8 [1,1,0,0,0,0|0,0,2]=4 1432 B15R1.892 CC(C)(C)NCC(O)c1ccc(cc1)Br 498dfa77076ef00653ee4fa1c0809d32 [1,1,0,0,0,0|0,0,0]=2 1433 B15R1.892 CC(C)(C)NCC(O)c1ccc(cc1)Cl 8c9a9199659a762be0f3140e90347284 [1,1,0,0,0,0|0,0,0]=2 1434 B15R1.892 CC(C)(C)NC[C@@H](O)c1ccc(cc1)Br 09708145fbc37148a134931e91a12a87 [1,1,0,0,0,0|0,0,0]=2 1435 B15R1.892 CC(C)(C)NC[C@@H](O)c1ccc(cc1)F b9fed08d01ad12fbabc20152a461a47a [1,1,0,0,0,0|0,0,0]=2 1436 B15R1.892 CC(C)(C)NC[C@H](O)c1ccc(cc1)Br 27a39815eacfa25d470a5f94a922d13a [1,1,0,0,0,0|0,0,0]=2 1437 B15R1.892 CC(C)(C)NC[C@H](O)c1ccc(cc1)Cl 5c91a86c9c63bb3783f752545de286dd [1,1,0,0,0,0|0,0,0]=2 1438 B15R1.892 CC(C)(C)NC[C@H](O)c1ccc(cc1)F 2bc57c5f50ef14c07d5924e70043f668 [1,1,0,0,0,0|0,0,0]=2 1439 B15R1.892 Cc1ccc(cc1)C(=O)CNC(C)(C)C 8b3e885ebfcaae86f68d91453b428a7b [1,1,0,0,0,0|0,0,2]=4 1440 B15R1.3977 CC(C)(C)NC(=O)C(O)c1cccnc1 28dff2b4958ef65dc2969a4869984f28 [1,1,0,0,0,0|1,0,1]=4 1441 B15R1.3977 CC(C)(C)NC(=O)C(O)c1ccncc1 8607914fe4935fdf4095941c82c30f14 [1,1,0,0,0,0|1,0,1]=4 1442 B15R1.5334 CC(C)(C)CNC(CO)c1ccccc1 6241b304668c79b9d734d997887c72ad [1,1,0,0,0,0|2,0,0]=4 1443 B15R1.5334 CC(C)(C)CN[C@@H](CO)c1ccccc1 f7fa052400701aca1dde80acde894b53 [1,1,0,0,0,0|2,0,0]=4 1444 B15R1.5334 CC(C)(C)CN[C@H](CO)c1ccccc1 b71fe60f9fd5df731539ec6bdeb2326e [1,1,0,0,0,0|2,0,0]=4 1445 B15R1.5334 CC(C)(O)CNC(CO)c1ccccc1 18ebef4f494742c4b87f317c07577519 [1,1,0,0,0,0|2,0,0]=4 1446 B15R1.5334 CC(C)(O)CN[C@@H](CO)c1ccccc1 05781a13364650535fd872defb56d079 [1,1,0,0,0,0|2,0,0]=4 1447 B15R1.5334 CC(C)(O)CN[C@H](CO)c1ccccc1 1148437c6c3be4a1d2f9cd119b62ed35 [1,1,0,0,0,0|2,0,0]=4 1448 B15R1.5392 C=C(CN(C)C(C)(C)C)c1ccccc1 60848a503dc81e9bc017a97ef78f6eb2 [1,1,0,0,0,0|1,0,1]=4 1449 B15R1.5392 CC(CN(C)C(C)(C)C)c1ccccc1 719c67a5e3b11f16e549ff12e3975154 [1,1,0,0,0,0|1,0,0]=3 1450 B15R1.5392 CN(CC(=O)c1ccccc1)C(C)(C)C 588de38e6b8adad22d894b152e7e40b9 [1,1,0,0,0,0|0,0,2]=4 1451 B15R1.5392 CN(CC(O)c1ccccc1)C(C)(C)C 7800b566965b437093fd704fcebf4475 [1,1,0,0,0,0|0,0,0]=2 1452 B15R1.5392 CN(CC(O)c1cnccn1)C(C)(C)C 70bac4930616d1f5d53df211fb7f4c98 [1,1,0,0,0,0|2,0,0]=4 1453 B15R1.5392 C[C@H](CN(C)C(C)(C)C)c1ccccc1 4976ca98441f9bd57ced7e0151e137d5 [1,1,0,0,0,0|1,0,0]=3 1454 B15R1.8018 CC(C)(C)NCC(=O)c1ccccc1Cl 15c2b97ad2db5e9d8bb0da82967ea0ce [1,1,0,0,0,0|0,0,2]=4 1455 B15R1.8018 CC(C)(C)NCC(=O)c1ccccc1F 00a2301059cfbb193e683d8f959747e1 [1,1,0,0,0,0|0,0,2]=4 1456 B15R1.8018 CC(C)(C)NCC(=O)c1ccccc1I b99d31f83ea0d8ac7c65e1dc571c4f88 [1,1,0,0,0,0|0,0,2]=4 1457 B15R1.8018 CC(C)(C)NCC(O)c1ccccc1Cl ec04ffa19611e4885b81f6ac142fe17d [1,1,0,0,0,0|0,0,0]=2 1458 B15R1.8018 Cc1ccccc1C(=O)CNC(C)(C)C affecfe2cef13f3537826c0847b2284a [1,1,0,0,0,0|0,0,2]=4 1459 B15R1.8277 CC(C)(C)NCC(=O)c1cccc(c1)Br c3511de63bf98cecabf3cb050a74eb2a [1,1,0,0,0,0|0,0,2]=4 1460 B15R1.8277 CC(C)(C)NCC(=O)c1cccc(c1)Cl 6979f4b0f14bbbef658f6882803941fe [1,1,0,0,0,0|0,0,2]=4 1461 B15R1.8277 CC(C)(C)NCC(=O)c1cccc(c1)F 5a8e604ee36e142a39f9d9148a8b3b4c [1,1,0,0,0,0|0,0,2]=4 1462 B15R1.8277 CC(C)(C)NCC(=O)c1cccc(c1)I 88269a244c83ad71784e56948781ceca [1,1,0,0,0,0|0,0,2]=4 1463 B15R1.8277 CC(C)(C)NC[C@H](O)c1cccc(c1)Cl a3d786972204d00b13567ac5bd9ecdf5 [1,1,0,0,0,0|0,0,0]=2 1464 B15R1.8277 Cc1cccc(c1)C(=O)CNC(C)(C)C e6d340b3c3b016456d9fe75dce1b8ef3 [1,1,0,0,0,0|0,0,2]=4 1465 B15R1.23261 CC(C)(C)NCC(F)(F)c1ccccc1 f0c69f3adb0a0ac27f8237e103ebab87 [1,1,0,0,0,0|1,0,0]=3 1466 B15R1.23261 CC(C)(C)NCS(=O)(=O)c1ccccc1 a4b746ccb1e5372e5149d08977337f7e [1,1,0,0,0,0|1,0,1]=4 1467 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)Br 90bba2b769105a17cf081aa83edcf172 [0,1,0,0,1,0|0,0,2]=4 1468 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)Cl 27a62956e13aa4957bfcfefcc8ac2365 [0,1,0,0,1,0|0,0,2]=4 1469 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)F 4fe1460c2e886cc61d18471f757e2c80 [0,1,0,0,1,0|0,0,2]=4 1470 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)I 94e6c20bb0bada4a67c3dd469a6b6613 [0,1,0,0,1,0|0,0,2]=4 1471 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)O 755b32c94b06d171e79d91148cbfb6a2 [0,1,0,0,1,0|0,0,2]=4 1472 B15R1.299 CC(C)(CO)NC(=O)c1ccc(cc1)S 11e4b7f84581c84174f9a4ad4a00a7e8 [0,1,0,0,1,0|0,0,2]=4 1473 B15R1.299 CC(NC(C)(C)CF)c1ccc(cc1)F 7c170ba4424c8b99cb8251bf9a1375ea [0,1,0,0,1,0|2,0,0]=4 1474 B15R1.299 CC(NC(C)(C)CO)c1ccc(cc1)F ae666aff89d2b5db7d9769fc4987ad4c [0,1,0,0,1,0|1,0,0]=3 1475 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)Br 242de237110cac868d03056e6df5e485 [0,1,0,0,1,0|2,0,0]=4 1476 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)Cl 8c43fe6257404f17d3f72904d88dd146 [0,1,0,0,1,0|2,0,0]=4 1477 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)F 1c52c8157dfb60279422f2df0386b7b3 [0,1,0,0,1,0|2,0,0]=4 1478 B15R1.299 CN(CC(C)(C)CO)c1ccc(cc1)I 2b85549fa25d90a2adfa651c79e7bdec [0,1,0,0,1,0|2,0,0]=4 1479 B15R1.299 Cc1ccc(cc1)C(=O)NC(C)(C)CO 55f963e4a5b3924948c3069fdca3481b [0,1,0,0,1,0|0,0,2]=4 1480 B15R1.300 CC(C)(CO)NC(=O)c1cccc(c1)Br 502c7817a99a633317484c83caea13f4 [0,1,0,0,1,0|0,0,2]=4 1481 B15R1.300 CC(C)(CO)NC(=O)c1cccc(c1)Cl caf88bd1181be717cecb7848024ceecf [0,1,0,0,1,0|0,0,2]=4 1482 B15R1.300 CC(C)(CO)NC(=O)c1cccc(c1)F febfbeb99ebf9b9ffec775322a8a469f [0,1,0,0,1,0|0,0,2]=4 1483 B15R1.300 CC(C)(CO)NC(=O)c1cccc(c1)I ecfb641192feddb13952024a779a9221 [0,1,0,0,1,0|0,0,2]=4 1484 B15R1.300 CC(C)(CO)NC(=O)c1cccc(c1)O ea07df635c736c2e4925b2c1101833e8 [0,1,0,0,1,0|0,0,2]=4 1485 B15R1.300 CC(C)(CO)NC(=O)c1cccc(c1)S ec803fc7eff09256847652882b56e884 [0,1,0,0,1,0|0,0,2]=4 1486 B15R1.300 CC(NC(C)(C)CF)c1cccc(c1)F 7b8121462b36090a320e6388c27dda55 [0,1,0,0,1,0|2,0,0]=4 1487 B15R1.300 CC(NC(C)(C)CO)c1cccc(c1)F 010f471f2b2105d35e3fef2993493584 [0,1,0,0,1,0|1,0,0]=3 1488 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)Br 85af3fdea21b7d5a2a17648481c4fe13 [0,1,0,0,1,0|2,0,0]=4 1489 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)Cl 668cfbda456f2f616997a6e177f17498 [0,1,0,0,1,0|2,0,0]=4 1490 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)F 95abdbcb1e58553652840a8b59e42e7b [0,1,0,0,1,0|2,0,0]=4 1491 B15R1.300 CN(CC(C)(C)CO)c1cccc(c1)I 553f5d54040351f70e23c915aad98449 [0,1,0,0,1,0|2,0,0]=4 1492 B15R1.300 Cc1cccc(c1)C(=O)NC(C)(C)CO 192e58edcfa422905c68f7a4c4a50a41 [0,1,0,0,1,0|0,0,2]=4 1493 B15R1.2992 CC(CO)(CO)NC(=O)c1ccccc1 3e604b6128365cc3972cda1dd4e64395 [0,1,0,0,1,0|0,0,2]=4 1494 B15R1.2992 CCC(C)(CO)NC(=O)c1ccccc1 51de6d4e3847ef90ea07fdabf262375d [0,1,0,0,1,0|0,0,2]=4 1495 B15R1.3001 CC(c1ccccn1)N(C)C(C)(C)CO 6ec97f4a1eed00be44eac7d2b3801323 [0,1,0,0,1,0|2,0,0]=4 1496 B15R1.3001 CN(C(=O)c1ccccc1)C(C)(C)CO 9d4ed07e3c1a1b0670b25c9f1fa11663 [0,1,0,0,1,0|0,0,2]=4 1497 B15R1.7724 CC(C)(CO)NC(=O)c1ccccc1Br 19ad514ac8bc80c8933f3cdde0d960e8 [0,1,0,0,1,0|0,0,2]=4 1498 B15R1.7724 CC(C)(CO)NC(=O)c1ccccc1Cl 43c176681c25019b2c2399ca94c9739b [0,1,0,0,1,0|0,0,2]=4 1499 B15R1.7724 CC(C)(CO)NC(=O)c1ccccc1F 0ccb0d414b075ff00bdb3bd5613a17e2 [0,1,0,0,1,0|0,0,2]=4 1500 B15R1.7724 CC(C)(CO)NC(=O)c1ccccc1I cbc22cc43cf1686afc4aa652abf52dff [0,1,0,0,1,0|0,0,2]=4 1501 B15R1.7724 CC(C)(CO)NC(=O)c1ccccc1O bd2001a091452eaa6b5cca4da925db25 [0,1,0,0,1,0|0,0,2]=4 1502 B15R1.7724 CC(C)(CO)NC(=O)c1ccccc1S d62f3582601fa19be8aeae3207db3d9f [0,1,0,0,1,0|0,0,2]=4 1503 B15R1.7724 CN(CC(C)(C)CO)c1ccccc1Cl 27ffc092901aaf175a6b53008a2ca6cc [0,1,0,0,1,0|2,0,0]=4 1504 B15R1.7724 Cc1ccccc1C(=O)NC(C)(C)CO cb4e5a26c6f2d0886f0b011082d7178f [0,1,0,0,1,0|0,0,2]=4 1505 B15R1.7724 Cc1ccccc1N(C)CC(C)(C)CO 9054cb72409f84cd8b21c8e54e919add [0,1,0,0,1,0|2,0,0]=4 1506 B15R1.9011 CC(NC(C)(C)C(=O)O)c1ccccc1 efb6c96bb0beb7b6bdf1d8042ce75606 [0,1,0,0,1,0|1,0,1]=4 1507 B15R1.9011 CC(O)C(C)(C)NC(=O)c1ccccc1 3dae94313d10dc12d74c046804bf501e [0,1,0,0,1,0|0,0,2]=4 1508 B15R1.9011 C[C@@H](NC(C)(C)C(=O)O)c1ccccc1 8e7a6a6bf25d038306437a161bd1ad03 [0,1,0,0,1,0|1,0,1]=4 1509 B15R1.9011 C[C@H](NC(C)(C)C(=O)O)c1ccccc1 7d5e74b28ded14cbed3dcfd2d75e3091 [0,1,0,0,1,0|1,0,1]=4 1510 B15R1.9724 CC(C)(CCO)NC(=O)c1ccccc1 4d3a466acc1d305168817d1578400699 [0,1,0,0,1,0|0,0,2]=4 1511 B15R1.9724 CN(CC(C)(C)CCO)c1ccccc1 703d42bf9c49a9510838eea2d1843b88 [0,1,0,0,1,0|2,0,0]=4 1512 B15R1.9724 COCC(C)(C)NC(=O)c1ccccc1 12edffd24eadff666d5eda12868a26da [0,1,0,0,1,0|0,0,2]=4 1513 B15R1.10044 C=CC(NC(C)(C)CC)c1ccccc1 dd2f927e5433201aa8e08f09019552e3 [0,1,0,0,1,0|2,0,0]=4 1514 B15R1.10044 C=CC(NC(C)(C)CF)c1ccccc1 bcb01369e31bb30c9ba5ab10799a1510 [0,1,0,0,1,0|2,0,0]=4 1515 B15R1.10044 C=CC(NC(C)(C)CO)c1ccccc1 19fa0507ec8258d8331cf89a1d9ac278 [0,1,0,0,1,0|1,0,0]=3 1516 B15R1.10044 CC(C)(CF)NC(C=O)c1ccccc1 629161107c746d6272cba6bd0ace32c4 [0,1,0,0,1,0|1,0,1]=4 1517 B15R1.10044 CC(C)(CO)NC(C=O)c1ccccc1 ab168a9f5535c6f9e60ee7e18a4f1628 [0,1,0,0,1,0|0,0,1]=3 1518 B17R1.373 CC(C)(C#N)CNCC(C)(O)c1ccccc1 f1cc325bed750bc9a98cf6fbc42785f2 [0,1,0,0,0,1|1,0,1]=4 1519 B17R1.373 CC(C)(CF)CNCC(C)(C)c1ccccc1 fc23dded54e4dd658562fd1b830055d0 [0,1,0,0,0,1|2,0,0]=4 1520 B17R1.373 CC(C)(CF)CNCC(F)(F)c1ccccc1 acb1e07dbde70aa9b34718ee01468ee7 [0,1,0,0,0,1|2,0,0]=4 1521 B17R1.373 CC(C)(CO)CNCC(C)(C)c1ccccc1 ef2928e96860a594f05d6e87954eb80d [0,1,0,0,0,1|1,0,0]=3 1522 B17R1.373 CC(C)(CO)CNCC(C)(C)c1ccccn1 a8d86a24d0a024fa2846085d5810f90e [0,1,0,0,0,1|2,0,0]=4 1523 B17R1.373 CC(C)(CO)CNCC(C)(C)c1ccncc1 9eea6eaee0a794cd7221dd4312f356f0 [0,1,0,0,0,1|2,0,0]=4 1524 B17R1.373 CC(C)(CO)CNCC(C)(O)c1ccccc1 bcc609432b9b9c6575dcd0dd9328b1c7 [0,1,0,0,0,1|0,0,0]=2 1525 B17R1.373 CC(C)(CO)CNCC(C)(O)c1cccnc1 90076aa7ee80263b46788f65cc0c0d24 [0,1,0,0,0,1|1,0,0]=3 1526 B17R1.373 CC(C)(CO)CNCC(F)(F)c1ccccc1 aa4f0adef25fd7578833f26ed70af42d [0,1,0,0,0,1|1,0,0]=3 1527 B17R1.373 CC(C)(CO)CNCC(F)(F)c1ccccn1 aebfc7feca320ca93bd5394a6a6227e9 [0,1,0,0,0,1|2,0,0]=4 1528 B17R1.373 CC(C)(CO)CNCS(=O)(=O)c1ccccc1 c1a2655e88bbe2396c83a480a2343265 [0,1,0,0,0,1|1,0,1]=4 1529 B17R1.373 CC(C)(CO)NCCS(=O)(=O)c1ccccc1 670396314057338b25fd375dbffdea63 [0,1,0,0,0,1|1,0,1]=4 1530 B17R1.373 CCC(C)(C)CNCC(C)(C)c1ccccc1 1a1e4bb24bafec3294012c459212858c [0,1,0,0,0,1|2,0,0]=4 1531 B17R1.373 CCC(C)(C)CNCC(F)(F)c1ccccc1 766ddf3592bed5786f489be50fab6de1 [0,1,0,0,0,1|2,0,0]=4 1532 B17R1.404 C#CC(C)(C)NCCC(O)c1ccc(cc1)Cl 56f70af66f0be48e22e29f13e6c7bc77 [0,1,0,0,0,1|1,0,1]=4 1533 B17R1.404 C#CC(C)(C)NCCC(O)c1ccc(cc1)F 467ae7bdd2c7f028b52e989e65b536d9 [0,1,0,0,0,1|1,0,1]=4 1534 B17R1.404 CC(C)(C#N)CNCC(O)c1ccc(cc1)Br c3aaccec56a3f55cdf43f364646439f2 [0,1,0,0,0,1|1,0,1]=4 1535 B17R1.404 CC(C)(C#N)CNCC(O)c1ccc(cc1)Cl efb3c4495d80034a56c89238caa1c340 [0,1,0,0,0,1|1,0,1]=4 1536 B17R1.404 CC(C)(C#N)CNCC(O)c1ccc(cc1)F 428c5402d4b4dda02e8b9a2ab61ff19f [0,1,0,0,0,1|1,0,1]=4 1537 B17R1.404 CC(C)(C#N)CNC[C@@H](O)c1ccc(cc1)Br 458a784d73e2726df30231b9bca15afb [0,1,0,0,0,1|1,0,1]=4 1538 B17R1.404 CC(C)(C#N)CNC[C@@H](O)c1ccc(cc1)F a24ecea590186b77fab2005eb1063a61 [0,1,0,0,0,1|1,0,1]=4 1539 B17R1.404 CC(C)(C#N)CNC[C@H](O)c1ccc(cc1)Br 7e3d168ffa9d48751484910af6fccb95 [0,1,0,0,0,1|1,0,1]=4 1540 B17R1.404 CC(C)(C#N)CNC[C@H](O)c1ccc(cc1)Cl b4d201d85b1afd649f98425ba46a068d [0,1,0,0,0,1|1,0,1]=4 1541 B17R1.404 CC(C)(C#N)CNC[C@H](O)c1ccc(cc1)F 50dbe684403c86f21c9c116d0b70a664 [0,1,0,0,0,1|1,0,1]=4 1542 B17R1.404 CC(C)(C#N)NCCC(O)c1ccc(cc1)Cl 3c239a6ec23969daaae26097ec8098a0 [0,1,0,0,0,1|1,0,1]=4 1543 B17R1.404 CC(C)(C#N)NCCC(O)c1ccc(cc1)F 72972284fc452d3ce39472d71e20df9d [0,1,0,0,0,1|1,0,1]=4 1544 B17R1.404 CC(C)(CF)CNCC(F)c1ccc(cc1)Br 8978ff01fbfab2caa4f4e11732bd01b6 [0,1,0,0,0,1|2,0,0]=4 1545 B17R1.404 CC(C)(CF)CNCC(O)c1ccc(cc1)Br 2ddbae9ea541188f57ae0fce439287f9 [0,1,0,0,0,1|1,0,0]=3 1546 B17R1.404 CC(C)(CF)CNCC(O)c1ccc(cc1)Cl cc76e2470a963966a6e94ed1f32f40fd [0,1,0,0,0,1|1,0,0]=3 1547 B17R1.404 CC(C)(CF)CNC[C@@H](O)c1ccc(cc1)Br 5dd15f65efe059812031192bd6e17866 [0,1,0,0,0,1|1,0,0]=3 1548 B17R1.404 CC(C)(CF)CNC[C@@H](O)c1ccc(cc1)Cl c6f4f7f85c22f3b0304b57f6574a91c1 [0,1,0,0,0,1|1,0,0]=3 1549 B17R1.404 CC(C)(CF)CNC[C@@H](O)c1ccc(cc1)F 31cfe7199699820f8e9799a62422ea98 [0,1,0,0,0,1|1,0,0]=3 1550 B17R1.404 CC(C)(CF)CNC[C@H](O)c1ccc(cc1)Br ea33d5be848667a54743a2c2380a478c [0,1,0,0,0,1|1,0,0]=3 1551 B17R1.404 CC(C)(CF)CNC[C@H](O)c1ccc(cc1)Cl bfc7b2c94c843fee221aca8342155453 [0,1,0,0,0,1|1,0,0]=3 1552 B17R1.404 CC(C)(CF)CNC[C@H](O)c1ccc(cc1)F 0f8a66ac3ad7eaace9fec64995303046 [0,1,0,0,0,1|1,0,0]=3 1553 B17R1.404 CC(C)(CF)NCCC(O)c1ccc(cc1)F 52965228beb4213d2798066dcfabf85c [0,1,0,0,0,1|1,0,0]=3 1554 B17R1.404 CC(C)(CO)CNCC(=O)c1ccc(cc1)Br c64d4060b5ec1f0cc12605e2af83e8aa [0,1,0,0,0,1|0,0,2]=4 1555 B17R1.404 CC(C)(CO)CNCC(=O)c1ccc(cc1)Cl 459c5bf1412e84a7a6840bd165c9cda7 [0,1,0,0,0,1|0,0,2]=4 1556 B17R1.404 CC(C)(CO)CNCC(=O)c1ccc(cc1)F a85b5640b75b24939ec17d7d2caab7e8 [0,1,0,0,0,1|0,0,2]=4 1557 B17R1.404 CC(C)(CO)CNCC(=O)c1ccc(cc1)I 6eda9929d2da334e91434f99b72d6ebe [0,1,0,0,0,1|0,0,2]=4 1558 B17R1.404 CC(C)(CO)CNCC(F)c1ccc(cc1)Br 07f16a7912a6ad36a3341961a0e01469 [0,1,0,0,0,1|1,0,0]=3 1559 B17R1.404 CC(C)(CO)CNCC(O)c1ccc(cc1)Br 99f46c15aaf1b433ca2964398975d758 [0,1,0,0,0,1|0,0,0]=2 1560 B17R1.404 CC(C)(CO)CNCC(O)c1ccc(cc1)Cl ecd9d08d7e1966d9bee8ff16c1a619e4 [0,1,0,0,0,1|0,0,0]=2 1561 B17R1.404 CC(C)(CO)CNCC(O)c1ccc(cc1)F 626b30e43391498782cfdeafe4dc9245 [0,1,0,0,0,1|0,0,0]=2 1562 B17R1.404 CC(C)(CO)CNC[C@@H](O)c1ccc(cc1)F 6ccb81b802ddd43303ad84caf5949ac1 [0,1,0,0,0,1|0,0,0]=2 1563 B17R1.404 CC(C)(CO)CNC[C@H](O)c1ccc(cc1)Cl 05def305fa889bf7f1631248efa19c44 [0,1,0,0,0,1|0,0,0]=2 1564 B17R1.404 CC(C)(CO)CNC[C@H](O)c1ccc(cc1)F 0c221f0f0610982e5b1f567f7aa29560 [0,1,0,0,0,1|0,0,0]=2 1565 B17R1.404 CC(C)(CO)NCCC(=O)c1ccc(cc1)Br 32d015770f1100f458ce74e6b98817f6 [0,1,0,0,0,1|0,0,2]=4 1566 B17R1.404 CC(C)(CO)NCCC(=O)c1ccc(cc1)Cl 616c1dcffd6ae307134d6c95adf4793b [0,1,0,0,0,1|0,0,2]=4 1567 B17R1.404 CC(C)(CO)NCCC(=O)c1ccc(cc1)F 0e424d9b8099b272cff8387d2f944d9e [0,1,0,0,0,1|0,0,2]=4 1568 B17R1.404 CC(C)(CO)NCCC(O)c1ccc(cc1)Cl 5d3062770f216e06bb6782fedc9ffe02 [0,1,0,0,0,1|0,0,0]=2 1569 B17R1.404 CC(C)(CO)NCCC(O)c1ccc(cc1)F 49b6c81aa0d3b16a55e7febfc9910709 [0,1,0,0,0,1|0,0,0]=2 1570 B17R1.404 CC(C)(CO)NCOC(=O)c1ccc(cc1)F 7cbfeaf57eced852388744f1b403bc95 [0,1,0,0,0,1|0,0,2]=4 1571 B17R1.404 CC(CNCC(C)(C)CO)c1ccc(cc1)Br ec7ec76ab394eb4e751001ee12abef60 [0,1,0,0,0,1|1,0,0]=3 1572 B17R1.404 CCC(C)(C)CNCC(O)c1ccc(cc1)Cl 22939e0c08837ff830de89cc5efd7eb4 [0,1,0,0,0,1|1,0,0]=3 1573 B17R1.404 CCC(C)(C)CNC[C@@H](O)c1ccc(cc1)F 09781bb9c7da1425654783610efab63e [0,1,0,0,0,1|1,0,0]=3 1574 B17R1.404 CCC(C)(C)CNC[C@H](O)c1ccc(cc1)Cl d83048aebfd99ff69baeb224b12749d4 [0,1,0,0,0,1|1,0,0]=3 1575 B17R1.404 CCC(C)(C)CNC[C@H](O)c1ccc(cc1)F 5aad2f1fdd4df21e9d48f3e60cb184f1 [0,1,0,0,0,1|1,0,0]=3 1576 B17R1.404 CCC(C)(O)CNCC(O)c1ccc(cc1)Br 1006a8e1457d3ab8d0a020fe308f5bb1 [0,1,0,0,0,1|2,0,0]=4 1577 B17R1.404 CCC(C)(O)CNCC(O)c1ccc(cc1)Cl ad35b57e7819a9df58954653ff1049c3 [0,1,0,0,0,1|2,0,0]=4 1578 B17R1.404 CCC(C)(O)CNC[C@@H](O)c1ccc(cc1)Br 4e150ce69860c2c5c4e19da502c9170c [0,1,0,0,0,1|2,0,0]=4 1579 B17R1.404 CCC(C)(O)CNC[C@@H](O)c1ccc(cc1)F 05a41c496fbf44a15d9320e7bd80ed64 [0,1,0,0,0,1|2,0,0]=4 1580 B17R1.404 CCC(C)(O)CNC[C@H](O)c1ccc(cc1)Br b4efa054ffd90c2fdb4dd901d0282b00 [0,1,0,0,0,1|2,0,0]=4 1581 B17R1.404 CCC(C)(O)CNC[C@H](O)c1ccc(cc1)Cl ece70397d07478bcad2ba9f260e677ce [0,1,0,0,0,1|2,0,0]=4 1582 B17R1.404 CCC(C)(O)CNC[C@H](O)c1ccc(cc1)F 66fb5953e4023a33231111039c270ec7 [0,1,0,0,0,1|2,0,0]=4 1583 B17R1.404 COC(C)(C)CNCC(O)c1ccc(cc1)Br d779b763df147ce02f32a2684792b118 [0,1,0,0,0,1|2,0,0]=4 1584 B17R1.404 COC(C)(C)CNCC(O)c1ccc(cc1)Cl 138c9b8e782c46a4b5b96ed50dd70c93 [0,1,0,0,0,1|2,0,0]=4 1585 B17R1.404 COC(C)(C)CNC[C@@H](O)c1ccc(cc1)Br 644d592134490cc6768a0a1baee239e4 [0,1,0,0,0,1|2,0,0]=4 1586 B17R1.404 COC(C)(C)CNC[C@@H](O)c1ccc(cc1)F d1824195d42019d56fc81660b45dbcef [0,1,0,0,0,1|2,0,0]=4 1587 B17R1.404 COC(C)(C)CNC[C@H](O)c1ccc(cc1)Br f7112a1f5650a44c1a79ea8d115611de [0,1,0,0,0,1|2,0,0]=4 1588 B17R1.404 COC(C)(C)CNC[C@H](O)c1ccc(cc1)Cl 032e7d3368f7414e16d6ff8af8809b91 [0,1,0,0,0,1|2,0,0]=4 1589 B17R1.404 COC(C)(C)CNC[C@H](O)c1ccc(cc1)F 388cf83d31deccf73602f8fec1977736 [0,1,0,0,0,1|2,0,0]=4 1590 B17R1.404 Cc1ccc(cc1)C(=O)CCNC(C)(C)CO 0286b7a5a2d7a9a844a88f190328d0dc [0,1,0,0,0,1|0,0,2]=4 1591 B17R1.404 Cc1ccc(cc1)C(=O)CNCC(C)(C)CO fce83f8265084b1aedd48f3b88a216e2 [0,1,0,0,0,1|0,0,2]=4 1592 B17R1.404 Cc1ccc(cc1)C(O)CNCC(C)(C)C#N f1fa9150ffbe9450e19bcd0ee599d86f [0,1,0,0,0,1|1,0,1]=4 1593 B17R1.404 Cc1ccc(cc1)[C@H](O)CNCC(C)(C)CF 1c3ffb6ec5450a80078e3add6aea6e02 [0,1,0,0,0,1|1,0,0]=3 1594 B17R1.404 OCC(F)(F)CNCC(O)c1ccc(cc1)Br 29ab1c18652a38c4b55e6b69cc35e5bd [0,1,0,0,0,1|2,0,0]=4 1595 B17R1.404 OCC(F)(F)CNCC(O)c1ccc(cc1)Cl 343754af3aba5feac7363a278f625c5d [0,1,0,0,0,1|2,0,0]=4 1596 B17R1.404 OCC(F)(F)CNC[C@@H](O)c1ccc(cc1)Br f2ef8acbd84e939ddcec2e74c803e071 [0,1,0,0,0,1|2,0,0]=4 1597 B17R1.404 OCC(F)(F)CNC[C@@H](O)c1ccc(cc1)F 833d5aabd405fe4d1b8998ae5adb1fdc [0,1,0,0,0,1|2,0,0]=4 1598 B17R1.404 OCC(F)(F)CNC[C@H](O)c1ccc(cc1)Br 5f02f2fba11472c50fb448bcd734fcc9 [0,1,0,0,0,1|2,0,0]=4 1599 B17R1.404 OCC(F)(F)CNC[C@H](O)c1ccc(cc1)Cl 7a9580b1b4d0cdad92a3d9516d1bc2eb [0,1,0,0,0,1|2,0,0]=4 1600 B17R1.404 OCC(F)(F)CNC[C@H](O)c1ccc(cc1)F 3f93f0e0891a719b058b103bbb7a52a6 [0,1,0,0,0,1|2,0,0]=4 1601 B17R1.405 CC(C)(C#N)CNCC(O)c1cccc(c1)Cl 70e7074d3b532771b727515a4dbff4b3 [0,1,0,0,0,1|1,0,1]=4 1602 B17R1.405 CC(C)(C#N)CNC[C@H](O)c1cccc(c1)Cl c7110c9e11290e4a8a0a1b30f7001c25 [0,1,0,0,0,1|1,0,1]=4 1603 B17R1.405 CC(C)(CF)CNC[C@H](O)c1cccc(c1)Cl f59162f926d9afbbf2cf27cc1f71babd [0,1,0,0,0,1|1,0,0]=3 1604 B17R1.405 CC(C)(CO)CNCC(=O)c1cccc(c1)Br 88547b0866bd56adfbd01b2ad1e96f64 [0,1,0,0,0,1|0,0,2]=4 1605 B17R1.405 CC(C)(CO)CNCC(=O)c1cccc(c1)Cl ee5a469f6f23596d7a7d03f4543d707f [0,1,0,0,0,1|0,0,2]=4 1606 B17R1.405 CC(C)(CO)CNCC(=O)c1cccc(c1)F caa340dbea845a3116500a362525e42d [0,1,0,0,0,1|0,0,2]=4 1607 B17R1.405 CC(C)(CO)CNCC(=O)c1cccc(c1)I 3c0e3a6295fbdd0a6334faee03d54154 [0,1,0,0,0,1|0,0,2]=4 1608 B17R1.405 CC(C)(CO)CNCC(O)c1cccc(c1)Cl 45127b4459be03456e02f34a3619b888 [0,1,0,0,0,1|0,0,0]=2 1609 B17R1.405 CC(C)(CO)CNC[C@H](O)c1cccc(c1)Cl cc9ee5a39ebbfa3734010d456ff5997b [0,1,0,0,0,1|0,0,0]=2 1610 B17R1.405 CCC(C)(C)CNC[C@H](O)c1cccc(c1)Cl 6f2af3103a60e62bf26f4bf65bc10c44 [0,1,0,0,0,1|1,0,0]=3 1611 B17R1.405 CCC(C)(O)CNC[C@H](O)c1cccc(c1)Cl 9dc0ea741d7df0dc7c53c7bc7699353d [0,1,0,0,0,1|2,0,0]=4 1612 B17R1.405 CN(CCNC(C)(C)CO)c1cccc(c1)F c25bb252d081919a167c6cc2fc7debe2 [0,1,0,0,0,1|2,0,0]=4 1613 B17R1.405 COC(C)(C)CNCC(O)c1cccc(c1)Cl 75b72dc51a30ab5488246cbabded7948 [0,1,0,0,0,1|2,0,0]=4 1614 B17R1.405 COC(C)(C)CNC[C@H](O)c1cccc(c1)Cl 1092c8ae40ab789d5e7a9ad1b4bc0ba2 [0,1,0,0,0,1|2,0,0]=4 1615 B17R1.405 Cc1cccc(c1)C(=O)CNCC(C)(C)CO 97e4cd04e73fe23f9088660f4a9b0a39 [0,1,0,0,0,1|0,0,2]=4 1616 B17R1.405 OCC(F)(F)CNC[C@H](O)c1cccc(c1)Cl 24c572db89e1910cfeb3e86dc5d27174 [0,1,0,0,0,1|2,0,0]=4 1617 B17R1.407 CC(CCN(C)C(C)(C)CO)c1ccccc1 0a147e01f041a9a49bcb64c5b9bf2c25 [0,1,0,0,0,1|1,0,0]=3 1618 B17R1.407 CCC(C)(C)N(C)CCC(C)c1ccccc1 e4259000d4b4509ae9b7375e82fb208d [0,1,0,0,0,1|2,0,0]=4 1619 B17R1.407 CN(CCC(=O)c1ccccc1)C(C)(C)CO 95a2305471fe3d86dba68367a46f88ec [0,1,0,0,0,1|0,0,2]=4 1620 B17R1.407 CN(CCC(O)c1ccccc1)C(C)(C)CO 815649e9ddd32d6bc3dedcbe2fa2843d [0,1,0,0,0,1|0,0,0]=2 1621 B17R1.407 CN(CCN(C)C(C)(C)CO)c1ccccc1 1fc83ac8799b859d5b0498b2c6239763 [0,1,0,0,0,1|2,0,0]=4 1622 B17R1.407 CN(CC[C@@H](O)c1ccccc1)C(C)(C)CO 0c040aec32237691f8491ed3ac4e6a4e [0,1,0,0,0,1|0,0,0]=2 1623 B17R1.407 CN(CC[C@H](O)c1ccccc1)C(C)(C)CO ed199ba4476b1beee32178829b27dfc0 [0,1,0,0,0,1|0,0,0]=2 1624 B17R1.407 CN(COC(=O)c1ccccc1)C(C)(C)CO 50016ffb45e18fd79fda4d0d1a5c22a7 [0,1,0,0,0,1|0,0,2]=4 1625 B17R1.2510 CC(C)(C#N)CNCC(CO)c1ccccc1 55e5646c55f40fdb11c9d4f0379a8952 [0,1,0,0,0,1|1,0,1]=4 1626 B17R1.2510 CC(C)(CO)CNCC(CO)c1ccccc1 e8fba49972c5ab93a7854c68f76b56f8 [0,1,0,0,0,1|0,0,0]=2 1627 B17R1.2510 CCC(C)(C)CCNC(CO)c1ccccc1 f33696d63b3cedf7610aba9acedafe83 [0,1,0,0,0,1|2,0,0]=4 1628 B17R1.2510 CCC(C)(C)CCN[C@@H](CO)c1ccccc1 1fd46141747b99106694f3fe21166490 [0,1,0,0,0,1|2,0,0]=4 1629 B17R1.2510 CCC(C)(C)CCN[C@H](CO)c1ccccc1 06b54480157473369b2ec87ab4c4e504 [0,1,0,0,0,1|2,0,0]=4 1630 B17R1.2510 COC(C)(C)CNCC(CO)c1ccccc1 c50c05c4cd50b4d9f582d9c0b57b3940 [0,1,0,0,0,1|2,0,0]=4 1631 B17R1.2749 CC(CCNC(C)(CO)CO)c1ccccc1 2d86f227628f3ba638fbfa583642f9c2 [0,1,0,0,0,1|1,0,0]=3 1632 B17R1.2749 CC(CO)(CO)NCOC(=O)c1ccccc1 90e50c155d7b077cb6c2642314da2c7d [0,1,0,0,0,1|0,0,2]=4 1633 B17R1.2749 CCC(C)(CO)NCCN(C)c1ccccc1 9f41d7b31e1a23ee06fa49696e9a42c1 [0,1,0,0,0,1|2,0,0]=4 1634 B17R1.2749 CN(CCNC(C)(CO)CO)c1ccccc1 f2034d6e5294012ac4596329926a3bc5 [0,1,0,0,0,1|2,0,0]=4 1635 B17R1.2749 COC(C)(CNCC(O)c1ccccc1)OC f943d22a8a00d236c543faefaf0b47d1 [0,1,0,0,0,1|2,0,0]=4 1636 B17R1.2749 COC(C)(CNC[C@@H](O)c1ccccc1)OC 8d304b7077d69359fe0601af792234ff [0,1,0,0,0,1|2,0,0]=4 1637 B17R1.2749 COC(C)(CNC[C@H](O)c1ccccc1)OC 026c2327a1f69f075135eec0183feb4c [0,1,0,0,0,1|2,0,0]=4 1638 B17R1.4241 CC(C)(CCO)NCCC(=O)c1ccccc1 84bbe3cb57861f16bb2dc5a33d465044 [0,1,0,0,0,1|0,0,2]=4 1639 B17R1.4241 CC(C)(CCO)NCCC(O)c1ccccc1 d63cd75c60f8cc891758f00551773153 [0,1,0,0,0,1|0,0,0]=2 1640 B17R1.4241 CC(C)(CCO)NCC[C@@H](O)c1ccccc1 5639224c7f0707325469c612ec640fb6 [0,1,0,0,0,1|0,0,0]=2 1641 B17R1.4241 CC(C)(CCO)NCC[C@H](O)c1ccccc1 75e300ed5ab39bd0d7a51f7771d0ebd2 [0,1,0,0,0,1|0,0,0]=2 1642 B17R1.4241 CC(C)(CCO)NCOC(=O)c1ccccc1 5a1563dd7d869cb2355cb59f4f6d7ad2 [0,1,0,0,0,1|0,0,2]=4 1643 B17R1.4241 CC(CCNC(C)(C)CCO)c1ccccc1 a90a9dfd1c6c14c727b3219c460a6ca7 [0,1,0,0,0,1|1,0,0]=3 1644 B17R1.4241 CCCC(C)(O)CNCC(O)c1ccccc1 560c0298554ccdd03a3c66d5802319a7 [0,1,0,0,0,1|2,0,0]=4 1645 B17R1.4241 CCCC(C)(O)CNC[C@@H](O)c1ccccc1 2250bf07e4f034eeb55d5997993bf09a [0,1,0,0,0,1|2,0,0]=4 1646 B17R1.4241 CCCC(C)(O)CNC[C@H](O)c1ccccc1 0d30ae60038870a297e956f282df93a8 [0,1,0,0,0,1|2,0,0]=4 1647 B17R1.4241 CN(CCNC(C)(C)CCO)c1ccccc1 8db3751279f484ecb9e4888460adecd5 [0,1,0,0,0,1|2,0,0]=4 1648 B17R1.4241 COCC(C)(C)NCCN(C)c1ccccc1 53f902164e3d061f4e953c7a6cdae427 [0,1,0,0,0,1|2,0,0]=4 1649 B17R1.4241 COCC(C)(C)NCOC(=O)c1ccccc1 ac0b1dc25325dee18102221f863d266b [0,1,0,0,0,1|0,0,2]=4 1650 B17R1.4241 CSCC(C)(C)NCCC(C)c1ccccc1 7cce71f6943e371a43881cf457ed1997 [0,1,0,0,0,1|1,1,0]=4 1651 B17R1.13064 CC(C)(CF)NC(=O)CC(O)c1ccccc1 7c1f010fb141f3c882d9b4508efab727 [0,1,0,0,0,1|1,0,0]=3 1652 B17R1.13064 CC(C)(CF)NC(=O)C[C@@H](O)c1ccccc1 e6a02b1cea919f5ddaca9015ce63ad83 [0,1,0,0,0,1|1,0,0]=3 1653 B17R1.13064 CC(C)(CF)NC(=O)C[C@H](O)c1ccccc1 532744b9fe204254a2dcbd22003074d7 [0,1,0,0,0,1|1,0,0]=3 1654 B17R1.13064 CC(C)(CO)NC(=O)CC(O)c1ccccc1 f08a2c7d163fddad1abc00a0fed0efb1 [0,1,0,0,0,1|0,0,0]=2 1655 B17R1.13064 CC(C)(CO)NC(=O)C[C@@H](O)c1ccccc1 2474a8022700725b592b9fd5438c62ed [0,1,0,0,0,1|0,0,0]=2 1656 B17R1.13064 CC(C)(CO)NC(=O)C[C@H](O)c1ccccc1 e42663ec203cd2d8eb85ba37484cd5b6 [0,1,0,0,0,1|0,0,0]=2 1657 B17R1.13064 CC(CC(=O)NC(C)(C)CF)c1ccccc1 db0145154df62ddc122ca5d2b6d2bfa6 [0,1,0,0,0,1|2,0,0]=4 1658 B17R1.13064 CC(CC(=O)NC(C)(C)CO)c1ccccc1 186d929dc931878297e483eed0dec29b [0,1,0,0,0,1|1,0,0]=3 1659 B17R1.13064 CC(CC(=O)NC(C)(C)CO)c1ccccn1 db679bd842014fe788e91f9e6a0866bf [0,1,0,0,0,1|2,0,0]=4 1660 B17R1.13064 CC(CC(=O)NC(C)(C)CO)c1cccnc1 8d04d61b842ec2a2dba511dd7221e1e5 [0,1,0,0,0,1|2,0,0]=4 1661 B17R1.13064 CC(NC(=O)NC(C)(C)CO)c1ccccc1 08ca7195954eddde2cb5a99ddc0f9999 [0,1,0,0,0,1|1,0,1]=4 1662 B17R1.13064 CC(NC(=S)NC(C)(C)CO)c1ccccc1 81a02102375a8bccee1756c32990a22b [0,1,0,0,0,1|1,0,1]=4 1663 B17R1.13064 CN(CC(=O)NC(C)(C)CO)c1ccccc1 b3ba7b1542844bb3f840f693dcf085a0 [0,1,0,0,0,1|2,0,0]=4 1664 B17R1.13064 CN(CC(=O)c1ccccc1)CC(C)(C)CO 21b106eb31ca4b76f2cef47ee10a6abb [0,1,0,0,0,1|0,0,2]=4 1665 B17R1.13064 CN(CC(O)c1ccccc1)CC(C)(C)C#N 9eec5925573f03167f25a4d62a30675b [0,1,0,0,0,1|1,0,1]=4 1666 B17R1.13064 CN(CC(O)c1ccccc1)CC(C)(C)CO 3231fcf936e5c16de7630646bff560a2 [0,1,0,0,0,1|0,0,0]=2 1667 B17R1.13064 CN(CC(O)c1ccccc1)CC(F)(F)CO 54d5ebf134b0c3311b1a9c065615c6e8 [0,1,0,0,0,1|2,0,0]=4 1668 B17R1.13064 CN(CC(O)c1ccncc1)CC(C)(C)CO ae3a848bb63a2cc1cbe265827bd0a1d1 [0,1,0,0,0,1|1,0,0]=3 1669 B17R1.13064 CN(CC(O)c1cnccn1)CC(C)(C)CO f82836fc758bb8cd87bd4daac6c46db5 [0,1,0,0,0,1|2,0,0]=4 1670 B17R1.13064 CN(C[C@H](O)c1ccccc1)CC(C)(C)C#N c2876a49f7bee45532d591042688e18b [0,1,0,0,0,1|1,0,1]=4 1671 B17R1.13064 CN(C[C@H](O)c1ccccc1)CC(C)(C)CO 7d2847e37e1144067677b40ed10fa482 [0,1,0,0,0,1|0,0,0]=2 1672 B17R1.13064 C[C@@H](CC(=O)NC(C)(C)CF)c1ccccc1 03fe4fe059d3b54b3810996b73585f96 [0,1,0,0,0,1|2,0,0]=4 1673 B17R1.13064 C[C@@H](CC(=O)NC(C)(C)CO)c1ccccc1 9da4fb68d7ba4fa9d414c32dbdcdbd15 [0,1,0,0,0,1|1,0,0]=3 1674 B17R1.13064 C[C@@H](NC(=O)NC(C)(C)CO)c1ccccc1 ed8ffdb5244d204860f333fec721116c [0,1,0,0,0,1|1,0,1]=4 1675 B17R1.13064 C[C@@H](NC(=S)NC(C)(C)CO)c1ccccc1 d1ed9d2f746eddc683d3c77d4e854f60 [0,1,0,0,0,1|1,0,1]=4 1676 B17R1.13064 C[C@H](CC(=O)NC(C)(C)CF)c1ccccc1 d39b2a2257db19718accf54cfc6cf9aa [0,1,0,0,0,1|2,0,0]=4 1677 B17R1.13064 C[C@H](CC(=O)NC(C)(C)CO)c1ccccc1 8faa465b8ec9e1adbb5cb31b0f3ac56d [0,1,0,0,0,1|1,0,0]=3 1678 B17R1.13064 C[C@H](NC(=O)NC(C)(C)CO)c1ccccc1 debdcc4af95d9ab007787b53186d36f4 [0,1,0,0,0,1|1,0,1]=4 1679 B17R1.13064 C[C@H](NC(=S)NC(C)(C)CO)c1ccccc1 07a722861be4ef841962bfd8964d6307 [0,1,0,0,0,1|1,0,1]=4 1680 B17R1.13067 CC(C(=O)NCC(C)(C)CO)c1ccccc1 00e02e735356cb33a360433ef3ad9ffb [0,1,0,0,0,1|1,0,1]=4 1681 B17R1.13067 CC(C)(CF)CNC(=O)C(O)c1ccccc1 fdfb8ec9ade8f68d9a7d2552cf89b963 [0,1,0,0,0,1|1,0,1]=4 1682 B17R1.13067 CC(C)(CF)CNC(=O)[C@@H](O)c1ccccc1 e888509a2630a8350bfbe65240527400 [0,1,0,0,0,1|1,0,1]=4 1683 B17R1.13067 CC(C)(CF)CNC(=O)[C@H](O)c1ccccc1 769a0dbb143344f8038cf87bd66a3410 [0,1,0,0,0,1|1,0,1]=4 1684 B17R1.13067 CC(C)(CO)CNC(=O)C(F)c1ccccc1 c6302ed44a406644a78fae07faac8e62 [0,1,0,0,0,1|1,0,1]=4 1685 B17R1.13067 CC(C)(CO)CNC(=O)C(O)c1ccccc1 696a8032560bf818d2af850b10151b7b [0,1,0,0,0,1|0,0,1]=3 1686 B17R1.13067 CC(C)(CO)CNC(=O)C(O)c1cccnc1 3a70615866cde3de3fb143622d3e9963 [0,1,0,0,0,1|1,0,1]=4 1687 B17R1.13067 CC(C)(CO)CNC(=O)C(O)c1ccncc1 093dca84ae2071719fd52e09114b3623 [0,1,0,0,0,1|1,0,1]=4 1688 B17R1.13067 CC(C)(CO)CNC(=O)[C@@H](O)c1ccccc1 484211cc6ec87131a47852df9b1bb32a [0,1,0,0,0,1|0,0,1]=3 1689 B17R1.13067 CC(C)(CO)CNC(=O)[C@H](F)c1ccccc1 36a9df56e2a12c282a9ed7a1e343cf88 [0,1,0,0,0,1|1,0,1]=4 1690 B17R1.13067 CC(C)(CO)CNC(=O)[C@H](O)c1ccccc1 7e2c3be749bd3f4523493f45c7f39442 [0,1,0,0,0,1|0,0,1]=3 1691 B17R1.13067 CCC(C)(C)CNC(=O)C(O)c1ccccc1 63fea6127456d358ba29d7a526da57e3 [0,1,0,0,0,1|1,0,1]=4 1692 B17R1.13067 CCC(C)(C)CNC(=O)[C@@H](O)c1ccccc1 90d3bf86294b24b2022423b83cdc6fb2 [0,1,0,0,0,1|1,0,1]=4 1693 B17R1.13067 CCC(C)(C)CNC(=O)[C@H](O)c1ccccc1 38430b17e5f7e002ed725d557473cf55 [0,1,0,0,0,1|1,0,1]=4 1694 B17R1.13067 CN(C(=O)CNC(C)(C)CO)c1ccccc1 f19bf2ebf86779f4e93edf5a5aca3eb9 [0,1,0,0,0,1|2,0,0]=4 1695 B17R1.13067 C[C@@H](C(=O)NCC(C)(C)CO)c1ccccc1 2ec376116854ca38b90de14b5ff4e689 [0,1,0,0,0,1|1,0,1]=4 1696 B17R1.13067 C[C@H](C(=O)NCC(C)(C)CO)c1ccccc1 6e948a98618df14f2a958d30bdee393b [0,1,0,0,0,1|1,0,1]=4 1697 B17R1.13451 CC(C)(C#N)CNCC(O)c1ccccc1Cl 060cb8a6ef892c300b3cdd31a1a2ba71 [0,1,0,0,0,1|1,0,1]=4 1698 B17R1.13451 CC(C)(CF)CNCC(O)c1ccccc1Cl 90ad1de4f338e1ac82be6217f2c28f81 [0,1,0,0,0,1|1,0,0]=3 1699 B17R1.13451 CC(C)(CO)CNCC(=O)c1ccccc1Br 352265130ed08899aacb13ff85c55d7a [0,1,0,0,0,1|0,0,2]=4 1700 B17R1.13451 CC(C)(CO)CNCC(=O)c1ccccc1Cl c720cda33fcc2fa5a6a3c399e5af7ccf [0,1,0,0,0,1|0,0,2]=4 1701 B17R1.13451 CC(C)(CO)CNCC(=O)c1ccccc1F 07f0b6a3f616b0243749fbc433ef41c4 [0,1,0,0,0,1|0,0,2]=4 1702 B17R1.13451 CC(C)(CO)CNCC(=O)c1ccccc1I fdc21e87de7dd6005ca3f6a90b68707d [0,1,0,0,0,1|0,0,2]=4 1703 B17R1.13451 CC(C)(CO)NCCC(=O)c1ccccc1F cec863004f9ad0c47c7ef71339491e71 [0,1,0,0,0,1|0,0,2]=4 1704 B17R1.13451 Cc1ccccc1C(=O)CNCC(C)(C)CO 087899906898a1b6718f11c818dfcb96 [0,1,0,0,0,1|0,0,2]=4 1705 B17R1.16182 C=C(CNCC(C)(C)C(C)O)c1ccccc1 96203279a5835a36e75d27fefd4ebefa [0,1,0,0,0,1|1,0,1]=4 1706 B17R1.16182 CC(=O)C(C)(C)NCCC(O)c1ccccc1 383d14f3338608dfe68859d12a77c7f1 [0,1,0,0,0,1|0,0,2]=4 1707 B17R1.16182 CC(=O)C(C)(C)NCC[C@@H](O)c1ccccc1 abc01ba15bcb4529945b26a522d48eb0 [0,1,0,0,0,1|0,0,2]=4 1708 B17R1.16182 CC(=O)C(C)(C)NCC[C@H](O)c1ccccc1 87fbb8866b876d2714a08fdb5b04478d [0,1,0,0,0,1|0,0,2]=4 1709 B17R1.16182 CC(C)(CNCC(F)c1ccccc1)C(=O)O a0b2ecd97eb12d138fbf3b085b9c762f [0,1,0,0,0,1|1,0,1]=4 1710 B17R1.16182 CC(C)(CNCC(O)c1ccccc1)C(=O)F 3a83135eb0cc659b66430e0f51b8b253 [0,1,0,0,0,1|0,0,2]=4 1711 B17R1.16182 CC(C)(CNCC(O)c1ccccc1)C(=O)N de8c1ee4868cb25acefbafd391e647e1 [0,1,0,0,0,1|0,0,2]=4 1712 B17R1.16182 CC(C)(CNCC(O)c1ccccc1)C(=O)O ce70598371f0090743ae5187fd4dc810 [0,1,0,0,0,1|0,0,1]=3 1713 B17R1.16182 CC(C)(CNCC(O)c1ccccn1)C(=O)O 188a1463849be1a92b4ac439a236010b [0,1,0,0,0,1|1,0,1]=4 1714 B17R1.16182 CC(C)(CNCC(O)c1cccnc1)C(=O)O 937cceb65465661e6285470233d4c152 [0,1,0,0,0,1|1,0,1]=4 1715 B17R1.16182 CC(C)(CNCC(O)c1ccncc1)C(=O)O b46c1ddedffb753cc0385fe69424f325 [0,1,0,0,0,1|1,0,1]=4 1716 B17R1.16182 CC(C)(CNC[C@@H](O)c1ccccc1)C(=O)F 91f0cc9124414d84841f3e214e826986 [0,1,0,0,0,1|0,0,2]=4 1717 B17R1.16182 CC(C)(CNC[C@@H](O)c1ccccc1)C(=O)N b3c18244e466304dc3ae8c2759e4a957 [0,1,0,0,0,1|0,0,2]=4 1718 B17R1.16182 CC(C)(CNC[C@@H](O)c1ccccc1)C(=O)O b18cab8c09351cd7559e79aeb24f8623 [0,1,0,0,0,1|0,0,1]=3 1719 B17R1.16182 CC(C)(CNC[C@H](O)c1ccccc1)C(=O)F d331cf8a6a549447edabdabc19719437 [0,1,0,0,0,1|0,0,2]=4 1720 B17R1.16182 CC(C)(CNC[C@H](O)c1ccccc1)C(=O)N b8b5636f9605c5b20d77d7a9ce9f24bc [0,1,0,0,0,1|0,0,2]=4 1721 B17R1.16182 CC(C)(CNC[C@H](O)c1ccccc1)C(=O)O 2429cb35cd9d27e8a5c4df48a890ed75 [0,1,0,0,0,1|0,0,1]=3 1722 B17R1.16182 CC(C)(NCCC(O)c1ccccc1)C(=O)N d7fbdc2c933775af919537ee42465080 [0,1,0,0,0,1|0,0,2]=4 1723 B17R1.16182 CC(C)(NCCC(O)c1ccccc1)C(=O)O 3a1d6005ae626e43e6a98132de887e53 [0,1,0,0,0,1|0,0,1]=3 1724 B17R1.16182 CC(C)(NCC[C@@H](O)c1ccccc1)C(=O)N 858c9e623e859687b2a3677b717c985e [0,1,0,0,0,1|0,0,2]=4 1725 B17R1.16182 CC(C)(NCC[C@@H](O)c1ccccc1)C(=O)O 9911d8c48054855bf11b3499d10bd4bf [0,1,0,0,0,1|0,0,1]=3 1726 B17R1.16182 CC(C)(NCC[C@H](O)c1ccccc1)C(=O)N e93f3a64f65b3628384b9fb0723b09e5 [0,1,0,0,0,1|0,0,2]=4 1727 B17R1.16182 CC(C)(NCC[C@H](O)c1ccccc1)C(=O)O 67d11be18b8c9010f7d20f285d523fd7 [0,1,0,0,0,1|0,0,1]=3 1728 B17R1.16182 CC(C)C(C)(C)CNCC(O)c1ccccc1 14a12d13aa5af07b4522cb61e9dfd286 [0,1,0,0,0,1|1,0,0]=3 1729 B17R1.16182 CC(C)C(C)(C)CNCC(O)c1ccccn1 3bd4377410dade8a781421779dd6c476 [0,1,0,0,0,1|2,0,0]=4 1730 B17R1.16182 CC(C)C(C)(C)CNCC(O)c1cccnc1 a200f922d1b399f33edb00705c51f0da [0,1,0,0,0,1|2,0,0]=4 1731 B17R1.16182 CC(C)C(C)(C)CNCC(O)c1ccncc1 2e6307d7373ed6c679a28321b2ad9eff [0,1,0,0,0,1|2,0,0]=4 1732 B17R1.16182 CC(C)C(C)(C)CNC[C@@H](C)c1ccccc1 0149a209043cfcc10a46c224eb94c20d [0,1,0,0,0,1|2,0,0]=4 1733 B17R1.16182 CC(C)C(C)(C)CNC[C@@H](O)c1ccccc1 e77570d7d286e020ed2d2fdc30090f0f [0,1,0,0,0,1|1,0,0]=3 1734 B17R1.16182 CC(C)C(C)(C)CNC[C@H](C)c1ccccc1 70cf504a54e2e1437a963fa1462c8973 [0,1,0,0,0,1|2,0,0]=4 1735 B17R1.16182 CC(C)C(C)(C)CNC[C@H](O)c1ccccc1 249549b0fe5dffdee09929e58efbc19a [0,1,0,0,0,1|1,0,0]=3 1736 B17R1.16182 CC(CCNC(C)(C)C(=O)O)c1ccccc1 20feff2c9603fded8ed51501881cde41 [0,1,0,0,0,1|1,0,1]=4 1737 B17R1.16182 CC(CCNC(C)(C)C(C)C)c1ccccc1 214a40a96cf0f9f2abac368d9ca1ad13 [0,1,0,0,0,1|2,0,0]=4 1738 B17R1.16182 CC(CCNC(C)(C)C(C)O)c1ccccc1 923dc67494181e71834b9543ab4aafff [0,1,0,0,0,1|1,0,0]=3 1739 B17R1.16182 CC(CNCC(C)(C)C(=O)O)c1ccccc1 a340cd8da82878842944bf4b9638b867 [0,1,0,0,0,1|1,0,1]=4 1740 B17R1.16182 CC(CNCC(C)(C)C(C)C)c1ccccc1 2f67ef09fc854bac0994b772edb478ef [0,1,0,0,0,1|2,0,0]=4 1741 B17R1.16182 CC(CNCC(C)(C)C(C)O)c1ccccc1 5fcdb84a16e71126a7c1f3746c478df0 [0,1,0,0,0,1|1,0,0]=3 1742 B17R1.16182 CC(O)C(C)(C)CNCC(=O)c1ccccc1 add1dddcad3a76620f75d93b2cc9e624 [0,1,0,0,0,1|0,0,2]=4 1743 B17R1.16182 CC(O)C(C)(C)CNCC(F)c1ccccc1 b38c4d5ec40e76248e850a6473653e4a [0,1,0,0,0,1|1,0,0]=3 1744 B17R1.16182 CC(O)C(C)(C)CNCC(O)c1ccccc1 59ad13aa7f5c49f106b8063dab9ba78d [0,1,0,0,0,1|0,0,0]=2 1745 B17R1.16182 CC(O)C(C)(C)CNCC(O)c1cnccn1 b5778d75a9c9ac72f807d9d01ab66f4a [0,1,0,0,0,1|2,0,0]=4 1746 B17R1.16182 CC(O)C(C)(C)CNC[C@@H](C)c1ccccc1 3f810ccb41a83ab39e3b72819c8eec24 [0,1,0,0,0,1|1,0,0]=3 1747 B17R1.16182 CC(O)C(C)(C)NCCN(C)c1ccccc1 426dc20022ffff97aa9d2dc413dc8f7c [0,1,0,0,0,1|2,0,0]=4 1748 B17R1.16182 CC(O)C(C)(C)NCOC(=O)c1ccccc1 d60bd6d41344c8b6acc466d6cf34acba [0,1,0,0,0,1|0,0,2]=4 1749 B17R1.16182 C[C@@H](CNCC(C)(C)C(=O)O)c1ccccc1 efcb7765f93e72d1dd1f30db0d703f11 [0,1,0,0,0,1|1,0,1]=4 1750 B17R1.16182 C[C@H](CNCC(C)(C)C(=O)O)c1ccccc1 92d12fad8954b10374bd1344cbf3d5b0 [0,1,0,0,0,1|1,0,1]=4 1751 B17R1.391 CC(C)(CF)NC(=O)C(O)Cc1ccccc1 2f4d924ea54ba3c09a8ab1093c1110bf [0,1,0,0,0,1|1,0,1]=4 1752 B17R1.391 CC(C)(CF)NC(=O)[C@@H](O)Cc1ccccc1 be80f89a8f66e6730c8b051496ba0a85 [0,1,0,0,0,1|1,0,1]=4 1753 B17R1.391 CC(C)(CF)NC(=O)[C@H](O)Cc1ccccc1 2048724fe93fc9fb35c02695cb5304e1 [0,1,0,0,0,1|1,0,1]=4 1754 B17R1.391 CC(C)(CO)NC(=O)C(=Cc1ccccc1)O 39c6ff929ae1891e8faea6e0539430da [0,1,0,0,0,1|0,0,2]=4 1755 B17R1.391 CC(C)(CO)NC(=O)C(O)Cc1ccccc1 8925e49bea9d37911280ab52e9454c51 [0,1,0,0,0,1|0,0,1]=3 1756 B17R1.391 CC(C)(CO)NC(=O)C(O)Cc1cccnc1 a336948d86fa638c6154e5982e9f91a1 [0,1,0,0,0,1|1,0,1]=4 1757 B17R1.391 CC(C)(CO)NC(=O)C(S)Cc1ccccc1 f0a0c5714de494ea827439b28ba924cb [0,1,0,0,0,1|0,1,1]=4 1758 B17R1.391 CC(C)(CO)NC(=O)[C@@H](O)Cc1ccccc1 0619902bba4caff2185f2a9a942684c8 [0,1,0,0,0,1|0,0,1]=3 1759 B17R1.391 CC(C)(CO)NC(=O)[C@H](O)Cc1ccccc1 209bd20fc334157e49adf029e967dca1 [0,1,0,0,0,1|0,0,1]=3 1760 B17R1.391 CC(Oc1ccccc1)C(=O)NC(C)(C)CO 6901dd449ea6009a0e333096abc77d76 [0,1,0,0,0,1|1,0,1]=4 1761 B17R1.391 C[C@@H](Oc1ccccc1)C(=O)NC(C)(C)CO 1bea1e7d15c3056a5a2e76d4396144ed [0,1,0,0,0,1|1,0,1]=4 1762 B17R1.391 C[C@H](Oc1ccccc1)C(=O)NC(C)(C)CO 15ee932b7589f66c93a1dac524318302 [0,1,0,0,0,1|1,0,1]=4 1763 B17R1.409 CC(C)(CO)NCC(=O)Nc1ccc(cc1)Cl c82aed765e86def532d62d33f4a0affb [0,1,0,0,0,1|0,0,2]=4 1764 B17R1.409 CC(C)(CO)NCC(=O)Nc1ccc(cc1)F 20a2f84bbd467ad7c9513601b5125595 [0,1,0,0,0,1|0,0,2]=4 1765 B17R1.409 CC(C)(CO)NCC(=O)Nc1ccc(cc1)I 2c2b37f57c08eb10453ad9ef05c9afff [0,1,0,0,0,1|0,0,2]=4 1766 B17R1.409 CC(C)(CO)NCC(=O)Oc1ccc(cc1)Cl 0a0ca552fbf8029bd40cd8fef73639c8 [0,1,0,0,0,1|0,0,2]=4 1767 B17R1.409 CC(CNC(C)(C)CF)Oc1ccc(cc1)F bce3def28315f644d5eb807fc65c293f [0,1,0,0,0,1|2,0,0]=4 1768 B17R1.409 CC(CNC(C)(C)CO)Oc1ccc(cc1)F 69bfeee419dbce078239c98f7031954a [0,1,0,0,0,1|1,0,0]=3 1769 B17R1.409 CCC(C)(C)NCC(C)Oc1ccc(cc1)F f6252365c0f6a85e66062239baeae757 [0,1,0,0,0,1|2,0,0]=4 1770 B17R1.409 Cc1ccc(cc1)NC(=O)CNC(C)(C)CO 8d9202cc7efedb55961921f5280602ce [0,1,0,0,0,1|0,0,2]=4 1771 B17R1.410 CC(C)(CO)NCC(=O)Cc1cccc(c1)Br 9bd9f733fb3808945e15b510508b24fe [0,1,0,0,0,1|0,0,2]=4 1772 B17R1.410 CC(C)(CO)NCC(=O)Nc1cccc(c1)Cl d00f6ef208a0a9a426ec336be3229981 [0,1,0,0,0,1|0,0,2]=4 1773 B17R1.410 Cc1cccc(c1)NC(=O)CNC(C)(C)CO 5f1319dfd1dcf0b2053c0448a24de121 [0,1,0,0,0,1|0,0,2]=4 1774 B17R1.2754 CC(CO)(CO)NCC(=O)Cc1ccccc1 c57703e0b4c2620d152b829891ed59b5 [0,1,0,0,0,1|0,0,2]=4 1775 B17R1.2754 CC(CO)(CO)NCC(=O)Nc1ccccc1 2c6ac50930b9fc41bd2798aa4e8d94fe [0,1,0,0,0,1|0,0,2]=4 1776 B17R1.2754 CC(CO)(CO)NCC(=O)Oc1ccccc1 988513e1db01d9a15777987a7d7e3b6b [0,1,0,0,0,1|0,0,2]=4 1777 B17R1.2754 CCC(C)(CO)NCC(=O)Cc1ccccc1 7558681632c638ce979f67b63655d3c9 [0,1,0,0,0,1|0,0,2]=4 1778 B17R1.2754 CCC(C)(CO)NCC(=O)Nc1ccccc1 0bcc9ef6fff49e0c0d645d515a2874fc [0,1,0,0,0,1|0,0,2]=4 1779 B17R1.2754 CCC(C)(CO)NCC(=O)Oc1ccccc1 e7860c4ca9c2c48bf185d6caf123130d [0,1,0,0,0,1|0,0,2]=4 1780 B17R1.4246 CC(C)(CCO)NCC(=O)Cc1ccccc1 e6e4516e503c3849f6230c5e4a346362 [0,1,0,0,0,1|0,0,2]=4 1781 B17R1.4246 CC(C)(CCO)NCC(=O)Nc1ccccc1 7228a78945b2c3b975336c94c7c281fe [0,1,0,0,0,1|0,0,2]=4 1782 B17R1.4246 CC(C)(CCO)NCC(=O)Oc1ccccc1 9030638f3477cfb53c72dfe9842bd140 [0,1,0,0,0,1|0,0,2]=4 1783 B17R1.4246 COCC(C)(C)NCC(=O)Cc1ccccc1 efa6106c25d0fe2fc97e8fd43a0dcb6e [0,1,0,0,0,1|0,0,2]=4 1784 B17R1.4246 COCC(C)(C)NCC(O)Cc1ccccc1 facb7925cb183cd6db5711a20ac46592 [0,1,0,0,0,1|0,0,0]=2 1785 B17R1.4246 COCC(C)(C)NC[C@@H](O)Cc1ccccc1 9bf4a7819533ec0048f9b251754dfd7e [0,1,0,0,0,1|0,0,0]=2 1786 B17R1.13320 C#CC(C)(C)NCC(O)Cc1ccccc1F b798783f53ab6f8733e904e48013ef15 [0,1,0,0,0,1|1,0,1]=4 1787 B17R1.13320 CC(C)(C#N)NCC(O)Cc1ccccc1F 5727f52859592d03a9c428aa3a7d9fd9 [0,1,0,0,0,1|1,0,1]=4 1788 B17R1.13320 CC(C)(CF)NCC(O)Cc1ccccc1F 2ddeb8737c642d0d846be17e87f36783 [0,1,0,0,0,1|1,0,0]=3 1789 B17R1.13320 CC(C)(CO)NCC(=O)Nc1ccccc1Cl b0a88d230b714f030c961fa75c6ea18f [0,1,0,0,0,1|0,0,2]=4 1790 B17R1.13320 CC(C)(CO)NCC(=O)Nc1ccccc1F 684f36a9a5ba37b5b188a22e491c81d4 [0,1,0,0,0,1|0,0,2]=4 1791 B17R1.13320 CC(C)(CO)NCC(O)Cc1ccccc1F ebf5b8e32a1554668fbc3c8d919a1697 [0,1,0,0,0,1|0,0,0]=2 1792 B17R1.13320 Cc1ccccc1NC(=O)CNC(C)(C)CO c98cc17c7997abde966f4643a25866b7 [0,1,0,0,0,1|0,0,2]=4 1793 B17R1.13372 CN(CC(=O)Cc1ccccc1)C(C)(C)CO bb3d26b602fb5845309547c3d1845f8e [0,1,0,0,0,1|0,0,2]=4 1794 B17R1.13372 CN(CC(=O)Nc1ccccc1)C(C)(C)CO 0a2567f1f0c9471778ce9c708317b32f [0,1,0,0,0,1|0,0,2]=4 1795 B17R1.13372 CN(CC(=O)Oc1ccccc1)C(C)(C)CO f789a78d567080a0ff568122a3f6783e [0,1,0,0,0,1|0,0,2]=4 1796 B17R1.16185 CC(=O)C(C)(C)NCC(O)Cc1ccccc1 49e2b889f0387edf59f44bad06ae79f9 [0,1,0,0,0,1|0,0,2]=4 1797 B17R1.16185 CC(=O)C(C)(C)NC[C@@H](O)Cc1ccccc1 ee826b8c2888ea573e85dfc64cf0ce52 [0,1,0,0,0,1|0,0,2]=4 1798 B17R1.16185 CC(C)(NCC(O)Cc1ccccc1)C(=O)N aefb00b74f03bdf0a0de8d652a51743d [0,1,0,0,0,1|0,0,2]=4 1799 B17R1.16185 CC(C)(NCC(O)Cc1ccccc1)C(=O)O 0842e92ca512db3600bc361ee87bbf10 [0,1,0,0,0,1|0,0,1]=3 1800 B17R1.16185 CC(C)(NC[C@@H](O)Cc1ccccc1)C(=O)N c0f32ab57eaf45e749f11d73483861da [0,1,0,0,0,1|0,0,2]=4 1801 B17R1.16185 CC(C)(NC[C@@H](O)Cc1ccccc1)C(=O)O 71a837768a62bf7fc20e0fd1e029eda0 [0,1,0,0,0,1|0,0,1]=3 1802 B17R1.16185 CC(O)C(C)(C)NCC(=O)Cc1ccccc1 6aabe315471e30ba8d13dbc1b2758418 [0,1,0,0,0,1|0,0,2]=4 1803 B17R1.16185 CC(O)C(C)(C)NCC(=O)Nc1ccccc1 2c29bea8e172abbd3a842040c20389af [0,1,0,0,0,1|0,0,2]=4 1804 B17R1.16185 CC(O)C(C)(C)NCC(=O)Oc1ccccc1 dc13cde948f81d7e136a15ef3380c149 [0,1,0,0,0,1|0,0,2]=4 1805 B17R1.19717 CC(C)(CF)NCC(C#N)Cc1ccccc1 98ea39cb57a1634e0bc64fde07af8995 [0,1,0,0,0,1|2,0,0]=4 1806 B17R1.19717 CC(C)(CO)NCC(C#N)Cc1ccccc1 6d2e9de3dc0d5e09725c0b80e96a2f94 [0,1,0,0,0,1|1,0,0]=3 1807 B17R1.89588 CC(C)(CO)NCS(=O)(=O)Nc1ccccc1 03395829b8aed97cb4b4c3ceceacf834 [0,1,0,0,0,1|1,0,1]=4 1808 B17R1.388 CCC(C)(C)N(C)CC(F)c1ccc(cc1)Br 7a67ef7f794ac4692c8b372fe64c81f7 [0,2,0,0,0,0|2,0,0]=4 1809 B17R1.388 CCC(C)(C)N(C)CC(O)c1ccc(cc1)Br 0b8d1c4c5b22a325ad20aa9de5711238 [0,2,0,0,0,0|1,0,0]=3 1810 B17R1.388 CCC(C)(C)N(C)CC(O)c1ccc(cc1)Cl be09038c7ced90aad6def1a4c5c8cf1d [0,2,0,0,0,0|1,0,0]=3 1811 B17R1.388 CCC(C)(C)N(C)C[C@@H](O)c1ccc(cc1)Br 54928a24e17b68b7fb62126bffad8aa6 [0,2,0,0,0,0|1,0,0]=3 1812 B17R1.388 CCC(C)(C)N(C)C[C@@H](O)c1ccc(cc1)C bdb12b2864e2034ec669f412ff499fb9 [0,2,0,0,0,0|1,0,0]=3 1813 B17R1.388 CCC(C)(C)N(C)C[C@@H](O)c1ccc(cc1)Cl 73213b242e391500664ea1354b43ddcd [0,2,0,0,0,0|1,0,0]=3 1814 B17R1.388 CCC(C)(C)N(C)C[C@@H](O)c1ccc(cc1)F 8d7c36f5114eba5695efda51050d9e15 [0,2,0,0,0,0|1,0,0]=3 1815 B17R1.388 CCC(C)(C)N(C)C[C@H](O)c1ccc(cc1)Br c262833fbcce6ac34552f27e06d2aa81 [0,2,0,0,0,0|1,0,0]=3 1816 B17R1.388 CCC(C)(C)N(C)C[C@H](O)c1ccc(cc1)Cl 9ccc261f0953bfd7de5e1c90719c0e7f [0,2,0,0,0,0|1,0,0]=3 1817 B17R1.388 CCC(C)(C)N(C)C[C@H](O)c1ccc(cc1)F 2cd1a05ed0437cc02ce6b2c097e490da [0,2,0,0,0,0|1,0,0]=3 1818 B17R1.388 CN(CC(=O)c1ccc(cc1)Br)C(C)(C)CO b61f8b514a7ace16e5e14870c4d098df [0,2,0,0,0,0|0,0,2]=4 1819 B17R1.388 CN(CC(=O)c1ccc(cc1)Cl)C(C)(C)CO 5b94a9c1680c37789a007e0e353b23af [0,2,0,0,0,0|0,0,2]=4 1820 B17R1.388 CN(CC(=O)c1ccc(cc1)F)C(C)(C)CO 1620376034c654c02dfe9f67e6a32c50 [0,2,0,0,0,0|0,0,2]=4 1821 B17R1.388 CN(CC(=O)c1ccc(cc1)I)C(C)(C)CO 5d740ccaf4d1b9896a2ebb7e37db9c3a [0,2,0,0,0,0|0,0,2]=4 1822 B17R1.388 CN(CC(F)c1ccc(cc1)Br)C(C)(C)CO 678431bf4cee87d2e90b57d43675ba0e [0,2,0,0,0,0|1,0,0]=3 1823 B17R1.388 CN(CC(O)c1ccc(cc1)Br)C(C)(C)CO 10e7d4b8f46188eecac5eeb9925ccba8 [0,2,0,0,0,0|0,0,0]=2 1824 B17R1.388 CN(CC(O)c1ccc(cc1)Cl)C(C)(C)CO 760d90cc9b43d98a6dea75a010be4a32 [0,2,0,0,0,0|0,0,0]=2 1825 B17R1.388 CN(C[C@@H](O)c1ccc(cc1)Br)C(C)(C)CO a0ef2bc70ee43603b6ff02dfb90ad4c3 [0,2,0,0,0,0|0,0,0]=2 1826 B17R1.388 CN(C[C@@H](O)c1ccc(cc1)Cl)C(C)(C)CO 40398b2ee8294dd14ce77df1064131c0 [0,2,0,0,0,0|0,0,0]=2 1827 B17R1.388 CN(C[C@@H](O)c1ccc(cc1)F)C(C)(C)CO 90e7183627a17c038f4ee7e196c54ed0 [0,2,0,0,0,0|0,0,0]=2 1828 B17R1.388 CN(C[C@H](O)c1ccc(cc1)Br)C(C)(C)CO 7017d5ad25a55991dca38d84f2bbda67 [0,2,0,0,0,0|0,0,0]=2 1829 B17R1.388 CN(C[C@H](O)c1ccc(cc1)Cl)C(C)(C)CO 4fbb34b61a7a6149972c355837fb585f [0,2,0,0,0,0|0,0,0]=2 1830 B17R1.388 CN(C[C@H](O)c1ccc(cc1)F)C(C)(C)CO 897e2776a1982451dc0929a017f9d190 [0,2,0,0,0,0|0,0,0]=2 1831 B17R1.388 Cc1ccc(cc1)C(=O)CN(C)C(C)(C)CO 441120d99c0e025a1dff9628f53edb69 [0,2,0,0,0,0|0,0,2]=4 1832 B17R1.388 Cc1ccc(cc1)[C@H](O)CN(C)C(C)(C)CO 04cfc1a7fd6a17075b05e704ad438abb [0,2,0,0,0,0|0,0,0]=2 1833 B17R1.392 CC(C(=O)NC(C)(C)CO)c1ccc(cc1)Br 13432dbd3346c9e3c6f1a4c052d053ae [0,2,0,0,0,0|1,0,1]=4 1834 B17R1.392 CC(C(=O)NC(C)(C)CO)c1ccc(cc1)Cl 2670de972b13d3ad697ff9d2aff3a90e [0,2,0,0,0,0|1,0,1]=4 1835 B17R1.392 CC(C(=O)NC(C)(C)CO)c1ccc(cc1)F 5b9c61d77c366e81f572647c2410496e [0,2,0,0,0,0|1,0,1]=4 1836 B17R1.392 CC(C(=O)NC(C)(C)CO)c1ccc(cc1)I 1d3267bedf2ef6027bd4989f03135d1a [0,2,0,0,0,0|1,0,1]=4 1837 B17R1.392 CC(C(=O)NC(C)(C)CO)c1ccc(cc1)O 1a97786b1d68ab07f070376be04db237 [0,2,0,0,0,0|1,0,1]=4 1838 B17R1.392 CC(C)(CF)NC(=O)C(O)c1ccc(cc1)Br c3741ea6c00579535bb6793410a25ea6 [0,2,0,0,0,0|1,0,1]=4 1839 B17R1.392 CC(C)(CF)NC(=O)C(O)c1ccc(cc1)Cl 4cd38000edccb4c9cde8175a3175600d [0,2,0,0,0,0|1,0,1]=4 1840 B17R1.392 CC(C)(CF)NC(=O)C(O)c1ccc(cc1)F a3a940daa415b70856d55f4556febd60 [0,2,0,0,0,0|1,0,1]=4 1841 B17R1.392 CC(C)(CF)NC(=O)C(O)c1ccc(cc1)O 96cb53230a6e390cc719f4e48b4d5529 [0,2,0,0,0,0|1,0,1]=4 1842 B17R1.392 CC(C)(CF)NC(=O)[C@@H](O)c1ccc(cc1)Br 2478c87179b9bc4d198544fa15cc767a [0,2,0,0,0,0|1,0,1]=4 1843 B17R1.392 CC(C)(CF)NC(=O)[C@@H](O)c1ccc(cc1)Cl 8f45c1860fc5d59905edef089afa0a39 [0,2,0,0,0,0|1,0,1]=4 1844 B17R1.392 CC(C)(CF)NC(=O)[C@@H](O)c1ccc(cc1)F 434c140fe767be7ab41f8ed9605b891f [0,2,0,0,0,0|1,0,1]=4 1845 B17R1.392 CC(C)(CF)NC(=O)[C@@H](O)c1ccc(cc1)O 4a03aa5da683871f62485c29d4371259 [0,2,0,0,0,0|1,0,1]=4 1846 B17R1.392 CC(C)(CF)NC(=O)[C@H](O)c1ccc(cc1)Br c600333c8a748f74d7134039c6b79403 [0,2,0,0,0,0|1,0,1]=4 1847 B17R1.392 CC(C)(CF)NC(=O)[C@H](O)c1ccc(cc1)Cl a095bdacd27cc565a2ae77014c6d71a0 [0,2,0,0,0,0|1,0,1]=4 1848 B17R1.392 CC(C)(CF)NC(=O)[C@H](O)c1ccc(cc1)F eee66508a5292d7d569ed0d745d90170 [0,2,0,0,0,0|1,0,1]=4 1849 B17R1.392 CC(C)(CF)NC(=O)[C@H](O)c1ccc(cc1)O 009d6ba738db23b45ca3093a0e72e137 [0,2,0,0,0,0|1,0,1]=4 1850 B17R1.392 CC(C)(CO)NC(=O)C(F)c1ccc(cc1)Br b555ca1c15d0899a68a0a1e2464a4fc0 [0,2,0,0,0,0|1,0,1]=4 1851 B17R1.392 CC(C)(CO)NC(=O)C(F)c1ccc(cc1)Cl 7b5ba17014c33af61645126726bb5402 [0,2,0,0,0,0|1,0,1]=4 1852 B17R1.392 CC(C)(CO)NC(=O)C(F)c1ccc(cc1)F a672511964376e5403695791736bd77e [0,2,0,0,0,0|1,0,1]=4 1853 B17R1.392 CC(C)(CO)NC(=O)C(O)c1ccc(cc1)Br 5359610310b1df1ba71873a2f0e63be4 [0,2,0,0,0,0|0,0,1]=3 1854 B17R1.392 CC(C)(CO)NC(=O)C(O)c1ccc(cc1)Cl 0680918530146caceb226d115c9b60fe [0,2,0,0,0,0|0,0,1]=3 1855 B17R1.392 CC(C)(CO)NC(=O)C(O)c1ccc(cc1)F 4ba708691580185d763d944c3ef16cd2 [0,2,0,0,0,0|0,0,1]=3 1856 B17R1.392 CC(C)(CO)NC(=O)C(O)c1ccc(cc1)O bfcaa39200496bfd5f98843891af1471 [0,2,0,0,0,0|0,0,1]=3 1857 B17R1.392 CC(C)(CO)NC(=O)[C@@H](O)c1ccc(cc1)Br d84a3bbbb361fdd894aad3883e1d6035 [0,2,0,0,0,0|0,0,1]=3 1858 B17R1.392 CC(C)(CO)NC(=O)[C@@H](O)c1ccc(cc1)Cl ed0fd718514adcb1bffd2bacbbbac2e3 [0,2,0,0,0,0|0,0,1]=3 1859 B17R1.392 CC(C)(CO)NC(=O)[C@@H](O)c1ccc(cc1)F 434e3e93fe49c07353ffddf40a5ea597 [0,2,0,0,0,0|0,0,1]=3 1860 B17R1.392 CC(C)(CO)NC(=O)[C@@H](O)c1ccc(cc1)O fca03368b889020a47cd41948068d464 [0,2,0,0,0,0|0,0,1]=3 1861 B17R1.392 CC(C)(CO)NC(=O)[C@H](O)c1ccc(cc1)Br bf0ee673c741bc797f1e1d1b75211e8f [0,2,0,0,0,0|0,0,1]=3 1862 B17R1.392 CC(C)(CO)NC(=O)[C@H](O)c1ccc(cc1)Cl 8ec936ae243f7171b86da8573572fade [0,2,0,0,0,0|0,0,1]=3 1863 B17R1.392 CC(C)(CO)NC(=O)[C@H](O)c1ccc(cc1)F ac198ed24a258fcfb8b1c3847fa34e8d [0,2,0,0,0,0|0,0,1]=3 1864 B17R1.392 CC(C)(CO)NC(=O)[C@H](O)c1ccc(cc1)O a4fb0c5708637bc6dca42e1dcaafb6f3 [0,2,0,0,0,0|0,0,1]=3 1865 B17R1.392 CCC(C)(C)NC(=O)C(O)c1ccc(cc1)Br bd17c08be69fbde914dec30f5e8ce129 [0,2,0,0,0,0|1,0,1]=4 1866 B17R1.392 CCC(C)(C)NC(=O)C(O)c1ccc(cc1)C 74abfb522c8ce4ee3157b22ee4a7c6ec [0,2,0,0,0,0|1,0,1]=4 1867 B17R1.392 CCC(C)(C)NC(=O)C(O)c1ccc(cc1)F 31f596744917b661faae8fcbb27b75ad [0,2,0,0,0,0|1,0,1]=4 1868 B17R1.392 CCC(C)(C)NC(=O)[C@@H](O)c1ccc(cc1)Br 52a6edb1d4a65b4c2714129f1ea6cde9 [0,2,0,0,0,0|1,0,1]=4 1869 B17R1.392 CCC(C)(C)NC(=O)[C@@H](O)c1ccc(cc1)F 18160dc53f975872fb9dca4a583e8dfc [0,2,0,0,0,0|1,0,1]=4 1870 B17R1.392 CCC(C)(C)NC(=O)[C@H](O)c1ccc(cc1)Br f039a250a48dcd36c00b90973aec901e [0,2,0,0,0,0|1,0,1]=4 1871 B17R1.392 CCC(C)(C)NC(=O)[C@H](O)c1ccc(cc1)C 764eccf7dc8da0daf9251356266a1d61 [0,2,0,0,0,0|1,0,1]=4 1872 B17R1.392 CCC(C)(C)NC(=O)[C@H](O)c1ccc(cc1)F ec7f21231ba03543a8f9e765122bb3fd [0,2,0,0,0,0|1,0,1]=4 1873 B17R1.392 C[C@@H](C(=O)NC(C)(C)CO)c1ccc(cc1)Br 5ff48432120bc6a0bc6b55caa52f5cd6 [0,2,0,0,0,0|1,0,1]=4 1874 B17R1.392 C[C@@H](C(=O)NC(C)(C)CO)c1ccc(cc1)Cl 0e9b185b0174c18dee9e0c185e940c0c [0,2,0,0,0,0|1,0,1]=4 1875 B17R1.392 C[C@@H](C(=O)NC(C)(C)CO)c1ccc(cc1)F 1361111b53ae5b61e26f7ae5df572174 [0,2,0,0,0,0|1,0,1]=4 1876 B17R1.392 C[C@@H](C(=O)NC(C)(C)CO)c1ccc(cc1)O 78f2323cede89beb769ae122d90cfa69 [0,2,0,0,0,0|1,0,1]=4 1877 B17R1.392 C[C@H](C(=O)NC(C)(C)CO)c1ccc(cc1)Br 1ecc37c388686c71fec56ffac09ec4ea [0,2,0,0,0,0|1,0,1]=4 1878 B17R1.392 C[C@H](C(=O)NC(C)(C)CO)c1ccc(cc1)F ccbbe60f25acac1f6cbf754ed1351e7f [0,2,0,0,0,0|1,0,1]=4 1879 B17R1.392 C[C@H](C(=O)NC(C)(C)CO)c1ccc(cc1)O 25819ba59be3b5deeb2bfb6d6fcae71e [0,2,0,0,0,0|1,0,1]=4 1880 B17R1.392 Cc1ccc(cc1)C(C)C(=O)NC(C)(C)CO cbd1c8bdae9ba0f75380a6a84179eeb2 [0,2,0,0,0,0|1,0,1]=4 1881 B17R1.392 Cc1ccc(cc1)C(F)C(=O)NC(C)(C)CO 3a10ba99656ec5dd7dfc48c055f61302 [0,2,0,0,0,0|1,0,1]=4 1882 B17R1.392 Cc1ccc(cc1)C(O)C(=O)NC(C)(C)CF 3e8ef922f09fec7a3e73a32e2d8d63d5 [0,2,0,0,0,0|1,0,1]=4 1883 B17R1.392 Cc1ccc(cc1)C(O)C(=O)NC(C)(C)CO c33e899915213640c3cb7a49f4d6cb1e [0,2,0,0,0,0|0,0,1]=3 1884 B17R1.392 Cc1ccc(cc1)[C@@H](C)C(=O)NC(C)(C)CO ff38e0fdb041c97489c448e92f3ebf9f [0,2,0,0,0,0|1,0,1]=4 1885 B17R1.392 Cc1ccc(cc1)[C@@H](O)C(=O)NC(C)(C)CF 45af1aff8cc56dbb02ad4e8c053d98f1 [0,2,0,0,0,0|1,0,1]=4 1886 B17R1.392 Cc1ccc(cc1)[C@@H](O)C(=O)NC(C)(C)CO eb356dfc6d08f3816e9cd2234630dd21 [0,2,0,0,0,0|0,0,1]=3 1887 B17R1.392 Cc1ccc(cc1)[C@H](C)C(=O)NC(C)(C)CO ecb2dd628e8ffa6f7cd82cbb59330cac [0,2,0,0,0,0|1,0,1]=4 1888 B17R1.2729 C#CC(C)(CC)NCC(O)c1ccc(cc1)Br 33feef32ced2deaa7adc8d2b714df5cf [0,2,0,0,0,0|1,0,1]=4 1889 B17R1.2729 C#CC(C)(CC)NCC(O)c1ccc(cc1)Cl c5a9d9d017ada139c1ea0eaefe5fabf0 [0,2,0,0,0,0|1,0,1]=4 1890 B17R1.2729 C#CC(C)(CC)NC[C@@H](O)c1ccc(cc1)Br f32e908b09bf68fa5c3d5442dded1c27 [0,2,0,0,0,0|1,0,1]=4 1891 B17R1.2729 C#CC(C)(CC)NC[C@@H](O)c1ccc(cc1)F bbbeccda4df05ad3439d5c0cda91ce77 [0,2,0,0,0,0|1,0,1]=4 1892 B17R1.2729 C#CC(C)(CC)NC[C@H](O)c1ccc(cc1)Br f09c01c1f957be5f92b37d177ef8eb9a [0,2,0,0,0,0|1,0,1]=4 1893 B17R1.2729 C#CC(C)(CC)NC[C@H](O)c1ccc(cc1)Cl 514fbe74e86676b2f21a6ebae812e56c [0,2,0,0,0,0|1,0,1]=4 1894 B17R1.2729 C#CC(C)(CC)NC[C@H](O)c1ccc(cc1)F cbe5ab7ad4bbe29d30518e470f981a1f [0,2,0,0,0,0|1,0,1]=4 1895 B17R1.2729 CC(CO)(CO)NCC(=O)c1ccc(cc1)Br 0936c211e7bd79b2a89f521097f2123b [0,2,0,0,0,0|0,0,2]=4 1896 B17R1.2729 CC(CO)(CO)NCC(=O)c1ccc(cc1)Cl fdd4290cb72ea1bba05df4b01f8cc0c2 [0,2,0,0,0,0|0,0,2]=4 1897 B17R1.2729 CC(CO)(CO)NCC(=O)c1ccc(cc1)F 0edc9870f8f03b8749cbb1a718a11cc9 [0,2,0,0,0,0|0,0,2]=4 1898 B17R1.2729 CC(CO)(CO)NCC(=O)c1ccc(cc1)I 6c103c86b29c8350615093c2baa36c8c [0,2,0,0,0,0|0,0,2]=4 1899 B17R1.2729 CC(CO)(CO)NCC(F)c1ccc(cc1)Br dc15b6a3b9f7ba3582e29d51d1b7c238 [0,2,0,0,0,0|1,0,0]=3 1900 B17R1.2729 CC(CO)(CO)NCC(O)c1ccc(cc1)Br 2030b0ff6249a8675ac6cb12de949016 [0,2,0,0,0,0|0,0,0]=2 1901 B17R1.2729 CC(CO)(CO)NCC(O)c1ccc(cc1)Cl b0289a124547d8f452e447f588024e7c [0,2,0,0,0,0|0,0,0]=2 1902 B17R1.2729 CC(CO)(CO)NC[C@@H](O)c1ccc(cc1)Br 4840c50f25d8903d8e3f676d949759d1 [0,2,0,0,0,0|0,0,0]=2 1903 B17R1.2729 CC(CO)(CO)NC[C@H](O)c1ccc(cc1)Br 4ac08a3de8cc84756ed65b4ce6a35c63 [0,2,0,0,0,0|0,0,0]=2 1904 B17R1.2729 CC(CO)(CO)NC[C@H](O)c1ccc(cc1)Cl 7d883c2f394f7ebad45556ac398cc54d [0,2,0,0,0,0|0,0,0]=2 1905 B17R1.2729 CC(CO)(CO)NC[C@H](O)c1ccc(cc1)F 19ecfae2bacf4588032252ffc2a3bd36 [0,2,0,0,0,0|0,0,0]=2 1906 B17R1.2729 CCC(C)(C#N)NCC(O)c1ccc(cc1)Cl 6d170b5ff67f900e3996238f8789768a [0,2,0,0,0,0|1,0,1]=4 1907 B17R1.2729 CCC(C)(C#N)NC[C@H](O)c1ccc(cc1)Cl 25eb5fff2b664adf24462d8ef006f7e8 [0,2,0,0,0,0|1,0,1]=4 1908 B17R1.2729 CCC(C)(C#N)NC[C@H](O)c1ccc(cc1)F dfb16261495acba456fbad1f0021b625 [0,2,0,0,0,0|1,0,1]=4 1909 B17R1.2729 CCC(C)(CC)NCC(O)c1ccc(cc1)Br 2cb80f447b40088545ed06401427a381 [0,2,0,0,0,0|1,0,0]=3 1910 B17R1.2729 CCC(C)(CC)NCC(O)c1ccc(cc1)Cl 9879aa9c02d9baf1caf51ad2c4266566 [0,2,0,0,0,0|1,0,0]=3 1911 B17R1.2729 CCC(C)(CC)NC[C@@H](O)c1ccc(cc1)Br a6c00cbb8ffbec54dab2d6b02b0e58ef [0,2,0,0,0,0|1,0,0]=3 1912 B17R1.2729 CCC(C)(CC)NC[C@@H](O)c1ccc(cc1)F 820fbba3565ac34d76b5539eef797d77 [0,2,0,0,0,0|1,0,0]=3 1913 B17R1.2729 CCC(C)(CC)NC[C@H](O)c1ccc(cc1)Br 8c9f959f8ff76a59d236b98dc9258178 [0,2,0,0,0,0|1,0,0]=3 1914 B17R1.2729 CCC(C)(CC)NC[C@H](O)c1ccc(cc1)Cl 5b26626d3d7ad1f5b35608bfcacb8858 [0,2,0,0,0,0|1,0,0]=3 1915 B17R1.2729 CCC(C)(CC)NC[C@H](O)c1ccc(cc1)F b78018a2fd5511e348e0e4bda58a0b5e [0,2,0,0,0,0|1,0,0]=3 1916 B17R1.2729 CCC(C)(CO)NCC(=O)c1ccc(cc1)Br bf8b956b7874a14cd9dd3734a44cc919 [0,2,0,0,0,0|0,0,2]=4 1917 B17R1.2729 CCC(C)(CO)NCC(=O)c1ccc(cc1)C cc632996bca12ef29ffc6cc3676700b8 [0,2,0,0,0,0|0,0,2]=4 1918 B17R1.2729 CCC(C)(CO)NCC(=O)c1ccc(cc1)Cl 338f5ea51ac020d7606c5b6c2875aa98 [0,2,0,0,0,0|0,0,2]=4 1919 B17R1.2729 CCC(C)(CO)NCC(=O)c1ccc(cc1)F 4acc17f9396b4169068c24c83624ccbf [0,2,0,0,0,0|0,0,2]=4 1920 B17R1.2729 CCC(C)(CO)NCC(=O)c1ccc(cc1)I 8089c675a428cb7b19e22b05f9e3090c [0,2,0,0,0,0|0,0,2]=4 1921 B17R1.2729 CCC(C)(CO)NC[C@H](O)c1ccc(cc1)F 4ad8ba5bd37c79bfd302807a385bcc88 [0,2,0,0,0,0|0,0,0]=2 1922 B17R1.2729 Cc1ccc(cc1)C(=O)CNC(C)(CO)CO db4fc9a59a2e5ad7112fb78c2044fecb [0,2,0,0,0,0|0,0,2]=4 1923 B17R1.10607 CC(C)(CO)NCC(=O)c1ccc(cc1)C#N aab43f4c94b4fb0202dc8fd39a74aeb3 [0,2,0,0,0,0|0,0,2]=4 1924 B17R1.10607 CC(C)(CO)NCC(=O)c1ccc(cc1)CF 835291d1cd63a7f90796df8281210fac [0,2,0,0,0,0|0,0,2]=4 1925 B17R1.10607 CCc1ccc(cc1)C(=O)CNC(C)(C)CO 875853afc0977b9c8fbc4251c7e60049 [0,2,0,0,0,0|0,0,2]=4 1926 B17R1.10607 COc1ccc(cc1)C(=O)CNC(C)(C)CO 2c3837efc5ad6211479f08953a7b05a6 [0,2,0,0,0,0|0,0,2]=4 1927 B17R1.10607 CSc1ccc(cc1)C(=O)CNC(C)(C)CO 8eeed69b04e36a9c9859654b65d62d45 [0,2,0,0,0,0|0,0,2]=4 1928 B17R1.13080 CC(C)(CF)NCC(F)(F)c1ccc(cc1)Br 2b18a4c72f256fcee46f4598739c2e6a [0,2,0,0,0,0|2,0,0]=4 1929 B17R1.13080 CC(C)(CF)NCC(F)(F)c1ccc(cc1)F 2a70241ec4f27b4fb705a300345796bb [0,2,0,0,0,0|2,0,0]=4 1930 B17R1.13080 CC(C)(CO)NCC(F)(F)c1ccc(cc1)Br 67052fe5e69bc63d18d58af94203647e [0,2,0,0,0,0|1,0,0]=3 1931 B17R1.13080 CC(C)(CO)NCC(F)(F)c1ccc(cc1)F 88725c47665cb40764591fffbebbcd80 [0,2,0,0,0,0|1,0,0]=3 1932 B17R1.13080 CCC(C)(C)NCC(F)(F)c1ccc(cc1)F 48207a1cf4d1ecae1e81c6f68889c6fa [0,2,0,0,0,0|2,0,0]=4 1933 B17R1.13317 C#CC(C)(C)NCC(O)c1ccc(c(c1)Cl)Cl b42c0afe1b4108d8b13296201159f54b [0,2,0,0,0,0|1,0,1]=4 1934 B17R1.13317 C#CC(C)(C)NCC(O)c1ccc(c(c1)F)F fa31c76fbea9a0401da3dd0a30c8e977 [0,2,0,0,0,0|1,0,1]=4 1935 B17R1.13317 C#CC(C)(C)NC[C@@H](O)c1ccc(c(c1)Cl)Cl 7d3136dfe2bc202514d308df06529dfc [0,2,0,0,0,0|1,0,1]=4 1936 B17R1.13317 C#CC(C)(C)NC[C@@H](O)c1ccc(c(c1)F)F eebc4236e38a967755c70287fb6990ae [0,2,0,0,0,0|1,0,1]=4 1937 B17R1.13317 C#CC(C)(C)NC[C@H](O)c1ccc(c(c1)F)F eb30dda2520dd695c9702b88c2ed299c [0,2,0,0,0,0|1,0,1]=4 1938 B17R1.13317 CC(C)(C#N)NCC(O)c1ccc(c(c1)F)F a585840d2319a2196d182d1f6c786710 [0,2,0,0,0,0|1,0,1]=4 1939 B17R1.13317 CC(C)(C#N)NC[C@@H](O)c1ccc(c(c1)F)F 60c712138a76ac851a6befdb939fe554 [0,2,0,0,0,0|1,0,1]=4 1940 B17R1.13317 CC(C)(C#N)NC[C@H](O)c1ccc(c(c1)F)F 7b4990e1a9768659b3495576ce8e68db [0,2,0,0,0,0|1,0,1]=4 1941 B17R1.13317 CC(C)(CO)NCC(=O)c1ccc(c(c1)Cl)Cl fc3c8cae894cda784190a390db725636 [0,2,0,0,0,0|0,0,2]=4 1942 B17R1.13317 CC(C)(CO)NCC(=O)c1ccc(c(c1)Cl)F 6fdc663b34918fb39e38510057657472 [0,2,0,0,0,0|0,0,2]=4 1943 B17R1.13317 CC(C)(CO)NCC(=O)c1ccc(c(c1)Cl)I efaa09fa9a7d853a895908033efd47ca [0,2,0,0,0,0|0,0,2]=4 1944 B17R1.13317 CC(C)(CO)NCC(=O)c1ccc(c(c1)F)Cl 3b3d7da34aeefc6ffe4c33ac6aa96d7f [0,2,0,0,0,0|0,0,2]=4 1945 B17R1.13317 CC(C)(CO)NCC(=O)c1ccc(c(c1)F)F 29eb19353ad6bcc211c495379c7c4c01 [0,2,0,0,0,0|0,0,2]=4 1946 B17R1.13317 Cc1cc(ccc1Cl)C(=O)CNC(C)(C)CO e8182bee12e55c12c5f9c9bc38b3250f [0,2,0,0,0,0|0,0,2]=4 1947 B17R1.13317 Cc1cc(ccc1F)C(=O)CNC(C)(C)CO 761d8502b1e1fd82bd26ad4e24d1a442 [0,2,0,0,0,0|0,0,2]=4 1948 B17R1.13317 Cc1ccc(cc1C)C(=O)CNC(C)(C)CO 1a9e307323ffc127a0d4b707f6cae848 [0,2,0,0,0,0|0,0,2]=4 1949 B17R1.13317 Cc1ccc(cc1F)C(=O)CNC(C)(C)CO bac22f477fadaeb0941fbf59b03167e5 [0,2,0,0,0,0|0,0,2]=4 1950 B17R1.18521 CC(C)(CCO)NCC(=O)c1ccc(cc1)Br 254bf0b8179853d4f9d55b7940e29039 [0,2,0,0,0,0|0,0,2]=4 1951 B17R1.18521 CC(C)(CCO)NCC(=O)c1ccc(cc1)Cl 37fbb0d6a31c0fb99e696839f940ed8f [0,2,0,0,0,0|0,0,2]=4 1952 B17R1.18521 CC(C)(CCO)NCC(=O)c1ccc(cc1)F a83bb5f0bba01b4baa9dee29e425a9b1 [0,2,0,0,0,0|0,0,2]=4 1953 B17R1.18521 CC(C)(CCO)NCC(=O)c1ccc(cc1)I 78556d65fc2eb1a94c0401545ec7436c [0,2,0,0,0,0|0,0,2]=4 1954 B17R1.18521 CC(C)(CCO)NCC(F)c1ccc(cc1)Br 29f02d4a01b4f2ee664974074c5941e0 [0,2,0,0,0,0|1,0,0]=3 1955 B17R1.18521 CC(C)(CCO)NCC(O)c1ccc(cc1)Br bc94d0616b2d3c97582a3eea71ebf6df [0,2,0,0,0,0|0,0,0]=2 1956 B17R1.18521 CC(C)(CCO)NCC(O)c1ccc(cc1)Cl e8c97903c957bf2815ea1449cc113be4 [0,2,0,0,0,0|0,0,0]=2 1957 B17R1.18521 CC(C)(CCO)NC[C@@H](O)c1ccc(cc1)Br 9aa89803711983ef7ca627bf7a0fa141 [0,2,0,0,0,0|0,0,0]=2 1958 B17R1.18521 CC(C)(CCO)NC[C@@H](O)c1ccc(cc1)Cl 05539e54eacfcf8e6d795af4cc4f5e24 [0,2,0,0,0,0|0,0,0]=2 1959 B17R1.18521 CC(C)(CCO)NC[C@@H](O)c1ccc(cc1)F bf48026d4191c6cb59b15237972f86c0 [0,2,0,0,0,0|0,0,0]=2 1960 B17R1.18521 CC(C)(CCO)NC[C@H](O)c1ccc(cc1)Br fcf56c6cabd880dcbb9709ce1d0e500f [0,2,0,0,0,0|0,0,0]=2 1961 B17R1.18521 CC(C)(CCO)NC[C@H](O)c1ccc(cc1)Cl c909e51870156826201ee29e08576760 [0,2,0,0,0,0|0,0,0]=2 1962 B17R1.18521 CC(C)(CCO)NC[C@H](O)c1ccc(cc1)F fc0eb80d10c36c7f99baf45311a4f74e [0,2,0,0,0,0|0,0,0]=2 1963 B17R1.18521 COCC(C)(C)NCC(=O)c1ccc(cc1)C 5343067ada0836f0d5be353c94dd2f3a [0,2,0,0,0,0|0,0,2]=4 1964 B17R1.18521 COCC(C)(C)NCC(=O)c1ccc(cc1)Cl 9b2dc264dde401343ea3751160f93d8d [0,2,0,0,0,0|0,0,2]=4 1965 B17R1.18521 COCC(C)(C)NCC(=O)c1ccc(cc1)F 1694c10289c803cc7c834f1d31473b37 [0,2,0,0,0,0|0,0,2]=4 1966 B17R1.18521 COCC(C)(C)NCC(=O)c1ccc(cc1)I c54d10fe33b95c9c5399ee2e085a7b45 [0,2,0,0,0,0|0,0,2]=4 1967 B17R1.18521 COCC(C)(C)NCC(O)c1ccc(cc1)Br 32aa06f44826d0b0c0c741398fc8793d [0,2,0,0,0,0|0,0,0]=2 1968 B17R1.18521 COCC(C)(C)NCC(O)c1ccc(cc1)Cl bde40a6c49e6f434db77abd7ce4a16f0 [0,2,0,0,0,0|0,0,0]=2 1969 B17R1.18521 COCC(C)(C)NC[C@@H](O)c1ccc(cc1)Br 496579ce40fb08d3ec4275e3295cb681 [0,2,0,0,0,0|0,0,0]=2 1970 B17R1.18521 COCC(C)(C)NC[C@@H](O)c1ccc(cc1)F 3e4be9582bc2187d85d768f6ef5f312a [0,2,0,0,0,0|0,0,0]=2 1971 B17R1.18521 COCC(C)(C)NC[C@H](O)c1ccc(cc1)Br 3e3d90d422a32446c642757ee421acd6 [0,2,0,0,0,0|0,0,0]=2 1972 B17R1.18521 COCC(C)(C)NC[C@H](O)c1ccc(cc1)Cl 87193c5abcbfa1dceca886031d4a4e1b [0,2,0,0,0,0|0,0,0]=2 1973 B17R1.18521 COCC(C)(C)NC[C@H](O)c1ccc(cc1)F 08173b16a015151000d6982394120d2a [0,2,0,0,0,0|0,0,0]=2 1974 B17R1.18521 CSCC(C)(C)NCC(F)c1ccc(cc1)Br 162a8dc44761fbb9f436a9d4adc4b781 [0,2,0,0,0,0|1,1,0]=4 1975 B17R1.18521 CSCC(C)(C)NCC(O)c1ccc(cc1)Br 29474347c53a7f1836fc72c18dd0a32f [0,2,0,0,0,0|0,1,0]=3 1976 B17R1.18521 CSCC(C)(C)NCC(O)c1ccc(cc1)Cl e3acd93e4026f691ac84d0279e49a1ea [0,2,0,0,0,0|0,1,0]=3 1977 B17R1.18521 CSCC(C)(C)NC[C@@H](O)c1ccc(cc1)Br 51f99753adb389e94ba099bd0812d594 [0,2,0,0,0,0|0,1,0]=3 1978 B17R1.18521 CSCC(C)(C)NC[C@@H](O)c1ccc(cc1)C b66f8c50989f518a86872301889232f0 [0,2,0,0,0,0|0,1,0]=3 1979 B17R1.18521 CSCC(C)(C)NC[C@@H](O)c1ccc(cc1)F a4d151604c51329589a81018969a7e9f [0,2,0,0,0,0|0,1,0]=3 1980 B17R1.18521 CSCC(C)(C)NC[C@H](O)c1ccc(cc1)Br 310c0c0540ef31678e5fccfa0c74971c [0,2,0,0,0,0|0,1,0]=3 1981 B17R1.18521 CSCC(C)(C)NC[C@H](O)c1ccc(cc1)Cl 5913124f76a6a8aa1a45477532f77e4d [0,2,0,0,0,0|0,1,0]=3 1982 B17R1.18521 CSCC(C)(C)NC[C@H](O)c1ccc(cc1)F 1591972326673de54f3cc61ef4aaba21 [0,2,0,0,0,0|0,1,0]=3 1983 B17R1.18521 Cc1ccc(cc1)C(=O)CNC(C)(C)CCO 9bedbfc410e3a8b5b4ea2b209fd99348 [0,2,0,0,0,0|0,0,2]=4 1984 B17R1.18521 Cc1ccc(cc1)[C@H](O)CNC(C)(C)CCO c8f7143258ec0dac5467484d47c682c6 [0,2,0,0,0,0|0,0,0]=2 1985 B17R1.19718 CC(C)(CO)CNC(CO)c1ccc(cc1)Br 49bb24d5c89c978bf81e18c104782150 [0,2,0,0,0,0|2,0,0]=4 1986 B17R1.19718 CC(C)(CO)CNC(CO)c1ccc(cc1)Cl 19bfdc95cf5a22acc86317c7cd85ebdb [0,2,0,0,0,0|2,0,0]=4 1987 B17R1.19718 CC(C)(CO)CNC(CO)c1ccc(cc1)F 7febe6793b4edad36730f2ba42592774 [0,2,0,0,0,0|2,0,0]=4 1988 B17R1.19718 CC(C)(CO)CN[C@@H](CO)c1ccc(cc1)Br 13731058d40ffb0184f3844765bd5090 [0,2,0,0,0,0|2,0,0]=4 1989 B17R1.19718 CC(C)(CO)CN[C@@H](CO)c1ccc(cc1)Cl ab6b4268c74c7a5316a8c659b4a6d812 [0,2,0,0,0,0|2,0,0]=4 1990 B17R1.19718 CC(C)(CO)CN[C@@H](CO)c1ccc(cc1)F befdea7d36aeb17950a17c15776936ae [0,2,0,0,0,0|2,0,0]=4 1991 B17R1.19718 CC(C)(CO)CN[C@H](CO)c1ccc(cc1)Br 656672095d275f0ede9fe4b47810b922 [0,2,0,0,0,0|2,0,0]=4 1992 B17R1.19718 CC(C)(CO)CN[C@H](CO)c1ccc(cc1)Cl 6ba93908bed183f3e58fbe4b5d5bd9ed [0,2,0,0,0,0|2,0,0]=4 1993 B17R1.19718 CC(C)(CO)CN[C@H](CO)c1ccc(cc1)F db9f6120c7b8695a7fb71db584b8aa4b [0,2,0,0,0,0|2,0,0]=4 1994 B17R1.19718 Cc1ccc(cc1)C(CO)NCC(C)(C)CO 60360bba16685653dfc25563923a2dc1 [0,2,0,0,0,0|2,0,0]=4 1995 B17R1.19718 Cc1ccc(cc1)[C@@H](CO)NCC(C)(C)CO 8be9138a767957ae2354dcf4e0a68069 [0,2,0,0,0,0|2,0,0]=4 1996 B17R1.19718 Cc1ccc(cc1)[C@H](CO)NCC(C)(C)CO 920654f8a4c615fc54027f1075060b9f [0,2,0,0,0,0|2,0,0]=4 1997 B17R1.23637 CC(=O)C(C)(C)NCC(O)c1ccc(cc1)Br 1dfa65a41afcc47bd149e6abd78560aa [0,2,0,0,0,0|0,0,2]=4 1998 B17R1.23637 CC(=O)C(C)(C)NCC(O)c1ccc(cc1)Cl aba0c719c2484ae0c4139b9e66763755 [0,2,0,0,0,0|0,0,2]=4 1999 B17R1.23637 CC(=O)C(C)(C)NC[C@@H](O)c1ccc(cc1)Br 97535789c11fb605c017f8d332bc935c [0,2,0,0,0,0|0,0,2]=4 2000 B17R1.23637 CC(=O)C(C)(C)NC[C@@H](O)c1ccc(cc1)C 84508c4cda6055121624e44f2f6550a3 [0,2,0,0,0,0|0,0,2]=4 2001 B17R1.23637 CC(=O)C(C)(C)NC[C@@H](O)c1ccc(cc1)Cl e8b409cca3ade6caa5df97d3de261c2d [0,2,0,0,0,0|0,0,2]=4 2002 B17R1.23637 CC(=O)C(C)(C)NC[C@@H](O)c1ccc(cc1)F 42dc3380ecd4d6c3100a28f33301f6e5 [0,2,0,0,0,0|0,0,2]=4 2003 B17R1.23637 CC(=O)C(C)(C)NC[C@H](O)c1ccc(cc1)Br e7d6412adaefa1377291aa5fec1fa729 [0,2,0,0,0,0|0,0,2]=4 2004 B17R1.23637 CC(=O)C(C)(C)NC[C@H](O)c1ccc(cc1)Cl a7855b8f691afc8a937636dbafc5b97f [0,2,0,0,0,0|0,0,2]=4 2005 B17R1.23637 CC(=O)C(C)(C)NC[C@H](O)c1ccc(cc1)F fe936eb7a4101207330e056558f29c02 [0,2,0,0,0,0|0,0,2]=4 2006 B17R1.23637 CC(C)(NCC(F)c1ccc(cc1)Br)C(=O)O 09f6e4372e0b37279b45a018166a75e3 [0,2,0,0,0,0|1,0,1]=4 2007 B17R1.23637 CC(C)(NCC(O)c1ccc(cc1)Br)C(=O)N ddd2bce78175a622a8b75820fdc2fcf3 [0,2,0,0,0,0|0,0,2]=4 2008 B17R1.23637 CC(C)(NCC(O)c1ccc(cc1)Br)C(=O)O 54709a1b7d51c238389d698d5a32a163 [0,2,0,0,0,0|0,0,1]=3 2009 B17R1.23637 CC(C)(NCC(O)c1ccc(cc1)Cl)C(=O)N 0a99ab88c19651f8d46da046542b51e0 [0,2,0,0,0,0|0,0,2]=4 2010 B17R1.23637 CC(C)(NCC(O)c1ccc(cc1)Cl)C(=O)O 30acc048ca8e7ba7b916747b5cd27c5b [0,2,0,0,0,0|0,0,1]=3 2011 B17R1.23637 CC(C)(NC[C@@H](O)c1ccc(cc1)Br)C(=O)N fd5362a5b5367b746ae5965b4b1db60a [0,2,0,0,0,0|0,0,2]=4 2012 B17R1.23637 CC(C)(NC[C@@H](O)c1ccc(cc1)Br)C(=O)O 9e33c835803ccae176ee6c18ff8814be [0,2,0,0,0,0|0,0,1]=3 2013 B17R1.23637 CC(C)(NC[C@@H](O)c1ccc(cc1)Cl)C(=O)N a66b2fd84f558d08236a9b6393d5e82e [0,2,0,0,0,0|0,0,2]=4 2014 B17R1.23637 CC(C)(NC[C@@H](O)c1ccc(cc1)Cl)C(=O)O a4587aef4b2ebde01ceea961197d4fdc [0,2,0,0,0,0|0,0,1]=3 2015 B17R1.23637 CC(C)(NC[C@@H](O)c1ccc(cc1)F)C(=O)N 2e92af8243ba4014f26a4bc71a182f63 [0,2,0,0,0,0|0,0,2]=4 2016 B17R1.23637 CC(C)(NC[C@@H](O)c1ccc(cc1)F)C(=O)O 9ac3f880758ddfce4fcb57f3edc47cfa [0,2,0,0,0,0|0,0,1]=3 2017 B17R1.23637 CC(C)(NC[C@H](O)c1ccc(cc1)Br)C(=O)N 3f9b7ce62a186c822feec7283d09bbf8 [0,2,0,0,0,0|0,0,2]=4 2018 B17R1.23637 CC(C)(NC[C@H](O)c1ccc(cc1)Br)C(=O)O ab8bea8dad46d1bc0ecbcbf9fd60ef68 [0,2,0,0,0,0|0,0,1]=3 2019 B17R1.23637 CC(C)(NC[C@H](O)c1ccc(cc1)Cl)C(=O)N 862d56a1fa233e3fd2198d58d941997e [0,2,0,0,0,0|0,0,2]=4 2020 B17R1.23637 CC(C)(NC[C@H](O)c1ccc(cc1)Cl)C(=O)O 6ed87cd979158b2849114c72c6c0ba04 [0,2,0,0,0,0|0,0,1]=3 2021 B17R1.23637 CC(C)(NC[C@H](O)c1ccc(cc1)F)C(=O)N c5ac19add2009b3e497b5fd4f0f0675a [0,2,0,0,0,0|0,0,2]=4 2022 B17R1.23637 CC(C)(NC[C@H](O)c1ccc(cc1)F)C(=O)O 6b50af18abe0b23547e51a44eb656abf [0,2,0,0,0,0|0,0,1]=3 2023 B17R1.23637 CC(C)C(C)(C)NCC(O)c1ccc(cc1)Br 029cf0ea31bb5ae0067e4d215cf04609 [0,2,0,0,0,0|1,0,0]=3 2024 B17R1.23637 CC(C)C(C)(C)NCC(O)c1ccc(cc1)Cl 863f4e1144b60ea6a184be302dce9faa [0,2,0,0,0,0|1,0,0]=3 2025 B17R1.23637 CC(C)C(C)(C)NC[C@@H](O)c1ccc(cc1)Br 2655811c6af5699a0bf1f7162b5719c5 [0,2,0,0,0,0|1,0,0]=3 2026 B17R1.23637 CC(C)C(C)(C)NC[C@@H](O)c1ccc(cc1)F 0de56466d50011018f6ddfca443a7d7f [0,2,0,0,0,0|1,0,0]=3 2027 B17R1.23637 CC(C)C(C)(C)NC[C@H](O)c1ccc(cc1)Br c0f5ffb38622b570857a21cb5d612dad [0,2,0,0,0,0|1,0,0]=3 2028 B17R1.23637 CC(C)C(C)(C)NC[C@H](O)c1ccc(cc1)Cl 297f06b455bc8bd8a50ac306d3926284 [0,2,0,0,0,0|1,0,0]=3 2029 B17R1.23637 CC(C)C(C)(C)NC[C@H](O)c1ccc(cc1)F 90fde0545b8c12d4421259baa5d83169 [0,2,0,0,0,0|1,0,0]=3 2030 B17R1.23637 CC(O)C(C)(C)NCC(=O)c1ccc(cc1)Br 5f8a3985811d11a077bc2a26e36660a3 [0,2,0,0,0,0|0,0,2]=4 2031 B17R1.23637 CC(O)C(C)(C)NCC(=O)c1ccc(cc1)Cl 4cb97fe07f1571b72a112c71986749af [0,2,0,0,0,0|0,0,2]=4 2032 B17R1.23637 CC(O)C(C)(C)NCC(=O)c1ccc(cc1)F c1b76157621efc70b494e20be2ebc493 [0,2,0,0,0,0|0,0,2]=4 2033 B17R1.23637 CC(O)C(C)(C)NCC(=O)c1ccc(cc1)I 16f8bf822c394265d5109e5e7d0b71e7 [0,2,0,0,0,0|0,0,2]=4 2034 B17R1.23637 CC(O)C(C)(C)NCC(O)c1ccc(cc1)Cl bd05fe34b84717701e4ed89312fc1199 [0,2,0,0,0,0|0,0,0]=2 2035 B17R1.23637 CC(O)C(C)(C)NC[C@@H](O)c1ccc(cc1)F 56a7ba4d9d71fa4b257c1a1f6db81867 [0,2,0,0,0,0|0,0,0]=2 2036 B17R1.23637 CC(O)C(C)(C)NC[C@H](O)c1ccc(cc1)Cl df51be18ab45ad9fa1cf8010b31246bb [0,2,0,0,0,0|0,0,0]=2 2037 B17R1.23637 CC(O)C(C)(C)NC[C@H](O)c1ccc(cc1)F 635ae63269fcc1a102a08cc2d0309ce6 [0,2,0,0,0,0|0,0,0]=2 2038 B17R1.23637 Cc1ccc(cc1)C(=O)CNC(C)(C)C(C)O 4739b1732accf7ce809a4d0854ad640d [0,2,0,0,0,0|0,0,2]=4 2039 B17R1.23637 Cc1ccc(cc1)[C@H](O)CNC(C)(C)C(=O)N 6220718e4ab0869880d19939efb28b43 [0,2,0,0,0,0|0,0,2]=4 2040 B17R1.23637 Cc1ccc(cc1)[C@H](O)CNC(C)(C)C(=O)O 2c98de7311fc721c0b9a184c7dfa332a [0,2,0,0,0,0|0,0,1]=3 2041 B17R1.90166 C#CC(C)(C)NCC(O)c1ccc(cc1Cl)Cl db0baaa6ae6a139141326a34eedbed09 [0,2,0,0,0,0|1,0,1]=4 2042 B17R1.90166 C#CC(C)(C)NC[C@@H](O)c1ccc(cc1Cl)Cl c155ea31575a51a9434640487bd0cd6f [0,2,0,0,0,0|1,0,1]=4 2043 B17R1.90166 C#CC(C)(C)NC[C@@H](O)c1ccc(cc1F)F 85b84d5a27ea0c43b7a4a7715a6d56dd [0,2,0,0,0,0|1,0,1]=4 2044 B17R1.90166 C#CC(C)(C)NC[C@H](O)c1ccc(cc1Cl)Cl 6ddd4ce7d5782ade04a7c86df0313f18 [0,2,0,0,0,0|1,0,1]=4 2045 B17R1.90166 C=C(CNC(C)(C)CO)c1ccc(cc1F)F ec1f2b7e37c1d3039fdfcde84476d2b3 [0,2,0,0,0,0|1,0,1]=4 2046 B17R1.90166 CC(C)(C#N)NCC(O)c1ccc(cc1Cl)Cl 618a4c6369d23fbd3ac6bdc2beb67168 [0,2,0,0,0,0|1,0,1]=4 2047 B17R1.90166 CC(C)(C#N)NC[C@@H](O)c1ccc(cc1Cl)Cl 0144b4bd8f8c0283d089aae2f61132d6 [0,2,0,0,0,0|1,0,1]=4 2048 B17R1.90166 CC(C)(C#N)NC[C@@H](O)c1ccc(cc1F)F 4eb06158b7b63adeb7360c3c6d7abebe [0,2,0,0,0,0|1,0,1]=4 2049 B17R1.90166 CC(C)(C#N)NC[C@H](O)c1ccc(cc1Cl)Cl b41a53db78bf162c44c94d3a68f8ab04 [0,2,0,0,0,0|1,0,1]=4 2050 B17R1.90166 CC(C)(CF)NCC(O)c1ccc(cc1Cl)Cl e9bc1815f3ac3c459e63540ec42a8368 [0,2,0,0,0,0|1,0,0]=3 2051 B17R1.90166 CC(C)(CF)NC[C@@H](O)c1ccc(cc1Cl)Cl 7d4fa874b94052a0aa7935fd1ec748ad [0,2,0,0,0,0|1,0,0]=3 2052 B17R1.90166 CC(C)(CF)NC[C@@H](O)c1ccc(cc1F)F 2ae97ab1da086ce4ac1b99e533df1c70 [0,2,0,0,0,0|1,0,0]=3 2053 B17R1.90166 CC(C)(CF)NC[C@H](O)c1ccc(cc1Cl)Cl 6daeeb6938e52127e682dcd4812b16cc [0,2,0,0,0,0|1,0,0]=3 2054 B17R1.90166 CC(C)(CO)NCC(=O)c1ccc(cc1Br)F b1f5ac582513397f13b54414dcf063b6 [0,2,0,0,0,0|0,0,2]=4 2055 B17R1.90166 CC(C)(CO)NCC(=O)c1ccc(cc1Cl)Cl 2dd70815484605fb1c58d42f6bece470 [0,2,0,0,0,0|0,0,2]=4 2056 B17R1.90166 CC(C)(CO)NCC(=O)c1ccc(cc1Cl)F 47710128a78d7d39120354ca26c0953e [0,2,0,0,0,0|0,0,2]=4 2057 B17R1.90166 CC(C)(CO)NCC(=O)c1ccc(cc1F)Br c44e99b5e27cec903d99cdadb93f6100 [0,2,0,0,0,0|0,0,2]=4 2058 B17R1.90166 CC(C)(CO)NCC(=O)c1ccc(cc1F)Cl 6388aa7aa14bf2ca84d5a0d4d1358e31 [0,2,0,0,0,0|0,0,2]=4 2059 B17R1.90166 CC(C)(CO)NCC(=O)c1ccc(cc1F)F 89439c06c60fd59f209c25244f4bc4dd [0,2,0,0,0,0|0,0,2]=4 2060 B17R1.90166 CC(C)(CO)NCC(O)c1ccc(cc1Cl)Cl b16c1c2873f2ec02fbae66e352c20b33 [0,2,0,0,0,0|0,0,0]=2 2061 B17R1.90166 CC(C)(CO)NC[C@@H](O)c1ccc(cc1Cl)Cl 4985d860ad949fbb78c6e56756631815 [0,2,0,0,0,0|0,0,0]=2 2062 B17R1.90166 CC(C)(CO)NC[C@@H](O)c1ccc(cc1F)F 8f5d815f933411ed584b2526b2dbbce4 [0,2,0,0,0,0|0,0,0]=2 2063 B17R1.90166 CC(C)(CO)NC[C@H](O)c1ccc(cc1Cl)Cl 5b9b1b913911b4d1d1116e065c05c6b8 [0,2,0,0,0,0|0,0,0]=2 2064 B17R1.90166 Cc1cc(ccc1C(=O)CNC(C)(C)CO)Cl 64624e0a39365f693c1a574e7f468fb2 [0,2,0,0,0,0|0,0,2]=4 2065 B17R1.90166 Cc1ccc(c(c1)C)C(=O)CNC(C)(C)CO 321283bf3ae19b5377605d48b3a62681 [0,2,0,0,0,0|0,0,2]=4 2066 B17R1.377 CC(C)(CO)NCC(=O)c1cccc(c1Cl)F dec5bb563cca7eb6a1b5bdd9eadaf072 [0,2,0,0,0,0|0,0,2]=4 2067 B17R1.377 CC(C)(CO)NCC(=O)c1cccc(c1F)Cl 95f09903716c8a94e98ef98cda6af35d [0,2,0,0,0,0|0,0,2]=4 2068 B17R1.377 CC(C)(CO)NCC(=O)c1cccc(c1F)F 3985274f921456e5c3800ff94797039b [0,2,0,0,0,0|0,0,2]=4 2069 B17R1.389 CCC(C)(C)N(C)CC(O)c1cccc(c1)Cl 2fd879c75ba0f9a8f41ff9148362ed81 [0,2,0,0,0,0|1,0,0]=3 2070 B17R1.389 CCC(C)(C)N(C)C[C@H](O)c1cccc(c1)Cl 1f0a469727f2ebc5d5bc85afdb8fe561 [0,2,0,0,0,0|1,0,0]=3 2071 B17R1.389 CN(CC(=O)c1cccc(c1)Br)C(C)(C)CO 429d7992b874f93898b6132d47430d49 [0,2,0,0,0,0|0,0,2]=4 2072 B17R1.389 CN(CC(=O)c1cccc(c1)Cl)C(C)(C)CO b04ae8a4932123a4dfc7f5a75c2502a1 [0,2,0,0,0,0|0,0,2]=4 2073 B17R1.389 CN(CC(=O)c1cccc(c1)F)C(C)(C)CO 9fc12a26bd8fc1ba8dd2bfc2a93cd962 [0,2,0,0,0,0|0,0,2]=4 2074 B17R1.389 CN(CC(=O)c1cccc(c1)I)C(C)(C)CO 6b4ec4c9476deb3c6b0693e354686de9 [0,2,0,0,0,0|0,0,2]=4 2075 B17R1.389 CN(CC(O)c1cccc(c1)Cl)C(C)(C)CO 4d202164dffc739dd2bf613c75e653ae [0,2,0,0,0,0|0,0,0]=2 2076 B17R1.389 CN(C[C@H](O)c1cccc(c1)Cl)C(C)(C)CO ecb34e481e01d69375e4567922896551 [0,2,0,0,0,0|0,0,0]=2 2077 B17R1.389 Cc1cccc(c1)C(=O)CN(C)C(C)(C)CO 5ffc50c22928c1e8d0ffd7d947a44461 [0,2,0,0,0,0|0,0,2]=4 2078 B17R1.393 CC(C(=O)NC(C)(C)CO)c1cccc(c1)Br f1e434290013a8734c7f64635ac3a577 [0,2,0,0,0,0|1,0,1]=4 2079 B17R1.393 CC(C(=O)NC(C)(C)CO)c1cccc(c1)Cl 853a6b0bb34188430efe2aca7dcc208a [0,2,0,0,0,0|1,0,1]=4 2080 B17R1.393 CC(C(=O)NC(C)(C)CO)c1cccc(c1)F 7b7a6d95a3fef4410fee9857db3f536e [0,2,0,0,0,0|1,0,1]=4 2081 B17R1.393 CC(C)(CF)NC(=O)C(O)c1cccc(c1)Br 5209813df4a95815090daebdf8cefc89 [0,2,0,0,0,0|1,0,1]=4 2082 B17R1.393 CC(C)(CF)NC(=O)C(O)c1cccc(c1)Cl 0dc84324a8e6feb163896364f05eaace [0,2,0,0,0,0|1,0,1]=4 2083 B17R1.393 CC(C)(CF)NC(=O)C(O)c1cccc(c1)F 6327bc2ba3bf743e4ef849c61927b1d3 [0,2,0,0,0,0|1,0,1]=4 2084 B17R1.393 CC(C)(CF)NC(=O)C(O)c1cccc(c1)O a2a7073ffdad4a148d21e68340d2b9e9 [0,2,0,0,0,0|1,0,1]=4 2085 B17R1.393 CC(C)(CF)NC(=O)[C@@H](O)c1cccc(c1)Br a41d27159010f1ae5d63b5c3a1dd61f6 [0,2,0,0,0,0|1,0,1]=4 2086 B17R1.393 CC(C)(CF)NC(=O)[C@@H](O)c1cccc(c1)Cl 4b626b68f083733117b5da551aba6463 [0,2,0,0,0,0|1,0,1]=4 2087 B17R1.393 CC(C)(CF)NC(=O)[C@H](O)c1cccc(c1)Br c75eb2f60ba448ebcfe9bf2569144a81 [0,2,0,0,0,0|1,0,1]=4 2088 B17R1.393 CC(C)(CF)NC(=O)[C@H](O)c1cccc(c1)Cl 7977f8533df5baa09d4e8b02d3c2a37a [0,2,0,0,0,0|1,0,1]=4 2089 B17R1.393 CC(C)(CO)NC(=O)C(F)c1cccc(c1)Br 73d6d8582f51df5c02927118c9b06dbf [0,2,0,0,0,0|1,0,1]=4 2090 B17R1.393 CC(C)(CO)NC(=O)C(F)c1cccc(c1)Cl 11ca4032fb974ba317de8cdf6d2e3f51 [0,2,0,0,0,0|1,0,1]=4 2091 B17R1.393 CC(C)(CO)NC(=O)C(F)c1cccc(c1)F 9e39e2c0a81a5357a71989413e7ca06d [0,2,0,0,0,0|1,0,1]=4 2092 B17R1.393 CC(C)(CO)NC(=O)C(O)c1cccc(c1)Br 864bee645244b287bf9a160013bf2a71 [0,2,0,0,0,0|0,0,1]=3 2093 B17R1.393 CC(C)(CO)NC(=O)C(O)c1cccc(c1)Cl 56f9cfd4776fe2950b3e34d44a53f12b [0,2,0,0,0,0|0,0,1]=3 2094 B17R1.393 CC(C)(CO)NC(=O)C(O)c1cccc(c1)F 332a61fb61807d71be18b1800d5d7e6f [0,2,0,0,0,0|0,0,1]=3 2095 B17R1.393 CC(C)(CO)NC(=O)C(O)c1cccc(c1)O 63aa0971ddbdb406c1983838d29bfc9a [0,2,0,0,0,0|0,0,1]=3 2096 B17R1.393 CC(C)(CO)NC(=O)[C@@H](O)c1cccc(c1)Br d01f88168b4ecef4fa847ce09a729a00 [0,2,0,0,0,0|0,0,1]=3 2097 B17R1.393 CC(C)(CO)NC(=O)[C@@H](O)c1cccc(c1)Cl 4d7d55ccfe5146dbd1a8798865a6a51a [0,2,0,0,0,0|0,0,1]=3 2098 B17R1.393 CC(C)(CO)NC(=O)[C@H](O)c1cccc(c1)Br 91283764255a9f2af81efa386ba6563f [0,2,0,0,0,0|0,0,1]=3 2099 B17R1.393 CC(C)(CO)NC(=O)[C@H](O)c1cccc(c1)Cl 8e5bc12286dde0d68ca09b0dfefeb2a6 [0,2,0,0,0,0|0,0,1]=3 2100 B17R1.393 CC(NC(C)(C)CO)C(=O)c1cccc(c1)Cl 8d244169ff924eebdfe329bcc05b33e0 [0,2,0,0,0,0|0,0,2]=4 2101 B17R1.393 CCC(C)(C)NC(=O)C(O)c1cccc(c1)Br 647203f1a8b65def3d97255d2837ec08 [0,2,0,0,0,0|1,0,1]=4 2102 B17R1.393 CCC(C)(C)NC(=O)C(O)c1cccc(c1)C 16cd8be9d7bc6e90717ce5489737ce86 [0,2,0,0,0,0|1,0,1]=4 2103 B17R1.393 CCC(C)(C)NC(=O)C(O)c1cccc(c1)Cl 54a7887ac338e96f464063d05675acef [0,2,0,0,0,0|1,0,1]=4 2104 B17R1.393 CCC(C)(C)NC(=O)C(O)c1cccc(c1)F 00cfabafdb3d70af208088567ffc4063 [0,2,0,0,0,0|1,0,1]=4 2105 B17R1.393 CCC(C)(C)NC(=O)C(O)c1cccc(c1)O 1c85f517e499c9e9878511c9e993f8b6 [0,2,0,0,0,0|1,0,1]=4 2106 B17R1.393 CCC(C)(C)NC(=O)[C@@H](O)c1cccc(c1)Br 37817e529dc49abc9d56e89b426bf254 [0,2,0,0,0,0|1,0,1]=4 2107 B17R1.393 CCC(C)(C)NC(=O)[C@@H](O)c1cccc(c1)Cl 448a7a2d77492d3256cff32145033365 [0,2,0,0,0,0|1,0,1]=4 2108 B17R1.393 CCC(C)(C)NC(=O)[C@H](O)c1cccc(c1)Br a15726aef154a78be7b8e0b1080155c9 [0,2,0,0,0,0|1,0,1]=4 2109 B17R1.393 CCC(C)(C)NC(=O)[C@H](O)c1cccc(c1)Cl 40a6bd1cce79847578fdc25a3916dc64 [0,2,0,0,0,0|1,0,1]=4 2110 B17R1.393 C[C@@H](C(=O)NC(C)(C)CO)c1cccc(c1)Br c07bf538eed210d211da9dded613f4e5 [0,2,0,0,0,0|1,0,1]=4 2111 B17R1.393 C[C@H](C(=O)NC(C)(C)CO)c1cccc(c1)Br 96d8679bac56e4fcac424a1e4a78015f [0,2,0,0,0,0|1,0,1]=4 2112 B17R1.393 Cc1cccc(c1)C(C)C(=O)NC(C)(C)CO e132b3409d95e6b317893bb8552324a1 [0,2,0,0,0,0|1,0,1]=4 2113 B17R1.393 Cc1cccc(c1)C(F)C(=O)NC(C)(C)CO 7c655c11f92beb211168e848b6a6d93e [0,2,0,0,0,0|1,0,1]=4 2114 B17R1.393 Cc1cccc(c1)C(O)C(=O)NC(C)(C)CF fa360d46739f4cfdb0fbe4e13ea81e56 [0,2,0,0,0,0|1,0,1]=4 2115 B17R1.393 Cc1cccc(c1)C(O)C(=O)NC(C)(C)CO ad30f2bebd0cbf2076d3fafee4969566 [0,2,0,0,0,0|0,0,1]=3 2116 B17R1.393 Cc1cccc(c1)[C@@H](C)C(=O)NC(C)(C)CO 442a3db9f58b52e483c7ab3d7253a88f [0,2,0,0,0,0|1,0,1]=4 2117 B17R1.393 Cc1cccc(c1)[C@H](C)C(=O)NC(C)(C)CO b76e4fa7a290fdf1626ff568b00d57f8 [0,2,0,0,0,0|1,0,1]=4 2118 B17R1.2730 C#CC(C)(CC)NC[C@H](O)c1cccc(c1)Cl 7c1c54d16ce630adfe4c89269845761b [0,2,0,0,0,0|1,0,1]=4 2119 B17R1.2730 CC(CO)(CO)NCC(=O)c1cccc(c1)Cl 95155463c32a3b1d751152b6835ac05d [0,2,0,0,0,0|0,0,2]=4 2120 B17R1.2730 CC(CO)(CO)NCC(=O)c1cccc(c1)F e57dae1ed8afa55d0aad67016a4da6b9 [0,2,0,0,0,0|0,0,2]=4 2121 B17R1.2730 CC(CO)(CO)NCC(=O)c1cccc(c1)I 78849bb071791d5b1dad3b47c2412503 [0,2,0,0,0,0|0,0,2]=4 2122 B17R1.2730 CC(CO)(CO)NC[C@H](O)c1cccc(c1)Cl 116ce15e4838e77a8226a382e850df41 [0,2,0,0,0,0|0,0,0]=2 2123 B17R1.2730 CCC(C)(C#N)NC[C@H](O)c1cccc(c1)Cl f2c303159610ff2c9f354a49af6d9b27 [0,2,0,0,0,0|1,0,1]=4 2124 B17R1.2730 CCC(C)(CC)NC[C@H](O)c1cccc(c1)Cl a5820f559d442ba3aa3e18550d438bd5 [0,2,0,0,0,0|1,0,0]=3 2125 B17R1.2730 CCC(C)(CO)NCC(=O)c1cccc(c1)Br 73fa274a9e63de55af3bc2d4499836c5 [0,2,0,0,0,0|0,0,2]=4 2126 B17R1.2730 CCC(C)(CO)NCC(=O)c1cccc(c1)C 9653b813159d1540d40a7ff50c39d2f8 [0,2,0,0,0,0|0,0,2]=4 2127 B17R1.2730 CCC(C)(CO)NCC(=O)c1cccc(c1)Cl 8987efe7e77f38ec6c297d7985280169 [0,2,0,0,0,0|0,0,2]=4 2128 B17R1.2730 CCC(C)(CO)NCC(=O)c1cccc(c1)F dc7bf6f57402b9f24287e6610b718117 [0,2,0,0,0,0|0,0,2]=4 2129 B17R1.2730 CCC(C)(CO)NCC(=O)c1cccc(c1)I 4f7bdf4837ae5178147ce4bacbbe94ec [0,2,0,0,0,0|0,0,2]=4 2130 B17R1.2730 Cc1cccc(c1)C(=O)CNC(C)(CO)CO b19387517b7e696dc86308f19cd85ecd [0,2,0,0,0,0|0,0,2]=4 2131 B17R1.13303 CC(C)(CO)NCC(=O)c1cc(ccc1Br)Cl 1db62a445280a4775f71b0c1a4b498cf [0,2,0,0,0,0|0,0,2]=4 2132 B17R1.13303 CC(C)(CO)NCC(=O)c1cc(ccc1Br)F 2a467e941c079ea198230c6bf2d343fd [0,2,0,0,0,0|0,0,2]=4 2133 B17R1.13303 CC(C)(CO)NCC(=O)c1cc(ccc1Cl)Cl 21f5c3794e6f91193fa66fdaac5a2195 [0,2,0,0,0,0|0,0,2]=4 2134 B17R1.13303 CC(C)(CO)NCC(=O)c1cc(ccc1Cl)F 38e4f083f1e0986825ca50b2b31ca90c [0,2,0,0,0,0|0,0,2]=4 2135 B17R1.13303 CC(C)(CO)NCC(=O)c1cc(ccc1F)Br 476d0ece5e0710c650496bd62db0cf4d [0,2,0,0,0,0|0,0,2]=4 2136 B17R1.13303 CC(C)(CO)NCC(=O)c1cc(ccc1F)Cl 4120e5bbc1709143beec419aedf141c1 [0,2,0,0,0,0|0,0,2]=4 2137 B17R1.13303 CC(C)(CO)NCC(=O)c1cc(ccc1F)F fe312433d4e7ef0d9e9a175091382ef0 [0,2,0,0,0,0|0,0,2]=4 2138 B17R1.13303 Cc1ccc(c(c1)C(=O)CNC(C)(C)CO)C 161cf2fc06bd8b8f97960183c32b2d57 [0,2,0,0,0,0|0,0,2]=4 2139 B17R1.13303 Cc1ccc(c(c1)C(=O)CNC(C)(C)CO)F 46c88354adbd9683d8a87167be5d5dea [0,2,0,0,0,0|0,0,2]=4 2140 B17R1.13303 Cc1ccc(cc1C(=O)CNC(C)(C)CO)Cl c74e51c5e2b36c1533331cf607da4351 [0,2,0,0,0,0|0,0,2]=4 2141 B17R1.13303 Cc1ccc(cc1C(=O)CNC(C)(C)CO)F d6f4452dedfbc74fd8fb0d107a2cfa91 [0,2,0,0,0,0|0,0,2]=4 2142 B17R1.13307 CC(C)(CO)NCC(=O)c1cc(cc(c1)Br)F 10d2f7c22c30af7eb0bb7f6c3b4f5b7e [0,2,0,0,0,0|0,0,2]=4 2143 B17R1.13307 CC(C)(CO)NCC(=O)c1cc(cc(c1)Cl)Cl 22a39c69c751ff5978bbde9b2b9fd2a0 [0,2,0,0,0,0|0,0,2]=4 2144 B17R1.13307 CC(C)(CO)NCC(=O)c1cc(cc(c1)Cl)F a02abbf9d0552e4bde7c47672fdbf260 [0,2,0,0,0,0|0,0,2]=4 2145 B17R1.13307 CC(C)(CO)NCC(=O)c1cc(cc(c1)F)F 1cd72c90b1e818d81abd130ece07da10 [0,2,0,0,0,0|0,0,2]=4 2146 B17R1.13307 CC(C)(CO)NCC(=O)c1cc(cc(c1)I)Cl 45c660cb8e4a56b06ee3e90a949b542a [0,2,0,0,0,0|0,0,2]=4 2147 B17R1.13307 Cc1cc(cc(c1)C(=O)CNC(C)(C)CO)Br adee49da585f2468cbbc441572660db5 [0,2,0,0,0,0|0,0,2]=4 2148 B17R1.13307 Cc1cc(cc(c1)C(=O)CNC(C)(C)CO)F 43ca64d5e9956f36f97e0ce338e9eed3 [0,2,0,0,0,0|0,0,2]=4 2149 B17R1.18522 CC(C)(CCO)NCC(=O)c1cccc(c1)Br a9cf81827ce8dfecfe6016b3eef02892 [0,2,0,0,0,0|0,0,2]=4 2150 B17R1.18522 CC(C)(CCO)NCC(=O)c1cccc(c1)Cl 638568d05610b631534b641059ff12b2 [0,2,0,0,0,0|0,0,2]=4 2151 B17R1.18522 CC(C)(CCO)NCC(=O)c1cccc(c1)F 4840022b20b0eea258d06d5af424d956 [0,2,0,0,0,0|0,0,2]=4 2152 B17R1.18522 CC(C)(CCO)NCC(=O)c1cccc(c1)I 12ff6ae6ec9a98df45c501dde3360519 [0,2,0,0,0,0|0,0,2]=4 2153 B17R1.18522 CC(C)(CCO)NCC(O)c1cccc(c1)Cl a55a5b037be36103beffc721150cb10d [0,2,0,0,0,0|0,0,0]=2 2154 B17R1.18522 CC(C)(CCO)NC[C@H](O)c1cccc(c1)Cl e5311382874bb5abac6d21bb253f66f9 [0,2,0,0,0,0|0,0,0]=2 2155 B17R1.18522 COCC(C)(C)NCC(=O)c1cccc(c1)Cl b5c6a04b36a3c74b1e45dfefb0207e9e [0,2,0,0,0,0|0,0,2]=4 2156 B17R1.18522 COCC(C)(C)NCC(=O)c1cccc(c1)F f981383fde4f1f9fd5c3836ae1c6fb72 [0,2,0,0,0,0|0,0,2]=4 2157 B17R1.18522 COCC(C)(C)NCC(=O)c1cccc(c1)I 5f2006804a17de6266933a2a4217a7eb [0,2,0,0,0,0|0,0,2]=4 2158 B17R1.18522 COCC(C)(C)NC[C@H](O)c1cccc(c1)Cl e44ec31138300b69d0b6ab0ec46899b0 [0,2,0,0,0,0|0,0,0]=2 2159 B17R1.18522 CSCC(C)(C)NC[C@H](O)c1cccc(c1)Cl 5e0b276fb70ad252a51f761a0855f607 [0,2,0,0,0,0|0,1,0]=3 2160 B17R1.18522 Cc1cccc(c1)C(=O)CNC(C)(C)CCO 8ad1940c82a71845665be60a5833507c [0,2,0,0,0,0|0,0,2]=4 2161 B17R1.19719 CC(C)(CO)CNC(CO)c1cccc(c1)Br 989764b4a90a7ff0ec61664b65022e84 [0,2,0,0,0,0|2,0,0]=4 2162 B17R1.19719 CC(C)(CO)CNC(CO)c1cccc(c1)Cl 8752db953e79e5dd7b5d1b4598d5cbb4 [0,2,0,0,0,0|2,0,0]=4 2163 B17R1.19719 CC(C)(CO)CNC(CO)c1cccc(c1)F 14c76dfb368434098d6dbb5b8c04ff63 [0,2,0,0,0,0|2,0,0]=4 2164 B17R1.19719 CC(C)(CO)CN[C@@H](CO)c1cccc(c1)Br 5e99f030e6d564cc788c4679f16126d2 [0,2,0,0,0,0|2,0,0]=4 2165 B17R1.19719 CC(C)(CO)CN[C@@H](CO)c1cccc(c1)Cl 4ee5824377e4a855a6515fdc63474d4b [0,2,0,0,0,0|2,0,0]=4 2166 B17R1.19719 CC(C)(CO)CN[C@@H](CO)c1cccc(c1)F db201765b968ffb6bb76fd1b7514e8ba [0,2,0,0,0,0|2,0,0]=4 2167 B17R1.19719 CC(C)(CO)CN[C@H](CO)c1cccc(c1)Br 55d29f20a1f50c7fa87cac758a7c7d12 [0,2,0,0,0,0|2,0,0]=4 2168 B17R1.19719 CC(C)(CO)CN[C@H](CO)c1cccc(c1)Cl f23551a869dd63e8caf88666c10f7998 [0,2,0,0,0,0|2,0,0]=4 2169 B17R1.19719 CC(C)(CO)CN[C@H](CO)c1cccc(c1)F 3ce2677339b5d5a2c14bed04ca22d6e6 [0,2,0,0,0,0|2,0,0]=4 2170 B17R1.19719 Cc1cccc(c1)C(CO)NCC(C)(C)CO 7c06c506b16f15c2672650a4bc320408 [0,2,0,0,0,0|2,0,0]=4 2171 B17R1.19719 Cc1cccc(c1)[C@@H](CO)NCC(C)(C)CO 649334d79f931ac390852a1d192d2dc3 [0,2,0,0,0,0|2,0,0]=4 2172 B17R1.19719 Cc1cccc(c1)[C@H](CO)NCC(C)(C)CO 676c50e3ecd2165d53025df6912e405f [0,2,0,0,0,0|2,0,0]=4 2173 B17R1.45822 CC(C)(CO)NCC(=O)c1cccc(c1)C#N 94d2755488a244cf8891e80aec85bbe9 [0,2,0,0,0,0|0,0,2]=4 2174 B17R1.45822 CCc1cccc(c1)C(=O)CNC(C)(C)CO d3e649dd6e0291e1ded40be06e653b4a [0,2,0,0,0,0|0,0,2]=4 2175 B17R1.45822 COc1cccc(c1)C(=O)CNC(C)(C)CO 9ef022021c8a7f97b03c94d3d8a1178a [0,2,0,0,0,0|0,0,2]=4 2176 B17R1.64051 CC(=O)C(C)(C)NCC(O)c1cccc(c1)Cl 47863c011f38d1e05cc461f64ed53298 [0,2,0,0,0,0|0,0,2]=4 2177 B17R1.64051 CC(=O)C(C)(C)NC[C@H](O)c1cccc(c1)Cl a9d62fb46b9b2e010ad4db4a520f88be [0,2,0,0,0,0|0,0,2]=4 2178 B17R1.64051 CC(C)(NCC(O)c1cccc(c1)Cl)C(=O)N 22824ec8bb33f097f70c35d0e30044f4 [0,2,0,0,0,0|0,0,2]=4 2179 B17R1.64051 CC(C)(NCC(O)c1cccc(c1)Cl)C(=O)O 831705b84afd689ba7f523e0c1dfef6a [0,2,0,0,0,0|0,0,1]=3 2180 B17R1.64051 CC(C)(NC[C@H](O)c1cccc(c1)Cl)C(=O)N efba1e0e043e0731a8da0c8d214bf796 [0,2,0,0,0,0|0,0,2]=4 2181 B17R1.64051 CC(C)(NC[C@H](O)c1cccc(c1)Cl)C(=O)O ef1fc3d3cac7f827e34c2866958e1a80 [0,2,0,0,0,0|0,0,1]=3 2182 B17R1.64051 CC(C)C(C)(C)NC[C@H](O)c1cccc(c1)Cl 6ad60909f0ec2378fb16c6fbbc3de162 [0,2,0,0,0,0|1,0,0]=3 2183 B17R1.64051 CC(O)C(C)(C)NCC(=O)c1cccc(c1)Br e16c22b84ad179eb9ed5e71d39c07d87 [0,2,0,0,0,0|0,0,2]=4 2184 B17R1.64051 CC(O)C(C)(C)NCC(=O)c1cccc(c1)Cl b2c50fd61205c5244940d3c549086874 [0,2,0,0,0,0|0,0,2]=4 2185 B17R1.64051 CC(O)C(C)(C)NCC(=O)c1cccc(c1)F 1a13e6a6a5c9f6cdf18d656511c12f7b [0,2,0,0,0,0|0,0,2]=4 2186 B17R1.64051 CC(O)C(C)(C)NCC(=O)c1cccc(c1)I e82bf669e520f212282ecbd7d077b3fe [0,2,0,0,0,0|0,0,2]=4 2187 B17R1.64051 CC(O)C(C)(C)NC[C@H](O)c1cccc(c1)Cl 5d43abbea2d4d1e56e221330fa05f523 [0,2,0,0,0,0|0,0,0]=2 2188 B17R1.64051 Cc1cccc(c1)C(=O)CNC(C)(C)C(C)O 837fd9e0ef2604be12d15ffac6fa5323 [0,2,0,0,0,0|0,0,2]=4 2189 B17R1.419 CC(C(=O)N(C)C(C)(C)CO)c1ccccc1 4d179abd7433756d7a087d932eba0a77 [0,2,0,0,0,0|1,0,1]=4 2190 B17R1.419 CCC(C)(C)N(C)C(=O)C(O)c1ccccc1 154ffce163e6547b5fa0fe8014dfde74 [0,2,0,0,0,0|1,0,1]=4 2191 B17R1.419 CCC(C)(C)N(C)C(=O)[C@@H](O)c1ccccc1 a968bef7577959055b668e6c04e3bb4b [0,2,0,0,0,0|1,0,1]=4 2192 B17R1.419 CCC(C)(C)N(C)C(=O)[C@H](O)c1ccccc1 c21c71307f4477faa0e19a2f2f740560 [0,2,0,0,0,0|1,0,1]=4 2193 B17R1.419 CN(C(=O)C(F)c1ccccc1)C(C)(C)CO 6fbf53e86c8f2b2633a17726d5f1d3fe [0,2,0,0,0,0|1,0,1]=4 2194 B17R1.419 CN(C(=O)C(O)c1ccccc1)C(C)(C)CO ac02402c7ae746070cef5baad03fab65 [0,2,0,0,0,0|0,0,1]=3 2195 B17R1.419 CN(C(=O)C(O)c1cccnc1)C(C)(C)CO a698aab9661c94b47e96086b6b8a8a12 [0,2,0,0,0,0|1,0,1]=4 2196 B17R1.419 CN(C(=O)C(O)c1ccncc1)C(C)(C)CO bff2dbc769aad77973693101495f383a [0,2,0,0,0,0|1,0,1]=4 2197 B17R1.419 CN(C(=O)[C@@H](O)c1ccccc1)C(C)(C)CO 79caaa08686054f4b453a0166642d3bd [0,2,0,0,0,0|0,0,1]=3 2198 B17R1.419 CN(C(=O)[C@H](F)c1ccccc1)C(C)(C)CO 45e5d698f3a16c8e6ff21c3527bfdd3b [0,2,0,0,0,0|1,0,1]=4 2199 B17R1.419 CN(C(=O)[C@H](O)c1ccccc1)C(C)(C)CO 910e65b0b663b61c0fc6250eb6da2316 [0,2,0,0,0,0|0,0,1]=3 2200 B17R1.419 C[C@@H](C(=O)N(C)C(C)(C)CO)c1ccccc1 67b68cc6ef3f53d80f44c66112899682 [0,2,0,0,0,0|1,0,1]=4 2201 B17R1.419 C[C@H](C(=O)N(C)C(C)(C)CO)c1ccccc1 7350b59592fffb295ad176250fb8e197 [0,2,0,0,0,0|1,0,1]=4 2202 B17R1.4224 C=C(CN(C)C(C)(C)COC)c1ccccc1 cd12281e52d49d912583509a8fe3637c [0,2,0,0,0,0|1,0,1]=4 2203 B17R1.4224 COCC(C)(C)N(C)CC(=O)c1ccccc1 85e6fc4ff54eedd9714a6bba04db8d4d [0,2,0,0,0,0|0,0,2]=4 2204 B17R1.4224 COCC(C)(C)N(C)CC(C)c1ccccc1 cf3540ab235ee90e574f7d0ffd9057b9 [0,2,0,0,0,0|1,0,0]=3 2205 B17R1.4224 COCC(C)(C)N(C)CC(F)c1ccccc1 704fb9efc2748c94b090ff97b93a77e0 [0,2,0,0,0,0|1,0,0]=3 2206 B17R1.4224 COCC(C)(C)N(C)CC(O)c1ccccc1 1b93c6247e783a2fb91738aaa61c7dd7 [0,2,0,0,0,0|0,0,0]=2 2207 B17R1.4224 COCC(C)(C)N(C)CC(O)c1cnccn1 c5403dc56abb644eded8ac5226875319 [0,2,0,0,0,0|2,0,0]=4 2208 B17R1.4224 COCC(C)(C)N(C)C[C@@H](C)c1ccccc1 7df8eb2b774a1b9ad4ee23f9817b0952 [0,2,0,0,0,0|1,0,0]=3 2209 B17R1.4224 COCC(C)(C)N(C)C[C@@H](O)c1ccccc1 32fef02c6c081c573b7f14861ab13969 [0,2,0,0,0,0|0,0,0]=2 2210 B17R1.4224 COCC(C)(C)N(C)C[C@H](O)c1ccccc1 257015b2eb202958eaf14fadc9e4ceda [0,2,0,0,0,0|0,0,0]=2 2211 B17R1.13370 CCC(C)(C)N(C)CC(F)(F)c1ccccc1 fdb8a5af3998c5157ebc01c58fed1c0e [0,2,0,0,0,0|2,0,0]=4 2212 B17R1.13370 CN(CC(C)(C)c1ccccc1)C(C)(C)CO eaa4ba994a981e2a3c0e335ca8c11f13 [0,2,0,0,0,0|1,0,0]=3 2213 B17R1.13370 CN(CC(F)(F)c1ccccc1)C(C)(C)CO 3af1daf33b446708dcdbeae7208e20aa [0,2,0,0,0,0|1,0,0]=3 2214 B17R1.13370 CN(CS(=O)(=O)c1ccccc1)C(C)(C)CO f3b6bd4bfd737cbdd0158fdce368091a [0,2,0,0,0,0|1,0,1]=4 2215 B17R1.13386 CCC(C)(C)N(C)CC(O)c1ccccc1Cl 88dee612a80c6809caf6cd76749252fb [0,2,0,0,0,0|1,0,0]=3 2216 B17R1.13386 CN(CC(=O)c1ccccc1Br)C(C)(C)CO 1b29d090fbfea06231f968358dbb1910 [0,2,0,0,0,0|0,0,2]=4 2217 B17R1.13386 CN(CC(=O)c1ccccc1Cl)C(C)(C)CO cef7151bc327fc2a1025260070daf7b2 [0,2,0,0,0,0|0,0,2]=4 2218 B17R1.13386 CN(CC(=O)c1ccccc1F)C(C)(C)CO 6f67ffb770f046ae125e67a96811ca1c [0,2,0,0,0,0|0,0,2]=4 2219 B17R1.13386 CN(CC(=O)c1ccccc1I)C(C)(C)CO 9d80d457d0df212d8ba946ac6368e2de [0,2,0,0,0,0|0,0,2]=4 2220 B17R1.13386 CN(CC(O)c1ccccc1Cl)C(C)(C)CO 59d5795ced4765a7b73f0be8c01901c6 [0,2,0,0,0,0|0,0,0]=2 2221 B17R1.13386 Cc1ccccc1C(=O)CN(C)C(C)(C)CO 3db777aa8033ba7f8b80977b0aa2e3c2 [0,2,0,0,0,0|0,0,2]=4 2222 B17R1.16178 CC(CN(C)C(C)(C)C(=O)O)c1ccccc1 0ace1fdeaf32f050f598641f83757a65 [0,2,0,0,0,0|1,0,1]=4 2223 B17R1.16178 CN(CC(F)c1ccccc1)C(C)(C)C(=O)O 4df4f4e6107e1457d616dd64c3ef9882 [0,2,0,0,0,0|1,0,1]=4 2224 B17R1.16178 CN(CC(O)c1ccccc1)C(C)(C)C(=O)O 796508efc55539090db7bb550b358f6b [0,2,0,0,0,0|0,0,1]=3 2225 B17R1.16178 CN(C[C@@H](O)c1ccccc1)C(C)(C)C(=O)O 897bb1540e68f66b2e2c52792ae5e518 [0,2,0,0,0,0|0,0,1]=3 2226 B17R1.16178 CN(C[C@H](O)c1ccccc1)C(C)(C)C(=O)O f8c468f2b714b676358cb0c992f4a2d2 [0,2,0,0,0,0|0,0,1]=3 2227 B17R1.16178 C[C@H](CN(C)C(C)(C)C(=O)O)c1ccccc1 6c7e9b3fd51eb9f7b7fb4182b779cf1d [0,2,0,0,0,0|1,0,1]=4 2228 B17R1.16723 C=C(CN(CC)C(C)(C)CO)c1ccccc1 bb4deb17c15c06ece4d00c401c28d76b [0,2,0,0,0,0|1,0,1]=4 2229 B17R1.16723 CC(C)(CO)N(C=O)CC(O)c1ccccc1 1385b9a19d5a7d5a9d76ae84326a8f27 [0,2,0,0,0,0|0,0,0]=2 2230 B17R1.16723 CC(C)(CO)N(CO)CC(O)c1ccccc1 af1b31760eca9c97bf796cd37bf17337 [0,2,0,0,0,0|0,0,0]=2 2231 B17R1.16723 CCN(CC(=O)c1ccccc1)C(C)(C)CO 18951ac8eb38879d4efc33ba05aaea50 [0,2,0,0,0,0|0,0,2]=4 2232 B17R1.16723 CCN(CC(O)c1ccccc1)C(C)(C)CO 1a993a77b0403b3b99d65bbc228d8e9c [0,2,0,0,0,0|0,0,0]=2 2233 B17R1.16723 CCN(CC(O)c1cnccn1)C(C)(C)CO a76297ea5aada1ccc01a77d9282d3af1 [0,2,0,0,0,0|2,0,0]=4 2234 B17R1.2741 CC(CO)(CO)NC(=O)C(F)c1ccccc1 f7e12db050700505abd25af8fb45ceec [0,2,0,0,0,0|1,0,1]=4 2235 B17R1.2741 CC(CO)(CO)NC(=O)C(O)c1ccccc1 3e07fb3e29794973fe35e3168f049062 [0,2,0,0,0,0|0,0,1]=3 2236 B17R1.2741 CC(CO)(CO)NC(=O)C(O)c1cccnc1 8fe642dda2d3d8c35ca4c9f9817632f8 [0,2,0,0,0,0|1,0,1]=4 2237 B17R1.2741 CC(CO)(CO)NC(=O)C(O)c1ccncc1 400d160f0444b363d0465f5f0893eb01 [0,2,0,0,0,0|1,0,1]=4 2238 B17R1.2741 CC(CO)(CO)NC(=O)[C@@H](O)c1ccccc1 6ab454e8f56ebe5f2a4d91fc8ea44edb [0,2,0,0,0,0|0,0,1]=3 2239 B17R1.2741 CC(CO)(CO)NC(=O)[C@H](F)c1ccccc1 b4b2f66c678b96e290b95eceb5f14b03 [0,2,0,0,0,0|1,0,1]=4 2240 B17R1.2741 CC(CO)(CO)NC(=O)[C@H](O)c1ccccc1 4ddc2b632ec806507dcf7792bd3d9062 [0,2,0,0,0,0|0,0,1]=3 2241 B17R1.2741 CCC(C)(CC)NC(=O)C(O)c1ccccc1 b4d42e33586fce79ccc4d6143485e8c2 [0,2,0,0,0,0|1,0,1]=4 2242 B17R1.2741 CCC(C)(CC)NC(=O)[C@@H](O)c1ccccc1 166cba6b2e2133f7b45482bd38392232 [0,2,0,0,0,0|1,0,1]=4 2243 B17R1.2741 CCC(C)(CC)NC(=O)[C@H](O)c1ccccc1 bca0017ccf327b6468c09b7c7d9e3db2 [0,2,0,0,0,0|1,0,1]=4 2244 B17R1.2741 CCC(C)(CO)NC(=O)C(O)c1ccccc1 e2f49afb1d76120f593c5f98a41af6c1 [0,2,0,0,0,0|0,0,1]=3 2245 B17R1.2741 CCC(C)(CO)NC(=O)C(O)c1cccnc1 6f5f0469cfbabb273d9c125b8c9474a1 [0,2,0,0,0,0|1,0,1]=4 2246 B17R1.2741 CCC(C)(CO)NC(=O)C(O)c1ccncc1 393552cf9230bb3b9cedcc9e550217f2 [0,2,0,0,0,0|1,0,1]=4 2247 B17R1.2741 CCC(C)(CO)NC(=O)[C@@H](O)c1ccccc1 0afedbccc712619608888d8960e7a741 [0,2,0,0,0,0|0,0,1]=3 2248 B17R1.2741 CCC(C)(CO)NC(=O)[C@H](O)c1ccccc1 acc381b94d6b8958989002aee2728973 [0,2,0,0,0,0|0,0,1]=3 2249 B17R1.4227 CC(C(=O)NC(C)(C)CCO)c1ccccc1 b1dfbeb81aa781adf6938dc40c2c8489 [0,2,0,0,0,0|1,0,1]=4 2250 B17R1.4227 CC(C)(CCO)NC(=O)C(F)c1ccccc1 1d04532481081a0d2c0a8930808b3769 [0,2,0,0,0,0|1,0,1]=4 2251 B17R1.4227 CC(C)(CCO)NC(=O)C(O)c1ccccc1 b43dbf60a48f117e2afa88f8498233f1 [0,2,0,0,0,0|0,0,1]=3 2252 B17R1.4227 CC(C)(CCO)NC(=O)C(O)c1cccnc1 3045b476dfa1b0a19167ea59b01b2848 [0,2,0,0,0,0|1,0,1]=4 2253 B17R1.4227 CC(C)(CCO)NC(=O)C(O)c1ccncc1 a9f60e79534c087314e547289c4c5cc2 [0,2,0,0,0,0|1,0,1]=4 2254 B17R1.4227 CC(C)(CCO)NC(=O)[C@@H](O)c1ccccc1 234b18d1300cd7da4eaca7f154d142f6 [0,2,0,0,0,0|0,0,1]=3 2255 B17R1.4227 CC(C)(CCO)NC(=O)[C@H](F)c1ccccc1 0e2116f63fce9d171ba8e361958d0caf [0,2,0,0,0,0|1,0,1]=4 2256 B17R1.4227 CC(C)(CCO)NC(=O)[C@H](O)c1ccccc1 1d6a8ff41c376acbfd26ccb0983d0d59 [0,2,0,0,0,0|0,0,1]=3 2257 B17R1.4227 COCC(C)(C)NC(=O)C(O)c1ccccc1 1e37707d845ad7cd115eba38db47b558 [0,2,0,0,0,0|0,0,1]=3 2258 B17R1.4227 COCC(C)(C)NC(=O)C(O)c1cccnc1 1a746527250755ddc86d2571a814f4ef [0,2,0,0,0,0|1,0,1]=4 2259 B17R1.4227 COCC(C)(C)NC(=O)C(O)c1ccncc1 54b7aae49c72cc78d7462249ca42171b [0,2,0,0,0,0|1,0,1]=4 2260 B17R1.4227 COCC(C)(C)NC(=O)[C@@H](O)c1ccccc1 103b8e0518ef08c3a8d06d5a75e9158a [0,2,0,0,0,0|0,0,1]=3 2261 B17R1.4227 COCC(C)(C)NC(=O)[C@H](O)c1ccccc1 a4c5c793bbbb0a55f14bccc999ec5a2c [0,2,0,0,0,0|0,0,1]=3 2262 B17R1.4227 CSCC(C)(C)NC(=O)C(O)c1ccccc1 3489da2acb0fc133cfcdda9b76f8b3c0 [0,2,0,0,0,0|0,1,1]=4 2263 B17R1.4227 CSCC(C)(C)NC(=O)[C@@H](O)c1ccccc1 617a216a2275a50b3348cd584f0d978b [0,2,0,0,0,0|0,1,1]=4 2264 B17R1.4227 CSCC(C)(C)NC(=O)[C@H](O)c1ccccc1 81fd2d46f15d5d15c8dcfd6c298323c2 [0,2,0,0,0,0|0,1,1]=4 2265 B17R1.4227 C[C@@H](C(=O)NC(C)(C)CCO)c1ccccc1 9e7574926309badc2b2ea347004e76ff [0,2,0,0,0,0|1,0,1]=4 2266 B17R1.4227 C[C@H](C(=O)NC(C)(C)CCO)c1ccccc1 5f8c35187d2d5015587bb123a2e0bceb [0,2,0,0,0,0|1,0,1]=4 2267 B17R1.13396 CC(C(=O)NC(C)(C)CO)c1ccccc1Br 2f5d5720f0a55e5f6518bb0533ffd733 [0,2,0,0,0,0|1,0,1]=4 2268 B17R1.13396 CC(C(=O)NC(C)(C)CO)c1ccccc1Cl 8da814484415b6ae9a72220796ee2651 [0,2,0,0,0,0|1,0,1]=4 2269 B17R1.13396 CC(C(=O)NC(C)(C)CO)c1ccccc1F 7aabc3ddad109f960a549ef9e8d89299 [0,2,0,0,0,0|1,0,1]=4 2270 B17R1.13396 CC(C(=O)NC(C)(C)CO)c1ccccc1I 4fb5d2c1af36c0152414f5a16a0f262c [0,2,0,0,0,0|1,0,1]=4 2271 B17R1.13396 CC(C)(CF)NC(=O)C(O)c1ccccc1Br b0415f630854dba0eb5fd08152e71b04 [0,2,0,0,0,0|1,0,1]=4 2272 B17R1.13396 CC(C)(CF)NC(=O)C(O)c1ccccc1Cl 8457fe6d2c33e1dd04fd840d8a72f441 [0,2,0,0,0,0|1,0,1]=4 2273 B17R1.13396 CC(C)(CF)NC(=O)C(O)c1ccccc1F 6268541681f363a2fa9b44a3e3098885 [0,2,0,0,0,0|1,0,1]=4 2274 B17R1.13396 CC(C)(CF)NC(=O)[C@@H](O)c1ccccc1Cl 46b311e943c72a9c194acc26275bb523 [0,2,0,0,0,0|1,0,1]=4 2275 B17R1.13396 CC(C)(CF)NC(=O)[C@H](O)c1ccccc1Cl 9153d883899fff9376217195d6d5fae3 [0,2,0,0,0,0|1,0,1]=4 2276 B17R1.13396 CC(C)(CF)NC(=O)[C@H](O)c1ccccc1F 810cde9e08a5c817437bb24a4d1024b5 [0,2,0,0,0,0|1,0,1]=4 2277 B17R1.13396 CC(C)(CO)NC(=O)C(F)c1ccccc1Br bb6600c7391077795cc0e78e272373dd [0,2,0,0,0,0|1,0,1]=4 2278 B17R1.13396 CC(C)(CO)NC(=O)C(F)c1ccccc1Cl 417488d5b193a6a23fce9ee24fe9239b [0,2,0,0,0,0|1,0,1]=4 2279 B17R1.13396 CC(C)(CO)NC(=O)C(F)c1ccccc1F 8ef0b1f45cafea078378f49b37627e64 [0,2,0,0,0,0|1,0,1]=4 2280 B17R1.13396 CC(C)(CO)NC(=O)C(O)c1ccccc1Br 0e878469a88aacfc9b22592af73dac6c [0,2,0,0,0,0|0,0,1]=3 2281 B17R1.13396 CC(C)(CO)NC(=O)C(O)c1ccccc1Cl 07c45b6cd8e24e071b6c3eb2972d1d8d [0,2,0,0,0,0|0,0,1]=3 2282 B17R1.13396 CC(C)(CO)NC(=O)C(O)c1ccccc1F 1ef95a3914c55ed6fad009a768a1ebd3 [0,2,0,0,0,0|0,0,1]=3 2283 B17R1.13396 CC(C)(CO)NC(=O)[C@@H](O)c1ccccc1Cl 1c7f5a2a609d72bfa902c07f099c56b7 [0,2,0,0,0,0|0,0,1]=3 2284 B17R1.13396 CC(C)(CO)NC(=O)[C@H](O)c1ccccc1Cl 2f0249d50ef74c99b57c17d1b69e6a1b [0,2,0,0,0,0|0,0,1]=3 2285 B17R1.13396 CC(C)(CO)NC(=O)[C@H](O)c1ccccc1F 6e8b9f1bb1d6fe310e984041db1c6920 [0,2,0,0,0,0|0,0,1]=3 2286 B17R1.13396 CCC(C)(C)NC(=O)C(O)c1ccccc1C 6307ba116ef268ac078bcf2293302651 [0,2,0,0,0,0|1,0,1]=4 2287 B17R1.13396 CCC(C)(C)NC(=O)C(O)c1ccccc1Cl b97cb31c1ae663901350400ede7bb470 [0,2,0,0,0,0|1,0,1]=4 2288 B17R1.13396 CCC(C)(C)NC(=O)C(O)c1ccccc1F 23c6eebc05a3223673e459518c005448 [0,2,0,0,0,0|1,0,1]=4 2289 B17R1.13396 CCC(C)(C)NC(=O)[C@@H](O)c1ccccc1Cl b6c7af1c2833f193d927aa6a5662d1cf [0,2,0,0,0,0|1,0,1]=4 2290 B17R1.13396 CCC(C)(C)NC(=O)[C@H](O)c1ccccc1Cl ba3f9a3796b5405f34961652f9635276 [0,2,0,0,0,0|1,0,1]=4 2291 B17R1.13396 CCC(C)(C)NC(=O)[C@H](O)c1ccccc1F 1963c0755090c92fc2c42c35ba45de64 [0,2,0,0,0,0|1,0,1]=4 2292 B17R1.13396 Cc1ccccc1C(C)C(=O)NC(C)(C)CO 0b754b46721ff11087739e6717f5fc3d [0,2,0,0,0,0|1,0,1]=4 2293 B17R1.13396 Cc1ccccc1C(F)C(=O)NC(C)(C)CO 963d2fa0b32e4fa27c5c47162b31886c [0,2,0,0,0,0|1,0,1]=4 2294 B17R1.13396 Cc1ccccc1C(O)C(=O)NC(C)(C)CF 22a3266b70a5979863c00ef4f6235546 [0,2,0,0,0,0|1,0,1]=4 2295 B17R1.13396 Cc1ccccc1C(O)C(=O)NC(C)(C)CO 21d8925bf365957ec13eac07bce4a352 [0,2,0,0,0,0|0,0,1]=3 2296 B17R1.13848 CC(C)(CF)NC(=O)C(C)(O)c1ccccc1 5ba56e244e40c8f5119d1f5db0b6d4fe [0,2,0,0,0,0|1,0,1]=4 2297 B17R1.13848 CC(C)(CF)NC(=O)[C@@](C)(O)c1ccccc1 d5c80222be4686ca0e53bd16c22d056e [0,2,0,0,0,0|1,0,1]=4 2298 B17R1.13848 CC(C)(CO)NC(=O)C(C)(O)c1ccccc1 814908a829a939a61be469ee04425164 [0,2,0,0,0,0|0,0,1]=3 2299 B17R1.13848 CC(C)(CO)NC(=O)C(F)(F)c1ccccc1 b87c3e8252c7671c3efb30520c8af6b3 [0,2,0,0,0,0|1,0,1]=4 2300 B17R1.13848 CC(C)(CO)NC(=O)[C@@](C)(O)c1ccccc1 49aaf56c39b9bd77503eeb56bf94e105 [0,2,0,0,0,0|0,0,1]=3 2301 B17R1.16180 CC(O)C(C)(C)NC(=O)C(O)c1cccnc1 2e37be3c9cb16c8a862675a2e92d6495 [0,2,0,0,0,0|1,0,1]=4 2302 B17R1.16180 CC(O)C(C)(C)NC(=O)C(O)c1ccncc1 ce03a21ed168d9a9bda7579b7072080b [0,2,0,0,0,0|1,0,1]=4 2303 B17R1.183790 CC(C)(CF)NC(=O)C(CO)c1ccccc1 fc79245a5774b7ed7ec24c445e767c89 [0,2,0,0,0,0|1,0,1]=4 2304 B17R1.183790 CC(C)(CF)NC(=O)[C@@H](CO)c1ccccc1 e0e741cd5694a45432ee7ce9b7ba9e07 [0,2,0,0,0,0|1,0,1]=4 2305 B17R1.183790 CC(C)(CF)NC(=O)[C@H](CO)c1ccccc1 28dfe4a26034577d9afa99e806536d17 [0,2,0,0,0,0|1,0,1]=4 2306 B17R1.183790 CC(C)(CO)NC(=O)C(C#N)c1ccccc1 c92fc02bb9d499aff0b8e8609ff41cff [0,2,0,0,0,0|1,0,1]=4 2307 B17R1.183790 CC(C)(CO)NC(=O)C(CO)c1ccccc1 ab2269c898db76c4686d574a0300e0e0 [0,2,0,0,0,0|0,0,1]=3 2308 B17R1.183790 CC(C)(CO)NC(=O)[C@@H](CO)c1ccccc1 2c6ebdabe51ba61f9bf598e858d761cf [0,2,0,0,0,0|0,0,1]=3 2309 B17R1.183790 CC(C)(CO)NC(=O)[C@H](CO)c1ccccc1 38d2f61572cc858ebdf618361a35d6b1 [0,2,0,0,0,0|0,0,1]=3 2310 B17R1.183790 CCC(C(=O)NC(C)(C)CO)c1ccccc1 b7b1cc9b458340f1fb9a7c3f0f6b7628 [0,2,0,0,0,0|1,0,1]=4 2311 B17R1.183790 CCC(C)(C)NC(=O)C(CO)c1ccccc1 afca2d6eff9da68a202cc332a7dcdb38 [0,2,0,0,0,0|1,0,1]=4 2312 B17R1.183790 CCC(C)(C)NC(=O)[C@@H](CO)c1ccccc1 0239ae09a44d7cc73208864117f3a41a [0,2,0,0,0,0|1,0,1]=4 2313 B17R1.183790 CCC(C)(C)NC(=O)[C@H](CO)c1ccccc1 300f4e6a561c99833e2f76eb0b9cea25 [0,2,0,0,0,0|1,0,1]=4 2314 B17R1.183790 CC[C@@H](C(=O)NC(C)(C)CO)c1ccccc1 16980e064dea7c52b7d982561f83aa45 [0,2,0,0,0,0|1,0,1]=4 2315 B17R1.183790 CC[C@H](C(=O)NC(C)(C)CO)c1ccccc1 e4ceb1497a861f7ff5e15e30165dee11 [0,2,0,0,0,0|1,0,1]=4 2316 B17R1.183790 COC(C(=O)NC(C)(C)CO)c1ccccc1 73a832786c0dfd00b3f59cbaf20b9b99 [0,2,0,0,0,0|0,0,1]=3 2317 B17R1.183790 CO[C@@H](C(=O)NC(C)(C)CO)c1ccccc1 c85414c1e1419b577fba23ede68cfdfe [0,2,0,0,0,0|0,0,1]=3 2318 B17R1.183790 CO[C@H](C(=O)NC(C)(C)CO)c1ccccc1 8411b74e4fe57debfbd826d42eca745c [0,2,0,0,0,0|0,0,1]=3 2319 B17R1.18904 C=C(CNC(C)(CO)CCC)c1ccccc1 e43f834cb6d3192088939ba8f925bea4 [0,2,0,0,0,0|1,0,1]=4 2320 B17R1.18904 CCCC(C)(C#N)NCC(O)c1ccccc1 7a8aabac054df9df7528b3f3e3f92e4a [0,2,0,0,0,0|1,0,1]=4 2321 B17R1.18904 CCCC(C)(CO)NCC(=O)c1ccccc1 c8af80d0a414c582972cd220f4cb295e [0,2,0,0,0,0|0,0,2]=4 2322 B17R1.18904 CCCC(C)(CO)NCC(C)c1ccccc1 5d0eab0a68eeddd4644dd0bfdcbd565c [0,2,0,0,0,0|1,0,0]=3 2323 B17R1.18904 CCCC(C)(CO)NCC(F)c1ccccc1 9e404619560fb5eebe3ae0623b7b1077 [0,2,0,0,0,0|1,0,0]=3 2324 B17R1.18904 CCCC(C)(CO)NCC(O)c1ccccc1 17f8edb9dcda96f239d3dad0d83def8c [0,2,0,0,0,0|0,0,0]=2 2325 B17R1.18904 CCCC(C)(CO)NCC(O)c1cnccn1 e980eefe24cfd9625875ec8f83bbeb84 [0,2,0,0,0,0|2,0,0]=4 2326 B17R1.18904 CCCC(C)(CO)NCS(=O)c1ccccc1 d49f052f2c65df699cf2445638d92016 [0,2,0,0,0,0|1,0,1]=4 2327 B17R1.18904 CCCC(C)(CO)NC[C@@H](C)c1ccccc1 047e9a66a0a44c35f3e768b5a32ada10 [0,2,0,0,0,0|1,0,0]=3 2328 B17R1.18904 CCCC(C)(CO)NC[C@@H](O)c1ccccc1 f39eefc6717a76920c1a16b724211274 [0,2,0,0,0,0|0,0,0]=2 2329 B17R1.18904 CCCC(C)(CO)NC[C@H](O)c1ccccc1 f9a19048c0ff21baa8f91195f9d703f2 [0,2,0,0,0,0|0,0,0]=2 2330 B17R1.19554 C#CC(CC)(CC)NCC(O)c1ccccc1 be5fa004e11a771b39dd64f01d9e531e [0,2,0,0,0,0|1,0,1]=4 2331 B17R1.19554 C=C(CNC(CC)(CO)CO)c1ccccc1 ed335d13d5be7e068752dc90961804fa [0,2,0,0,0,0|1,0,1]=4 2332 B17R1.19554 C=C(CNC(CO)(CO)CO)c1ccccc1 9f8817153e98ab1f913e983f61a821ec [0,2,0,0,0,0|1,0,1]=4 2333 B17R1.19554 CC(CNC(CO)(CO)CO)c1ccccc1 f8137a96b4d785bdca06dec6421a2aa0 [0,2,0,0,0,0|1,0,0]=3 2334 B17R1.19554 CCC(C#N)(CC)NCC(O)c1ccccc1 a53f37c504f857b72e7d33641c1e17f5 [0,2,0,0,0,0|1,0,1]=4 2335 B17R1.19554 CCC(CO)(CO)NCC(=O)c1ccccc1 4d7fbf82edc558d5c31fba81d2917ad1 [0,2,0,0,0,0|0,0,2]=4 2336 B17R1.19554 CCC(CO)(CO)NCC(O)c1ccccc1 fbf7349adbb29d6a6358a1a3077a7f65 [0,2,0,0,0,0|0,0,0]=2 2337 B17R1.19554 CCC(CO)(CO)NCC(O)c1cnccn1 c58b4b72a4cbfacb87c1405a4940cf57 [0,2,0,0,0,0|2,0,0]=4 2338 B17R1.19554 C[C@H](CNC(CO)(CO)CO)c1ccccc1 873cac4c29b8fa3a0a9e0392724e5bf4 [0,2,0,0,0,0|1,0,0]=3 2339 B17R1.19554 O=C(CNC(CO)(CO)CO)c1ccccc1 eefc00386c94d361463e3b24c180e6ff [0,2,0,0,0,0|0,0,2]=4 2340 B17R1.19554 OCC(CO)(CO)NCC(F)c1ccccc1 f49658a3c727a96e7defbeac85902b2c [0,2,0,0,0,0|1,0,0]=3 2341 B17R1.19554 OCC(CO)(CO)NCC(O)c1ccccc1 dad08de663db1838ac60589040d37ba9 [0,2,0,0,0,0|0,0,0]=2 2342 B17R1.19554 OCC(CO)(CO)NCC(O)c1cnccn1 ca4a48ed5acd36aadadc0db988e61d06 [0,2,0,0,0,0|2,0,0]=4 2343 B17R1.47626 CC(CO)(CO)NCC(C)(C)c1ccccc1 16c53d7e446a7f221b950d6878d14961 [0,2,0,0,0,0|1,0,0]=3 2344 B17R1.47626 CC(CO)(CO)NCC(F)(F)c1ccccc1 cc0ae74cc75d5e085a42243a883a402e [0,2,0,0,0,0|1,0,0]=3 2345 B17R1.47626 CC(CO)(CO)NCS(=O)(=O)c1ccccc1 d78181f879d267c97fac8f599c108855 [0,2,0,0,0,0|1,0,1]=4 2346 B17R1.47626 CCC(C)(CC)NCC(C)(C)c1ccccc1 94b4f38b9d7b121b2fff4e2a4a2d8108 [0,2,0,0,0,0|2,0,0]=4 2347 B17R1.47626 CCC(C)(CC)NCC(F)(F)c1ccccc1 7bcc74025b1e58f12507216863556498 [0,2,0,0,0,0|2,0,0]=4 2348 B17R1.47626 CCC(C)(CO)NCC(F)(F)c1ccccc1 7399f707093b9c1859312bc107a4272e [0,2,0,0,0,0|1,0,0]=3 2349 B17R1.47671 CC(C)C(C)(C#N)NCC(O)c1ccccc1 b10007e49bf26906e203e12603f0ac42 [0,2,0,0,0,0|1,0,1]=4 2350 B17R1.47671 CC(CNC(C)(CO)C(=O)O)c1ccccc1 796a588172fd4186f4bcc02f69dedec8 [0,2,0,0,0,0|1,0,1]=4 2351 B17R1.47671 CC(CN[C@@](C)(CO)C(=O)O)c1ccccc1 eea448cf560b99b48a6c2b87d52809d2 [0,2,0,0,0,0|1,0,1]=4 2352 B17R1.47671 CC(CN[C@](C)(CO)C(=O)O)c1ccccc1 f66882b90bdb63cadf95030a30961539 [0,2,0,0,0,0|1,0,1]=4 2353 B17R1.47671 CC(CO)(NCC(O)c1ccccc1)C(=O)O b941725bd0f02e1f459609dfb698cd74 [0,2,0,0,0,0|0,0,1]=3 2354 B17R1.47671 CCC(C)(NCC(O)c1ccccc1)C(=O)N dd2d68782cf0bb97237f7df2e29909ac [0,2,0,0,0,0|0,0,2]=4 2355 B17R1.47671 CCC(C)(NCC(O)c1ccccc1)C(=O)O 58e7e8c2f7a355a38f2b9a45c66e2ddc [0,2,0,0,0,0|0,0,1]=3 2356 B17R1.47671 CC[C@@](C)(NCC(O)c1ccccc1)C(=O)O ba2a13bdb14bb4b5907858d91f817949 [0,2,0,0,0,0|0,0,1]=3 2357 B17R1.47671 CC[C@](C)(NCC(O)c1ccccc1)C(=O)O f6ff0336f212c157509577bf0a9455dd [0,2,0,0,0,0|0,0,1]=3 2358 B17R1.47671 C[C@@](CO)(NCC(O)c1ccccc1)C(=O)O 814d82f0fc1119380fafd6fab892e8f7 [0,2,0,0,0,0|0,0,1]=3 2359 B17R1.47671 C[C@H](CNC(C)(CO)C(=O)O)c1ccccc1 a8e42a795945bd4aa2890ae42653e5eb [0,2,0,0,0,0|1,0,1]=4 2360 B17R1.47671 C[C@H](CN[C@@](C)(CO)C(=O)O)c1ccccc1 30f57aa3a377f934218b05d5f860c823 [0,2,0,0,0,0|1,0,1]=4 2361 B17R1.47671 C[C@H](CN[C@](C)(CO)C(=O)O)c1ccccc1 d0cded31dc875b3067c8993e0d327b94 [0,2,0,0,0,0|1,0,1]=4 2362 B17R1.47671 C[C@](CO)(NCC(O)c1ccccc1)C(=O)O 4259824b0c80adb8ce6bf968ea088a08 [0,2,0,0,0,0|0,0,1]=3 2363 B17R1.181864 CC(CO)(CO)NCC(=O)c1ccccc1Cl c19664ecc6472e418443ebcf11761736 [0,2,0,0,0,0|0,0,2]=4 2364 B17R1.181864 CC(CO)(CO)NCC(=O)c1ccccc1F f27c4a6a1594ee5cad75e0a429152e48 [0,2,0,0,0,0|0,0,2]=4 2365 B17R1.181864 CC(CO)(CO)NCC(=O)c1ccccc1I 22f1bcb1f7dfcb00407514d28f119262 [0,2,0,0,0,0|0,0,2]=4 2366 B17R1.181864 CCC(C)(CO)NCC(=O)c1ccccc1C 8b7c3ef2ec8f71364bc314df0b933958 [0,2,0,0,0,0|0,0,2]=4 2367 B17R1.181864 CCC(C)(CO)NCC(=O)c1ccccc1Cl e0d2fd0cf1a49094750020b21302edb6 [0,2,0,0,0,0|0,0,2]=4 2368 B17R1.181864 CCC(C)(CO)NCC(=O)c1ccccc1F 76302191d87a5e0f46c08558828037ba [0,2,0,0,0,0|0,0,2]=4 2369 B17R1.181864 CCC(C)(CO)NCC(=O)c1ccccc1I d90565ed5cf7d78434539f8f7f982201 [0,2,0,0,0,0|0,0,2]=4 2370 B17R1.181864 Cc1ccccc1C(=O)CNC(C)(CO)CO 1497dfb2de0e71a32a22e9ba615e194a [0,2,0,0,0,0|0,0,2]=4 2371 B17R1.88864 CC(C)(CO)NCC(C)(C)c1ccccc1Cl dcba6fb9c0c9a8061d488a50d7904491 [0,2,0,0,0,0|1,0,0]=3 2372 B17R1.103549 CC(C)(NCC(C)(C)c1ccccc1)C(=O)O ef540ca4f0a72d2eb08c5f2ec6f0e52e [0,2,0,0,0,0|1,0,1]=4 2373 B17R1.103549 CC(C)(NCC(F)(F)c1ccccc1)C(=O)O b1f92754122bb4bde94f121ef0b326af [0,2,0,0,0,0|1,0,1]=4 2374 B17R1.103549 CC(C)C(C)(C)NCC(C)(C)c1ccccc1 4936e01e0caee5ff42a3b26d1663b353 [0,2,0,0,0,0|2,0,0]=4 2375 B17R1.103549 CC(C)C(C)(C)NCC(F)(F)c1ccccc1 2ed7ea4ef62c09e5f5b3e025a1aa9787 [0,2,0,0,0,0|2,0,0]=4 2376 B17R1.103549 CC(O)C(C)(C)NCC(C)(C)c1ccccc1 1c4c257c129c629839c2f360a4ff9475 [0,2,0,0,0,0|1,0,0]=3 2377 B17R1.103549 CC(O)C(C)(C)NCC(F)(F)c1ccccc1 354f9e73a39cdbef1c0a1b88eb1c4f72 [0,2,0,0,0,0|1,0,0]=3 2378 B17R1.103549 CC(O)C(C)(C)NCS(=O)(=O)c1ccccc1 eff6fdd9b836cc8a335b01891e1b1d23 [0,2,0,0,0,0|1,0,1]=4 2379 B17R1.110864 CC(C)(CCO)NCC(C)(C)c1ccccc1 d4374e9602171037ea727a1d6a522e93 [0,2,0,0,0,0|1,0,0]=3 2380 B17R1.110864 CC(C)(CCO)NCC(F)(F)c1ccccc1 564d8e2f77921314da41553491ce97b9 [0,2,0,0,0,0|1,0,0]=3 2381 B17R1.110864 CC(C)(CCO)NCS(=O)(=O)c1ccccc1 5013e37100ba0bd08955d108c1214e12 [0,2,0,0,0,0|1,0,1]=4 2382 B17R1.110864 COCC(C)(C)NCC(F)(F)c1ccccc1 92a22a817e955a73dc581195f02b6e50 [0,2,0,0,0,0|1,0,0]=3 2383 B17R1.110864 COCC(C)(C)NCS(=O)(=O)c1ccccc1 41e35c6c54715e68d604e0bf49b67d9f [0,2,0,0,0,0|1,0,1]=4 2384 B17R1.110864 CSCC(C)(C)NCC(C)(C)c1ccccc1 cc903c14a7f4a7275a982b9bd5bdf1bb [0,2,0,0,0,0|1,1,0]=4 2385 B17R1.110864 CSCC(C)(C)NCC(F)(F)c1ccccc1 ef919fd9ad0051a1fa6fb530f7f4df1b [0,2,0,0,0,0|1,1,0]=4 2386 B17R1.77086 CC(=O)C(C)(C)NCC(O)c1ccccc1Cl 0d984ab379223be94c2d8c9afb3df647 [0,2,0,0,0,0|0,0,2]=4 2387 B17R1.77086 CC(C)(NCC(O)c1ccccc1Cl)C(=O)N 1a50e93483b6dde35489e522b7edd6f1 [0,2,0,0,0,0|0,0,2]=4 2388 B17R1.77086 CC(C)(NCC(O)c1ccccc1Cl)C(=O)O 727bc0f7386171ac2626fbba5bb3d57c [0,2,0,0,0,0|0,0,1]=3 2389 B17R1.77086 CC(C)C(C)(C)NCC(O)c1ccccc1Cl 664f9e82109412b52562d84b56fed92c [0,2,0,0,0,0|1,0,0]=3 2390 B17R1.77086 CC(O)C(C)(C)NCC(=O)c1ccccc1Cl 81e07768b68ccb082f725d5578db6545 [0,2,0,0,0,0|0,0,2]=4 2391 B17R1.77086 CC(O)C(C)(C)NCC(=O)c1ccccc1F 280b79c1f13327221487e9103cde3e6f [0,2,0,0,0,0|0,0,2]=4 2392 B17R1.77086 CC(O)C(C)(C)NCC(=O)c1ccccc1I 41d49b6fba92c73665e1675fb1c89398 [0,2,0,0,0,0|0,0,2]=4 2393 B17R1.77086 Cc1ccccc1C(=O)CNC(C)(C)C(C)O 490a6fac2ff62ff28894ce356b7071c8 [0,2,0,0,0,0|0,0,2]=4 2394 B17R1.115179 CC(C)(CCO)NCC(=O)c1ccccc1Cl 3f205bacd1b57c0b4f00f00d19ef73fe [0,2,0,0,0,0|0,0,2]=4 2395 B17R1.115179 CC(C)(CCO)NCC(=O)c1ccccc1F f8f1ed990e8cfc3e816454c41759b7d6 [0,2,0,0,0,0|0,0,2]=4 2396 B17R1.115179 CC(C)(CCO)NCC(=O)c1ccccc1I 35409625e3f43f52f23f7cafe6998824 [0,2,0,0,0,0|0,0,2]=4 2397 B17R1.115179 CC(C)(CCO)NCC(O)c1ccccc1Cl 3b7e3d970539fe8931e463c05289abb7 [0,2,0,0,0,0|0,0,0]=2 2398 B17R1.115179 COCC(C)(C)NCC(=O)c1ccccc1C b3ab40013bf66e353706383fe31a5877 [0,2,0,0,0,0|0,0,2]=4 2399 B17R1.115179 COCC(C)(C)NCC(=O)c1ccccc1Cl 658f845f6a3eb7b26dbbd3e87a096227 [0,2,0,0,0,0|0,0,2]=4 2400 B17R1.115179 COCC(C)(C)NCC(=O)c1ccccc1F 7dded2488f5447f85612928985e37ef4 [0,2,0,0,0,0|0,0,2]=4 2401 B17R1.115179 COCC(C)(C)NCC(=O)c1ccccc1I 8e6838540d2ec81619e5ef1f2dc2c5a0 [0,2,0,0,0,0|0,0,2]=4 2402 B17R1.115179 CSCC(C)(C)NCC(O)c1ccccc1Cl 82ddeaa0bdb5f2183af2220c0194cb29 [0,2,0,0,0,0|0,1,0]=3 2403 B17R1.115179 Cc1ccccc1C(=O)CNC(C)(C)CCO 52372c9e812e9741dde8f25f0cb87886 [0,2,0,0,0,0|0,0,2]=4 2404 B17R1.121600 CC(C)(CO)CNC(CO)c1ccccc1Cl 9dcf605c2cb1a5b4c3b8180b476cbbd8 [0,2,0,0,0,0|2,0,0]=4 2405 B17R1.121600 CC(C)(CO)CNC(CO)c1ccccc1F ae2ca6fcd3453e5f92f46366c4ce2316 [0,2,0,0,0,0|2,0,0]=4 2406 B17R1.121600 CC(C)(CO)CN[C@@H](CO)c1ccccc1Cl 6e19991e8254326e099afa5ac6d5f8fc [0,2,0,0,0,0|2,0,0]=4 2407 B17R1.121600 CC(C)(CO)CN[C@@H](CO)c1ccccc1F de35c1356413dcc53abbb9f005ecf432 [0,2,0,0,0,0|2,0,0]=4 2408 B17R1.121600 CC(C)(CO)CN[C@H](CO)c1ccccc1Cl 5feff9cd005346923e4720770b9f78c4 [0,2,0,0,0,0|2,0,0]=4 2409 B17R1.121600 CC(C)(CO)CN[C@H](CO)c1ccccc1F 0c44d229173cdbb7460eb36f8ff302dc [0,2,0,0,0,0|2,0,0]=4 2410 B17R1.121600 Cc1ccccc1C(CO)NCC(C)(C)CO de02f07984bb5876053a5bf2c2857099 [0,2,0,0,0,0|2,0,0]=4 2411 B17R1.121600 Cc1ccccc1[C@H](CO)NCC(C)(C)CO 0f02899ce7399c7ed5e85491a068a9b8 [0,2,0,0,0,0|2,0,0]=4 2412 B17R1.154776 CC(C)(CO)NCC(=O)c1ccccc1C#N 3e22e4461025eeeeae673fb671fb590e [0,2,0,0,0,0|0,0,2]=4 2413 B17R1.154776 COc1ccccc1C(=O)CNC(C)(C)CO 51dad9a3706292ce2b27903458be6dca [0,2,0,0,0,0|0,0,2]=4 2414 B17R1.300037 C#CC(C)(C)NCC(O)c1c(cccc1Cl)Cl e931e0dcce6e9f713d4067f2f7fd77d3 [0,2,0,0,0,0|1,0,1]=4 2415 B17R1.300037 CC(C)(C#N)NCC(O)c1c(cccc1Cl)Cl 08df730162f02e317f1feaf5526dc55e [0,2,0,0,0,0|1,0,1]=4 2416 B17R1.300037 CC(C)(CF)NCC(O)c1c(cccc1Cl)Cl 214a9ef9bef2ed732fa116e662db1120 [0,2,0,0,0,0|1,0,0]=3 2417 B17R1.300037 CC(C)(CO)NCC(=O)c1c(cccc1Cl)Cl 1c225fc4e072cca539f3595e277d2cd3 [0,2,0,0,0,0|0,0,2]=4 2418 B17R1.300037 CC(C)(CO)NCC(=O)c1c(cccc1F)F 072f9d98403379ad39884616b30ee14a [0,2,0,0,0,0|0,0,2]=4 2419 B17R1.300037 CC(C)(CO)NCC(O)c1c(cccc1Cl)Cl 8217c3922b81f43cc3ffe8d992033463 [0,2,0,0,0,0|0,0,0]=2 2420 B17R1.16668 CC(C)(NCC(F)c1ccccc1)C(F)(F)F 5d48ae4634d222e38574563eb2a79304 [0,2,0,0,0,0|2,0,0]=4 2421 B17R1.16668 CC(C)(NCC(O)c1ccccc1)C(F)(F)F 0b420ec64ffb0fd023ef2913aa3d8e30 [0,2,0,0,0,0|1,0,0]=3 2422 B17R1.16668 CC(C)(O)C(C)(C)NCC(=O)c1ccccc1 5bc84737475bc50794b6f86a1441480f [0,2,0,0,0,0|0,0,2]=4 2423 B17R1.16668 CC(C)(O)C(C)(C)NCC(O)c1cnccn1 85da12e7b55204e12388bbcf43c85143 [0,2,0,0,0,0|2,0,0]=4 2424 B17R1.24649 COC(=O)C(C)(C)NCC(C)c1ccccc1 ed78b65474184c574d87a81ca4453de4 [0,2,0,0,0,0|1,0,1]=4 2425 B17R1.24649 COC(=O)C(C)(C)NCC(F)c1ccccc1 bd7fd4662d31305ba85285b711c42675 [0,2,0,0,0,0|1,0,1]=4 2426 B17R1.24649 COC(=O)C(C)(C)NCC(O)c1ccccc1 a0216f18dea988abe8ae4c7eb9cec530 [0,2,0,0,0,0|0,0,1]=3 2427 B17R1.24649 COC(=O)C(C)(C)NC[C@@H](C)c1ccccc1 2c4a9ffacf98d9826b512915186d0faf [0,2,0,0,0,0|1,0,1]=4 2428 B17R1.9325 C=C(CNC(C)(C)CCCO)c1ccccc1 f1158849488b4224657663c523eecc51 [0,2,0,0,0,0|1,0,1]=4 2429 B17R1.9325 CC(C)(CCC#N)NCC(F)c1ccccc1 e563561e6779bd899d3cb3092e23cabe [0,2,0,0,0,0|2,0,0]=4 2430 B17R1.9325 CC(C)(CCC#N)NCC(O)c1ccccc1 9373178743e8df0f30ee106cd13b820b [0,2,0,0,0,0|1,0,0]=3 2431 B17R1.9325 CC(C)(CCC#N)NC[C@@H](O)c1ccccc1 bc86fd3281f1e67510d4ccfc18e294b6 [0,2,0,0,0,0|1,0,0]=3 2432 B17R1.9325 CC(C)(CCC#N)NC[C@H](O)c1ccccc1 387cc9c33018276eba9f6466c27d1e31 [0,2,0,0,0,0|1,0,0]=3 2433 B17R1.9325 CC(C)(CCCO)NCC(=O)c1ccccc1 d3a41c328cec3705b2f1947e1b9cee5f [0,2,0,0,0,0|0,0,2]=4 2434 B17R1.9325 CC(C)(CCCO)NCC(F)c1ccccc1 7186d3aa79fa93a7afb0b032674a8aee [0,2,0,0,0,0|1,0,0]=3 2435 B17R1.9325 CC(C)(CCCO)NCC(O)c1ccccc1 56fbae5c0861db5d3b3c34724d2086ca [0,2,0,0,0,0|0,0,0]=2 2436 B17R1.9325 CC(C)(CCCO)NCC(O)c1cnccn1 3bfb33634cfbb9e10c27f25328e59644 [0,2,0,0,0,0|2,0,0]=4 2437 B17R1.9325 CC(C)(CCCO)NCS(=O)c1ccccc1 7d4a64e090ab7a496f6ff2d286b17dbd [0,2,0,0,0,0|1,0,1]=4 2438 B17R1.9325 CC(C)(CCCO)NC[C@@H](O)c1ccccc1 3ed6cdacb2a07897d240205484918dad [0,2,0,0,0,0|0,0,0]=2 2439 B17R1.9325 CC(C)(CCCO)NC[C@H](O)c1ccccc1 36a320a5c7cd8e06ace862877b269ae1 [0,2,0,0,0,0|0,0,0]=2 2440 B17R1.9325 CC(CNC(C)(C)CCC#N)c1ccccc1 6eb909ce199dc4422ab6224d09d3bb56 [0,2,0,0,0,0|2,0,0]=4 2441 B17R1.9325 CC(CNC(C)(C)CCCO)c1ccccc1 8678d74027ab902d1e03cfdceee73959 [0,2,0,0,0,0|1,0,0]=3 2442 B17R1.9325 CCOCC(C)(C)NCC(O)c1cnccn1 5c972d4bfc0bcc89c3a14a91bc49fd7e [0,2,0,0,0,0|2,0,0]=4 2443 B17R1.9325 CSCCC(C)(C)NCC(C)c1ccccc1 a468c93652f397213c97d01ef516b54a [0,2,0,0,0,0|1,1,0]=4 2444 B17R1.9325 CSCCC(C)(C)NCC(F)c1ccccc1 b41d62d2b4c0781c38a2653062d6892f [0,2,0,0,0,0|1,1,0]=4 2445 B17R1.9325 CSCCC(C)(C)NCC(O)c1ccccc1 2e56f2ab525afc82add29ad7c0ca6733 [0,2,0,0,0,0|0,1,0]=3 2446 B17R1.9325 CSCCC(C)(C)NC[C@@H](C)c1ccccc1 0780aaf80f4eff61a7ea5d3f86898ded [0,2,0,0,0,0|1,1,0]=4 2447 B17R1.9325 CSCCC(C)(C)NC[C@@H](O)c1ccccc1 6a50cca8d6d5653a126d6508835fcdf4 [0,2,0,0,0,0|0,1,0]=3 2448 B17R1.9325 CSCCC(C)(C)NC[C@H](O)c1ccccc1 cc806f5876e41dd6b7439e3110f23b3e [0,2,0,0,0,0|0,1,0]=3 2449 B17R1.9325 C[C@H](CNC(C)(C)CCC#N)c1ccccc1 eb9eeab1cc55bdb1e3e2f90a198202c6 [0,2,0,0,0,0|2,0,0]=4 2450 B17R1.9325 C[C@H](CNC(C)(C)CCCO)c1ccccc1 d30e9e419d13e1f32e68632afe11ff2d [0,2,0,0,0,0|1,0,0]=3 2451 B17R1.26311 C=C(CNC(C)(C)CC(=O)O)c1ccccc1 7b920b013b52326ce39e6a071b62b8e0 [0,2,0,0,0,0|1,0,1]=4 2452 B17R1.26311 CC(=O)CC(C)(C)NCC(C)c1ccccc1 4a1311f59cab75f578f9d71de1805e3a [0,2,0,0,0,0|1,0,1]=4 2453 B17R1.26311 CC(=O)CC(C)(C)NCC(F)c1ccccc1 8b5be1a5b8b078c1f6e844d3eb013bd8 [0,2,0,0,0,0|1,0,1]=4 2454 B17R1.26311 CC(=O)CC(C)(C)NCC(O)c1ccccc1 d0008cee70b51e34f2bdc977aabc81e9 [0,2,0,0,0,0|0,0,1]=3 2455 B17R1.26311 CC(=O)CC(C)(C)NC[C@@H](C)c1ccccc1 1f25b73e61dd42c6d9ae0d264644e570 [0,2,0,0,0,0|1,0,1]=4 2456 B17R1.26311 CC(C)(CC(=O)N)NCC(F)c1ccccc1 868794307a2ea8614fa9eb33877118a6 [0,2,0,0,0,0|1,0,1]=4 2457 B17R1.26311 CC(C)(CC(=O)N)NCC(O)c1ccccc1 b710a3501213aa884123ba853e415d61 [0,2,0,0,0,0|0,0,1]=3 2458 B17R1.26311 CC(C)(CC(=O)O)NCC(=O)c1ccccc1 c6451554d9fed5ffa5da556284bb1a25 [0,2,0,0,0,0|0,0,2]=4 2459 B17R1.26311 CC(C)(CC(=O)O)NCC(F)c1ccccc1 8ea60481047c55a4ebac56218a02716a [0,2,0,0,0,0|1,0,0]=3 2460 B17R1.26311 CC(C)(CC(=O)O)NCC(O)c1ccccc1 fe924f1b24e5824c6b6e669aef31eda5 [0,2,0,0,0,0|0,0,0]=2 2461 B17R1.26311 CC(C)(CC(=O)O)NCC(O)c1cnccn1 9a363c57a269f2464a5e3505a59e1b7f [0,2,0,0,0,0|2,0,0]=4 2462 B17R1.26311 CC(C)(CC(=O)O)NCS(=O)c1ccccc1 23669363cbaab32b26fa6950d8eba125 [0,2,0,0,0,0|1,0,1]=4 2463 B17R1.26311 CC(C)(CC(=O)O)NC[C@@H](O)c1ccccc1 3ca9bccbe66d971492d978d1a8aebb14 [0,2,0,0,0,0|0,0,0]=2 2464 B17R1.26311 CC(C)(CC(=O)O)NC[C@H](O)c1ccccc1 bc3dcab7e4621ded2f484dd1d694f30d [0,2,0,0,0,0|0,0,0]=2 2465 B17R1.26311 CC(CNC(C)(C)CC(=O)N)c1ccccc1 196b110d0feddaa9e5408d958b10b728 [0,2,0,0,0,0|1,0,1]=4 2466 B17R1.26311 CC(CNC(C)(C)CC(=O)O)c1ccccc1 fe006cbd7801c54a71c7d8d681c4feff [0,2,0,0,0,0|1,0,0]=3 2467 B17R1.26311 CC(CNC(C)(C)CN(C)C)c1ccccc1 24943885b55decc77746d5ef74e8038a [0,2,0,0,0,0|2,0,0]=4 2468 B17R1.26311 CN(C)CC(C)(C)NCC(F)c1ccccc1 6146d1ff493b63314a60a5d661ad8586 [0,2,0,0,0,0|2,0,0]=4 2469 B17R1.26311 CN(C)CC(C)(C)NCC(O)c1ccccc1 dc3bd9a1fb40d7415493ee1c654da3c8 [0,2,0,0,0,0|1,0,0]=3 2470 B17R1.26311 CN(C)CC(C)(C)NC[C@@H](O)c1ccccc1 545d0bd4277d2c13cec63a588bf8ef55 [0,2,0,0,0,0|1,0,0]=3 2471 B17R1.26311 CN(C)CC(C)(C)NC[C@H](O)c1ccccc1 bfd5762b8049414d3889984661cf905a [0,2,0,0,0,0|1,0,0]=3 2472 B17R1.26311 C[C@H](CNC(C)(C)CC(=O)N)c1ccccc1 d6c914945d2bf1e34f6214d9d629fd6a [0,2,0,0,0,0|1,0,1]=4 2473 B17R1.26311 C[C@H](CNC(C)(C)CC(=O)O)c1ccccc1 df41d967813822525f28d94a3e2331d3 [0,2,0,0,0,0|1,0,0]=3 2474 B17R1.26311 C[C@H](CNC(C)(C)CN(C)C)c1ccccc1 e37f8f9b6f3f268ac99518bb3bd7175c [0,2,0,0,0,0|2,0,0]=4 2475 B17R1.31391 CC(C)(CO)CNC(CCO)c1ccccc1 eeb88fd45e0ae80145a7de68b3dc8d25 [0,2,0,0,0,0|2,0,0]=4 2476 B17R1.31391 CC(C)(CO)CN[C@@H](CCO)c1ccccc1 42b58d6bd06725e1cf48f67a4d3e3dbb [0,2,0,0,0,0|2,0,0]=4 2477 B17R1.31391 CC(C)(CO)CN[C@H](CCO)c1ccccc1 34a97c53fe0c2d9cfd86697ef07ee02d [0,2,0,0,0,0|2,0,0]=4 2478 B17R1.31391 COCC(NCC(C)(C)CO)c1ccccc1 84ed9542c62686720c74b4494ece5501 [0,2,0,0,0,0|2,0,0]=4 2479 B17R1.31391 COC[C@@H](NCC(C)(C)CO)c1ccccc1 78515d1be668e47ef04c221a6cc7b0d6 [0,2,0,0,0,0|2,0,0]=4 2480 B17R1.31391 COC[C@H](NCC(C)(C)CO)c1ccccc1 8a51a607a4ea42e47a62e7c5654b4750 [0,2,0,0,0,0|2,0,0]=4 2481 B17R1.88938 CC(C)(CO)CNC(C(=O)O)c1ccccc1 1bc6d977c1cab7367b516cfc84435d6a [0,2,0,0,0,0|2,0,0]=4 2482 B17R1.88938 CC(C)(CO)CN[C@@H](C(=O)O)c1ccccc1 ce5b7ba8199727e4f160118be4ebb703 [0,2,0,0,0,0|2,0,0]=4 2483 B17R1.88938 CC(C)(CO)CN[C@H](C(=O)O)c1ccccc1 d61600d0bed01f792bb284bb2a5de02a [0,2,0,0,0,0|2,0,0]=4 2484 B17R1.88938 CC(O)C(NCC(C)(C)CO)c1ccccc1 dc4de3d716a2992bb02b521559a8f50e [0,2,0,0,0,0|2,0,0]=4 2485 B17R1.88938 C[C@@H](O)[C@@H](NCC(C)(C)CO)c1ccccc1 e2df98e283f086c77e2a17653ab64cf6 [0,2,0,0,0,0|2,0,0]=4 2486 B17R1.88938 C[C@H](O)[C@H](NCC(C)(C)CO)c1ccccc1 90dcc94123b0a774003b2dd39e3f5f83 [0,2,0,0,0,0|2,0,0]=4 2487 B15R1.44130 C=Cc1cccc(c1)CNC(C)(C)CO f164ef82b307474aba27b3a67c693805 [0,0,1,1,0,0|1,0,1]=4 2488 B15R1.4545 C=Cc1ccccc1CNC(C)(C)CO 57057e35ab105e147f76bdabb74ee27f [0,0,1,1,0,0|1,0,1]=4 2489 B15R2.1040 CC(CNC1CC1C)c2ccccc2 382dc097c263bab39f83e647d6ccb507 [1,0,0,1,0,0|2,0,0]=4 2490 B15R2.1040 CC(CN[C@@H]1C[C@H]1F)c2ccccc2 21964c9a0164b7d43c6cab04f1c44c70 [1,0,0,1,0,0|2,0,0]=4 2491 B15R2.1040 CC(CN[C@H]1C[C@@H]1F)c2ccccc2 def3e1998800d70489231b5a3ce4a31d [1,0,0,1,0,0|2,0,0]=4 2492 B15R2.1040 CC(CN[C@H]1C[C@H]1F)c2ccccc2 68813e0cc69e701cc281c61cbcf7f313 [1,0,0,1,0,0|2,0,0]=4 2493 B15R2.1040 CC1CC1NCC(F)c2ccccc2 e56216428fb7c314ec291bf393359b8d [1,0,0,1,0,0|2,0,0]=4 2494 B15R2.1040 CC1CC1NCC(O)c2ccccc2 f7ac58123654b0d90b620c1090f9fa60 [1,0,0,1,0,0|1,0,0]=3 2495 B15R2.1040 CC1CC1NC[C@@H](C)c2ccccc2 79914248e124a4fbc07f795abbdf0af7 [1,0,0,1,0,0|2,0,0]=4 2496 B15R2.1040 C[C@H](CN[C@@H]1C[C@H]1F)c2ccccc2 c3dadbc9e47d80cee2fdf3177e8c6ef5 [1,0,0,1,0,0|2,0,0]=4 2497 B15R2.1040 C[C@H](CN[C@H]1C[C@@H]1F)c2ccccc2 0289e3933bbf896f21e58adb274cfd49 [1,0,0,1,0,0|2,0,0]=4 2498 B15R2.1040 C[C@H](CN[C@H]1C[C@H]1F)c2ccccc2 c43d29c5a4fc9ed90e4e32a15d822b60 [1,0,0,1,0,0|2,0,0]=4 2499 B15R2.1040 FC(CN[C@@H]1C[C@H]1F)c2ccccc2 fd85393b728a6c06e699b17f3947a450 [1,0,0,1,0,0|2,0,0]=4 2500 B15R2.1040 FC(CN[C@H]1C[C@@H]1F)c2ccccc2 d0c715cccf875b346729c0d945af45fe [1,0,0,1,0,0|2,0,0]=4 2501 B15R2.1040 FC(CN[C@H]1C[C@H]1F)c2ccccc2 c1a015e0e3f956ea2de4966225acc676 [1,0,0,1,0,0|2,0,0]=4 2502 B15R2.1040 OC(CN[C@@H]1C[C@H]1F)c2ccccc2 28860b4dc8459711202d51097cf46f98 [1,0,0,1,0,0|1,0,0]=3 2503 B15R2.1040 OC(CN[C@H]1C[C@@H]1F)c2ccccc2 e22f2ae283ce5dc005b774fd6f211024 [1,0,0,1,0,0|1,0,0]=3 2504 B15R2.1040 OC(CN[C@H]1C[C@H]1F)c2ccccc2 d8df5567edb67d941ba8c2a521947543 [1,0,0,1,0,0|1,0,0]=3 2505 B15R2.1596 CC(CO)N1CC(C1)c2ccccc2 00bd3912e20ca68002746b54069487d6 [1,0,0,1,0,0|1,0,0]=3 2506 B15R2.1596 CC(CO)N1CC(C1)c2ccccn2 5c8dbc48b9d567abd1576fbdc29a9def [1,0,0,1,0,0|2,0,0]=4 2507 B15R2.1596 CC(CO)N1CC(C1)c2cccnc2 036fab22bc7613b01b29f625bff5f2ed [1,0,0,1,0,0|2,0,0]=4 2508 B15R2.1596 CC(CO)N1CC(C1)c2ccncc2 ce6592f7de109594cf957ebc1b68d150 [1,0,0,1,0,0|2,0,0]=4 2509 B15R2.1596 CCC(C)N1CC(C1)c2ccccc2 23ea88259dbf8f6b209f9d5439dda113 [1,0,0,1,0,0|2,0,0]=4 2510 B15R2.1596 C[C@@H](CO)N1CC(C1)c2ccccc2 c964e1b79d03b37d97cebddad85c5891 [1,0,0,1,0,0|1,0,0]=3 2511 B15R2.1596 C[C@@H](CO)N1CC(C1)c2ccccn2 e1476cacb4499cba04b7a818538899e3 [1,0,0,1,0,0|2,0,0]=4 2512 B15R2.1596 C[C@@H](CO)N1CC(C1)c2cccnc2 35ded470c6ba8c631fb3493fad46488f [1,0,0,1,0,0|2,0,0]=4 2513 B15R2.1596 C[C@@H](CO)N1CC(C1)c2ccncc2 1adecce57e7966e583ab95c08954e88a [1,0,0,1,0,0|2,0,0]=4 2514 B15R2.1596 C[C@H](CO)N1CC(C1)c2ccccc2 15b3b5811cf95ee1d6071123315ed5ff [1,0,0,1,0,0|1,0,0]=3 2515 B15R2.1596 C[C@H](CO)N1CC(C1)c2ccccn2 caa8614290bf63bd4619cee98cd16762 [1,0,0,1,0,0|2,0,0]=4 2516 B15R2.1596 C[C@H](CO)N1CC(C1)c2cccnc2 47ed74462be7b6f26d1fe5653d6c646d [1,0,0,1,0,0|2,0,0]=4 2517 B15R2.1596 C[C@H](CO)N1CC(C1)c2ccncc2 1009d969196d40c3290ad918be3a545f [1,0,0,1,0,0|2,0,0]=4 2518 B15R2.1621 CC(CO)NC1CC1c2ccccc2 5f53cba5c3d1223f7b9d841240098d00 [1,0,0,1,0,0|1,0,0]=3 2519 B15R2.1621 CC(CO)N[C@@H]1C[C@H]1c2ccccc2 837947e6907174d2ddbe614c8a467e3e [1,0,0,1,0,0|1,0,0]=3 2520 B15R2.1621 CC(CO)N[C@H]1C[C@@H]1c2ccccc2 25150fabcacaca8f6fb2d93100a2d506 [1,0,0,1,0,0|1,0,0]=3 2521 B15R2.1621 CCC(C)NC1CC1c2ccccc2 bc8b6f36f01f86f83cdf4e0adffbadec [1,0,0,1,0,0|2,0,0]=4 2522 B15R2.1621 CCC(C)N[C@@H]1C[C@H]1c2ccccc2 2929d4a697c6156b83b28ccc36bf9ce1 [1,0,0,1,0,0|2,0,0]=4 2523 B15R2.1621 CCC(C)N[C@H]1C[C@@H]1c2ccccc2 74da91640e2eef04c56a7e7b973fa2cb [1,0,0,1,0,0|2,0,0]=4 2524 B15R2.1621 C[C@@H](CO)NC1CC1c2ccccc2 a6f3c86182403b562b448a35119566b7 [1,0,0,1,0,0|1,0,0]=3 2525 B15R2.1621 C[C@@H](CO)N[C@@H]1C[C@H]1c2ccccc2 f5e7fc515431e348c0db48f51b910edf [1,0,0,1,0,0|1,0,0]=3 2526 B15R2.1621 C[C@@H](CO)N[C@H]1C[C@@H]1c2ccccc2 8982a8fc0b0541a77a1351aea5df1d80 [1,0,0,1,0,0|1,0,0]=3 2527 B15R2.1621 C[C@H](CO)NC1CC1c2ccccc2 9974e80ee471f6a534574639df629467 [1,0,0,1,0,0|1,0,0]=3 2528 B15R2.1621 C[C@H](CO)N[C@@H]1C[C@H]1c2ccccc2 8855eb33e3ea02ef9948fc080b991a90 [1,0,0,1,0,0|1,0,0]=3 2529 B15R2.1621 C[C@H](CO)N[C@H]1C[C@@H]1c2ccccc2 0220a171d0c277f480641f8dca5eee5e [1,0,0,1,0,0|1,0,0]=3 2530 B15R2.6783 OCN1CCC(C1)(O)c2ccccc2 87080daa705c1f36188e20621b90ddc0 [1,0,0,1,0,0|2,0,0]=4 2531 B15R2.6783 OCN1CC[C@](C1)(O)c2ccccc2 c80f468e63216dba260b65f953a1cb1e [1,0,0,1,0,0|2,0,0]=4 2532 B15R2.16439 CC(CNC1CCC1)c2ccccc2 62999c378f69719e1b4dd800f2a472c3 [1,0,0,1,0,0|2,0,0]=4 2533 B15R2.16439 CC(CNC1COC1)c2ccccc2 348c672015d602fdb6f64321624e262b [1,0,0,1,0,0|1,0,0]=3 2534 B15R2.16439 CC(COC1COC1)c2ccccc2 32edb1d387b6da65e07caca8d9ccf248 [1,0,0,1,0,0|2,0,0]=4 2535 B15R2.16439 C[C@H](CNC1CCC1)c2ccccc2 2d12beef768a4e1b3e613ca72745f430 [1,0,0,1,0,0|2,0,0]=4 2536 B15R2.16439 C[C@H](CNC1COC1)c2ccccc2 1904e22cf09beb7e1b67278c6539e7d2 [1,0,0,1,0,0|1,0,0]=3 2537 B15R2.16439 C[C@H](COC1COC1)c2ccccc2 6b03b53fcca99262140ff3f6e61271ff [1,0,0,1,0,0|2,0,0]=4 2538 B15R2.16439 FC(CNC1CCC1)c2ccccc2 c09281ee407a735a74a9cbbf9e44dad2 [1,0,0,1,0,0|2,0,0]=4 2539 B15R2.16439 FC(CNC1COC1)c2ccccc2 a0bef448227e8258bcee292dbb1b4d10 [1,0,0,1,0,0|1,0,0]=3 2540 B15R2.16439 FC(COC1COC1)c2ccccc2 0b049eb474ce49d3ea386500578546bf [1,0,0,1,0,0|2,0,0]=4 2541 B15R2.16439 O=C(CNC1COC1)c2ccccc2 0d8740193bda60f0b8f20498aec976c0 [1,0,0,1,0,0|0,0,2]=4 2542 B15R2.16439 OC(CNC1CCC1)c2ccccc2 9610d5dcae111d4ddcdf56f331fbdaae [1,0,0,1,0,0|1,0,0]=3 2543 B15R2.16439 OC(CNC1CCC1)c2ccccn2 3a1ec1dae166670d26cc6b7408daaced [1,0,0,1,0,0|2,0,0]=4 2544 B15R2.16439 OC(CNC1CCC1)c2cccnc2 7801ce5d2ee061228c04d61d49d7090e [1,0,0,1,0,0|2,0,0]=4 2545 B15R2.16439 OC(CNC1CCC1)c2ccncc2 640de391938d486e7e5dfb8f35b6445c [1,0,0,1,0,0|2,0,0]=4 2546 B15R2.16439 OC(CNC1COC1)c2ccccc2 7ce3de60446208a4f24ebc3e20e1d12c [1,0,0,1,0,0|0,0,0]=2 2547 B15R2.16439 OC(CNC1COC1)c2ccccn2 ccb0a9b0d1fb1333f3531380406045e0 [1,0,0,1,0,0|1,0,0]=3 2548 B15R2.16439 OC(CNC1COC1)c2ccncc2 3536980f4df5c0f5ae394e1f2f1cf3c3 [1,0,0,1,0,0|1,0,0]=3 2549 B15R2.16439 OC(CNC1COC1)c2cnccn2 9535083bc2b115e098c015db2c283d07 [1,0,0,1,0,0|2,0,0]=4 2550 B15R2.23388 CCC(C)N1CC(c2c1cccc2)C 58b16ed0e9d3f4f6e9a61f61e31e02d1 [1,0,0,1,0,0|2,0,0]=4 2551 B15R2.24496 CC(CNC1(CC1)C)c2ccccc2 0ebb8405e304dc4d8d194e8f304651c5 [1,0,0,1,0,0|2,0,0]=4 2552 B15R2.24496 CC1(CC1)NCC(F)c2ccccc2 2fa349c07ec7d10f3f3a81d87ee43f0e [1,0,0,1,0,0|2,0,0]=4 2553 B15R2.24496 CC1(CC1)NCC(O)c2ccccc2 a4d7a10f7b84deca67efb6d0fe640b5e [1,0,0,1,0,0|1,0,0]=3 2554 B15R2.24496 CC1(CC1)NC[C@@H](O)c2ccccc2 616e8a9435212f50dce75fa2b51d68e9 [1,0,0,1,0,0|1,0,0]=3 2555 B15R2.24496 CC1(CC1)NC[C@H](O)c2ccccc2 56f6fed8b5dd0524547d00f2973f264f [1,0,0,1,0,0|1,0,0]=3 2556 B15R2.24496 C[C@H](CNC1(CC1)C)c2ccccc2 b69ca9eeab142045f662bc9c776a3269 [1,0,0,1,0,0|2,0,0]=4 2557 B15R2.79185 CC(CO)NCC1Cc2c1cccc2 3e699eca2172b6335fa36af3a30705be [1,0,0,1,0,0|1,0,0]=3 2558 B15R2.79185 CCC(C)NCC1Cc2c1cccc2 aca0b4e05a5e2a200ca82cb6b060fe78 [1,0,0,1,0,0|2,0,0]=4 2559 B15R2.79185 C[C@@H](CO)NCC1Cc2c1cccc2 dedabfb01876eeb66c5053e999292ef1 [1,0,0,1,0,0|1,0,0]=3 2560 B15R2.79185 C[C@H](CO)NCC1Cc2c1cccc2 290dfca3a141e6621137c233c75e18ea [1,0,0,1,0,0|1,0,0]=3 2561 B15R2.585 CC1(COC1CNc2ccccc2)C fb5cd86b3b64b2b059483dfdf8696e20 [1,0,0,1,0,0|2,0,0]=4 2562 B15R2.5142 CC1(CN(C1)Cc2ccccc2)CO ce5d220cc70196cb414c3d0783c3193d [1,0,0,1,0,0|2,0,0]=4 2563 B15R2.5228 C#CC1(CC1)NCCc2ccccc2 012c0c0141f9aedff75be9726b54414a [1,0,0,1,0,0|1,0,1]=4 2564 B15R2.5228 N#CC1(CC1)NCCc2ccccc2 747e5114efbc8c68a705de2842d4dacc [1,0,0,1,0,0|1,0,1]=4 2565 B15R2.5228 OCC1(CC1)CCNc2ccccc2 8544902b394d6964c6d789e5929cec91 [1,0,0,1,0,0|2,0,0]=4 2566 B15R2.5228 OCC1(CC1)CNCc2ccccc2 b4b048573602ce0bfefd835556585af7 [1,0,0,1,0,0|2,0,0]=4 2567 B15R2.5228 OCC1(CC1)NCCc2ccccc2 1020d4c5fca46f2f1a0eddfa171b92ac [1,0,0,1,0,0|0,0,0]=2 2568 B15R2.5228 OCC1(CC1)NCCc2ccccn2 e2a83e2a208e9f82b1d6d14e7b81fad7 [1,0,0,1,0,0|1,0,0]=3 2569 B15R2.5228 OCC1(CC1)NCCc2cccnc2 40a85c653f0d6ea99788db7e2fb87df0 [1,0,0,1,0,0|1,0,0]=3 2570 B15R2.5228 OCC1(CC1)NCCc2ccncc2 6402ec27ff27cd093f7f04ccd1b59d8e [1,0,0,1,0,0|1,0,0]=3 2571 B15R2.5228 OCC1(CC1)NCSc2ccccc2 ff664a3a4bcc8cabba2d5fc749acbee0 [1,0,0,1,0,0|1,0,0]=3 2572 B15R2.7507 CC1(CCC1)NCCc2ccccc2 8957dbcacbf80ff73d3b9ff092e68a28 [1,0,0,1,0,0|1,0,0]=3 2573 B15R2.7507 CC1(CCC1)NCCc2ccccn2 57791e0f6a3cb89a1cb81b1627c8d8cd [1,0,0,1,0,0|2,0,0]=4 2574 B15R2.7507 CC1(CCC1)NCCc2cccnc2 33f3e943dfaddf16bffa8bc3320c510b [1,0,0,1,0,0|2,0,0]=4 2575 B15R2.7507 CC1(CCC1)NCCc2ccncc2 b6e50518b56bdbc8597e04ea7e52c3b0 [1,0,0,1,0,0|2,0,0]=4 2576 B15R2.7507 CC1(COC1)CNCc2ccccc2 1f078743b380f80cabd4cd07e6c5b6b0 [1,0,0,1,0,0|2,0,0]=4 2577 B15R2.7507 CC1(COC1)COCc2ccccc2 355cf5409d89491a94297650233a6b2f [1,0,0,1,0,0|2,0,0]=4 2578 B15R2.7507 CC1(COC1)NCCc2ccccc2 0374ebc1ce0c8233b47df3dae4545622 [1,0,0,1,0,0|0,0,0]=2 2579 B15R2.7507 CC1(COC1)NCCc2ccccn2 8bb62e800575ac7e22f535e4cdd19c35 [1,0,0,1,0,0|1,0,0]=3 2580 B15R2.7507 CC1(COC1)NCCc2cccnc2 8966a490943a261b58242c5d215a761b [1,0,0,1,0,0|1,0,0]=3 2581 B15R2.7507 CC1(COC1)NCCc2ccncc2 147d4c95332150b76e3410a6127a4913 [1,0,0,1,0,0|1,0,0]=3 2582 B15R2.7507 CC1(CSC1)NCCc2ccccc2 87dfac50e3a66c86ea7666adc5929508 [1,0,0,1,0,0|0,1,0]=3 2583 B15R2.7507 CC1(CSC1)NCCc2ccccn2 9fc174026413cb021e02e51b0dad735c [1,0,0,1,0,0|1,1,0]=4 2584 B15R2.7507 CC1(CSC1)NCCc2cccnc2 dcec8779236e90d7fa04e1df3ccb7c3b [1,0,0,1,0,0|1,1,0]=4 2585 B15R2.7507 CC1(CSC1)NCCc2ccncc2 d450b0545a10ee089083b3a747ee1f1e [1,0,0,1,0,0|1,1,0]=4 2586 B15R2.59561 C#CC(C)(C)NC1Cc2c1cccc2 d806c0f7728055e47e925aeedc9bc88e [1,0,0,1,0,0|1,0,1]=4 2587 B15R2.59561 CC(C)(C#N)NC1Cc2c1cccc2 197f3ca2bd9b3c2e75da409ff64246f8 [1,0,0,1,0,0|1,0,1]=4 2588 B15R2.16436 C=C(CN1CC1(C)C)c2ccccc2 03e18218f871deafacfc441f2db12887 [1,0,0,1,0,0|1,0,1]=4 2589 B15R2.16436 CC(CN1CC1(C)C)c2ccccc2 239e08ad965aa143a6aaa41622133cea [1,0,0,1,0,0|1,0,0]=3 2590 B15R2.16436 CC1(CN1CC(=O)c2ccccc2)C efd868bc29aa4e35548f10f77f534aae [1,0,0,1,0,0|0,0,2]=4 2591 B15R2.16436 CC1(CN1CC(F)c2ccccc2)C 3d687f98a227c4d31339fbf589d64d59 [1,0,0,1,0,0|1,0,0]=3 2592 B15R2.16436 CC1(CN1CC(O)c2ccccc2)C 3ba2aeae89457d25228aa7b5c7a05800 [1,0,0,1,0,0|0,0,0]=2 2593 B15R2.16436 CC1(CN1CC(O)c2cnccn2)C 43ce5117e03320df4dd1acf7d10b08fd [1,0,0,1,0,0|2,0,0]=4 2594 B15R2.16436 CC1(CN1C[C@@H](O)c2ccccc2)C cd35cfcdc93f20686b43266bf0db46dc [1,0,0,1,0,0|0,0,0]=2 2595 B15R2.16436 CC1(CN1C[C@H](O)c2ccccc2)C 6d683fdd01ec078a0771813e6f3271ee [1,0,0,1,0,0|0,0,0]=2 2596 B15R2.16436 C[C@H](CN1CC1(C)C)c2ccccc2 097c9626be7490a7a80bb9cdc7fed5ba [1,0,0,1,0,0|1,0,0]=3 2597 B15R2.5216 CN(CC1(CC1)CO)c2ccccc2 8be34c42cdd436bfc2f3f3263b1abf3f [0,0,0,1,1,0|2,0,0]=4 2598 B15R2.5216 O=C(NC1(CC1)CO)c2ccccc2 5fbbc66b7b8cd80b69add0b006d99b77 [0,0,0,1,1,0|0,0,2]=4 2599 B15R2.16456 CC1(COC1)NC(=O)c2ccccc2 c2f7634cf829f7f29328a4d5a74c5ead [0,0,0,1,1,0|0,0,2]=4 2600 B15R2.16456 CN(CC1(COC1)C)c2ccccc2 ec0bcdaf9374aaf1fd418663f004133f [0,0,0,1,1,0|2,0,0]=4 2601 B17R2.4752 CC(C)(CO)CN1CC(C1)c2ccccc2 095475607c1a5a5990e4d28890899559 [0,0,0,1,0,1|1,0,0]=3 2602 B17R2.4752 CC(C)(CO)CN1CC(C1)c2ccccn2 f75ce869b449d1f03d9dafea7d16b93d [0,0,0,1,0,1|2,0,0]=4 2603 B17R2.4752 CC(C)(CO)CN1CC(C1)c2cccnc2 bde7e3711e1a0b93ab824c27ce38bd16 [0,0,0,1,0,1|2,0,0]=4 2604 B17R2.4752 CC(C)(CO)CN1CC(C1)c2ccncc2 32ef03984a622969206242da489dbd1b [0,0,0,1,0,1|2,0,0]=4 2605 B17R2.4757 CC(C)(CO)CNC1CC1c2ccccc2 22e2029ae6d6b6f84ab70725f56649fd [0,0,0,1,0,1|1,0,0]=3 2606 B17R2.4757 CC(C)(CO)CN[C@@H]1C[C@H]1c2ccccc2 55e41dd42758bf4f1663d5be4c46dba9 [0,0,0,1,0,1|1,0,0]=3 2607 B17R2.4757 CC(C)(CO)CN[C@H]1C[C@@H]1c2ccccc2 fa187a20264909edc4e66af9951ec916 [0,0,0,1,0,1|1,0,0]=3 2608 B17R2.12920 C=C(CNCC1(CC1)CO)c2ccccc2 10c984f87f2d39a9e17f4278a67a38ef [0,0,0,1,0,1|1,0,1]=4 2609 B17R2.12920 CC(CCNC1(CC1)CO)c2ccccc2 2163b0d628bfabd54276dcc1eb949ee8 [0,0,0,1,0,1|1,0,0]=3 2610 B17R2.12920 CC(CNCC1(CC1)CO)c2ccccc2 1219a67625e535a10a164834c09d089c [0,0,0,1,0,1|1,0,0]=3 2611 B17R2.12920 CN(CCNC1(CC1)CO)c2ccccc2 e6ddd57d10748529456c5fed9352d387 [0,0,0,1,0,1|2,0,0]=4 2612 B17R2.12920 C[C@H](CNCC1(CC1)CO)c2ccccc2 40ca14d27bd7a582690ddcc6914dcd83 [0,0,0,1,0,1|1,0,0]=3 2613 B17R2.12920 N#CC1(CC1)CNCC(O)c2ccccc2 cfb0c83f741a87bded15abdaf698225f [0,0,0,1,0,1|1,0,1]=4 2614 B17R2.12920 N#CC1(CC1)CNC[C@@H](O)c2ccccc2 6fa6925764293b3b1701260ceed0ecce [0,0,0,1,0,1|1,0,1]=4 2615 B17R2.12920 N#CC1(CC1)CNC[C@H](O)c2ccccc2 0b89e73d918965d78a298c9cebb62dc8 [0,0,0,1,0,1|1,0,1]=4 2616 B17R2.12920 O=C(CNCC1(CC1)CO)c2ccccc2 40280cfc8458a1ee4d6ec293c655f886 [0,0,0,1,0,1|0,0,2]=4 2617 B17R2.12920 O=C(OCNC1(CC1)CO)c2ccccc2 420aabefb80b1fce094183fe23742614 [0,0,0,1,0,1|0,0,2]=4 2618 B17R2.12920 OCC1(CC1)CNCC(F)c2ccccc2 fd66c6bee5c784a284e182528fa10097 [0,0,0,1,0,1|1,0,0]=3 2619 B17R2.12920 OCC1(CC1)CNCC(O)c2ccccc2 19388188c18030ca26382f8334e9ff54 [0,0,0,1,0,1|0,0,0]=2 2620 B17R2.12920 OCC1(CC1)CNCC(O)c2cnccn2 abf182737cedb31794971f35b7e86d1d [0,0,0,1,0,1|2,0,0]=4 2621 B17R2.12920 OCC1(CC1)CNC[C@@H](O)c2ccccc2 87315ea5ce24f01534277fe1918960e8 [0,0,0,1,0,1|0,0,0]=2 2622 B17R2.12920 OCC1(CC1)CNC[C@H](O)c2ccccc2 9ecd6f1edb51de4508001bb462042081 [0,0,0,1,0,1|0,0,0]=2 2623 B17R2.12920 OCC1(CC1)NCCC(O)c2ccccc2 c7731239ead36c14abdd7d1acb445b14 [0,0,0,1,0,1|0,0,0]=2 2624 B17R2.12920 OCC1(CC1)NCC[C@@H](O)c2ccccc2 efc22b5fb2fdbcb0f66b9937f34d94f2 [0,0,0,1,0,1|0,0,0]=2 2625 B17R2.12920 OCC1(CC1)NCC[C@H](O)c2ccccc2 0725bd58a435d365c47d97c65fc98f18 [0,0,0,1,0,1|0,0,0]=2 2626 B17R2.13043 C=C(CN1CC(C1)(C)CO)c2ccccc2 24639a41f0013e9d7dfa0d66a9a20c84 [0,0,0,1,0,1|1,0,1]=4 2627 B17R2.13043 CC(CN1CC(C1)(C)CO)c2ccccc2 1114eb204cd6999a4786fe992f68e334 [0,0,0,1,0,1|1,0,0]=3 2628 B17R2.13043 CC(CN1CC(C1)(F)CO)c2ccccc2 7f8b1fb04d7d40bd39ded9124a53557c [0,0,0,1,0,1|2,0,0]=4 2629 B17R2.13043 CC1(CN(C1)CC(=O)c2ccccc2)CO 8430102b4af742b44225602725be07bd [0,0,0,1,0,1|0,0,2]=4 2630 B17R2.13043 CC1(CN(C1)CC(F)c2ccccc2)CO 59385f49052711d0a9ab22cd5d3cd6a0 [0,0,0,1,0,1|1,0,0]=3 2631 B17R2.13043 CC1(CN(C1)CC(O)c2ccccc2)CO 79e3847a0705271ac4d2f2ef20befdc1 [0,0,0,1,0,1|0,0,0]=2 2632 B17R2.13043 CC1(CN(C1)CC(O)c2cnccn2)CO a32f22ee1d35cef30d6ef29e176032d8 [0,0,0,1,0,1|2,0,0]=4 2633 B17R2.13043 CC1(CN(C1)CS(=O)c2ccccc2)CO 0291c02aede94ff89aa2f46570370217 [0,0,0,1,0,1|1,0,1]=4 2634 B17R2.13043 CC1(CN(C1)C[C@@H](O)c2ccccc2)CO 09df4817e6e6a9cd7b70fca0033d3510 [0,0,0,1,0,1|0,0,0]=2 2635 B17R2.13043 CC1(CN(C1)C[C@H](O)c2ccccc2)CO dfe5cd59eebba7bd8180c6890eecbd2f [0,0,0,1,0,1|0,0,0]=2 2636 B17R2.13043 COC1(CN(C1)CC(O)c2ccccc2)C a5d3ff31a6445e0a64fa3becd62dc8b0 [0,0,0,1,0,1|2,0,0]=4 2637 B17R2.13043 COC1(CN(C1)C[C@@H](O)c2ccccc2)C 33511d1387a48b827b7ae2a6e7b82f38 [0,0,0,1,0,1|2,0,0]=4 2638 B17R2.13043 COC1(CN(C1)C[C@H](O)c2ccccc2)C b6b1a1b281e552eb338301e4c883e5ab [0,0,0,1,0,1|2,0,0]=4 2639 B17R2.13043 C[C@H](CN1CC(C1)(C)CO)c2ccccc2 50ae28893f7fdd59deda65e1743e18e4 [0,0,0,1,0,1|1,0,0]=3 2640 B17R2.13043 C[C@H](CN1CC(C1)(F)CO)c2ccccc2 2b1fbf0fef0e1b766aae3af3fcee479a [0,0,0,1,0,1|2,0,0]=4 2641 B17R2.13043 OCC1(CN(C1)CC(F)c2ccccc2)F 8f13d919300811919d0b72da2d1de5a5 [0,0,0,1,0,1|2,0,0]=4 2642 B17R2.13043 OCC1(CN(C1)CC(O)c2ccccc2)F 29ce24809fac485e9aedffddb1502221 [0,0,0,1,0,1|1,0,0]=3 2643 B17R2.13043 OCC1(CN(C1)C[C@@H](O)c2ccccc2)F 6501486b777b09bbfc05679ce81060b4 [0,0,0,1,0,1|1,0,0]=3 2644 B17R2.13043 OCC1(CN(C1)C[C@H](O)c2ccccc2)F 53b1e398b91048856b1da135f7d8afc6 [0,0,0,1,0,1|1,0,0]=3 2645 B17R2.13109 CC(c1ccccc1)N2CCC(C2)(C)CO 3627936240f7fafb2d6fcc432542530f [0,0,0,1,0,1|2,0,0]=4 2646 B17R2.13109 CC(c1ccccc1)N2CC[C@@](C2)(C)CO 3ab222ae2dfa7002edac780863d5d54d [0,0,0,1,0,1|2,0,0]=4 2647 B17R2.13109 CC(c1ccccc1)N2CC[C@](C2)(C)CO 6bd1c385944f44b058adfc2bd41d0395 [0,0,0,1,0,1|2,0,0]=4 2648 B17R2.13109 C[C@@H](c1ccccc1)N2CCC(C2)(C)CO 2123e1ed34260d397cea5a2f84e5306d [0,0,0,1,0,1|2,0,0]=4 2649 B17R2.13109 C[C@@H](c1ccccc1)N2CC[C@@](C2)(C)CO bb6de9b21e3b3ecc38c9c315ec5e93f0 [0,0,0,1,0,1|2,0,0]=4 2650 B17R2.13109 C[C@@H](c1ccccc1)N2CC[C@](C2)(C)CO 860ac93e88c6bda421c43d9cdfee6702 [0,0,0,1,0,1|2,0,0]=4 2651 B17R2.13109 C[C@H](c1ccccc1)N2CCC(C2)(C)CO ee1b740950ee9348a78e316ee561478a [0,0,0,1,0,1|2,0,0]=4 2652 B17R2.13109 C[C@H](c1ccccc1)N2CC[C@@](C2)(C)CO bfff03fc911ee3c2b0ab597b75154bdb [0,0,0,1,0,1|2,0,0]=4 2653 B17R2.13109 C[C@H](c1ccccc1)N2CC[C@](C2)(C)CO 0707608077ac2e3e8237b92954e8bdd6 [0,0,0,1,0,1|2,0,0]=4 2654 B17R2.35876 CC1CN(c2c1cccc2)CC(C)(C)CO a64e07ec30c0f4624477879a34900099 [0,0,0,1,0,1|1,0,0]=3 2655 B17R2.45554 CC(NCC1OCC1(C)C)c2ccccc2 76d58b1ccd0cedb22dc68e373fd3585c [0,0,0,1,0,1|2,0,0]=4 2656 B17R2.45554 CC1(OCC1NCC(O)c2ccccc2)C a1887d460213c265a8813c0ad7089562 [0,0,0,1,0,1|2,0,0]=4 2657 B17R2.45554 CC1(OCC1NC[C@@H](O)c2ccccc2)C 493048a5dc126d02dec885c6ade29cac [0,0,0,1,0,1|2,0,0]=4 2658 B17R2.45554 CC1(OCC1NC[C@H](O)c2ccccc2)C 6036017b3f9c50d1aca9f937ef170622 [0,0,0,1,0,1|2,0,0]=4 2659 B17R2.45554 C[C@@H](NCC1OCC1(C)C)c2ccccc2 fec98fd6282936a6b697de980993e3e2 [0,0,0,1,0,1|2,0,0]=4 2660 B17R2.45554 C[C@H](NCC1OCC1(C)C)c2ccccc2 b41f879ee53111b1f82791f99f819375 [0,0,0,1,0,1|2,0,0]=4 2661 B17R2.45628 CC(CN1CCC(C1)(C)C)c2ccccc2 ce9c318627b18c99df814d29d93da7e3 [0,0,0,1,0,1|2,0,0]=4 2662 B17R2.45628 CC1(CCN(C1)CC(F)c2ccccc2)C 750ab4bf6358bcd362f06e7e9ead27ef [0,0,0,1,0,1|2,0,0]=4 2663 B17R2.45628 CC1(CCN(C1)CC(O)c2ccccc2)C 38d5f9dc66eed5a544425fc9bd37240a [0,0,0,1,0,1|1,0,0]=3 2664 B17R2.45628 CC1(CCN(C1)CC(O)c2ccccc2)F 9ca426435def779c96687323455012d8 [0,0,0,1,0,1|2,0,0]=4 2665 B17R2.45628 CC1(CCN(C1)CC(O)c2ccccc2)O c52354875aa3db13b0994be305bd93d9 [0,0,0,1,0,1|2,0,0]=4 2666 B17R2.45628 CC1(CCN(C1)C[C@@H](O)c2ccccc2)C 739d4351a86a1b9f54ee48e363033d5d [0,0,0,1,0,1|1,0,0]=3 2667 B17R2.45628 CC1(CCN(C1)C[C@@H](O)c2ccccc2)F eed7e5a43c821c0d615f574d8261204e [0,0,0,1,0,1|2,0,0]=4 2668 B17R2.45628 CC1(CCN(C1)C[C@@H](O)c2ccccc2)O 5973d1a077fff16d769baa5d5cd71cbd [0,0,0,1,0,1|2,0,0]=4 2669 B17R2.45628 CC1(CCN(C1)C[C@H](O)c2ccccc2)C 2f6397d0f591373f48d991a1766325d0 [0,0,0,1,0,1|1,0,0]=3 2670 B17R2.45628 CC1(CCN(C1)C[C@H](O)c2ccccc2)F 4f861bacf4875a1d496d0cd56719ed67 [0,0,0,1,0,1|2,0,0]=4 2671 B17R2.45628 CC1(CCN(C1)C[C@H](O)c2ccccc2)O 338e9f88f293cdd2a605eee78fba20e9 [0,0,0,1,0,1|2,0,0]=4 2672 B17R2.45628 C[C@@]1(CCN(C1)CC(O)c2ccccc2)O 4982d54bb04ed38d32892bd0888898b7 [0,0,0,1,0,1|2,0,0]=4 2673 B17R2.45628 C[C@@]1(CCN(C1)C[C@@H](O)c2ccccc2)O addee79ff4984191dc1bf07e3b4fa1df [0,0,0,1,0,1|2,0,0]=4 2674 B17R2.45628 C[C@@]1(CCN(C1)C[C@H](O)c2ccccc2)O 45d1ad4943017b029213b09ca905c933 [0,0,0,1,0,1|2,0,0]=4 2675 B17R2.45628 C[C@H](CN1CCC(C1)(C)C)c2ccccc2 1d1b6de16fe99a6ca2ead13a3744b95b [0,0,0,1,0,1|2,0,0]=4 2676 B17R2.45628 C[C@]1(CCN(C1)CC(O)c2ccccc2)O c36018dbd43b31069ded29fd38047622 [0,0,0,1,0,1|2,0,0]=4 2677 B17R2.45628 C[C@]1(CCN(C1)C[C@@H](O)c2ccccc2)O 690d29b06922382e714c6066f424b994 [0,0,0,1,0,1|2,0,0]=4 2678 B17R2.45628 C[C@]1(CCN(C1)C[C@H](O)c2ccccc2)O 4e17911c98ddd5bdd48086b8c4521f62 [0,0,0,1,0,1|2,0,0]=4 2679 B17R2.243387 CC(C)(CO)CNCC1Cc2c1cccc2 9c6dce5351dbd38ae955aafd699b95d7 [0,0,0,1,0,1|1,0,0]=3 2680 B17R2.295060 CC(CCNC1(CCC1)C)c2ccccc2 b9890e6ef83fe275756c90c453f7d173 [0,0,0,1,0,1|2,0,0]=4 2681 B17R2.295060 CC(CCNC1(CSC1)C)c2ccccc2 6ba845466f2d1d3b8ffb2aadeae086eb [0,0,0,1,0,1|1,1,0]=4 2682 B17R2.295060 CC(CNCC1(CCC1)C)c2ccccc2 f9e5a38b353b6d1058e658be34018b8b [0,0,0,1,0,1|2,0,0]=4 2683 B17R2.295060 CC(CNCC1(COC1)C)c2ccccc2 848c21f0de08622249832facf2d40737 [0,0,0,1,0,1|1,0,0]=3 2684 B17R2.295060 CC(CNCC1(COC1)F)c2ccccc2 654765bbe9693acd7823f41c7410836a [0,0,0,1,0,1|2,0,0]=4 2685 B17R2.295060 CC(CNCC1(COC1)O)c2ccccc2 de86bd127824c862a0bbade72eebbdff [0,0,0,1,0,1|2,0,0]=4 2686 B17R2.295060 CC(COCC1(COC1)C)c2ccccc2 b1ba6309e8aca709106cee633c7eab12 [0,0,0,1,0,1|2,0,0]=4 2687 B17R2.295060 CC1(CCC1)CNCC(O)c2ccccc2 13b501dbf5d3087c904a2411f64feacd [0,0,0,1,0,1|1,0,0]=3 2688 B17R2.295060 CC1(CCC1)CNCC(O)c2ccccn2 c0e998ecff9e5ec05b127518dfffe9a9 [0,0,0,1,0,1|2,0,0]=4 2689 B17R2.295060 CC1(CCC1)CNCC(O)c2cccnc2 678a6a1f0fc8c9fe85b245f3221e7dc9 [0,0,0,1,0,1|2,0,0]=4 2690 B17R2.295060 CC1(CCC1)CNCC(O)c2ccncc2 e31e89435001cef3d682027b0e4a5f32 [0,0,0,1,0,1|2,0,0]=4 2691 B17R2.295060 CC1(CCC1)CNC[C@@H](O)c2ccccc2 9e64243f9f0714a25fc841c66012fbce [0,0,0,1,0,1|1,0,0]=3 2692 B17R2.295060 CC1(CCC1)CNC[C@H](O)c2ccccc2 77acaadcb7e84786f3a5c0f0342a1afc [0,0,0,1,0,1|1,0,0]=3 2693 B17R2.295060 CC1(CCC1)NCCC(O)c2ccccc2 0afa4c184764fd268b84d8a8bf520da8 [0,0,0,1,0,1|1,0,0]=3 2694 B17R2.295060 CC1(CCC1)NCC[C@@H](O)c2ccccc2 6a43c6c8a489f75f63e9a0fa0c907580 [0,0,0,1,0,1|1,0,0]=3 2695 B17R2.295060 CC1(CCC1)NCC[C@H](O)c2ccccc2 e96a4606dbb9accf22466367dd5f2a59 [0,0,0,1,0,1|1,0,0]=3 2696 B17R2.295060 CC1(CCO1)CNCC(O)c2ccccc2 aca62f0773881361ae6e0e1e758d1cd4 [0,0,0,1,0,1|2,0,0]=4 2697 B17R2.295060 CC1(COC1)CNCC(=O)c2ccccc2 19b139d9b0ae0ce1ceb31585f81bde03 [0,0,0,1,0,1|0,0,2]=4 2698 B17R2.295060 CC1(COC1)CNCC(F)c2ccccc2 95094738c0e5fd5c93f973bde5c2a9ad [0,0,0,1,0,1|1,0,0]=3 2699 B17R2.295060 CC1(COC1)CNCC(O)c2ccccc2 6fe560fbf3268c712c293a87257fa819 [0,0,0,1,0,1|0,0,0]=2 2700 B17R2.295060 CC1(COC1)CNCC(O)c2ccccn2 b458165358ef1243ada9d7f339e47df9 [0,0,0,1,0,1|1,0,0]=3 2701 B17R2.295060 CC1(COC1)CNCC(O)c2cccnc2 e012c05e8a62b7cd3ac36c30d7e22d4b [0,0,0,1,0,1|1,0,0]=3 2702 B17R2.295060 CC1(COC1)CNCC(O)c2ccncc2 7f96acd480583ceeacb6232e8bda235c [0,0,0,1,0,1|1,0,0]=3 2703 B17R2.295060 CC1(COC1)CNCC(O)c2cnccn2 36136953f8708af486621cab6c88ac09 [0,0,0,1,0,1|2,0,0]=4 2704 B17R2.295060 CC1(COC1)CNC[C@@H](O)c2ccccc2 89a002b97c2fe1b71d9f946d606d1394 [0,0,0,1,0,1|0,0,0]=2 2705 B17R2.295060 CC1(COC1)CNC[C@H](O)c2ccccc2 400949d0a078047856a6739e7b2aed11 [0,0,0,1,0,1|0,0,0]=2 2706 B17R2.295060 CC1(COC1)NCOC(=O)c2ccccc2 80125b06b65c8f7618c97af095b93525 [0,0,0,1,0,1|0,0,2]=4 2707 B17R2.295060 CC1(CSC1)NCCC(O)c2ccccc2 ac31497d8afce125c0619671a14d6c3b [0,0,0,1,0,1|0,1,0]=3 2708 B17R2.295060 CC1(CSC1)NCC[C@@H](O)c2ccccc2 ab192985b43a3e911686b586150c5789 [0,0,0,1,0,1|0,1,0]=3 2709 B17R2.295060 CC1(CSC1)NCC[C@H](O)c2ccccc2 735ea1f7a8e9087b85fd6be4ccc9b685 [0,0,0,1,0,1|0,1,0]=3 2710 B17R2.295060 CN(CCNC1(COC1)C)c2ccccc2 5a9c51cb51a38a4dfad78e1f830d2735 [0,0,0,1,0,1|2,0,0]=4 2711 B17R2.295060 C[C@@H](CNCC1(CCC1)C)c2ccccc2 0e7f1568ac5997e83572c849ace42f6f [0,0,0,1,0,1|2,0,0]=4 2712 B17R2.295060 C[C@@H](CNCC1(COC1)C)c2ccccc2 3025e2247d88aaf1aff355242a2dacd9 [0,0,0,1,0,1|1,0,0]=3 2713 B17R2.295060 C[C@@H](CNCC1(COC1)F)c2ccccc2 232495d065185964b8039c7a4ac5da87 [0,0,0,1,0,1|2,0,0]=4 2714 B17R2.295060 C[C@@H](COCC1(COC1)C)c2ccccc2 e6fadb0bb523dd2c4a3b44800148849d [0,0,0,1,0,1|2,0,0]=4 2715 B17R2.295060 C[C@H](CNCC1(CCC1)C)c2ccccc2 17aefbb6df73b27c05000425a7f6de77 [0,0,0,1,0,1|2,0,0]=4 2716 B17R2.295060 C[C@H](CNCC1(COC1)C)c2ccccc2 282617cc0ca1856bb22d28ae580f8727 [0,0,0,1,0,1|1,0,0]=3 2717 B17R2.295060 C[C@H](CNCC1(COC1)F)c2ccccc2 db608246162a5cc68f5ec1fed40b4dfd [0,0,0,1,0,1|2,0,0]=4 2718 B17R2.295060 C[C@H](CNCC1(COC1)O)c2ccccc2 8bffe3dcc7d869b86e20ad1638737ff7 [0,0,0,1,0,1|2,0,0]=4 2719 B17R2.295060 C[C@H](COCC1(COC1)C)c2ccccc2 d5da4bae03664c2a062235c8558e03b5 [0,0,0,1,0,1|2,0,0]=4 2720 B17R2.295060 C[C@]1(CCO1)CNCC(O)c2ccccc2 2630c4a05e40dd000465deeb8a09aa53 [0,0,0,1,0,1|2,0,0]=4 2721 B17R2.295060 FC(CNCC1(COC1)F)c2ccccc2 517640eafb7fa77571df30abb6edb053 [0,0,0,1,0,1|2,0,0]=4 2722 B17R2.295060 OC(CNCC1(CCC1)O)c2ccccc2 4606b30a4d9f1d1ad9b8ce94b1ba2239 [0,0,0,1,0,1|2,0,0]=4 2723 B17R2.295060 OC(CNCC1(COC1)F)c2ccccc2 1021859f4932135f7c5640d456200494 [0,0,0,1,0,1|1,0,0]=3 2724 B17R2.295060 OC(CNCC1(COC1)F)c2ccccn2 085bf647cfe9a07c972de5f5b47e151d [0,0,0,1,0,1|2,0,0]=4 2725 B17R2.295060 OC(CNCC1(COC1)F)c2cccnc2 a34cb190c6d0fa2a080c02aaf215206a [0,0,0,1,0,1|2,0,0]=4 2726 B17R2.295060 OC(CNCC1(COC1)F)c2ccncc2 1e5d4ce56c2d5f1700f08f7cdf293e37 [0,0,0,1,0,1|2,0,0]=4 2727 B17R2.295060 OC(CNCC1(COC1)O)c2ccccc2 5d0c1294ca924f451df51d70e02a2db5 [0,0,0,1,0,1|1,0,0]=3 2728 B17R2.295060 OC1(COC1)CNCC(F)c2ccccc2 c062113f76ce3969abb98b675af006bd [0,0,0,1,0,1|2,0,0]=4 2729 B17R2.295060 O[C@@H](CNCC1(CCC1)O)c2ccccc2 762a9e3daf7bbf02cce60d61baf6b039 [0,0,0,1,0,1|2,0,0]=4 2730 B17R2.295060 O[C@@H](CNCC1(COC1)F)c2ccccc2 4d36b4bf69c6a03e62eb6b554e98dd36 [0,0,0,1,0,1|1,0,0]=3 2731 B17R2.295060 O[C@H](CNCC1(CCC1)O)c2ccccc2 1c388a8f30749eb5b2d6d9e9a5d30390 [0,0,0,1,0,1|2,0,0]=4 2732 B17R2.295060 O[C@H](CNCC1(COC1)F)c2ccccc2 efbbc79d43775b2cfd5c964cb92b7e3f [0,0,0,1,0,1|1,0,0]=3 2733 B17R2.4766 CC(C)(CF)NCC1Cc2ccccc2C1 6cc8a80d8d5ee034da66a467e6eee48e [0,0,0,1,0,1|2,0,0]=4 2734 B17R2.4766 CC(C)(CF)NCc1nc2ccccc2o1 551a0f854b6455ff441f41d640923f4d [0,0,0,1,0,1|1,0,1]=4 2735 B17R2.4766 CC(C)(CO)NCC1Cc2ccccc2C1 1280d157bf5938772fa455468192c246 [0,0,0,1,0,1|1,0,0]=3 2736 B17R2.4766 CC(C)(CO)NCc1cc2ccccc2s1 5729eba169e2571ab16a255146a5207f [0,0,0,1,0,1|0,1,1]=4 2737 B17R2.4766 CC(C)(CO)NCc1nc2ccccc2[nH]1 77988fe811f22fbe97a1d960846b2ab6 [0,0,0,1,0,1|1,0,1]=4 2738 B17R2.4766 CC(C)(CO)NCc1nc2ccccc2o1 562dbe5e3ebb1ad43d1cc16b32e57d24 [0,0,0,1,0,1|0,0,1]=3 2739 B17R2.4766 CC(C)(CO)NCc1nc2ccccc2s1 2b1c867d38238f099997beccad65d3ee [0,0,0,1,0,1|0,1,1]=4 2740 B17R2.4766 CC(C)(CO)NCc1nc2ncccc2o1 21e175b4519f864c61c9dae9f2a5f0ff [0,0,0,1,0,1|1,0,1]=4 2741 B17R2.4766 CCC(C)(C)NCC1Cc2ccccc2C1 ab3e44c464cf8ac626eb12542292e505 [0,0,0,1,0,1|2,0,0]=4 2742 B17R2.4766 CCC(C)(C)NCc1nc2ccccc2o1 84c3598237d38e1e25adf19377f20248 [0,0,0,1,0,1|1,0,1]=4 2743 B17R2.13152 O=C(CNC1(CC1)CO)Cc2ccccc2 782feeb049ead1c670c1e6986c7304e1 [0,0,0,1,0,1|0,0,2]=4 2744 B17R2.13152 O=C(CNC1(CC1)CO)Nc2ccccc2 0550d1bcb4923726d4e5c59589266807 [0,0,0,1,0,1|0,0,2]=4 2745 B17R2.13152 O=C(CNC1(CC1)CO)Oc2ccccc2 3753271b125b5d4a9b58936b4a6b74cb [0,0,0,1,0,1|0,0,2]=4 2746 B17R2.76773 CC1(CCC1)NCC(O)Cc2ccccc2 0a0085d289f568bb286dac97432387bf [0,0,0,1,0,1|1,0,0]=3 2747 B17R2.76773 CC1(CCC1)NC[C@@H](O)Cc2ccccc2 67232d4b638b6059a247b135ed540f58 [0,0,0,1,0,1|1,0,0]=3 2748 B17R2.76773 CC1(COC1)NCC(=O)Cc2ccccc2 ab60ea7d4f3c950d335026cdea722abf [0,0,0,1,0,1|0,0,2]=4 2749 B17R2.76773 CC1(COC1)NCC(=O)Nc2ccccc2 5dc0747d17e203e1b7ddb8a9cb5bd0a8 [0,0,0,1,0,1|0,0,2]=4 2750 B17R2.76773 CC1(COC1)NCC(=O)Oc2ccccc2 08687d72acc176ea410eba4c5fe445cb [0,0,0,1,0,1|0,0,2]=4 2751 B17R2.76773 CC1(CSC1)NCC(O)Cc2ccccc2 dcee83af19a8d03166b71bc6cf3a414e [0,0,0,1,0,1|0,1,0]=3 2752 B17R2.76773 CC1(CSC1)NC[C@@H](O)Cc2ccccc2 1a63de458608fdd1df274f29db5491aa [0,0,0,1,0,1|0,1,0]=3 2753 B17R2.56738 CC1(CCC1)NCC(F)c2ccc(cc2)Br cc1e56c71636b69a396e633641cc98c8 [0,1,0,1,0,0|2,0,0]=4 2754 B17R2.56738 CC1(CCC1)NCC(O)c2ccc(cc2)Br 073ba4b429f2640211cbe58b7ba2b36b [0,1,0,1,0,0|1,0,0]=3 2755 B17R2.56738 CC1(CCC1)NCC(O)c2ccc(cc2)Cl f0a889401f8bb3294179c52bcce4920f [0,1,0,1,0,0|1,0,0]=3 2756 B17R2.56738 CC1(CCC1)NC[C@@H](O)c2ccc(cc2)Br 2bd0be8dacf66fd059ab153c97d0e034 [0,1,0,1,0,0|1,0,0]=3 2757 B17R2.56738 CC1(CCC1)NC[C@@H](O)c2ccc(cc2)Cl 63651a4a2a8c79ddcf1c074de2bc6a4e [0,1,0,1,0,0|1,0,0]=3 2758 B17R2.56738 CC1(CCC1)NC[C@@H](O)c2ccc(cc2)F 4ac15bc9876e346d9c88642c143cadd3 [0,1,0,1,0,0|1,0,0]=3 2759 B17R2.56738 CC1(CCC1)NC[C@H](O)c2ccc(cc2)Br 78d81fe6f7ebd125f1c8c91f60e975d0 [0,1,0,1,0,0|1,0,0]=3 2760 B17R2.56738 CC1(CCC1)NC[C@H](O)c2ccc(cc2)Cl 50b624297f43eba1de5e8fe8ed37d787 [0,1,0,1,0,0|1,0,0]=3 2761 B17R2.56738 CC1(CCC1)NC[C@H](O)c2ccc(cc2)F 3abe6466ced80b32b9e748f504a1fba3 [0,1,0,1,0,0|1,0,0]=3 2762 B17R2.56738 CC1(COC1)NCC(=O)c2ccc(cc2)Br e5cea0bccb2e60818423014cf1b85e35 [0,1,0,1,0,0|0,0,2]=4 2763 B17R2.56738 CC1(COC1)NCC(=O)c2ccc(cc2)Cl e85668ec302bafbd40ff3f1e8da8dea6 [0,1,0,1,0,0|0,0,2]=4 2764 B17R2.56738 CC1(COC1)NCC(=O)c2ccc(cc2)F 37b6008dbdc8ee78c6bc4fb75aac0ad9 [0,1,0,1,0,0|0,0,2]=4 2765 B17R2.56738 CC1(COC1)NCC(=O)c2ccc(cc2)I 14123151397ff896cb548e5e8b4067f4 [0,1,0,1,0,0|0,0,2]=4 2766 B17R2.56738 CC1(COC1)NCC(F)c2ccc(cc2)Br 149e4cb722af79bc0059fd49c97cf90c [0,1,0,1,0,0|1,0,0]=3 2767 B17R2.56738 CC1(COC1)NCC(O)c2ccc(cc2)Br ad4838066aa15dee74692c67ca3369d6 [0,1,0,1,0,0|0,0,0]=2 2768 B17R2.56738 CC1(COC1)NCC(O)c2ccc(cc2)Cl d4950d6b39f5f64a1863df1da46af758 [0,1,0,1,0,0|0,0,0]=2 2769 B17R2.56738 CC1(COC1)NC[C@@H](O)c2ccc(cc2)Br 23a6fa26c84ad5c61be4c807920f4a87 [0,1,0,1,0,0|0,0,0]=2 2770 B17R2.56738 CC1(COC1)NC[C@@H](O)c2ccc(cc2)Cl f2e5b594f3323b41646b0692a1792180 [0,1,0,1,0,0|0,0,0]=2 2771 B17R2.56738 CC1(COC1)NC[C@@H](O)c2ccc(cc2)F 5cb5d5189e4747640ab3812d96d94a6c [0,1,0,1,0,0|0,0,0]=2 2772 B17R2.56738 CC1(COC1)NC[C@H](O)c2ccc(cc2)Br b5c185077f4d9f783600e99a465fa618 [0,1,0,1,0,0|0,0,0]=2 2773 B17R2.56738 CC1(COC1)NC[C@H](O)c2ccc(cc2)Cl fb5d9509ef9f1505c398b31402ac13f0 [0,1,0,1,0,0|0,0,0]=2 2774 B17R2.56738 CC1(COC1)NC[C@H](O)c2ccc(cc2)F 7a7dbab33e9177308b2c089a47eaba40 [0,1,0,1,0,0|0,0,0]=2 2775 B17R2.56738 CC1(CSC1)NCC(F)c2ccc(cc2)Br 4bcbdb1bd1fb6d04e2a36dbf9351455e [0,1,0,1,0,0|1,1,0]=4 2776 B17R2.56738 CC1(CSC1)NCC(O)c2ccc(cc2)Br ac74c2d834aa496050ca90dce3431444 [0,1,0,1,0,0|0,1,0]=3 2777 B17R2.56738 CC1(CSC1)NCC(O)c2ccc(cc2)Cl 84e62c4ae9b1a015a9b1326e3a49271d [0,1,0,1,0,0|0,1,0]=3 2778 B17R2.56738 CC1(CSC1)NC[C@@H](O)c2ccc(cc2)Br a7b20df5272d275cc430d72a9c41245c [0,1,0,1,0,0|0,1,0]=3 2779 B17R2.56738 CC1(CSC1)NC[C@@H](O)c2ccc(cc2)Cl d8a7e61b9b8de92edc1bd56ebe311b64 [0,1,0,1,0,0|0,1,0]=3 2780 B17R2.56738 CC1(CSC1)NC[C@@H](O)c2ccc(cc2)F c54b71f41e08e9d91a9c9232f30ea4f6 [0,1,0,1,0,0|0,1,0]=3 2781 B17R2.56738 CC1(CSC1)NC[C@H](O)c2ccc(cc2)Br e8508c024ad0922473eb57132b515a2d [0,1,0,1,0,0|0,1,0]=3 2782 B17R2.56738 CC1(CSC1)NC[C@H](O)c2ccc(cc2)Cl 5ab79a5f2f7b2d14027358332f08dde5 [0,1,0,1,0,0|0,1,0]=3 2783 B17R2.56738 CC1(CSC1)NC[C@H](O)c2ccc(cc2)F 09714dc02d1787da24fba131256f256a [0,1,0,1,0,0|0,1,0]=3 2784 B17R2.56738 Cc1ccc(cc1)C(=O)CNC2(COC2)C 6b8eba603bd518d22c83266eb1ebb177 [0,1,0,1,0,0|0,0,2]=4 2785 B17R2.56738 Cc1ccc(cc1)[C@H](O)CNC2(CCC2)C f424e8730fa412ddeb1c44789325f91b [0,1,0,1,0,0|1,0,0]=3 2786 B17R2.56738 Cc1ccc(cc1)[C@H](O)CNC2(COC2)C a78aa3150788ba32f3e00a76b75a8d04 [0,1,0,1,0,0|0,0,0]=2 2787 B17R2.56738 Cc1ccc(cc1)[C@H](O)CNC2(CSC2)C c13cc4c4e6090d5de3ea1803766e55f8 [0,1,0,1,0,0|0,1,0]=3 2788 B17R2.110957 C#CC1(CC1)NCC(O)c2ccc(cc2)Br c789eb58a08bce411acec1e9aa947a3f [0,1,0,1,0,0|1,0,1]=4 2789 B17R2.110957 C#CC1(CC1)NCC(O)c2ccc(cc2)Cl abd03f000974d0e525d2476295346491 [0,1,0,1,0,0|1,0,1]=4 2790 B17R2.110957 C#CC1(CC1)NC[C@@H](O)c2ccc(cc2)Br 2d84eb5372ee1a909295d7b1b8834a86 [0,1,0,1,0,0|1,0,1]=4 2791 B17R2.110957 C#CC1(CC1)NC[C@@H](O)c2ccc(cc2)C 6871b01b07403f1afe74176c72359c88 [0,1,0,1,0,0|1,0,1]=4 2792 B17R2.110957 C#CC1(CC1)NC[C@@H](O)c2ccc(cc2)F c3eb9ced1b84d1f4fd34686226287805 [0,1,0,1,0,0|1,0,1]=4 2793 B17R2.110957 C#CC1(CC1)NC[C@H](O)c2ccc(cc2)Br b7a6bfa0baf805830a0c22acf9d7c74f [0,1,0,1,0,0|1,0,1]=4 2794 B17R2.110957 C#CC1(CC1)NC[C@H](O)c2ccc(cc2)Cl 8b43f50bb2d41ffe7560e103c7130ddc [0,1,0,1,0,0|1,0,1]=4 2795 B17R2.110957 C#CC1(CC1)NC[C@H](O)c2ccc(cc2)F 813072f52be9aae0a59e28a580d51016 [0,1,0,1,0,0|1,0,1]=4 2796 B17R2.110957 Cc1ccc(cc1)C(=O)CNC2(CC2)CO 571e745b3d2a535ab4198731f027f5d8 [0,1,0,1,0,0|0,0,2]=4 2797 B17R2.110957 Cc1ccc(cc1)[C@H](O)CNC2(CC2)C#N 1dab730b0ca54d72822d986ab13d7c9a [0,1,0,1,0,0|1,0,1]=4 2798 B17R2.110957 Cc1ccc(cc1)[C@H](O)CNC2(CC2)CO e6a96f35671d15a1e020beb192427469 [0,1,0,1,0,0|0,0,0]=2 2799 B17R2.110957 N#CC1(CC1)NCC(O)c2ccc(cc2)Br 9ebb0010e51c6b77719ba102d1df675e [0,1,0,1,0,0|1,0,1]=4 2800 B17R2.110957 N#CC1(CC1)NCC(O)c2ccc(cc2)Cl 059f0ebd77fb67f75167ebfb18a94e9e [0,1,0,1,0,0|1,0,1]=4 2801 B17R2.110957 N#CC1(CC1)NC[C@@H](O)c2ccc(cc2)Br 9450121c21145430f0d18b2dc7742db2 [0,1,0,1,0,0|1,0,1]=4 2802 B17R2.110957 N#CC1(CC1)NC[C@@H](O)c2ccc(cc2)F a665b832270cb5277fb53c6dab49b169 [0,1,0,1,0,0|1,0,1]=4 2803 B17R2.110957 N#CC1(CC1)NC[C@H](O)c2ccc(cc2)Br 028ebb4d20a3082943a159772396d1f1 [0,1,0,1,0,0|1,0,1]=4 2804 B17R2.110957 N#CC1(CC1)NC[C@H](O)c2ccc(cc2)Cl 214ccdd234ccf30223251dd229df607b [0,1,0,1,0,0|1,0,1]=4 2805 B17R2.110957 N#CC1(CC1)NC[C@H](O)c2ccc(cc2)F 90f9179036a5f2d83c571e9b6264d074 [0,1,0,1,0,0|1,0,1]=4 2806 B17R2.110957 O=C(CNC1(CC1)CO)c2ccc(cc2)Br 284a79b6a98ef4c55ceea014f1d9e5ad [0,1,0,1,0,0|0,0,2]=4 2807 B17R2.110957 O=C(CNC1(CC1)CO)c2ccc(cc2)Cl 7181df9876f0f56c692112f6442bccf6 [0,1,0,1,0,0|0,0,2]=4 2808 B17R2.110957 O=C(CNC1(CC1)CO)c2ccc(cc2)F 69b2b0e9af236fcdcff7933ba63f00d2 [0,1,0,1,0,0|0,0,2]=4 2809 B17R2.110957 O=C(CNC1(CC1)CO)c2ccc(cc2)I 026b108cc2994e14a0c5af907c6c2d3b [0,1,0,1,0,0|0,0,2]=4 2810 B17R2.110957 OCC1(CC1)NCC(F)c2ccc(cc2)Br 973c290310925f57a96402ef14d3b4f5 [0,1,0,1,0,0|1,0,0]=3 2811 B17R2.110957 OCC1(CC1)NCC(O)c2ccc(cc2)Br 3d4a699188bf30c7fe9e4487f2021067 [0,1,0,1,0,0|0,0,0]=2 2812 B17R2.110957 OCC1(CC1)NCC(O)c2ccc(cc2)Cl 06288d0d2ecc1350293b4228add9f78f [0,1,0,1,0,0|0,0,0]=2 2813 B17R2.110957 OCC1(CC1)NC[C@@H](O)c2ccc(cc2)Br 68601074fd58edebdeb35f66e683c311 [0,1,0,1,0,0|0,0,0]=2 2814 B17R2.110957 OCC1(CC1)NC[C@@H](O)c2ccc(cc2)Cl 3a21a8cbb906292a30427ff344f6ec7e [0,1,0,1,0,0|0,0,0]=2 2815 B17R2.110957 OCC1(CC1)NC[C@@H](O)c2ccc(cc2)F 54e01a2b564c2689b70416b2939bc99f [0,1,0,1,0,0|0,0,0]=2 2816 B17R2.110957 OCC1(CC1)NC[C@H](O)c2ccc(cc2)Br 32a2401cb3374e47d3dbf59c9bda886b [0,1,0,1,0,0|0,0,0]=2 2817 B17R2.110957 OCC1(CC1)NC[C@H](O)c2ccc(cc2)Cl d89f3e0d9109063aa51a7a08f5e95efd [0,1,0,1,0,0|0,0,0]=2 2818 B17R2.110957 OCC1(CC1)NC[C@H](O)c2ccc(cc2)F cffd5d012695bfc8cdb3af1a8dafd7b4 [0,1,0,1,0,0|0,0,0]=2 2819 B17R2.13151 C#CC1(CC1)NC[C@H](O)c2cccc(c2)Cl c21aa720f780201fc5837aedd2def21a [0,1,0,1,0,0|1,0,1]=4 2820 B17R2.13151 Cc1cccc(c1)C(=O)CNC2(CC2)CO e753f36c49071e065bc25c6dcb6f67db [0,1,0,1,0,0|0,0,2]=4 2821 B17R2.13151 N#CC1(CC1)NC[C@H](O)c2cccc(c2)Cl 5989c25079ef2476f9bde31ad0d3438f [0,1,0,1,0,0|1,0,1]=4 2822 B17R2.13151 O=C(CNC1(CC1)CO)c2cccc(c2)Br 11b1c5c09438f59f769162a2855b4962 [0,1,0,1,0,0|0,0,2]=4 2823 B17R2.13151 O=C(CNC1(CC1)CO)c2cccc(c2)Cl abb61d6fbe5fc5dc8061359f3ee93af9 [0,1,0,1,0,0|0,0,2]=4 2824 B17R2.13151 O=C(CNC1(CC1)CO)c2cccc(c2)F 8a1e345bc69ef414db7e679c9e59be36 [0,1,0,1,0,0|0,0,2]=4 2825 B17R2.13151 O=C(CNC1(CC1)CO)c2cccc(c2)I 2a004250a4af31641904fd940dfe47e9 [0,1,0,1,0,0|0,0,2]=4 2826 B17R2.13151 OCC1(CC1)NCC(O)c2cccc(c2)Cl d003c89db6d90fed14443939128f1b88 [0,1,0,1,0,0|0,0,0]=2 2827 B17R2.13151 OCC1(CC1)NC[C@H](O)c2cccc(c2)Cl 059b4332063ec181534af620f3848787 [0,1,0,1,0,0|0,0,0]=2 2828 B17R2.150384 CC1(CCC1)NCC(O)c2cccc(c2)Cl a97bf5f370821b30e0013c3171aac9fc [0,1,0,1,0,0|1,0,0]=3 2829 B17R2.150384 CC1(CCC1)NC[C@@H](O)c2cccc(c2)Br 68a168369b33b488ad66559f863d636d [0,1,0,1,0,0|1,0,0]=3 2830 B17R2.150384 CC1(CCC1)NC[C@H](O)c2cccc(c2)Cl c63e50430e716d2d550ce664b2e33cc3 [0,1,0,1,0,0|1,0,0]=3 2831 B17R2.150384 CC1(COC1)NCC(=O)c2cccc(c2)Br bf295c2bc81f6681d01b97e2fc0ccffa [0,1,0,1,0,0|0,0,2]=4 2832 B17R2.150384 CC1(COC1)NCC(=O)c2cccc(c2)Cl 9db08bfd319832198acd7ef677bc0850 [0,1,0,1,0,0|0,0,2]=4 2833 B17R2.150384 CC1(COC1)NCC(=O)c2cccc(c2)F ba1b98c1a98a1d09b14c42138ae19c3e [0,1,0,1,0,0|0,0,2]=4 2834 B17R2.150384 CC1(COC1)NCC(=O)c2cccc(c2)I 1b704e5bc350af9fe77f93536fbf4f21 [0,1,0,1,0,0|0,0,2]=4 2835 B17R2.150384 CC1(COC1)NCC(O)c2cccc(c2)Cl 7ede4f1a3689a2389747dcc80e8c2740 [0,1,0,1,0,0|0,0,0]=2 2836 B17R2.150384 CC1(COC1)NC[C@H](O)c2cccc(c2)Cl 197b615b5e50050e5b0e81ac23f2d15e [0,1,0,1,0,0|0,0,0]=2 2837 B17R2.150384 CC1(CSC1)NCC(O)c2cccc(c2)Cl c1fa1b463f5ebcd110042475ac9be00c [0,1,0,1,0,0|0,1,0]=3 2838 B17R2.150384 CC1(CSC1)NC[C@@H](O)c2cccc(c2)Br 8edeb0f47bd55798f1ac118eb4432105 [0,1,0,1,0,0|0,1,0]=3 2839 B17R2.150384 CC1(CSC1)NC[C@H](O)c2cccc(c2)Cl a8609a72dc81c6d689312afda4c28ab5 [0,1,0,1,0,0|0,1,0]=3 2840 B17R2.150384 Cc1cccc(c1)C(=O)CNC2(COC2)C 3db0b26a0c92973de103606d396be57f [0,1,0,1,0,0|0,0,2]=4 2841 B17R2.5730 CC(CN1CCCC1(C)C)c2ccccc2 fc342f1453a29b0cd07bf5fea4af2661 [0,1,0,1,0,0|2,0,0]=4 2842 B17R2.5730 CC(CN1CCOC1(C)C)c2ccccc2 c2d957606e0a7632c2bd52d3a2f2e7b1 [0,1,0,1,0,0|2,0,0]=4 2843 B17R2.5730 CC(CN1CCSC1(C)C)c2ccccc2 6e502402dba05ae8d73152b2e5eb24c0 [0,1,0,1,0,0|2,0,0]=4 2844 B17R2.5730 CC(CN1COCC1(C)C)c2ccccc2 b7c94ed98761f5ee0af7c1bb20e4d2b2 [0,1,0,1,0,0|1,0,0]=3 2845 B17R2.5730 CC1(CCCN1CC(O)c2ccccc2)C ebdd60170e4f906e3482df071bdcd015 [0,1,0,1,0,0|1,0,0]=3 2846 B17R2.5730 CC1(CCCN1C[C@@H](O)c2ccccc2)C 405cecb6ad8979b50a23d806ffbe9774 [0,1,0,1,0,0|1,0,0]=3 2847 B17R2.5730 CC1(CCCN1C[C@H](O)c2ccccc2)C 164a22ad5400507b8c8b0825cc907593 [0,1,0,1,0,0|1,0,0]=3 2848 B17R2.5730 CC1(COCN1CC(=O)c2ccccc2)C c74c3ef0e120bbef1562264d7da82bd5 [0,1,0,1,0,0|0,0,2]=4 2849 B17R2.5730 CC1(COCN1CC(F)c2ccccc2)C 9513b97fff724db1955fb3ca62a6b73e [0,1,0,1,0,0|1,0,0]=3 2850 B17R2.5730 CC1(COCN1CC(O)c2ccccc2)C 574959d60a3248879a93a6b2ae637381 [0,1,0,1,0,0|0,0,0]=2 2851 B17R2.5730 CC1(COCN1CC(O)c2cnccn2)C 46cdd95f8564d441473fb43f8f405c11 [0,1,0,1,0,0|2,0,0]=4 2852 B17R2.5730 CC1(COCN1C[C@@H](O)c2ccccc2)C 52d1cc7125dc192d2b1ce82b100afd28 [0,1,0,1,0,0|0,0,0]=2 2853 B17R2.5730 CC1(COCN1C[C@H](O)c2ccccc2)C 4acdee09faac6f0271483072bc83bb18 [0,1,0,1,0,0|0,0,0]=2 2854 B17R2.5730 CC1(OCCN1CC(F)c2ccccc2)C e293500c4cdf5546c2f18a6151f11f6c [0,1,0,1,0,0|2,0,0]=4 2855 B17R2.5730 CC1(OCCN1CC(O)c2ccccc2)C 9808e5473f6f4fcaf78f076429f19f24 [0,1,0,1,0,0|1,0,0]=3 2856 B17R2.5730 CC1(OCCN1C[C@@H](O)c2ccccc2)C 8ea70dd1f1123d753c6a3082567f4d96 [0,1,0,1,0,0|1,0,0]=3 2857 B17R2.5730 CC1(OCCN1C[C@H](O)c2ccccc2)C 102b58b7d0b34d318d2073ed6ef2023b [0,1,0,1,0,0|1,0,0]=3 2858 B17R2.5730 CC1(SCCN1CC(F)c2ccccc2)C 0accb9e92d25781e77256ff88ec0b23d [0,1,0,1,0,0|2,0,0]=4 2859 B17R2.5730 CC1(SCCN1CC(O)c2ccccc2)C 4aeff13e48136dc54f96e4ce0f16281d [0,1,0,1,0,0|1,0,0]=3 2860 B17R2.5730 CC1(SCCN1C[C@@H](O)c2ccccc2)C 6e3a747de96dc63540ddd3c98dd61f29 [0,1,0,1,0,0|1,0,0]=3 2861 B17R2.5730 CC1(SCCN1C[C@H](O)c2ccccc2)C bfeb27cb05c3720f0535c29770007499 [0,1,0,1,0,0|1,0,0]=3 2862 B17R2.5730 C[C@H](CN1CCCC1(C)C)c2ccccc2 4247f3e7583aaf5f865f24e19f42038f [0,1,0,1,0,0|2,0,0]=4 2863 B17R2.5730 C[C@H](CN1CCOC1(C)C)c2ccccc2 ca0e70a4c5234f77f9f3511ce2357a88 [0,1,0,1,0,0|2,0,0]=4 2864 B17R2.5730 C[C@H](CN1CCSC1(C)C)c2ccccc2 261fa7e2efa1257758ee62b969e72735 [0,1,0,1,0,0|2,0,0]=4 2865 B17R2.5730 C[C@H](CN1COCC1(C)C)c2ccccc2 afbd99638dac591ca314ae55d972e683 [0,1,0,1,0,0|1,0,0]=3 2866 B17R2.12913 CN(CC(O)c1ccccc1)C2(CC2)C#N 08ca625cb93aa2d03c2d84c1da11504f [0,1,0,1,0,0|1,0,1]=4 2867 B17R2.12913 CN(C[C@@H](O)c1ccccc1)C2(CC2)C#N c901688f14a3df8df261f5403edc392d [0,1,0,1,0,0|1,0,1]=4 2868 B17R2.12913 CN(C[C@H](O)c1ccccc1)C2(CC2)C#N 3f8422961df88606299a5d912e91d553 [0,1,0,1,0,0|1,0,1]=4 2869 B17R2.145696 CC(CN(C)C1(COC1)C)c2ccccc2 a64249c5812373c05ca75639eb4d1d04 [0,1,0,1,0,0|1,0,0]=3 2870 B17R2.145696 CN(CC(=O)c1ccccc1)C2(COC2)C 13fcf5db1e2eeea36f12266d27fca6b7 [0,1,0,1,0,0|0,0,2]=4 2871 B17R2.145696 CN(CC(O)c1ccccc1)C2(COC2)C c0592123e3766747acb6b414e868fa14 [0,1,0,1,0,0|0,0,0]=2 2872 B17R2.145696 CN(CC(O)c1cnccn1)C2(COC2)C f70217e77e0d92df70884b7742f6dc8a [0,1,0,1,0,0|2,0,0]=4 2873 B17R2.145696 C[C@H](CN(C)C1(COC1)C)c2ccccc2 19cbd9b64918b49c10660bfc26506313 [0,1,0,1,0,0|1,0,0]=3 2874 B17R2.4754 C#CC(C)(C)NC1Cc2ccccc2C1O c0ca394156c8d8c927f1b2560574caa3 [0,1,0,1,0,0|1,0,1]=4 2875 B17R2.4754 C#CC(C)(C)N[C@@H]1Cc2ccccc2[C@@H]1O 8369fc2e5e951113399e9ad3a9b19345 [0,1,0,1,0,0|1,0,1]=4 2876 B17R2.4754 C#CC(C)(C)N[C@H]1Cc2ccccc2[C@@H]1O 8f8ee535a2397bfdd113747853929613 [0,1,0,1,0,0|1,0,1]=4 2877 B17R2.4754 CC(C)(C#N)NC1Cc2ccccc2C1O 5f7cf6a2fafd327e9f18b41b0f9ca333 [0,1,0,1,0,0|1,0,1]=4 2878 B17R2.4754 CC(C)(C#N)N[C@@H]1Cc2ccccc2[C@@H]1O 7826f8ff0c2fe6c30ec0bdc909c5cbaf [0,1,0,1,0,0|1,0,1]=4 2879 B17R2.4754 CC(C)(C#N)N[C@H]1Cc2ccccc2[C@@H]1O fd9465dfc1dc694a9c9284ba31164395 [0,1,0,1,0,0|1,0,1]=4 2880 B17R2.4754 CC(C)(CO)NC1Cc2ccccc2C1=O 500d242b722c3cea7af9c83c3700c4fa [0,1,0,1,0,0|0,0,2]=4 2881 B17R2.4754 CC(C)(CO)NC1Cc2ccccc2C1O 5db94c2166f11eb451f940a290dfc489 [0,1,0,1,0,0|0,0,0]=2 2882 B17R2.4754 CC(C)(CO)N[C@@H]1Cc2ccccc2[C@@H]1O 461713f76a6b5f329bbd57890884a0d4 [0,1,0,1,0,0|0,0,0]=2 2883 B17R2.4754 CC(C)(CO)N[C@H]1Cc2ccccc2[C@@H]1O d2e5c0321948ef52ff6f1e95c84ad930 [0,1,0,1,0,0|0,0,0]=2 2884 B17R2.12917 O=C(NC1(CC1)CO)C(O)c2cccnc2 7cde43280717d6fa1b5b8567274084b0 [0,1,0,1,0,0|1,0,1]=4 2885 B17R2.12917 O=C(NC1(CC1)CO)C(O)c2ccncc2 d53cc46a1fe8e7281d794432f423f3c8 [0,1,0,1,0,0|1,0,1]=4 2886 B17R2.45658 CC1(COC1)NC(=O)C(O)c2ccncc2 46de8428f556af855515f82248cf2a88 [0,1,0,1,0,0|1,0,1]=4 2887 B17R2.45658 CC1(CSC1)NC(=O)C(O)c2ccccc2 dd1fb4b51b52a4559cfa1dcf01789ac8 [0,1,0,1,0,0|0,1,1]=4 2888 B17R2.45658 CC1(CSC1)NC(=O)[C@@H](O)c2ccccc2 b1e191e01736df21f34eca7200302b72 [0,1,0,1,0,0|0,1,1]=4 2889 B17R2.45658 CC1(CSC1)NC(=O)[C@H](O)c2ccccc2 1e0732b386afc5ef49fb1c929165deab [0,1,0,1,0,0|0,1,1]=4 2890 B17R2.869414 CC(C)(CO)NC(=O)C1Cc2c1cccc2 a68b7208f4342694f7730b74f031bc48 [0,1,0,1,0,0|1,0,1]=4 2891 B17R2.12809 C#CC1(CCC1)NCC(O)c2ccccc2 cf5e6a7ae8484119beade60a88e0c11f [0,1,0,1,0,0|1,0,1]=4 2892 B17R2.12809 C#CC1(CCC1)NC[C@@H](O)c2ccccc2 ddb4fe01791cf1bc8865dc627883bd4d [0,1,0,1,0,0|1,0,1]=4 2893 B17R2.12809 C#CC1(CCC1)NC[C@H](O)c2ccccc2 1f223f25b268fec3cce5de9fc02a2d20 [0,1,0,1,0,0|1,0,1]=4 2894 B17R2.12809 CC(CNC1(CCC1)CO)c2ccccc2 197bce138224f6b6a279a5afcd69c408 [0,1,0,1,0,0|1,0,0]=3 2895 B17R2.12809 CC(CNC1(COC1)C#N)c2ccccc2 d279ddc92cee40d1968e42d147b5b6f9 [0,1,0,1,0,0|1,0,1]=4 2896 B17R2.12809 CCC1(CCC1)NCC(O)c2ccccc2 83a2039f8edd82d36e4ba056eb1027e9 [0,1,0,1,0,0|1,0,0]=3 2897 B17R2.12809 CCC1(COC1)NCC(O)c2cnccn2 1139f26fd76ade0fffb32d74288ad57e [0,1,0,1,0,0|2,0,0]=4 2898 B17R2.12809 C[C@H](CNC1(CCC1)CO)c2ccccc2 5cb4f7b6c865d92f96af096c7a15be91 [0,1,0,1,0,0|1,0,0]=3 2899 B17R2.12809 C[C@H](CNC1(COC1)C#N)c2ccccc2 7693b4b4eb93843e76f80e683f3a70df [0,1,0,1,0,0|1,0,1]=4 2900 B17R2.12809 N#CC1(CCC1)NCC(O)c2ccccc2 3221149c489df3c217cb10e0e7ad60af [0,1,0,1,0,0|1,0,1]=4 2901 B17R2.12809 N#CC1(COC1)NCC(O)c2ccccc2 85e567d3ce1f44b7da4ddb5e8c40d495 [0,1,0,1,0,0|0,0,1]=3 2902 B17R2.12809 O=C(CNC1(CCC1)CO)c2ccccc2 ddde7871ff95662d8d2d2143ab09b9d1 [0,1,0,1,0,0|0,0,2]=4 2903 B17R2.12809 O=C(CNC1(COC1)CO)c2ccccc2 3d0a4f5637529241b3f3b0eab49bc0a7 [0,1,0,1,0,0|0,0,2]=4 2904 B17R2.12809 OCC1(CCC1)NCC(F)c2ccccc2 7bd11d7d77b658ecda91eaa284676d87 [0,1,0,1,0,0|1,0,0]=3 2905 B17R2.12809 OCC1(CCC1)NCC(O)c2ccccc2 64590bcde4bd722c5536666dc38d627f [0,1,0,1,0,0|0,0,0]=2 2906 B17R2.12809 OCC1(CCC1)NCC(O)c2cnccn2 612ca71b77ee3831f8505030083f6f5a [0,1,0,1,0,0|2,0,0]=4 2907 B17R2.12809 OCC1(CCC1)NC[C@@H](O)c2ccccc2 2acd4111994224ae416b11da16499f28 [0,1,0,1,0,0|0,0,0]=2 2908 B17R2.12809 OCC1(CCC1)NC[C@H](O)c2ccccc2 fa6428fb5173c8fde40c3d31e3d25724 [0,1,0,1,0,0|0,0,0]=2 2909 B17R2.12809 OCC1(COC1)NCC(O)c2ccccc2 f8876326f7a0dba024dbcf87ebfd9fd9 [0,1,0,1,0,0|0,0,0]=2 2910 B17R2.12809 OCC1(COC1)NCC(O)c2cnccn2 9ed88d514cd261de308b9bcaf15b3335 [0,1,0,1,0,0|2,0,0]=4 2911 B17R2.295596 CC(CNC1(CC=CC1)C)c2ccccc2 eee7ad0203f502d1e7abf404caec0004 [0,1,0,1,0,0|2,0,0]=4 2912 B17R2.295596 CC(CNC1(CCCC1)C)c2ccccc2 d8144d34f32a5e9ffda9ed63abcd4619 [0,1,0,1,0,0|2,0,0]=4 2913 B17R2.295596 CC(CNC1(CCOC1)C)c2ccccc2 a065424ed345f4cad9348fd06f7c96af [0,1,0,1,0,0|1,0,0]=3 2914 B17R2.295596 CC1(CC=CC1)NCC(F)c2ccccc2 1520f3007b949adf843b1d3919425b2e [0,1,0,1,0,0|2,0,0]=4 2915 B17R2.295596 CC1(CC=CC1)NCC(O)c2ccccc2 6d5f4d8712613a0cd5cb80c25bb7f01a [0,1,0,1,0,0|1,0,0]=3 2916 B17R2.295596 CC1(CC=CC1)NC[C@@H](O)c2ccccc2 5cc263806d3a236b636267c035eb69ef [0,1,0,1,0,0|1,0,0]=3 2917 B17R2.295596 CC1(CC=CC1)NC[C@H](O)c2ccccc2 fa9035aca215042718e4a94795c0e9d3 [0,1,0,1,0,0|1,0,0]=3 2918 B17R2.295596 CC1(CCCC1)NCC(F)c2ccccc2 ca0409ff31a2b041778b179d3e37f91d [0,1,0,1,0,0|2,0,0]=4 2919 B17R2.295596 CC1(CCCC1)NCC(O)c2ccccc2 ed7537952b16092d6e638c3ea1f6b75a [0,1,0,1,0,0|1,0,0]=3 2920 B17R2.295596 CC1(CCCC1)NC[C@@H](O)c2ccccc2 96fdf8fb51236bcab7d140072f65a4d6 [0,1,0,1,0,0|1,0,0]=3 2921 B17R2.295596 CC1(CCCC1)NC[C@H](O)c2ccccc2 c53e9d78fb01f403386d725dcad21282 [0,1,0,1,0,0|1,0,0]=3 2922 B17R2.295596 CC1(CCOC1)NCC(=O)c2ccccc2 0a45a3f02969549725fac0d464d33600 [0,1,0,1,0,0|0,0,2]=4 2923 B17R2.295596 CC1(CCOC1)NCC(F)c2ccccc2 b85a234f077e5ba88908661c93deee2a [0,1,0,1,0,0|1,0,0]=3 2924 B17R2.295596 CC1(CCOC1)NCC(O)c2ccccc2 cabf8cedbad246adddf6e1290c15a0ec [0,1,0,1,0,0|0,0,0]=2 2925 B17R2.295596 CC1(CCOC1)NCC(O)c2cnccn2 d99a4eb977742a08d2e9bae5576687dc [0,1,0,1,0,0|2,0,0]=4 2926 B17R2.295596 C[C@H](CNC1(CC=CC1)C)c2ccccc2 dfc2b62a68f4eacbd6e9fc79e0c71f40 [0,1,0,1,0,0|2,0,0]=4 2927 B17R2.295596 C[C@H](CNC1(CCCC1)C)c2ccccc2 a32afa7bfef69120ddc3deccf664a4f3 [0,1,0,1,0,0|2,0,0]=4 2928 B17R2.295596 C[C@H](CNC1(CCOC1)C)c2ccccc2 08a978358dc975eedfe5072a8291e3d9 [0,1,0,1,0,0|1,0,0]=3 2929 B17R2.35844 CC(C)(CO)NCC1(CC1)c2ccccc2 4fa85fc53d8a6777949ddf23eafe124f [0,1,0,1,0,0|1,0,0]=3 2930 B17R2.110938 CC(C)(CNC1(CC1)CO)c2ccccc2 9a8466c469579a8c40888cb83393c6db [0,1,0,1,0,0|1,0,0]=3 2931 B17R2.110938 O=S(=O)(CNC1(CC1)CO)c2ccccc2 7910d0a2f6a7c6afa3c851ff62b310fb [0,1,0,1,0,0|1,0,1]=4 2932 B17R2.110938 OCC1(CC1)NCC(F)(F)c2ccccc2 6c865b5d3b08ef4c99c1e17314177ea1 [0,1,0,1,0,0|1,0,0]=3 2933 B17R2.156819 CC1(CCC1)NCC(C)(C)c2ccccc2 eff3ce679a9e3aa5373162f8a5e89616 [0,1,0,1,0,0|2,0,0]=4 2934 B17R2.156819 CC1(CCC1)NCC(F)(F)c2ccccc2 1fabfdb0fc3b36bfcbb8a3af42448481 [0,1,0,1,0,0|2,0,0]=4 2935 B17R2.156819 CC1(COC1)NCC(F)(F)c2ccccc2 bb37ee3671d01531889480ae5a9db0ac [0,1,0,1,0,0|1,0,0]=3 2936 B17R2.156819 CC1(COC1)NCS(=O)(=O)c2ccccc2 e3111a46a0224f46d1b97dbdad7aba1d [0,1,0,1,0,0|1,0,1]=4 2937 B17R2.156819 CC1(CSC1)NCC(C)(C)c2ccccc2 32e7b3027a006c7b719d0312ba1cd46d [0,1,0,1,0,0|1,1,0]=4 2938 B17R2.156819 CC1(CSC1)NCC(F)(F)c2ccccc2 ed22bfda883090c2ccc890980b98d2f6 [0,1,0,1,0,0|1,1,0]=4 2939 B17R2.95 C#CC(C)(C)NCC1COc2c1cccc2 c8481c8cb060bbf1036d4bf5ca907c41 [0,1,0,1,0,0|1,0,1]=4 2940 B17R2.95 CC(C)(C#N)NCC1COc2c1cccc2 3f07dc4958d155178507ea921659badb [0,1,0,1,0,0|1,0,1]=4 2941 B17R2.95 CC(C)(CF)NCC1COc2c1cccc2 90817cf3d8e9a3e4e3e8edb594c05d35 [0,1,0,1,0,0|1,0,0]=3 2942 B17R2.95 CC(C)(CF)NCc1coc2c1cccc2 c4d6745781bc6b6901f850104ea051db [0,1,0,1,0,0|1,0,1]=4 2943 B17R2.95 CC(C)(CF)NCc1noc2c1cccc2 74ceaf183b249dce5d6f221d354329e8 [0,1,0,1,0,0|1,0,1]=4 2944 B17R2.95 CC(C)(CO)CNC1COc2c1cccc2 3d164afe7360d59dda4d7a035b7ff2ab [0,1,0,1,0,0|2,0,0]=4 2945 B17R2.95 CC(C)(CO)CN[C@@H]1COc2c1cccc2 2f05026a0e01d6b4b63412360fb32824 [0,1,0,1,0,0|2,0,0]=4 2946 B17R2.95 CC(C)(CO)CN[C@H]1COc2c1cccc2 0fcb1d07b3a68fa7f0a1918a6c8a1def [0,1,0,1,0,0|2,0,0]=4 2947 B17R2.95 CC(C)(CO)NCC1COc2c1cccc2 e1abeb4eceee22d8bff384ebdc16bf84 [0,1,0,1,0,0|0,0,0]=2 2948 B17R2.95 CC(C)(CO)NCc1coc2c1cccc2 2b88d079f5dc3a8a7b3b0248b4aaa67c [0,1,0,1,0,0|0,0,1]=3 2949 B17R2.95 CC(C)(CO)NCc1csc2c1cccc2 9b01e582e7135c78eae2cd56f75fa211 [0,1,0,1,0,0|0,1,1]=4 2950 B17R2.95 CC(C)(CO)NCc1noc2c1cccc2 1ec03d5576acb676a96e5b56acd776a3 [0,1,0,1,0,0|0,0,1]=3 2951 B17R2.95 CC(C)(CO)NCc1noc2c1cccn2 a423d0e774dc9c08eaa47fbc0db44bc7 [0,1,0,1,0,0|1,0,1]=4 2952 B17R2.95 CC(C)(CO)NCn1nnc2c1cccc2 fa2af8c1dfad1c24bcd701fc5ff4e39f [0,1,0,1,0,0|2,0,0]=4 2953 B17R2.95 CCC(C)(C)NCc1noc2c1cccc2 0f9d663497032ebfc249e5639e813bbd [0,1,0,1,0,0|1,0,1]=4 2954 B17R2.111367 Cc1ccccc1C(=O)CNC2(CC2)CO f5c7a474312e8c37663b6a23e09b10c0 [0,1,0,1,0,0|0,0,2]=4 2955 B17R2.111367 O=C(CNC1(CC1)CO)c2ccccc2Cl e6ed4f4c28bbca863036af0882d80b78 [0,1,0,1,0,0|0,0,2]=4 2956 B17R2.111367 O=C(CNC1(CC1)CO)c2ccccc2F a6123e49eceb766fc62d3d5b07d8566c [0,1,0,1,0,0|0,0,2]=4 2957 B17R2.111367 O=C(CNC1(CC1)CO)c2ccccc2I 3fd4e9b1a4dded4965dea0d3e2c20262 [0,1,0,1,0,0|0,0,2]=4 2958 B17R2.181377 CC1(CCC1)NCC(O)c2ccccc2Cl 219f8aa89f8fef2334353df162e203ea [0,1,0,1,0,0|1,0,0]=3 2959 B17R2.181377 CC1(COC1)NCC(=O)c2ccccc2Br 381341c81399fc12906f8d9407b92156 [0,1,0,1,0,0|0,0,2]=4 2960 B17R2.181377 CC1(COC1)NCC(=O)c2ccccc2Cl eece1a98bf564ff018f61a8836b7c12d [0,1,0,1,0,0|0,0,2]=4 2961 B17R2.181377 CC1(COC1)NCC(=O)c2ccccc2F 252339ffa664bb2135834c7cce3dde23 [0,1,0,1,0,0|0,0,2]=4 2962 B17R2.181377 CC1(COC1)NCC(=O)c2ccccc2I 500deec8c68a4e6ee2dfb215e045ed86 [0,1,0,1,0,0|0,0,2]=4 2963 B17R2.181377 CC1(COC1)NCC(O)c2ccccc2Cl 113068171620e2138c7888f97aa80449 [0,1,0,1,0,0|0,0,0]=2 2964 B17R2.181377 CC1(CSC1)NCC(O)c2ccccc2Cl 52d93dcfdd586d16e87fb27b28fc2bba [0,1,0,1,0,0|0,1,0]=3 2965 B17R2.181377 Cc1ccccc1C(=O)CNC2(COC2)C e8677a556683c20f7801422ae703a291 [0,1,0,1,0,0|0,0,2]=4 2966 B17R2.45352 CC(CNC1(CC1)C(=O)O)c2ccccc2 fa88e9da5ae448ba663ac42415843ab5 [0,1,0,1,0,0|1,0,1]=4 2967 B17R2.45352 CC(CNC1(CC1)C(C)O)c2ccccc2 7b1e36cde13a5ac0574766276e00ded6 [0,1,0,1,0,0|1,0,0]=3 2968 B17R2.45352 CC(O)C1(CC1)NCC(=O)c2ccccc2 882bcc35d659c9bf64e3fe925502f11d [0,1,0,1,0,0|0,0,2]=4 2969 B17R2.45352 CC(O)C1(CC1)NCC(F)c2ccccc2 0bf1ecdaa145dcf54d1818ca79d650ff [0,1,0,1,0,0|1,0,0]=3 2970 B17R2.45352 CC(O)C1(CC1)NCC(O)c2ccccc2 604d40c73dcdf0feb4bf1b6fbb8e9a37 [0,1,0,1,0,0|0,0,0]=2 2971 B17R2.45352 CC(O)C1(CC1)NCC(O)c2cnccn2 c0979e30446147ffa5e279942d627274 [0,1,0,1,0,0|2,0,0]=4 2972 B17R2.45352 CC(O)C1(CC1)NC[C@@H](C)c2ccccc2 33e36366da3f25c9784a059b64d06701 [0,1,0,1,0,0|1,0,0]=3 2973 B17R2.45352 C[C@H](CNC1(CC1)C(=O)O)c2ccccc2 81958ee10fb9b4107ee6e4ff5564ade1 [0,1,0,1,0,0|1,0,1]=4 2974 B17R2.45352 NC(=O)C1(CC1)NCC(O)c2ccccc2 2347f66b35968d403d6be71b610038c7 [0,1,0,1,0,0|0,0,2]=4 2975 B17R2.45352 NC(=O)C1(CC1)NC[C@@H](O)c2ccccc2 b268ce60a109326ffb510bf9f4bf034a [0,1,0,1,0,0|0,0,2]=4 2976 B17R2.45352 NC(=O)C1(CC1)NC[C@H](O)c2ccccc2 dd818d302bcd74e2bd81ad14bf9985f3 [0,1,0,1,0,0|0,0,2]=4 2977 B17R2.45352 O=C(O)C1(CC1)NCC(F)c2ccccc2 3eccb902957964c924ff5054f933d9ce [0,1,0,1,0,0|1,0,1]=4 2978 B17R2.45352 O=C(O)C1(CC1)NCC(O)c2ccccc2 ed73882be68fcbc4331520ca5ebc9204 [0,1,0,1,0,0|0,0,1]=3 2979 B17R2.45352 O=C(O)C1(CC1)NC[C@@H](O)c2ccccc2 e38b05ce34b8ea29c114676c6dc056eb [0,1,0,1,0,0|0,0,1]=3 2980 B17R2.45352 O=C(O)C1(CC1)NC[C@H](O)c2ccccc2 27f180f75f031dabb97aed206f124d7d [0,1,0,1,0,0|0,0,1]=3 2981 B17R2.25511 C=C(CN[C@@]1(C[C@H](C1)O)C)c2ccccc2 4cd9d293111aec1db6be4f3177ddd943 [0,1,0,1,0,0|1,0,1]=4 2982 B17R2.25511 CC(CNC1(CN(C1)C)C)c2ccccc2 172a8b0945f32f62758b1779afe8ae74 [0,1,0,1,0,0|2,0,0]=4 2983 B17R2.25511 CC(CN[C@@]1(C[C@H](C1)O)C)c2ccccc2 1b7d5d3784d62d7c0bd5ec6373945510 [0,1,0,1,0,0|1,0,0]=3 2984 B17R2.25511 CN1CC(C1)(C)NCC(F)c2ccccc2 9e64e21bc3c300c525011c6798863b8d [0,1,0,1,0,0|2,0,0]=4 2985 B17R2.25511 CN1CC(C1)(C)NCC(O)c2ccccc2 5d56e302812366358534df0c1c18a992 [0,1,0,1,0,0|1,0,0]=3 2986 B17R2.25511 CN1CC(C1)(C)NC[C@@H](O)c2ccccc2 35d492cfafc8df512375afd2e3a4c0e5 [0,1,0,1,0,0|1,0,0]=3 2987 B17R2.25511 CN1CC(C1)(C)NC[C@H](O)c2ccccc2 d5de0e421c598073cd376a357ff3a393 [0,1,0,1,0,0|1,0,0]=3 2988 B17R2.25511 C[C@@]1(C[C@@H](C1)O)NCC(=O)c2ccccc2 75efef5173e27e3310659c8b5ec214c3 [0,1,0,1,0,0|0,0,2]=4 2989 B17R2.25511 C[C@@]1(C[C@@H](C1)O)NCC(F)c2ccccc2 352126c383665f7d28ad5c3eb1f6ddfe [0,1,0,1,0,0|1,0,0]=3 2990 B17R2.25511 C[C@@]1(C[C@@H](C1)O)NCC(O)c2ccccc2 6eac6711c11aea0fa2eb3ba2f8697807 [0,1,0,1,0,0|0,0,0]=2 2991 B17R2.25511 C[C@@]1(C[C@@H](C1)O)NCC(O)c2cnccn2 e6e8d94a8e1fd752dcbf1888f73bff8a [0,1,0,1,0,0|2,0,0]=4 2992 B17R2.25511 C[C@@]1(C[C@@H](C1)O)NCS(=O)c2ccccc2 7d44efc48ebb3567c2e3cfcf967d4e38 [0,1,0,1,0,0|1,0,1]=4 2993 B17R2.25511 C[C@@]1(C[C@@H](C1)O)NC[C@@H](O)c2ccccc2 0bcac719434eb5af735a0f2d167ee4ec [0,1,0,1,0,0|0,0,0]=2 2994 B17R2.25511 C[C@@]1(C[C@@H](C1)O)NC[C@H](O)c2ccccc2 eac31df42afd6be33b31109ea3fa4349 [0,1,0,1,0,0|0,0,0]=2 2995 B17R2.25511 C[C@H](CNC1(CN(C1)C)C)c2ccccc2 f8b1a5687aaf25a948ff1aa6bfeb7f83 [0,1,0,1,0,0|2,0,0]=4 2996 B17R2.25511 C[C@H](CN[C@@]1(C[C@H](C1)O)C)c2ccccc2 4e8ed464d04cbbe70b0ecef3471086a4 [0,1,0,1,0,0|1,0,0]=3 2997 B17R2.47590 C=C(CNC1(CC1)CCO)c2ccccc2 f9bb020f4203ad677957d0d9f5cb1c02 [0,1,0,1,0,0|1,0,1]=4 2998 B17R2.47590 CC(CNC1(CC1)CC#N)c2ccccc2 fb2d8c481af8bd2045481fb6a4fb3b4b [0,1,0,1,0,0|2,0,0]=4 2999 B17R2.47590 CC(CNC1(CC1)CCO)c2ccccc2 1730da4abf9f1bf79b9000f45c897bc8 [0,1,0,1,0,0|1,0,0]=3 3000 B17R2.47590 CCCC1(CC1)NCC(O)c2ccccc2 dba5c1a8beb191cf25bb5ca7e11be9df [0,1,0,1,0,0|1,0,0]=3 3001 B17R2.47590 COCC1(CC1)NCC(O)c2ccccc2 d01cf68dcb14e6bb3865bfe369eeb240 [0,1,0,1,0,0|0,0,0]=2 3002 B17R2.47590 COCC1(CC1)NCC(O)c2cnccn2 23dbf17302534a613a9c602709411069 [0,1,0,1,0,0|2,0,0]=4 3003 B17R2.47590 C[C@H](CNC1(CC1)CC#N)c2ccccc2 554e2094076cc043f7773b09e55de85a [0,1,0,1,0,0|2,0,0]=4 3004 B17R2.47590 C[C@H](CNC1(CC1)CCO)c2ccccc2 072ffca2f353715d7cf8ff406702308d [0,1,0,1,0,0|1,0,0]=3 3005 B17R2.47590 N#CCC1(CC1)NCC(O)c2ccccc2 4dfec425f5f520c49df1f970fcf1c91c [0,1,0,1,0,0|1,0,0]=3 3006 B17R2.47590 O=C(CNC1(CC1)CCO)c2ccccc2 1b7d35b39751bc43c2f9746d607288c5 [0,1,0,1,0,0|0,0,2]=4 3007 B17R2.47590 OCCC1(CC1)NCC(F)c2ccccc2 fedf8a33241a8e12e2997f0b56204287 [0,1,0,1,0,0|1,0,0]=3 3008 B17R2.47590 OCCC1(CC1)NCC(O)c2ccccc2 efc21e259597e81ea3226bb0e0ad08ae [0,1,0,1,0,0|0,0,0]=2 3009 B17R2.47590 OCCC1(CC1)NCC(O)c2cnccn2 92e4b5c74a3c477f757391cdd9a29a1a [0,1,0,1,0,0|2,0,0]=4 3010 B17R2.452732 CC1(COC1)CNC(CO)c2ccccc2 792596a2cbfa8b7b35071733bad0672c [0,1,0,1,0,0|2,0,0]=4 3011 B17R2.452732 CC1(COC1)CN[C@@H](CO)c2ccccc2 07ce1dd6890748b1b1a49523020a2d55 [0,1,0,1,0,0|2,0,0]=4 3012 B17R2.452732 CC1(COC1)CN[C@H](CO)c2ccccc2 c839f0a415333fcecca0b1f0adbe43f8 [0,1,0,1,0,0|2,0,0]=4 3013 B13R1.11 CC(CO)CN(C)c1ccccc1 d6b3c8ad65a7f6d9538fbfaa12babefb [1,0,0,0,1,0|2,0,0]=4 3014 B13R1.11 CC(CO)NC(=O)c1ccccc1 df750009c3e55e45b197efd3b545a3b5 [1,0,0,0,1,0|0,0,2]=4 3015 B13R1.11 CC(CO)NC(C)c1ccccn1 963dc843d15e04a92fc3a281eb2e1d43 [1,0,0,0,1,0|2,0,0]=4 3016 B13R1.11 CC(CO)NC(C)c1cccnc1 07e36bc383c33704ee35cb9e78ce2ca7 [1,0,0,0,1,0|2,0,0]=4 3017 B13R1.11 CC(CO)NC(C)c1ccncc1 30db6daf73365ba43c8728b422d5d169 [1,0,0,0,1,0|2,0,0]=4 3018 B13R1.11 CC(CO)N[C@@H](C)c1ccccn1 4a229c34f1fd9706da678c0242250e33 [1,0,0,0,1,0|2,0,0]=4 3019 B13R1.11 CC(CO)N[C@@H](C)c1cccnc1 b797cb10faab05917b1d5e89a8661cc5 [1,0,0,0,1,0|2,0,0]=4 3020 B13R1.11 CC(CO)N[C@@H](C)c1ccncc1 e5e7b65b604de90f57580f5ad8d14df0 [1,0,0,0,1,0|2,0,0]=4 3021 B13R1.11 CC(CO)N[C@H](C)c1ccccn1 045b12f978c170c034379f00d7afaff4 [1,0,0,0,1,0|2,0,0]=4 3022 B13R1.11 CC(CO)N[C@H](C)c1cccnc1 a34610b0d5a7d9a77086149465fbced1 [1,0,0,0,1,0|2,0,0]=4 3023 B13R1.11 CC(CO)N[C@H](C)c1ccncc1 43f02e9ea7e5bbce568bdd36854682c5 [1,0,0,0,1,0|2,0,0]=4 3024 B13R1.11 CC(N[C@@H](C)CO)c1ccccn1 2f60c66e53808ce91292ba7518984f11 [1,0,0,0,1,0|2,0,0]=4 3025 B13R1.11 CC(N[C@@H](C)CO)c1cccnc1 2a973a8bb4020f0d7af4c9d254405e0e [1,0,0,0,1,0|2,0,0]=4 3026 B13R1.11 CC(N[C@@H](C)CO)c1ccncc1 b1c8652fe11afdd14368edcbcf116620 [1,0,0,0,1,0|2,0,0]=4 3027 B13R1.11 CC(N[C@H](C)CO)c1ccccn1 22965acc8e9aa67970c3b1f0783bf5f7 [1,0,0,0,1,0|2,0,0]=4 3028 B13R1.11 CC(N[C@H](C)CO)c1cccnc1 a465aa4987a72fdfa71b4af0ebee3149 [1,0,0,0,1,0|2,0,0]=4 3029 B13R1.11 CC(N[C@H](C)CO)c1ccncc1 8e2041647cf7d8ca7af334e29b23eb07 [1,0,0,0,1,0|2,0,0]=4 3030 B13R1.11 CCN(C)CC(O)c1ccccc1 d45ab040335d9c291ff1d0dee78bd157 [1,0,0,0,1,0|2,0,0]=4 3031 B13R1.11 CCN(C)C[C@H](O)c1ccccc1 f912c0d939165dc0f095ac8f10acbab6 [1,0,0,0,1,0|2,0,0]=4 3032 B13R1.11 CN(CF)CC(O)c1ccccc1 6044e9a09e29a14190a89ebe0cb6c0ed [1,0,0,0,1,0|2,0,0]=4 3033 B13R1.11 CN(CF)C[C@H](O)c1ccccc1 2cd27be8bf81e10e8ef14649c6ead622 [1,0,0,0,1,0|2,0,0]=4 3034 B13R1.11 CN(CO)CC(O)c1ccccc1 55c7d0f76d5ec974a482765492db178d [1,0,0,0,1,0|1,0,0]=3 3035 B13R1.11 CN(CO)CC(O)c1ccncc1 627b7aef24024cf785d3dcf3475f4b14 [1,0,0,0,1,0|2,0,0]=4 3036 B13R1.11 CN(CO)C[C@H](O)c1ccccc1 c6cc3889b9bff3c54b6be7f32b542a6f [1,0,0,0,1,0|1,0,0]=3 3037 B13R1.11 C[C@@H](CO)CN(C)c1ccccc1 a6c6aa35a6a366f84b5fbac7aca70dac [1,0,0,0,1,0|2,0,0]=4 3038 B13R1.11 C[C@@H](CO)NC(=O)c1ccccc1 5ac46a612d039f4f7153f2869e6a4af6 [1,0,0,0,1,0|0,0,2]=4 3039 B13R1.11 C[C@@H](CO)N[C@H](C)c1ccccn1 a43159b8efdee8f9ff586e3897dea16f [1,0,0,0,1,0|2,0,0]=4 3040 B13R1.11 C[C@@H](CO)N[C@H](C)c1cccnc1 699c8162538cdf2926693fdba937d61c [1,0,0,0,1,0|2,0,0]=4 3041 B13R1.11 C[C@@H](CO)N[C@H](C)c1ccncc1 046e668cf586066e65efe412a65a6bef [1,0,0,0,1,0|2,0,0]=4 3042 B13R1.11 C[C@H](CO)CN(C)c1ccccc1 6db868a9ea66ff781e65efd81dca8223 [1,0,0,0,1,0|2,0,0]=4 3043 B13R1.11 C[C@H](CO)NC(=O)c1ccccc1 1a37ee807e2700436419a9a18680b478 [1,0,0,0,1,0|0,0,2]=4 3044 B13R1.11 C[C@H](CO)N[C@@H](C)c1ccccn1 6048e7941b2c42461e4f523bed1c041b [1,0,0,0,1,0|2,0,0]=4 3045 B13R1.11 C[C@H](CO)N[C@@H](C)c1cccnc1 f4d82f4d29ec0b05c03f2f58b67cc138 [1,0,0,0,1,0|2,0,0]=4 3046 B13R1.11 C[C@H](CO)N[C@@H](C)c1ccncc1 2e7762e3b3620b654ef340f722cc66cf [1,0,0,0,1,0|2,0,0]=4 3047 B13R1.11 C[C@H](CO)N[C@H](C)c1ccccn1 fe7d79aa50d4a4756fb1da39327d0bb2 [1,0,0,0,1,0|2,0,0]=4 3048 B13R1.11 C[C@H](CO)N[C@H](C)c1cccnc1 38919da6ac8c06556f3c2fd526b2d692 [1,0,0,0,1,0|2,0,0]=4 3049 B13R1.11 C[C@H](CO)N[C@H](C)c1ccncc1 03e6b84a4617c662ecd78c2857b498e8 [1,0,0,0,1,0|2,0,0]=4 3050 B13R1.11 C[C@H](N[C@@H](C)CO)c1ccccn1 6333bce3cff1eb923db36e801919bf69 [1,0,0,0,1,0|2,0,0]=4 3051 B13R1.11 C[C@H](N[C@@H](C)CO)c1cccnc1 a9f6b4865cd242ef062e137f18bb5e9c [1,0,0,0,1,0|2,0,0]=4 3052 B13R1.11 C[C@H](N[C@@H](C)CO)c1ccncc1 02b53af044b56f7d8bd9526f91878b87 [1,0,0,0,1,0|2,0,0]=4 3053 B13R1.162 CC(CO)NCC(O)c1ccco1 6fff123e9e4233803fd03b13d6822b8d [1,0,0,0,1,0|1,0,0]=3 3054 B13R1.162 CCC(C)NCC(O)c1ccco1 fa22cf8e6a4817146379fd8e020a02ad [1,0,0,0,1,0|2,0,0]=4 3055 B13R1.162 CCC(C)NCC(O)c1cccs1 568530e56b8c7c91186b77f8b79f5322 [1,0,0,0,1,0|2,0,0]=4 3056 B13R1.162 C[C@@H](CO)NCC(O)c1ccco1 05b22818f494fe382477d6054da13aef [1,0,0,0,1,0|1,0,0]=3 3057 B13R1.162 C[C@H](CO)NCC(O)c1ccco1 0d1393d790ed321481f6b9391156e416 [1,0,0,0,1,0|1,0,0]=3 3058 B13R1.252 CC(C)(CF)NCCc1cccs1 37fbe48ee74469c1022aa3df7fb02a7e [1,0,0,0,1,0|2,0,0]=4 3059 B13R1.252 CC(C)(CF)NCCc1ccsc1 82ac2d374e54d6873d4d78f574423217 [1,0,0,0,1,0|2,0,0]=4 3060 B13R1.252 CC(C)(CF)NCCn1cccc1 2d108eb351ffc89e2372f4e13a1f896e [1,0,0,0,1,0|2,0,0]=4 3061 B13R1.252 CC(C)(CO)NCCc1c[nH]cn1 6a649c2d881948536ecb678b5c3f2591 [1,0,0,0,1,0|2,0,0]=4 3062 B13R1.252 CC(C)(CO)NCCc1cccs1 b073deb15b8d1319645edbcfc68018de [1,0,0,0,1,0|1,0,0]=3 3063 B13R1.252 CC(C)(CO)NCCc1ccn[nH]1 4bbb6d4ae936c586b5ad2863de605f01 [1,0,0,0,1,0|2,0,0]=4 3064 B13R1.252 CC(C)(CO)NCCc1ccsc1 2890c9293c71f34baf1873047fff5182 [1,0,0,0,1,0|1,0,0]=3 3065 B13R1.252 CC(C)(CO)NCCc1cn[nH]c1 120a01502fe2c19a15bb13cc87bf69a8 [1,0,0,0,1,0|2,0,0]=4 3066 B13R1.252 CC(C)(CO)NCCc1cscn1 26e2c15f4a947cb9b7e1adfe1c404392 [1,0,0,0,1,0|2,0,0]=4 3067 B13R1.252 CC(C)(CO)NCCn1cccc1 7f439e48ed1dcd1182f9457d765f04a2 [1,0,0,0,1,0|1,0,0]=3 3068 B13R1.252 CC(C)(CO)NCCn1cccn1 148b2e20ea71d59d90b3b546522ec8e3 [1,0,0,0,1,0|2,0,0]=4 3069 B13R1.252 CC(C)(CO)NCCn1ccnc1 ae12ad5f3b0a6a6a26eb6cf54d3314d7 [1,0,0,0,1,0|2,0,0]=4 3070 B13R1.252 CCC(C)(C)NCCc1cccs1 6c789dccf630d1309f51a2e981c91e9b [1,0,0,0,1,0|2,0,0]=4 3071 B13R1.252 CCC(C)(C)NCCn1cccc1 6e024fcec24342ae496e4cb007b2c187 [1,0,0,0,1,0|2,0,0]=4 3072 B13R1.254 C#CC(C)(C)NCc1ccccc1 64d2fa634fe924fd4589ffc2874c5753 [1,0,0,0,1,0|1,0,1]=4 3073 B13R1.254 CC(C)(C#N)NCc1ccccc1 83efd1f474618be3ed67e80860226a43 [1,0,0,0,1,0|1,0,1]=4 3074 B13R1.254 CC(C)(CF)CNc1ccccc1 08e543bbe83104b4ddf7bb04441934a3 [1,0,0,0,1,0|2,0,0]=4 3075 B13R1.254 CC(C)(CF)NCc1ccccc1 c69f3949aaaed78f67d0fa1e10da8037 [1,0,0,0,1,0|1,0,0]=3 3076 B13R1.254 CC(C)(CF)NCc1ccccn1 7c0be4e1507c7dc70b45a6afdaab9259 [1,0,0,0,1,0|2,0,0]=4 3077 B13R1.254 CC(C)(CF)NCc1cccnc1 ff9ed96ee71e1b9d70343150ce03d3a4 [1,0,0,0,1,0|2,0,0]=4 3078 B13R1.254 CC(C)(CO)CNc1ccccc1 f8b3f5cf042ed0c0c420963fa1f3f799 [1,0,0,0,1,0|1,0,0]=3 3079 B13R1.254 CC(C)(CO)CNc1ccccn1 7fd2d9778ca68c2e4df0e5685dc71a97 [1,0,0,0,1,0|2,0,0]=4 3080 B13R1.254 CC(C)(CO)CNc1cccnc1 aa61686ba3b242f076a66f19a5783ecb [1,0,0,0,1,0|2,0,0]=4 3081 B13R1.254 CC(C)(CO)CNc1ccncc1 0c142c1be55973d004ce6fcf0d1bf050 [1,0,0,0,1,0|2,0,0]=4 3082 B13R1.254 CC(C)(CO)NCc1ccccc1 c0308e124e3e09217037785baaabc17b [1,0,0,0,1,0|0,0,0]=2 3083 B13R1.254 CC(C)(CO)NCc1ccccn1 af01aceb25337d8503159bb791929e4a [1,0,0,0,1,0|1,0,0]=3 3084 B13R1.254 CC(C)(CO)NCc1cccnc1 133c7b0c3adcb7eb2a3bfefeb673f146 [1,0,0,0,1,0|1,0,0]=3 3085 B13R1.254 CC(C)(CO)NCc1cccnn1 14c715f61845e19493dac20917e9f641 [1,0,0,0,1,0|2,0,0]=4 3086 B13R1.254 CC(C)(CO)NCc1ccncn1 af3abd3568527fe1832afb1231141cab [1,0,0,0,1,0|2,0,0]=4 3087 B13R1.254 CC(C)(CO)NCc1cncnc1 046fe14172c29b075090fa1d3c145c16 [1,0,0,0,1,0|2,0,0]=4 3088 B13R1.254 CC(C)(CO)NCc1ncccn1 bb419284d1a39b6eb9680a2cfb21b3c6 [1,0,0,0,1,0|2,0,0]=4 3089 B13R1.254 CCC(C)(C)CNc1ccccc1 57e0f7745801d3a9ef93112da52879cc [1,0,0,0,1,0|2,0,0]=4 3090 B13R1.254 CCC(C)(C)NCc1ccccc1 c23d315dd1142156bcb929792b807c12 [1,0,0,0,1,0|1,0,0]=3 3091 B13R1.254 CCC(C)(C)NCc1ccccn1 b4cec9232b4d3f129eac85be2a03bb0a [1,0,0,0,1,0|2,0,0]=4 3092 B13R1.254 CCC(C)(C)NCc1cccnc1 c63342c49488483d2cabca2f54cdf845 [1,0,0,0,1,0|2,0,0]=4 3093 B13R1.352 CC(C)(C)NC(=O)c1ccccc1 a82ffd04679db65bd6b4bd44bbaf44e9 [1,0,0,0,1,0|0,0,2]=4 3094 B13R1.352 CN(CC(C)(C)C)c1ccccc1 158a23a43b218efa856cd9c3370c68dd [1,0,0,0,1,0|2,0,0]=4 3095 B13R1.352 CN(CC(C)(C)O)c1ccccc1 626016ea8818c1aee915e88bc2fa2b82 [1,0,0,0,1,0|2,0,0]=4 3096 B13R1.263 CN(c1ccccc1)C(C)(C)CO 37dacd28ca6e3eb1c69a5a18c8776351 [0,0,0,0,2,0|2,0,0]=4 3097 B15R1.959 C#CC(C)NCCC(O)c1ccccc1 5944f0ab31bb31cc4c879aeec51939ec [1,0,0,0,0,1|1,0,1]=4 3098 B15R1.959 C#CC(C)NCC[C@@H](O)c1ccccc1 6fdd0c454e0182bb5f65bd2802b80337 [1,0,0,0,0,1|1,0,1]=4 3099 B15R1.959 C#CC(C)NCC[C@H](O)c1ccccc1 413fccb446aa214b4f4e9666afc132b6 [1,0,0,0,0,1|1,0,1]=4 3100 B15R1.959 C#C[C@@H](C)NCCC(O)c1ccccc1 27f61cd5ce14c6d4db6a8da34f49fa1e [1,0,0,0,0,1|1,0,1]=4 3101 B15R1.959 C#C[C@@H](C)NCC[C@@H](O)c1ccccc1 018a80b86848435ec5c028cb87d4dc69 [1,0,0,0,0,1|1,0,1]=4 3102 B15R1.959 C#C[C@@H](C)NCC[C@H](O)c1ccccc1 7282dbc52a38c7714fe378da75c702d4 [1,0,0,0,0,1|1,0,1]=4 3103 B15R1.959 C#C[C@H](C)NCCC(O)c1ccccc1 e730ff2dde6efb86333e80651e66310c [1,0,0,0,0,1|1,0,1]=4 3104 B15R1.959 C#C[C@H](C)NCC[C@@H](O)c1ccccc1 5aeceaa002d88a749627971165f58ff3 [1,0,0,0,0,1|1,0,1]=4 3105 B15R1.959 C#C[C@H](C)NCC[C@H](O)c1ccccc1 8e2d6a06523d91b6af513d600212e014 [1,0,0,0,0,1|1,0,1]=4 3106 B15R1.959 C=C(CNCC(C)CO)c1ccccc1 834eeac91cc2653c741a45b4ff18b16d [1,0,0,0,0,1|1,0,1]=4 3107 B15R1.959 C=C(CNC[C@H](C)CO)c1ccccc1 68ad48a378ff61063222a9f23a6ce880 [1,0,0,0,0,1|1,0,1]=4 3108 B15R1.959 C=C(CO)CNCC(O)c1ccccc1 d26655ac86844798fd4ef69184a225be [1,0,0,0,0,1|0,0,2]=4 3109 B15R1.959 C=C(CO)CNC[C@@H](O)c1ccccc1 c428b44572c178a95092304143eca31a [1,0,0,0,0,1|0,0,2]=4 3110 B15R1.959 C=C(CO)CNC[C@H](O)c1ccccc1 00040748ca5c50d4f4823ecf0b7380ae [1,0,0,0,0,1|0,0,2]=4 3111 B15R1.959 C=CC(C)NCCC(O)c1ccccc1 93591d4e96a411cf07c57406277e5121 [1,0,0,0,0,1|1,0,1]=4 3112 B15R1.959 C=CC(C)NCC[C@@H](O)c1ccccc1 1d3213278afcaca074b8d65f16cc7282 [1,0,0,0,0,1|1,0,1]=4 3113 B15R1.959 C=CC(C)NCC[C@H](O)c1ccccc1 51bb597680b15d66c4a4b381591c22f4 [1,0,0,0,0,1|1,0,1]=4 3114 B15R1.959 CC(C#N)CNCC(O)c1ccccc1 83edb6caaaf34c2ad7ff9e8b9f858fe1 [1,0,0,0,0,1|1,0,1]=4 3115 B15R1.959 CC(C#N)CNC[C@@H](O)c1ccccc1 b651b1f42d1a227fa9d22818114e401b [1,0,0,0,0,1|1,0,1]=4 3116 B15R1.959 CC(C#N)CNC[C@H](O)c1ccccc1 b7a5a94d944bf2f88aeb7c632c4aacc3 [1,0,0,0,0,1|1,0,1]=4 3117 B15R1.959 CC(C#N)NCCC(O)c1ccccc1 140540b7b0520e4f86141d2817ed5a69 [1,0,0,0,0,1|1,0,1]=4 3118 B15R1.959 CC(C#N)NCC[C@@H](O)c1ccccc1 54d8899c63bc6562c8f5c1cf8a151853 [1,0,0,0,0,1|1,0,1]=4 3119 B15R1.959 CC(C#N)NCC[C@H](O)c1ccccc1 1fc1ef6a9e1e5999cf3eb085f29eccd0 [1,0,0,0,0,1|1,0,1]=4 3120 B15R1.959 CC(C=O)NCCC(O)c1ccccc1 1d53f84fc1f0df0c40495d13fa6c027b [1,0,0,0,0,1|0,0,2]=4 3121 B15R1.959 CC(C=O)NCC[C@@H](O)c1ccccc1 dacd7bebc08bba6a106d78059ed53742 [1,0,0,0,0,1|0,0,2]=4 3122 B15R1.959 CC(C=O)NCC[C@H](O)c1ccccc1 e3db64704c1045eacd3d308a88677d45 [1,0,0,0,0,1|0,0,2]=4 3123 B15R1.959 CC(CCN[C@@H](C)CO)c1ccccc1 1b08d127371f621b3ae8fa157c42ed7e [1,0,0,0,0,1|1,0,0]=3 3124 B15R1.959 CC(CCN[C@H](C)CO)c1ccccc1 914d70b9748d53157598d75331f1bb7d [1,0,0,0,0,1|1,0,0]=3 3125 B15R1.959 CC(CNCC(F)CO)c1ccccc1 891cd2ac6188c23da614210da63c6cb1 [1,0,0,0,0,1|2,0,0]=4 3126 B15R1.959 CC(CNCC(O)CO)c1ccccc1 3d04bf5517a4f240fd90a78def53e64c [1,0,0,0,0,1|2,0,0]=4 3127 B15R1.959 CC(CNC[C@@H](C)CO)c1ccccc1 ca51cfd7912590ec292caccc970fb48e [1,0,0,0,0,1|1,0,0]=3 3128 B15R1.959 CC(CNC[C@@H](F)CO)c1ccccc1 f225d4309cb350530814f5816b1a0a87 [1,0,0,0,0,1|2,0,0]=4 3129 B15R1.959 CC(CNC[C@@H](O)CO)c1ccccc1 ff2dd87674f48d50196d03acc302a870 [1,0,0,0,0,1|2,0,0]=4 3130 B15R1.959 CC(CNC[C@H](C)CO)c1ccccc1 42870540cbf7b2e0b6c98ff618642cd5 [1,0,0,0,0,1|1,0,0]=3 3131 B15R1.959 CC(CNC[C@H](F)CO)c1ccccc1 1b4a68c34a34a8d108db44739e4feb23 [1,0,0,0,0,1|2,0,0]=4 3132 B15R1.959 CC(CNC[C@H](O)CO)c1ccccc1 bd47979542abbdf7c3d83eb8525f4b6b [1,0,0,0,0,1|2,0,0]=4 3133 B15R1.959 CC(CO)CNCC(=O)c1ccccc1 172ffa582e41f3128be0d57185deae99 [1,0,0,0,0,1|0,0,2]=4 3134 B15R1.959 CC(CO)CNCC(C)c1ccccc1 6787e9a24fc753f5f3de16c39ccb826f [1,0,0,0,0,1|1,0,0]=3 3135 B15R1.959 CC(CO)CNCC(F)c1ccccc1 bc0ea47b6c76f965e0d0096e1873e36a [1,0,0,0,0,1|1,0,0]=3 3136 B15R1.959 CC(CO)CNCC(O)c1ccccc1 856c75d1af2001158091002e5a5c0878 [1,0,0,0,0,1|0,0,0]=2 3137 B15R1.959 CC(CO)CNCC(O)c1ccccn1 442f06e59aeda8cfe6b244f1b3410d4e [1,0,0,0,0,1|1,0,0]=3 3138 B15R1.959 CC(CO)CNCC(O)c1cccnc1 e40ea9c0d321d88c4c8bc61c6a037d05 [1,0,0,0,0,1|1,0,0]=3 3139 B15R1.959 CC(CO)CNCC(O)c1ccncc1 1d915521140032b3aecff6c2f120f592 [1,0,0,0,0,1|1,0,0]=3 3140 B15R1.959 CC(CO)CNCC(O)c1cnccn1 17d7e9827e74e0347ed9f81e0434fae2 [1,0,0,0,0,1|2,0,0]=4 3141 B15R1.959 CC(CO)CNC[C@@H](C)c1ccccc1 d252361b91e1e648cb51a4bbda9af855 [1,0,0,0,0,1|1,0,0]=3 3142 B15R1.959 CC(CO)CNC[C@@H](O)c1ccccc1 59252393aa117937f66c9ea94397cfae [1,0,0,0,0,1|0,0,0]=2 3143 B15R1.959 CC(CO)CNC[C@H](C)c1ccccc1 9659c07e3bf4e99927f5997b987f8b35 [1,0,0,0,0,1|1,0,0]=3 3144 B15R1.959 CC(CO)CNC[C@H](O)c1ccccc1 a57fbf00db7715480ccb7de535bb2ab7 [1,0,0,0,0,1|0,0,0]=2 3145 B15R1.959 CC(CO)NCCC(C)c1ccccc1 001e6155679de7a01998ceec8a62ff68 [1,0,0,0,0,1|1,0,0]=3 3146 B15R1.959 CC(CO)NCCC(O)c1ccccc1 a6b9d4f47b01449993c043e373442226 [1,0,0,0,0,1|0,0,0]=2 3147 B15R1.959 CC(CO)NCCC(O)c1cccnc1 f9d83daf62abac2c58616eaa3e09a70a [1,0,0,0,0,1|1,0,0]=3 3148 B15R1.959 CC(CO)NCCN(C)c1ccccc1 4162d8293661d2ea58d0a31f77e82626 [1,0,0,0,0,1|2,0,0]=4 3149 B15R1.959 CC(CO)NCC[C@@H](O)c1ccccc1 8a9e04c7deb8bda6d2082af13c2d6689 [1,0,0,0,0,1|0,0,0]=2 3150 B15R1.959 CC(CO)NCC[C@H](O)c1ccccc1 85ec339f53d1386578a269925831ef94 [1,0,0,0,0,1|0,0,0]=2 3151 B15R1.959 CC(CO)NCOC(=O)c1ccccc1 a162805d2c216d837c0abffc39238580 [1,0,0,0,0,1|0,0,2]=4 3152 B15R1.959 CCC(C)CNCC(C)c1ccccc1 40a8234b6215c444f80ae2739f6ac397 [1,0,0,0,0,1|2,0,0]=4 3153 B15R1.959 CCC(C)CNCC(F)c1ccccc1 05c7e0fb1bcc43372a41fe0c1efd7014 [1,0,0,0,0,1|2,0,0]=4 3154 B15R1.959 CCC(C)CNCC(O)c1ccccc1 0ce5a0442dc1c2d1030d363482045c60 [1,0,0,0,0,1|1,0,0]=3 3155 B15R1.959 CCC(C)CNCC(O)c1ccccn1 61950153fa2d9943700a3f9a6bceaaed [1,0,0,0,0,1|2,0,0]=4 3156 B15R1.959 CCC(C)CNCC(O)c1cccnc1 c1ecd97f79678b23d6220b01f73ca6a8 [1,0,0,0,0,1|2,0,0]=4 3157 B15R1.959 CCC(C)CNCC(O)c1ccncc1 29e3cf0208ca481cb10a7f9363345e60 [1,0,0,0,0,1|2,0,0]=4 3158 B15R1.959 CCC(C)CNC[C@@H](C)c1ccccc1 6bfb935c19b54711c91891a0864ceb02 [1,0,0,0,0,1|2,0,0]=4 3159 B15R1.959 CCC(C)CNC[C@@H](O)c1ccccc1 568cd1d3b8e98528bca40e47736cb265 [1,0,0,0,0,1|1,0,0]=3 3160 B15R1.959 CCC(C)CNC[C@H](C)c1ccccc1 eaf803e2f37c74ef74717d8d8e30601f [1,0,0,0,0,1|2,0,0]=4 3161 B15R1.959 CCC(C)CNC[C@H](O)c1ccccc1 82dfb6fb8bb8612a79c14a583e5e9435 [1,0,0,0,0,1|1,0,0]=3 3162 B15R1.959 CCC(C)NCCC(O)c1ccccc1 a1ead34bf33e2f7bc9cb4a78eae7437c [1,0,0,0,0,1|1,0,0]=3 3163 B15R1.959 CCC(C)NCCC(O)c1cccnc1 5e91d092e9099a290736a79eecfc46f1 [1,0,0,0,0,1|2,0,0]=4 3164 B15R1.959 CCC(C)NCC[C@@H](O)c1ccccc1 45d47637714dd899d3f2d3aa4e525ca3 [1,0,0,0,0,1|1,0,0]=3 3165 B15R1.959 CCC(C)NCC[C@H](O)c1ccccc1 7fc35fa0f5f53176e249b4eda7902b38 [1,0,0,0,0,1|1,0,0]=3 3166 B15R1.959 CCC(O)CNCC(O)c1ccccc1 35d991790dca96ddc2e48bc60d22fe45 [1,0,0,0,0,1|2,0,0]=4 3167 B15R1.959 CCC(O)CNC[C@@H](O)c1ccccc1 08d943bef41963b41d08c63b93d2d524 [1,0,0,0,0,1|2,0,0]=4 3168 B15R1.959 CCC(O)CNC[C@H](O)c1ccccc1 67ce30cbfaab1ae92f1744cc0a56cbf7 [1,0,0,0,0,1|2,0,0]=4 3169 B15R1.959 CC[C@@H](C)CNCC(C)c1ccccc1 e010a2132d66f56de893a9a314f3a3fb [1,0,0,0,0,1|2,0,0]=4 3170 B15R1.959 CC[C@@H](C)CNCC(O)c1ccccc1 608efb7d78d431f59964d765f2cfe016 [1,0,0,0,0,1|1,0,0]=3 3171 B15R1.959 CC[C@@H](C)CNCC(O)c1ccccn1 4b20aca4292c6c3f919769dc3da9bd83 [1,0,0,0,0,1|2,0,0]=4 3172 B15R1.959 CC[C@@H](C)CNCC(O)c1cccnc1 dc5adee0ca00955fc4a728646bebba50 [1,0,0,0,0,1|2,0,0]=4 3173 B15R1.959 CC[C@@H](C)CNCC(O)c1ccncc1 3381ed343c072f82790b7bd6bdb92bc8 [1,0,0,0,0,1|2,0,0]=4 3174 B15R1.959 CC[C@@H](C)CNC[C@@H](C)c1ccccc1 216aeee6367475d3f2e7c8adef5398eb [1,0,0,0,0,1|2,0,0]=4 3175 B15R1.959 CC[C@@H](C)CNC[C@@H](O)c1ccccc1 3c83cdc87b92140193be4a2de162ad2e [1,0,0,0,0,1|1,0,0]=3 3176 B15R1.959 CC[C@@H](C)CNC[C@H](C)c1ccccc1 51c10ed34736b08ca9090ffa44102745 [1,0,0,0,0,1|2,0,0]=4 3177 B15R1.959 CC[C@@H](C)CNC[C@H](O)c1ccccc1 3713be3526eb5323fefacc58a19d54dc [1,0,0,0,0,1|1,0,0]=3 3178 B15R1.959 CC[C@H](C)CNCC(C)c1ccccc1 0879d97f89cc76aed8d5c32bbce4e835 [1,0,0,0,0,1|2,0,0]=4 3179 B15R1.959 CC[C@H](C)CNCC(F)c1ccccc1 a0c0db4219f91b53b60e0088955a653d [1,0,0,0,0,1|2,0,0]=4 3180 B15R1.959 CC[C@H](C)CNCC(O)c1ccccc1 39cf5fd469c51d221faf4d4dddc5f7c9 [1,0,0,0,0,1|1,0,0]=3 3181 B15R1.959 CC[C@H](C)CNCC(O)c1ccccn1 1bb4a65da825a3380fbea0a5bc572094 [1,0,0,0,0,1|2,0,0]=4 3182 B15R1.959 CC[C@H](C)CNCC(O)c1cccnc1 c6f51414181ee2eeb97128610fc74494 [1,0,0,0,0,1|2,0,0]=4 3183 B15R1.959 CC[C@H](C)CNCC(O)c1ccncc1 3d86355063a74be17c9b919602eec421 [1,0,0,0,0,1|2,0,0]=4 3184 B15R1.959 CC[C@H](C)CNC[C@@H](C)c1ccccc1 79d11eaae827677196d53efe40a4cadd [1,0,0,0,0,1|2,0,0]=4 3185 B15R1.959 CC[C@H](C)CNC[C@@H](O)c1ccccc1 38e14f0b17ff00dc5c414060df9a8b65 [1,0,0,0,0,1|1,0,0]=3 3186 B15R1.959 CC[C@H](C)CNC[C@H](C)c1ccccc1 d6136ae4eab5f6499faf56bc5d9246b1 [1,0,0,0,0,1|2,0,0]=4 3187 B15R1.959 CC[C@H](C)CNC[C@H](O)c1ccccc1 10515aef49c93d97857d5982de030ae2 [1,0,0,0,0,1|1,0,0]=3 3188 B15R1.959 COC(C)CNCC(O)c1ccccc1 7e44094e2785232477aa78756b2abcc2 [1,0,0,0,0,1|2,0,0]=4 3189 B15R1.959 COC(C)CNC[C@@H](O)c1ccccc1 37868cc0fabae9212617a4ca2d72834b [1,0,0,0,0,1|2,0,0]=4 3190 B15R1.959 COC(C)CNC[C@H](O)c1ccccc1 c8ae4cc1fe8af545f9f3d7b529e0dba7 [1,0,0,0,0,1|2,0,0]=4 3191 B15R1.959 CO[C@@H](C)CNCC(O)c1ccccc1 4cc5de3cbe42f2e4a5ddefcec99b9fd5 [1,0,0,0,0,1|2,0,0]=4 3192 B15R1.959 CO[C@@H](C)CNC[C@@H](O)c1ccccc1 d54a7519cd42ac69033ecace14dab6b1 [1,0,0,0,0,1|2,0,0]=4 3193 B15R1.959 CO[C@@H](C)CNC[C@H](O)c1ccccc1 3869b56428047eca5af45332758a1b29 [1,0,0,0,0,1|2,0,0]=4 3194 B15R1.959 CO[C@H](C)CNCC(O)c1ccccc1 6c48ae471220f5417742c2f82fe001e1 [1,0,0,0,0,1|2,0,0]=4 3195 B15R1.959 CO[C@H](C)CNC[C@@H](O)c1ccccc1 9cb4727ce89e170c6df0f92d53c96795 [1,0,0,0,0,1|2,0,0]=4 3196 B15R1.959 CO[C@H](C)CNC[C@H](O)c1ccccc1 7af2b8da4fc88e81ff80cfe116ed7869 [1,0,0,0,0,1|2,0,0]=4 3197 B15R1.959 C[C@@H](CNCC(O)CO)c1ccccc1 024bce09379bfc4352e68db3b71412fe [1,0,0,0,0,1|2,0,0]=4 3198 B15R1.959 C[C@@H](CNC[C@@H](O)CO)c1ccccc1 3a7aa484054240369946337f3c3dbefd [1,0,0,0,0,1|2,0,0]=4 3199 B15R1.959 C[C@@H](CNC[C@H](O)CO)c1ccccc1 6701e34020ad1181e4f57a872f147b59 [1,0,0,0,0,1|2,0,0]=4 3200 B15R1.959 C[C@@H](CO)CNCC(=O)c1ccccc1 9727c5aaf1714958fbe92bba26e3ae9e [1,0,0,0,0,1|0,0,2]=4 3201 B15R1.959 C[C@@H](CO)CNCC(O)c1ccccc1 a7fd5fb5c5e506285578c747778ce2e1 [1,0,0,0,0,1|0,0,0]=2 3202 B15R1.959 C[C@@H](CO)CNCC(O)c1ccccn1 49ea0c54ff43a57f2d959a9c95175b20 [1,0,0,0,0,1|1,0,0]=3 3203 B15R1.959 C[C@@H](CO)CNCC(O)c1cccnc1 be35774dac9a20ae27c133b9d5da0f28 [1,0,0,0,0,1|1,0,0]=3 3204 B15R1.959 C[C@@H](CO)CNCC(O)c1ccncc1 f052504aef3f53a5218cbf8ae2c3f187 [1,0,0,0,0,1|1,0,0]=3 3205 B15R1.959 C[C@@H](CO)CNC[C@@H](C)c1ccccc1 a782df5604c3b46669e711222656e0a8 [1,0,0,0,0,1|1,0,0]=3 3206 B15R1.959 C[C@@H](CO)CNC[C@@H](O)c1ccccc1 9e7b88cfaf641376db6219d055838520 [1,0,0,0,0,1|0,0,0]=2 3207 B15R1.959 C[C@@H](CO)CNC[C@H](C)c1ccccc1 e4964571db91c302d701a0d2fd76f20d [1,0,0,0,0,1|1,0,0]=3 3208 B15R1.959 C[C@@H](CO)CNC[C@H](O)c1ccccc1 bad1e94a69cf0522ab0f685be29001fe [1,0,0,0,0,1|0,0,0]=2 3209 B15R1.959 C[C@@H](CO)NCCC(O)c1ccccc1 1974a681bdd4b7e690283945033f83a7 [1,0,0,0,0,1|0,0,0]=2 3210 B15R1.959 C[C@@H](CO)NCCC(O)c1cccnc1 af7c0c757f53e97da67efb6d9626ea06 [1,0,0,0,0,1|1,0,0]=3 3211 B15R1.959 C[C@@H](CO)NCCN(C)c1ccccc1 182c5ef88d641faf46f8ee161ff47443 [1,0,0,0,0,1|2,0,0]=4 3212 B15R1.959 C[C@@H](CO)NCC[C@@H](O)c1ccccc1 cc14d2ee5977961e74b498e60707a650 [1,0,0,0,0,1|0,0,0]=2 3213 B15R1.959 C[C@@H](CO)NCC[C@H](O)c1ccccc1 53d611e787eb3a7ba76fe168e5ce0b63 [1,0,0,0,0,1|0,0,0]=2 3214 B15R1.959 C[C@@H](CO)NCOC(=O)c1ccccc1 bb671c7ef6f3ea63d04d7b84374e559d [1,0,0,0,0,1|0,0,2]=4 3215 B15R1.959 C[C@H](C=O)NCCC(O)c1ccccc1 946b4fbd609096cbde1fa816f11e16d5 [1,0,0,0,0,1|0,0,2]=4 3216 B15R1.959 C[C@H](C=O)NCC[C@@H](O)c1ccccc1 265a870857b3d7cbddd22749d8a97747 [1,0,0,0,0,1|0,0,2]=4 3217 B15R1.959 C[C@H](C=O)NCC[C@H](O)c1ccccc1 c30d9366bf9e74d30daf2cc01dfdc6bc [1,0,0,0,0,1|0,0,2]=4 3218 B15R1.959 C[C@H](CNCC(F)CO)c1ccccc1 cfda323fa09fadc6e509e15c8144ab2f [1,0,0,0,0,1|2,0,0]=4 3219 B15R1.959 C[C@H](CNCC(O)CO)c1ccccc1 da578eb296809826ec0bd19f82096cf3 [1,0,0,0,0,1|2,0,0]=4 3220 B15R1.959 C[C@H](CNC[C@@H](F)CO)c1ccccc1 7ff164fa7102b972a078e8d150c651e8 [1,0,0,0,0,1|2,0,0]=4 3221 B15R1.959 C[C@H](CNC[C@@H](O)CO)c1ccccc1 c78906ebdd16c45d62dbfba3e96a1322 [1,0,0,0,0,1|2,0,0]=4 3222 B15R1.959 C[C@H](CNC[C@H](F)CO)c1ccccc1 293c08da2a8e948dd09f8cd9e04c4338 [1,0,0,0,0,1|2,0,0]=4 3223 B15R1.959 C[C@H](CNC[C@H](O)CO)c1ccccc1 c57c0da53eb192b5159da2d38d058823 [1,0,0,0,0,1|2,0,0]=4 3224 B15R1.959 C[C@H](CO)CNCC(=O)c1ccccc1 3c7b3cb48df6ee03074e836c4d33832a [1,0,0,0,0,1|0,0,2]=4 3225 B15R1.959 C[C@H](CO)CNCC(F)c1ccccc1 3f96aa6d14aa9d4a3cee5aa914abef2e [1,0,0,0,0,1|1,0,0]=3 3226 B15R1.959 C[C@H](CO)CNCC(O)c1ccccc1 bc3d76215e3a4af97c1b6bf0f02da897 [1,0,0,0,0,1|0,0,0]=2 3227 B15R1.959 C[C@H](CO)CNCC(O)c1ccccn1 9b24326659df135a4178d8821a0d7d97 [1,0,0,0,0,1|1,0,0]=3 3228 B15R1.959 C[C@H](CO)CNCC(O)c1cccnc1 58be10e4090188e3316ed1b9116b79f3 [1,0,0,0,0,1|1,0,0]=3 3229 B15R1.959 C[C@H](CO)CNCC(O)c1ccncc1 9349b3938c19984b915f3ab6cd51ca25 [1,0,0,0,0,1|1,0,0]=3 3230 B15R1.959 C[C@H](CO)CNCC(O)c1cnccn1 21e3b32d9714b607552a713e1b64f94d [1,0,0,0,0,1|2,0,0]=4 3231 B15R1.959 C[C@H](CO)CNC[C@@H](C)c1ccccc1 05a04ab822689db748f02e3804e29822 [1,0,0,0,0,1|1,0,0]=3 3232 B15R1.959 C[C@H](CO)CNC[C@@H](O)c1ccccc1 c1d6be7e4653d6f310982b73c2d06be1 [1,0,0,0,0,1|0,0,0]=2 3233 B15R1.959 C[C@H](CO)CNC[C@H](C)c1ccccc1 392293967829364398c59266033dddbc [1,0,0,0,0,1|1,0,0]=3 3234 B15R1.959 C[C@H](CO)CNC[C@H](O)c1ccccc1 ad251f9ee276e37312142337b39df403 [1,0,0,0,0,1|0,0,0]=2 3235 B15R1.959 C[C@H](CO)NCCC(O)c1ccccc1 2c8e443ed1bb6d2ad30d6b808912081d [1,0,0,0,0,1|0,0,0]=2 3236 B15R1.959 C[C@H](CO)NCCC(O)c1cccnc1 f63e175aed17825de24f64b584cb239e [1,0,0,0,0,1|1,0,0]=3 3237 B15R1.959 C[C@H](CO)NCCN(C)c1ccccc1 d542193d9cdd4a7a4ec2108d121bbf3c [1,0,0,0,0,1|2,0,0]=4 3238 B15R1.959 C[C@H](CO)NCC[C@@H](O)c1ccccc1 098636747288ca8b36b7926f2b90045c [1,0,0,0,0,1|0,0,0]=2 3239 B15R1.959 C[C@H](CO)NCC[C@H](O)c1ccccc1 8a599524cd39acab20bb6a8cca3f8c7c [1,0,0,0,0,1|0,0,0]=2 3240 B15R1.959 C[C@H](CO)NCOC(=O)c1ccccc1 3c3af47ea8d5b73220cba666a7a4dc4a [1,0,0,0,0,1|0,0,2]=4 3241 B15R1.959 O=C(CO)CNCC(O)c1ccccc1 d034f6c8b9ea026cdd493ee35fd73c93 [1,0,0,0,0,1|1,0,1]=4 3242 B15R1.959 O=C(CO)CNC[C@@H](O)c1ccccc1 9fe3576c2f7547d61e7b2b929fde3541 [1,0,0,0,0,1|1,0,1]=4 3243 B15R1.959 O=C(CO)CNC[C@H](O)c1ccccc1 519dea0315991ace9ca6b6ca4c15cf8f [1,0,0,0,0,1|1,0,1]=4 3244 B15R1.959 O=C(CO)NCCC(O)c1ccccc1 ff145b79eba34327f0b5798902d2d6a3 [1,0,0,0,0,1|1,0,1]=4 3245 B15R1.959 O=C(CO)NCC[C@@H](O)c1ccccc1 98e34e4e11cedff94103d0188f7e3c30 [1,0,0,0,0,1|1,0,1]=4 3246 B15R1.959 O=C(CO)NCC[C@H](O)c1ccccc1 762d6a915dc62205909b2113a39704ab [1,0,0,0,0,1|1,0,1]=4 3247 B15R1.959 OC(CF)CNCC(O)c1ccccc1 44f14e1feff88f8b3a8d7e18c341b531 [1,0,0,0,0,1|2,0,0]=4 3248 B15R1.959 OC(CF)CNC[C@@H](O)c1ccccc1 48cb8fd0b114dba0e7eec3fd84daa86d [1,0,0,0,0,1|2,0,0]=4 3249 B15R1.959 OC(CF)CNC[C@H](O)c1ccccc1 de38b18c082c53b5120ef4a6803fee41 [1,0,0,0,0,1|2,0,0]=4 3250 B15R1.959 OC(CNCC(Br)CBr)c1ccccc1 1c01effde381a484345d524ce849c312 [1,0,0,0,0,1|2,0,0]=4 3251 B15R1.959 OCC(F)CNCC(F)c1ccccc1 f273c5b9637d81c4775e28a64fef92fe [1,0,0,0,0,1|2,0,0]=4 3252 B15R1.959 OCC(F)CNCC(O)c1ccccc1 952bb0bff8f29f00e0ad5cd77e6c0912 [1,0,0,0,0,1|1,0,0]=3 3253 B15R1.959 OCC(F)CNC[C@@H](O)c1ccccc1 4cbfa87dd11873a5dbf573b913e9f044 [1,0,0,0,0,1|1,0,0]=3 3254 B15R1.959 OCC(F)CNC[C@H](O)c1ccccc1 2dc059f7e82c26463a040fcb4ff13ab8 [1,0,0,0,0,1|1,0,0]=3 3255 B15R1.959 OCC(O)CNCC(F)c1ccccc1 278c2088da6b33c0a06c8f0e4f8bc70c [1,0,0,0,0,1|2,0,0]=4 3256 B15R1.959 OCC(O)CNCC(O)c1ccccc1 d2f25886b0e326acc74fef69519d4120 [1,0,0,0,0,1|1,0,0]=3 3257 B15R1.959 OCC(O)CNCC(O)c1ccccn1 80590e162347bea2381ac7c64b0ce196 [1,0,0,0,0,1|2,0,0]=4 3258 B15R1.959 OCC(O)CNCC(O)c1cccnc1 86d4709cb7041bafe66d2e302a3598bc [1,0,0,0,0,1|2,0,0]=4 3259 B15R1.959 OCC(O)CNCC(O)c1ccncc1 77c824ec09a9aac9d84d36509a55e1cf [1,0,0,0,0,1|2,0,0]=4 3260 B15R1.959 OCC(O)CNC[C@@H](O)c1ccccc1 2cb9ef57235a2d4a17d883ea2656335b [1,0,0,0,0,1|1,0,0]=3 3261 B15R1.959 OCC(O)CNC[C@H](O)c1ccccc1 98e9b20f1d5e0d02f43c63db251d9053 [1,0,0,0,0,1|1,0,0]=3 3262 B15R1.959 OC[C@@H](F)CNCC(F)c1ccccc1 e016eaba662c53fd19c5a7a6a723cd76 [1,0,0,0,0,1|2,0,0]=4 3263 B15R1.959 OC[C@@H](F)CNCC(O)c1ccccc1 6395184dd149e94cc3c801063cb27cd5 [1,0,0,0,0,1|1,0,0]=3 3264 B15R1.959 OC[C@@H](F)CNC[C@@H](O)c1ccccc1 a1bac501047f8a9c675cfc83b99700d9 [1,0,0,0,0,1|1,0,0]=3 3265 B15R1.959 OC[C@@H](F)CNC[C@H](O)c1ccccc1 ffae7e20b45276b7c322671cfefe5abe [1,0,0,0,0,1|1,0,0]=3 3266 B15R1.959 OC[C@@H](O)CNCC(F)c1ccccc1 3e7e8714312a63d040c8b87eac52d944 [1,0,0,0,0,1|2,0,0]=4 3267 B15R1.959 OC[C@@H](O)CNCC(O)c1ccccc1 0b304a04eff0bb11a030955d64fcfa0b [1,0,0,0,0,1|1,0,0]=3 3268 B15R1.959 OC[C@@H](O)CNCC(O)c1ccccn1 b11fbd10e9b6262cb075b711ed343586 [1,0,0,0,0,1|2,0,0]=4 3269 B15R1.959 OC[C@@H](O)CNCC(O)c1cccnc1 d336017ab6b4c3757e3be327e5a50665 [1,0,0,0,0,1|2,0,0]=4 3270 B15R1.959 OC[C@@H](O)CNCC(O)c1ccncc1 72c1a60c810a87afce9020a5c257b9d4 [1,0,0,0,0,1|2,0,0]=4 3271 B15R1.959 OC[C@@H](O)CNC[C@@H](O)c1ccccc1 77bd716d91ea14f50dcc22743af3e8c8 [1,0,0,0,0,1|1,0,0]=3 3272 B15R1.959 OC[C@@H](O)CNC[C@H](O)c1ccccc1 1fb916a6928540e46bd0e8885c4daa11 [1,0,0,0,0,1|1,0,0]=3 3273 B15R1.959 OC[C@H](F)CNCC(F)c1ccccc1 ab2bfde1020eaa84ac45524b4c8162e5 [1,0,0,0,0,1|2,0,0]=4 3274 B15R1.959 OC[C@H](F)CNCC(O)c1ccccc1 f2f6b8e3c82da0b06592f04bc4badec5 [1,0,0,0,0,1|1,0,0]=3 3275 B15R1.959 OC[C@H](F)CNC[C@@H](O)c1ccccc1 30d744fb6e9e8abe76ebc38028d0155a [1,0,0,0,0,1|1,0,0]=3 3276 B15R1.959 OC[C@H](F)CNC[C@H](O)c1ccccc1 95c3c685dfd896be8f7ca696ab27e8d7 [1,0,0,0,0,1|1,0,0]=3 3277 B15R1.959 OC[C@H](O)CNCC(F)c1ccccc1 31e6822b463c1806990859907d2f9bfc [1,0,0,0,0,1|2,0,0]=4 3278 B15R1.959 OC[C@H](O)CNCC(O)c1ccccc1 4df4796f13a7088d59d1f7d9e77cf86f [1,0,0,0,0,1|1,0,0]=3 3279 B15R1.959 OC[C@H](O)CNCC(O)c1ccccn1 c02afa70485299cf1cea2ece1520c239 [1,0,0,0,0,1|2,0,0]=4 3280 B15R1.959 OC[C@H](O)CNCC(O)c1cccnc1 e90c3cd8e16ee81c9d5772a161b35d28 [1,0,0,0,0,1|2,0,0]=4 3281 B15R1.959 OC[C@H](O)CNCC(O)c1ccncc1 93b725c004560e2b6b3b5e2739e76110 [1,0,0,0,0,1|2,0,0]=4 3282 B15R1.959 OC[C@H](O)CNC[C@@H](O)c1ccccc1 657f5e27337f100e292405f6290a79e5 [1,0,0,0,0,1|1,0,0]=3 3283 B15R1.959 OC[C@H](O)CNC[C@H](O)c1ccccc1 57abe4200f5e0c8a848a96b93d3a23ce [1,0,0,0,0,1|1,0,0]=3 3284 B15R1.964 C#CC(C)NCC(O)Cc1ccccc1 781ff8b324c051f221277051dfa67bfc [1,0,0,0,0,1|1,0,1]=4 3285 B15R1.964 C#CC(C)NC[C@@H](O)Cc1ccccc1 c73efc5f13095979ac131ca17102ae6f [1,0,0,0,0,1|1,0,1]=4 3286 B15R1.964 C#C[C@@H](C)NCC(O)Cc1ccccc1 d3509a14380a0e86bab85cdc4f3c823e [1,0,0,0,0,1|1,0,1]=4 3287 B15R1.964 C#C[C@@H](C)NC[C@@H](O)Cc1ccccc1 1b866bb35c0b05687be453480eddf442 [1,0,0,0,0,1|1,0,1]=4 3288 B15R1.964 C#C[C@H](C)NCC(O)Cc1ccccc1 a846fd656427e7c0ea7f61a9ca33ec36 [1,0,0,0,0,1|1,0,1]=4 3289 B15R1.964 C#C[C@H](C)NC[C@@H](O)Cc1ccccc1 2b9a85207922f20a2cb92b4b47501504 [1,0,0,0,0,1|1,0,1]=4 3290 B15R1.964 C=CC(C)NCC(O)Cc1ccccc1 8dab93259b6702d1a9bf1fa34ae7ff95 [1,0,0,0,0,1|1,0,1]=4 3291 B15R1.964 C=CC(C)NC[C@@H](O)Cc1ccccc1 b12bbc22aa97d9f6439f8e4710651b21 [1,0,0,0,0,1|1,0,1]=4 3292 B15R1.964 CC(C#N)NCC(O)Cc1ccccc1 fd9ee1ad443957e6d83442c95593cbce [1,0,0,0,0,1|1,0,1]=4 3293 B15R1.964 CC(C#N)NC[C@@H](O)Cc1ccccc1 5307650ce81b16151abe0204bf983926 [1,0,0,0,0,1|1,0,1]=4 3294 B15R1.964 CC(C=O)NCC(O)Cc1ccccc1 21ff87608b4e8c0a58a193bff4ee0bdc [1,0,0,0,0,1|0,0,2]=4 3295 B15R1.964 CC(CN[C@@H](C)CO)Oc1ccccc1 6115b26b128ba8d6d8131d62b654e711 [1,0,0,0,0,1|1,0,0]=3 3296 B15R1.964 CC(CN[C@@H](C)CO)Oc1cccnc1 91499ae3524ff2ad70fd63f80f8ea303 [1,0,0,0,0,1|2,0,0]=4 3297 B15R1.964 CC(CN[C@H](C)CO)Oc1ccccc1 0eb6fe16210d351170419d0b99598b7b [1,0,0,0,0,1|1,0,0]=3 3298 B15R1.964 CC(CN[C@H](C)CO)Oc1cccnc1 1553f1dc7fa3dc9023e20a0c002fb067 [1,0,0,0,0,1|2,0,0]=4 3299 B15R1.964 CC(CO)NCC(=O)Cc1ccccc1 340ff30524fb377963a379ce8ed0fc8b [1,0,0,0,0,1|0,0,2]=4 3300 B15R1.964 CC(CO)NCC(=O)Nc1ccccc1 c76cb3ad38c79c7b0c9218cdc710c56e [1,0,0,0,0,1|0,0,2]=4 3301 B15R1.964 CC(CO)NCC(=O)Oc1ccccc1 4195d97700527cc0f7ad7342acb63130 [1,0,0,0,0,1|0,0,2]=4 3302 B15R1.964 CC(CO)NCC(C)Oc1ccccc1 060cf3086ed5a4c14f1ce2f935e3a7f9 [1,0,0,0,0,1|1,0,0]=3 3303 B15R1.964 CC(CO)NCC(C)Oc1cccnc1 23cb8b8c8f191ca0decc49e85dac1900 [1,0,0,0,0,1|2,0,0]=4 3304 B15R1.964 CC(CO)NCC(O)Cc1ccccc1 688ff0270be040d19b8ac7948b334f58 [1,0,0,0,0,1|0,0,0]=2 3305 B15R1.964 CC(CO)NC[C@@H](O)Cc1ccccc1 08ff7781a1791c35917c195574efee2e [1,0,0,0,0,1|0,0,0]=2 3306 B15R1.964 CCC(C)NCC(C)Oc1ccccc1 1aa8bca62bfaeffee34dc6c1d3669eac [1,0,0,0,0,1|2,0,0]=4 3307 B15R1.964 CCC(C)NCC(O)Cc1ccccc1 6a7888a23727adec874920640135f36a [1,0,0,0,0,1|1,0,0]=3 3308 B15R1.964 CCC(C)NC[C@@H](O)Cc1ccccc1 e9d22b15de8a902082b17edc0cc85507 [1,0,0,0,0,1|1,0,0]=3 3309 B15R1.964 CC[C@@H](C)NCC(O)Cc1ccccc1 75948b9c28c112419f8deda866256707 [1,0,0,0,0,1|1,0,0]=3 3310 B15R1.964 CC[C@@H](C)NC[C@@H](O)Cc1ccccc1 9a194b1e672a0d47a2a77003ed75810e [1,0,0,0,0,1|1,0,0]=3 3311 B15R1.964 CC[C@H](C)NCC(O)Cc1ccccc1 fb54d21a954de8d2a436a04802a60d3f [1,0,0,0,0,1|1,0,0]=3 3312 B15R1.964 CC[C@H](C)NC[C@@H](O)Cc1ccccc1 99a6886c2a2956866521a9031817a48b [1,0,0,0,0,1|1,0,0]=3 3313 B15R1.964 C[C@@H](CO)NCC(=O)Cc1ccccc1 5c48e59443a45685a3028a2c79e1450d [1,0,0,0,0,1|0,0,2]=4 3314 B15R1.964 C[C@@H](CO)NCC(=O)Nc1ccccc1 efb1708d489579c13a16ca29be831ef9 [1,0,0,0,0,1|0,0,2]=4 3315 B15R1.964 C[C@@H](CO)NCC(=O)Oc1ccccc1 a7b3afe3a1df201711ea39ee201f5cf4 [1,0,0,0,0,1|0,0,2]=4 3316 B15R1.964 C[C@@H](CO)NCC(O)Cc1ccccc1 3443962cb18ecd9bc3ed4dbe1ffa1ddb [1,0,0,0,0,1|0,0,0]=2 3317 B15R1.964 C[C@@H](CO)NC[C@@H](O)Cc1ccccc1 bb6d01a9546fc82400d364d50e217eb9 [1,0,0,0,0,1|0,0,0]=2 3318 B15R1.964 C[C@H](C=O)NCC(O)Cc1ccccc1 a0ea0d4201d8fb2c2ad17be49c61aa08 [1,0,0,0,0,1|0,0,2]=4 3319 B15R1.964 C[C@H](CO)NCC(=O)Cc1ccccc1 69a00776d3a2e1a531f354dcb077949e [1,0,0,0,0,1|0,0,2]=4 3320 B15R1.964 C[C@H](CO)NCC(=O)Nc1ccccc1 83cc9ac586cb3c9e6c4883ff6bc9b9fe [1,0,0,0,0,1|0,0,2]=4 3321 B15R1.964 C[C@H](CO)NCC(=O)Oc1ccccc1 8ec137f5f550d334f7816d04c87cdbeb [1,0,0,0,0,1|0,0,2]=4 3322 B15R1.964 C[C@H](CO)NCC(O)Cc1ccccc1 9bd9f2dc6decb4c178fece3e45d06c51 [1,0,0,0,0,1|0,0,0]=2 3323 B15R1.964 C[C@H](CO)NC[C@@H](O)Cc1ccccc1 6a6bf767dd9cc4d20a4ee94bfdcf0798 [1,0,0,0,0,1|0,0,0]=2 3324 B15R1.964 O=C(CO)NCC(O)Cc1ccccc1 c52e59b64c9638b529d3cff097604265 [1,0,0,0,0,1|1,0,1]=4 3325 B15R1.315 C#CC(C)(C)NCCCc1ccccc1 f0f2c4ce13d2fe7efad125950baf6325 [1,0,0,0,0,1|1,0,1]=4 3326 B15R1.315 C#CC(C)(C)NCCOc1ccccc1 4e1d3baaa28d9d35e03b6446912a488d [1,0,0,0,0,1|1,0,1]=4 3327 B15R1.315 C#CC(C)(C)NCCSc1ccccc1 453536857c2875f6101577c7db75df11 [1,0,0,0,0,1|1,0,1]=4 3328 B15R1.315 C#CC(C)(C)NCOCc1ccccc1 2e153cfd34556de461ef45fc6f5748b6 [1,0,0,0,0,1|1,0,1]=4 3329 B15R1.315 C#CC(C)(C)NCSCc1ccccc1 ebd2c38f293dd84c76355c9c7c07e020 [1,0,0,0,0,1|1,0,1]=4 3330 B15R1.315 CC(C)(C#N)CNCCc1ccccc1 2a526e7f2cf9b0db4db85bba96b11282 [1,0,0,0,0,1|1,0,1]=4 3331 B15R1.315 CC(C)(C#N)NCCCc1ccccc1 5d9d2ffd790d815e8cc675adc29ba314 [1,0,0,0,0,1|1,0,1]=4 3332 B15R1.315 CC(C)(C#N)NCCOc1ccccc1 41bdff5af2f31d55f2f0bc8427c4053d [1,0,0,0,0,1|1,0,1]=4 3333 B15R1.315 CC(C)(C#N)NCCSc1ccccc1 d9ca051125b6cac47943fe4e08bdcdc1 [1,0,0,0,0,1|1,0,1]=4 3334 B15R1.315 CC(C)(CF)CNCCc1ccccc1 3c90c4299beb782e60f3d5642c91d9bf [1,0,0,0,0,1|1,0,0]=3 3335 B15R1.315 CC(C)(CF)CNCCc1ccccn1 4ec706058668e7abf23321fad2d16ed6 [1,0,0,0,0,1|2,0,0]=4 3336 B15R1.315 CC(C)(CF)CNCCc1cccnc1 096e66a93dfc6e2e77febc7014a5a778 [1,0,0,0,0,1|2,0,0]=4 3337 B15R1.315 CC(C)(CF)CNCCc1ccncc1 87571bd8860dd50874f321c1abc15f10 [1,0,0,0,0,1|2,0,0]=4 3338 B15R1.315 CC(C)(CF)CNCSc1ccccc1 ba703e655020a142a4adda2b85fe27c1 [1,0,0,0,0,1|2,0,0]=4 3339 B15R1.315 CC(C)(CF)COCCc1ccccc1 0db6924870eed9aacf9251a0d876140f [1,0,0,0,0,1|2,0,0]=4 3340 B15R1.315 CC(C)(CF)NCCCc1ccccc1 20be2e20f882a6430b341af93ce1f673 [1,0,0,0,0,1|1,0,0]=3 3341 B15R1.315 CC(C)(CF)NCCCc1ccccn1 135b4582b60ec77ed850b0b1bd371bd7 [1,0,0,0,0,1|2,0,0]=4 3342 B15R1.315 CC(C)(CF)NCCCc1cccnc1 f308805f22f1cb577d62cb1a6876d49e [1,0,0,0,0,1|2,0,0]=4 3343 B15R1.315 CC(C)(CF)NCCCc1ccncc1 5d98e1102678808501c53caf188fc505 [1,0,0,0,0,1|2,0,0]=4 3344 B15R1.315 CC(C)(CF)NCCOc1ccccc1 07fab40b32beeb43ec53749c4b474158 [1,0,0,0,0,1|1,0,0]=3 3345 B15R1.315 CC(C)(CO)CCCNc1ccccc1 e9dd4e50ece3a8d8d781352bc9884675 [1,0,0,0,0,1|1,0,0]=3 3346 B15R1.315 CC(C)(CO)CCCNc1cccnc1 9b6ab02b51a353f51564025204743803 [1,0,0,0,0,1|2,0,0]=4 3347 B15R1.315 CC(C)(CO)CCCNc1ccncc1 a3aebc03134176fe7ecdd1fa1c341482 [1,0,0,0,0,1|2,0,0]=4 3348 B15R1.315 CC(C)(CO)CNCCc1ccccc1 07b3dde8907a2a2dccb3683d34ea8387 [1,0,0,0,0,1|0,0,0]=2 3349 B15R1.315 CC(C)(CO)CNCCc1ccccn1 adbac6d7a052cdbc70ca0b7b7b311417 [1,0,0,0,0,1|1,0,0]=3 3350 B15R1.315 CC(C)(CO)CNCCc1cccnc1 fffc163a654862f754b8ca952b298b3e [1,0,0,0,0,1|1,0,0]=3 3351 B15R1.315 CC(C)(CO)CNCCc1ccncc1 3a8f50b5253bbdf3f375ba13983d335e [1,0,0,0,0,1|1,0,0]=3 3352 B15R1.315 CC(C)(CO)CNCCc1ccncn1 74007cc890de266ab8a7f62bb1ea9fd6 [1,0,0,0,0,1|2,0,0]=4 3353 B15R1.315 CC(C)(CO)CNCCc1cnccn1 7b43f4923fc32c986d5fa4297c6d78b6 [1,0,0,0,0,1|2,0,0]=4 3354 B15R1.315 CC(C)(CO)CNCCc1ncccn1 f39fe9c1617da58d95bfa13c899ec4f5 [1,0,0,0,0,1|2,0,0]=4 3355 B15R1.315 CC(C)(CO)NC/C=C/c1ccccc1 681acc0bfdefdc9fe67d3039ea0af47e [1,0,0,0,0,1|0,0,1]=3 3356 B15R1.315 CC(C)(CO)NCC=Cc1ccccc1 2cf1416eb34c994d3e4f4cf6e1475039 [1,0,0,0,0,1|0,0,1]=3 3357 B15R1.315 CC(C)(CO)NCCCc1ccccc1 a94d6453b8683e47bf191e0400f12287 [1,0,0,0,0,1|0,0,0]=2 3358 B15R1.315 CC(C)(CO)NCCCc1ccccn1 0a497fd805e593697b215055a1288f25 [1,0,0,0,0,1|1,0,0]=3 3359 B15R1.315 CC(C)(CO)NCCCc1cccnc1 1d965ee1f26a8a70e2fdc9b80edf6559 [1,0,0,0,0,1|1,0,0]=3 3360 B15R1.315 CC(C)(CO)NCCCc1ccncc1 e7c3ffd6ee004881bb0a388563fd6633 [1,0,0,0,0,1|1,0,0]=3 3361 B15R1.315 CC(C)(CO)NCCOc1ccccc1 b65f30f38784bffea8ce14dd44990388 [1,0,0,0,0,1|0,0,0]=2 3362 B15R1.315 CC(C)(CO)NCCSc1ccccc1 627f7c20cb21a46f9c0d716de428952e [1,0,0,0,0,1|0,0,0]=2 3363 B15R1.315 CC(C)(CO)NCOCc1ccccc1 24f4f56251646a2e25ad5c70de1d6fba [1,0,0,0,0,1|0,0,0]=2 3364 B15R1.315 CC(C)(CO)NCSCc1ccccc1 abab167dce3dcaf388b9e931c5f21fce [1,0,0,0,0,1|0,0,0]=2 3365 B15R1.315 CCC(C)(C)CCNCc1ccccc1 bc3f0a8fc7b1bc2ab39a36ffcc71a22c [1,0,0,0,0,1|2,0,0]=4 3366 B15R1.315 CCC(C)(C)CCOCc1ccccc1 1eed9bbbc89ce43109d77834d19213f1 [1,0,0,0,0,1|2,0,0]=4 3367 B15R1.315 CCC(C)(C)CNCCc1ccccc1 2f8ce0897a6665929c8a5e1e5533e13b [1,0,0,0,0,1|1,0,0]=3 3368 B15R1.315 CCC(C)(C)CNCCc1ccccn1 37e29a7aac2e795059b0ae6b2e031e2c [1,0,0,0,0,1|2,0,0]=4 3369 B15R1.315 CCC(C)(C)CNCCc1cccnc1 2661a5c316dbf568fe490c8eac0fa90f [1,0,0,0,0,1|2,0,0]=4 3370 B15R1.315 CCC(C)(C)CNCCc1ccncc1 86728c94bea676012836f46b6b56f178 [1,0,0,0,0,1|2,0,0]=4 3371 B15R1.315 CCC(C)(C)NCCCc1ccccn1 b91315020a4cf88be272e73910140c9d [1,0,0,0,0,1|2,0,0]=4 3372 B15R1.315 CCC(C)(C)NCCCc1cccnc1 76240c307076823ddf288d72cda840be [1,0,0,0,0,1|2,0,0]=4 3373 B15R1.315 CCC(C)(C)NCCCc1ccncc1 ce14acae582b943908edffcd48c8a94d [1,0,0,0,0,1|2,0,0]=4 3374 B15R1.315 CCC(C)(O)CNCCc1ccccc1 9ca6385f28d83419f2730e09b0c14cf6 [1,0,0,0,0,1|2,0,0]=4 3375 B15R1.315 COC(C)(C)CNCCc1ccccc1 bafb740fea7fe06d22cf08211a080601 [1,0,0,0,0,1|2,0,0]=4 3376 B15R1.315 OCC(F)(F)CNCCc1ccccc1 2f9f30960badc98a504e367f9ff6d6ff [1,0,0,0,0,1|2,0,0]=4 3377 B15R1.9094 C=C(CNCC(C)(C)C)c1ccccc1 bba62ffc2be1eaf4d3225cc5825838af [1,0,0,0,0,1|1,0,1]=4 3378 B15R1.9094 C=C(CNCC(C)(C)O)c1ccccc1 417eb5a4a33b00d7949e9e58b7aa7ea5 [1,0,0,0,0,1|1,0,1]=4 3379 B15R1.9094 CC(C)(C)CNCC(=O)c1ccccc1 c62d7df69b99c608c5de9137a1471322 [1,0,0,0,0,1|0,0,2]=4 3380 B15R1.9094 CC(C)(C)CNCC(F)c1ccccc1 9a38fd83772ee33085ed2ad3f5721f9c [1,0,0,0,0,1|1,0,0]=3 3381 B15R1.9094 CC(C)(C)CNCC(O)c1ccccc1 d19683fa5f2849fefc4db104befbf6dd [1,0,0,0,0,1|0,0,0]=2 3382 B15R1.9094 CC(C)(C)CNCC(O)c1ccccn1 f9588e815f4fb34748a5cf3f54669cf5 [1,0,0,0,0,1|1,0,0]=3 3383 B15R1.9094 CC(C)(C)CNCC(O)c1cccnc1 a19b2d017286348bd8e7b01bfa201e8a [1,0,0,0,0,1|1,0,0]=3 3384 B15R1.9094 CC(C)(C)CNCC(O)c1ccncc1 003d53b4abda426dd8d8444c83af9e82 [1,0,0,0,0,1|1,0,0]=3 3385 B15R1.9094 CC(C)(C)CNCC(O)c1cnccn1 09f25ed6728b7ee44bb086d1460fe12c [1,0,0,0,0,1|2,0,0]=4 3386 B15R1.9094 CC(C)(C)CNC[C@@H](O)c1ccccc1 bb93e248e302b537bbc9b097c22b5d00 [1,0,0,0,0,1|0,0,0]=2 3387 B15R1.9094 CC(C)(C)CNC[C@H](O)c1ccccc1 54ce52008e4f39159cdd22b5a4df62b2 [1,0,0,0,0,1|0,0,0]=2 3388 B15R1.9094 CC(C)(C)NCOC(=O)c1ccccc1 ebcab18f7ae276ae412b4487c61ee9b3 [1,0,0,0,0,1|0,0,2]=4 3389 B15R1.9094 CC(C)(F)CNCC(O)c1ccccc1 9df6fe55db0503fa26382cd0ce802cfa [1,0,0,0,0,1|1,0,0]=3 3390 B15R1.9094 CC(C)(F)CNCC(O)c1ccccn1 07e40b2da2f6fe03b9be784f36bb4de4 [1,0,0,0,0,1|2,0,0]=4 3391 B15R1.9094 CC(C)(F)CNCC(O)c1cccnc1 4214a21ab214fb577d1271e9d4a909d4 [1,0,0,0,0,1|2,0,0]=4 3392 B15R1.9094 CC(C)(F)CNCC(O)c1ccncc1 5d1c1e6c8b770acbae80e1cddd60f4fb [1,0,0,0,0,1|2,0,0]=4 3393 B15R1.9094 CC(C)(F)CNC[C@@H](O)c1ccccc1 2bfb83c131a1eb5913717579d513b622 [1,0,0,0,0,1|1,0,0]=3 3394 B15R1.9094 CC(C)(F)CNC[C@H](O)c1ccccc1 a84a94212a423691185a67a5cf9c6ba6 [1,0,0,0,0,1|1,0,0]=3 3395 B15R1.9094 CC(C)(O)CNCC(=O)c1ccccc1 7d12302fbef95296fc505fa585826839 [1,0,0,0,0,1|0,0,2]=4 3396 B15R1.9094 CC(C)(O)CNCC(F)c1ccccc1 114e3106b81ea287ee2baf5742dc3942 [1,0,0,0,0,1|1,0,0]=3 3397 B15R1.9094 CC(C)(O)CNCC(O)c1ccccc1 0b3f301cee70fd9976e256c0b26345fb [1,0,0,0,0,1|0,0,0]=2 3398 B15R1.9094 CC(C)(O)CNCC(O)c1ccccn1 cac482e199f3ef6252d1086cc756c15c [1,0,0,0,0,1|1,0,0]=3 3399 B15R1.9094 CC(C)(O)CNCC(O)c1cccnc1 6bd117d50863d6f21d6f07f7e752cceb [1,0,0,0,0,1|1,0,0]=3 3400 B15R1.9094 CC(C)(O)CNCC(O)c1ccncc1 80034966d5ce97a3b40ad38a3b511688 [1,0,0,0,0,1|1,0,0]=3 3401 B15R1.9094 CC(C)(O)CNCC(O)c1cnccn1 06246888453088980c7dac4615ec0b1d [1,0,0,0,0,1|2,0,0]=4 3402 B15R1.9094 CC(C)(O)CNC[C@@H](O)c1ccccc1 3a21b25e0bb3336a7829f21ad209e6e9 [1,0,0,0,0,1|0,0,0]=2 3403 B15R1.9094 CC(C)(O)CNC[C@H](O)c1ccccc1 f2cf1f000082b486d418c31c0fac72a7 [1,0,0,0,0,1|0,0,0]=2 3404 B15R1.9094 CC(CNCC(C)(C)C)c1ccccc1 07bf4d17625ea1587ee9ca8e2bd35744 [1,0,0,0,0,1|1,0,0]=3 3405 B15R1.9094 CC(CNCC(C)(C)F)c1ccccc1 0db5e3b88cdf09f2a52b8d63c0118101 [1,0,0,0,0,1|2,0,0]=4 3406 B15R1.9094 CC(CNCC(C)(C)O)c1ccccc1 de4a8fafd342c27bd8ac7cb7ca3487be [1,0,0,0,0,1|1,0,0]=3 3407 B15R1.9094 CC(COCC(C)(C)C)c1ccccc1 ccd948702f3087fb78ba3f27e3c152bb [1,0,0,0,0,1|2,0,0]=4 3408 B15R1.9094 CC(COCC(C)(C)O)c1ccccc1 ece5ccae7da99298c0ad8cbe9fde0964 [1,0,0,0,0,1|2,0,0]=4 3409 B15R1.9094 CC(F)(F)CNCC(O)c1ccccc1 e9c0514d6cd451097480dfe87f3d7bcd [1,0,0,0,0,1|2,0,0]=4 3410 B15R1.9094 CC(F)(F)CNC[C@@H](O)c1ccccc1 5ebef4e3d47ef15bd9fc6980d5810800 [1,0,0,0,0,1|2,0,0]=4 3411 B15R1.9094 CC(F)(F)CNC[C@H](O)c1ccccc1 ee0d55f46290815e945bdfd91225e5e0 [1,0,0,0,0,1|2,0,0]=4 3412 B15R1.9094 CC(NCCC(C)(C)C)c1ccccc1 ca89980386594748f9f42f6750710ca7 [1,0,0,0,0,1|2,0,0]=4 3413 B15R1.9094 CC(NCCC(C)(C)O)c1ccccc1 e73348b5be2027fedd67093576dd51e3 [1,0,0,0,0,1|2,0,0]=4 3414 B15R1.9094 CC(OCCC(C)(C)C)c1ccccc1 54eaf8095b897b730677e268aa1bc81f [1,0,0,0,0,1|2,0,0]=4 3415 B15R1.9094 CC(OCCC(C)(C)O)c1ccccc1 2468efcd02d7db7b9f1fff97c5651637 [1,0,0,0,0,1|2,0,0]=4 3416 B15R1.9094 CN(CCNC(C)(C)C)c1ccccc1 03a8e5b321d8a53acc3344d313b7c9c5 [1,0,0,0,0,1|2,0,0]=4 3417 B15R1.9094 C[C@@H](CNCC(C)(C)C)c1ccccc1 803193de5f19e79df335fac02ce3f6b2 [1,0,0,0,0,1|1,0,0]=3 3418 B15R1.9094 C[C@@H](CNCC(C)(C)F)c1ccccc1 2fb9ab08d79f6a77f17fc2859c9e1b02 [1,0,0,0,0,1|2,0,0]=4 3419 B15R1.9094 C[C@@H](CNCC(C)(C)O)c1ccccc1 2f9ff2a67a5f76b980725c02596ec6d0 [1,0,0,0,0,1|1,0,0]=3 3420 B15R1.9094 C[C@@H](COCC(C)(C)C)c1ccccc1 16ef684e13bb4b16474f15deb6feb767 [1,0,0,0,0,1|2,0,0]=4 3421 B15R1.9094 C[C@@H](COCC(C)(C)O)c1ccccc1 087da1d2caf8b835a354a1df212803c5 [1,0,0,0,0,1|2,0,0]=4 3422 B15R1.9094 C[C@@H](NCCC(C)(C)C)c1ccccc1 c0d48c32dc3a6401404df4cefa517657 [1,0,0,0,0,1|2,0,0]=4 3423 B15R1.9094 C[C@@H](NCCC(C)(C)O)c1ccccc1 e889810dd6c68dee71c990e70c26c79f [1,0,0,0,0,1|2,0,0]=4 3424 B15R1.9094 C[C@@H](OCCC(C)(C)C)c1ccccc1 2b4be2275d9498d4adc5ab2f09d8656b [1,0,0,0,0,1|2,0,0]=4 3425 B15R1.9094 C[C@@H](OCCC(C)(C)O)c1ccccc1 db7c7b456d3ab7ab17eb99f5b753b80e [1,0,0,0,0,1|2,0,0]=4 3426 B15R1.9094 C[C@H](CNCC(C)(C)C)c1ccccc1 37675350289cde5fa66a49013c4929a9 [1,0,0,0,0,1|1,0,0]=3 3427 B15R1.9094 C[C@H](CNCC(C)(C)F)c1ccccc1 d46ee1083cc891a1a14edb0df32a8195 [1,0,0,0,0,1|2,0,0]=4 3428 B15R1.9094 C[C@H](CNCC(C)(C)O)c1ccccc1 f642b21e157155a7a24f756f4abc8528 [1,0,0,0,0,1|1,0,0]=3 3429 B15R1.9094 C[C@H](COCC(C)(C)C)c1ccccc1 287e4ef542148c6e323f60d0d494d37d [1,0,0,0,0,1|2,0,0]=4 3430 B15R1.9094 C[C@H](COCC(C)(C)O)c1ccccc1 b4ed14f4e2eb998d4105ce91a8f3efa0 [1,0,0,0,0,1|2,0,0]=4 3431 B15R1.9094 C[C@H](NCCC(C)(C)C)c1ccccc1 dd1ae1e10763a30f689343264ae0f604 [1,0,0,0,0,1|2,0,0]=4 3432 B15R1.9094 C[C@H](NCCC(C)(C)O)c1ccccc1 244a5c696c4e4a33d383c3bec1e87f8d [1,0,0,0,0,1|2,0,0]=4 3433 B15R1.9094 C[C@H](OCCC(C)(C)C)c1ccccc1 5564670c7560a30d1787f7d35c96e1bf [1,0,0,0,0,1|2,0,0]=4 3434 B15R1.9094 C[C@H](OCCC(C)(C)O)c1ccccc1 f0548e327dd5fe83f2690e7fea526c76 [1,0,0,0,0,1|2,0,0]=4 3435 B15R1.9108 CC(C)(C)NCC(=O)Cc1ccccc1 67a1d19c9300acf9d4a8bb39dc0639df [1,0,0,0,0,1|0,0,2]=4 3436 B15R1.9108 CC(C)(C)NCC(=O)Nc1ccccc1 c6895d7d94e89136ab65118bd9dea62b [1,0,0,0,0,1|0,0,2]=4 3437 B15R1.9108 CC(C)(C)NCC(=O)Oc1ccccc1 5540755f0ed51a65fe4d24f943d80306 [1,0,0,0,0,1|0,0,2]=4 3438 B15R1.9108 CC(CCC(C)(C)C)Nc1ccccc1 9a0905b07a1562de0a5b33ee3ca42860 [1,0,0,0,0,1|2,0,0]=4 3439 B15R1.328 CC(C)(CF)NCCC(O)c1cccs1 1acf090f09d9fcf8840b470763534628 [0,0,0,0,1,1|2,0,0]=4 3440 B15R1.328 CC(C)(CO)CNCC(O)c1ccco1 98be481df4ffef35e1c9d4263f8e8d48 [0,0,0,0,1,1|1,0,0]=3 3441 B15R1.328 CC(C)(CO)CNCC(O)c1cccs1 e2960376666f1f59244f97a5adc143e8 [0,0,0,0,1,1|1,0,0]=3 3442 B15R1.328 CC(C)(CO)NCCC(O)c1cccs1 354c55defebf9a5e998b1fed98138ed1 [0,0,0,0,1,1|1,0,0]=3 3443 B15R1.328 CCC(C)(C)NCCC(O)c1cccs1 b6dd54006041cdcf197944edf86f584a [0,0,0,0,1,1|2,0,0]=4 3444 B17R1.396 CC(C)(CF)CNCCC(O)c1ccccc1 65678fcb39d2ddc2500ab56422f6972c [0,0,0,0,0,2|1,0,0]=3 3445 B17R1.396 CC(C)(CF)CNCC[C@@H](O)c1ccccc1 9d866fd376cf618c0a83769e230c0a03 [0,0,0,0,0,2|1,0,0]=3 3446 B17R1.396 CC(C)(CF)CNCC[C@H](O)c1ccccc1 e103a32198b8f718b59802239ea4f53a [0,0,0,0,0,2|1,0,0]=3 3447 B17R1.396 CC(C)(CO)CNCCC(O)c1ccccc1 c9534c60b9b7dcb07cf29ca60d7a0c95 [0,0,0,0,0,2|0,0,0]=2 3448 B17R1.396 CC(C)(CO)CNCCC(O)c1cccnc1 6560f9261ea6c978e2f55059f4adbbb3 [0,0,0,0,0,2|1,0,0]=3 3449 B17R1.396 CC(C)(CO)CNCC[C@@H](O)c1ccccc1 2b12da3291fec463d01b33d69e9ee444 [0,0,0,0,0,2|0,0,0]=2 3450 B17R1.396 CC(C)(CO)CNCC[C@H](O)c1ccccc1 053583d225b31c2216f3a4c20e5e14bb [0,0,0,0,0,2|0,0,0]=2 3451 B17R1.396 CC(C)(CO)CNCOC(=O)c1ccccc1 0642d899aeac6fc5ed29e7f2275c3f97 [0,0,0,0,0,2|0,0,2]=4 3452 B17R1.396 CC(C)(CO)NCCCC(=O)c1ccccc1 1d7f42a269cd324700065740bd085baf [0,0,0,0,0,2|0,0,2]=4 3453 B17R1.396 CC(C)(CO)NCCNC(=O)c1ccccc1 1b1938c5fed100ec3862cbd4e1c6a723 [0,0,0,0,0,2|0,0,2]=4 3454 B17R1.396 CC(C)(CO)NCCOC(=O)c1ccccc1 b18f7a7e486c0ec5baa906990137482d [0,0,0,0,0,2|0,0,2]=4 3455 B17R1.396 CC(CCNCC(C)(C)CF)c1ccccc1 798651c7e5fe9554bcaae7e1ff4aab73 [0,0,0,0,0,2|2,0,0]=4 3456 B17R1.396 CC(CCNCC(C)(C)CO)c1ccccc1 258ebc014740150e0e2651de46178fb1 [0,0,0,0,0,2|1,0,0]=3 3457 B17R1.396 CC(NCCCC(C)(C)CO)c1ccccc1 75cee8525af7bdfb5dafef87c8744519 [0,0,0,0,0,2|2,0,0]=4 3458 B17R1.396 CCC(C)(C)CCNCC(C)c1ccccc1 ba5fd9c45e361d0875c1a207bcf8b862 [0,0,0,0,0,2|2,0,0]=4 3459 B17R1.396 CCC(C)(C)CCNCC(O)c1ccccc1 8797663f58177778de5e9030ba9a2d75 [0,0,0,0,0,2|1,0,0]=3 3460 B17R1.396 CCC(C)(C)CCNCC(O)c1ccccn1 21b9f9a7710c8af1b1345e5af6026914 [0,0,0,0,0,2|2,0,0]=4 3461 B17R1.396 CCC(C)(C)CCNCC(O)c1cccnc1 ead2662e5ed1dc5de8accea98e1d80ec [0,0,0,0,0,2|2,0,0]=4 3462 B17R1.396 CCC(C)(C)CCNCC(O)c1ccncc1 73f61d126d9d32f80de07835db0759f9 [0,0,0,0,0,2|2,0,0]=4 3463 B17R1.396 CCC(C)(C)CCNC[C@@H](C)c1ccccc1 232d77f5775d6db92044093be4a75f16 [0,0,0,0,0,2|2,0,0]=4 3464 B17R1.396 CCC(C)(C)CCNC[C@@H](O)c1ccccc1 ded2fb08136320dbff503f25a10b8148 [0,0,0,0,0,2|1,0,0]=3 3465 B17R1.396 CCC(C)(C)CCNC[C@H](C)c1ccccc1 06b007a7c16b5e07d6dce1f7790c42aa [0,0,0,0,0,2|2,0,0]=4 3466 B17R1.396 CCC(C)(C)CCNC[C@H](O)c1ccccc1 443b5e1ae57f9448b1ac92518ca5ec47 [0,0,0,0,0,2|1,0,0]=3 3467 B17R1.396 CN(CCNCC(C)(C)CO)c1ccccc1 20ebf441b8300f8180b9b427a388285c [0,0,0,0,0,2|2,0,0]=4 3468 B17R1.396 COC(C)(C)CCNCC(O)c1ccccc1 eaa97435cb681a08e14df3e82586bf76 [0,0,0,0,0,2|2,0,0]=4 3469 B17R1.396 COC(C)(C)CCNC[C@@H](O)c1ccccc1 09bddaab33c1dcd6d6b2a85469dc5d4f [0,0,0,0,0,2|2,0,0]=4 3470 B17R1.396 COC(C)(C)CCNC[C@H](O)c1ccccc1 3cb3a4e160d8fa7e73d837947a682d12 [0,0,0,0,0,2|2,0,0]=4 3471 B17R1.396 C[C@@H](NCCCC(C)(C)CO)c1ccccc1 c7b09582e6b19f4ab9e93becef40c3b9 [0,0,0,0,0,2|2,0,0]=4 3472 B17R1.396 C[C@H](NCCCC(C)(C)CO)c1ccccc1 f717cf3032970078c59000a37e945a86 [0,0,0,0,0,2|2,0,0]=4 3473 B17R1.396 OCC(F)(F)CCNCC(O)c1ccccc1 21abe61fb25c5633fc04075d4626fc3f [0,0,0,0,0,2|2,0,0]=4 3474 B17R1.396 OCC(F)(F)CCNC[C@@H](O)c1ccccc1 2deb339d840f8a8250cd4fae9fc83916 [0,0,0,0,0,2|2,0,0]=4 3475 B17R1.396 OCC(F)(F)CCNC[C@H](O)c1ccccc1 ca4c49e42a193af3c6d9a71c6a447ead [0,0,0,0,0,2|2,0,0]=4 3476 B17R1.13073 CC(C)(CF)CNCC(O)Cc1ccccc1 5c482653dd0db89370bafbc91f75e318 [0,0,0,0,0,2|1,0,0]=3 3477 B17R1.13073 CC(C)(CF)CNC[C@@H](O)Cc1ccccc1 acc81c577c50e4284a356d32ec5e20c3 [0,0,0,0,0,2|1,0,0]=3 3478 B17R1.13073 CC(C)(CO)CNCC(=O)Cc1ccccc1 1188a935ea2573de10f11418d8e666c3 [0,0,0,0,0,2|0,0,2]=4 3479 B17R1.13073 CC(C)(CO)CNCC(=O)Nc1ccccc1 b025a0921242f2da1c24ab008fdd1aaf [0,0,0,0,0,2|0,0,2]=4 3480 B17R1.13073 CC(C)(CO)CNCC(=O)Oc1ccccc1 718fad21653b3e8704b2d27960e708d7 [0,0,0,0,0,2|0,0,2]=4 3481 B17R1.13073 CC(C)(CO)NCCC(=O)Nc1ccccc1 6a3a6691f49c0b73041a02f771f7b595 [0,0,0,0,0,2|0,0,2]=4 3482 B17R1.13073 CC(C)(CO)NCCC(=O)Oc1ccccc1 c18f4028af93859560b5716632ce7536 [0,0,0,0,0,2|0,0,2]=4 3483 B17R1.13073 CC(CNCC(C)(C)CO)Oc1ccccc1 9c79ccf30119011050db67eae06a680a [0,0,0,0,0,2|1,0,0]=3 3484 B17R1.13073 CC(CNCC(C)(C)CO)Oc1cccnc1 55df7d2366d7d3f53c80d3d2cb6e6b5d [0,0,0,0,0,2|2,0,0]=4 3485 B17R1.13073 CN(CCNC(C)(C)CO)Cc1ccccc1 a7009641b569a800b1331f12b224be63 [0,0,0,0,0,2|2,0,0]=4 3486 B17R1.13184 C#CC(C)(C)NCC(O)COc1ccccc1 d27c34e98b1646551b268c5aee4fba76 [0,0,0,0,0,2|1,0,1]=4 3487 B17R1.13184 CC(C)(CO)NCC(=O)NCc1ccccc1 d0766db303750f090e339371659b6fb9 [0,0,0,0,0,2|0,0,2]=4 3488 B17R1.13184 CC(C)(CO)NCC(=O)OCc1ccccc1 b248b0b0df77db9ead4bf84e1fee17de [0,0,0,0,0,2|0,0,2]=4 3489 B17R1.13184 CC(C)(CO)NCC(O)COc1ccccc1 1bfc032a78b4dbcd9821977a7b2d489b [0,0,0,0,0,2|0,0,0]=2