0 B11R1.77 C=C(C)CC(=O)N1CC=CC1 35bd2cc0534478db5b48edc955238fcc [0,0,0,0,0,0|3,0,1]=4 1 B11R1.77 C=C(C)CN(C)c1ncco1 60b4bc4f81a0282eb3e2f6c36fb5c074 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.77 CC(=O)CC(=O)N1CC=CC1 a0d26fac9a95e4e323f1c2af3536401d [0,0,0,0,0,0|2,0,1]=3 3 B11R1.77 CC(=O)NC(C)c1ccco1 c1f414cbe29927a43c5ea82bc1066b08 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.77 CC(=O)NC(C)c1cccs1 e7ae72928c15ab3e748d7e1c8cf72906 [0,0,0,0,0,0|2,1,1]=4 5 B11R1.77 CC(=O)NC(C)c1ncco1 fd525221588f8253603eb6525149d065 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.77 CC(=O)N[C@@H](C)c1cccs1 b818cd586259681e42d14261ef748959 [0,0,0,0,0,0|2,1,1]=4 7 B11R1.77 CC(=O)N[C@H](C)c1ccco1 b21b5fa102dd5d98ec9d9b39f45da936 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.77 CC(=O)N[C@H](C)c1cccs1 f815dc1cf41a56fe27ec577f5b868185 [0,0,0,0,0,0|2,1,1]=4 9 B11R1.77 CN(CC(=O)N)c1ncco1 f368f9ff1ccc7daaf84f4dc076f24930 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.77 CN(CC(=O)O)c1ncco1 c91892fc17a595c52495ce8f5ff28e21 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.77 NC(=O)CC(=O)N1CC=CC1 272f090c5dd00ab3dffebc70456216ad [0,0,0,0,0,0|3,0,1]=4 12 B10R1.11 CC(NC=O)c1ccco1 ddbe85663f32152ae7a905d80f70dce5 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.11 CN(CC=O)c1ncco1 67ddaa0508c67b711ba2fcc9711a9eda [1,0,0,0,0,0|3,0,0]=4 14 B10R1.11 C[C@@H](NC=O)c1ccco1 dabf68fc67919a7d4d3c16b33f054bdc [1,0,0,0,0,0|2,0,1]=4 15 B10R1.11 N#CNC(=O)c1ccco1 1adef430898af33746a6c9ec84528171 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.11 O=CCC(=O)N1CC=CC1 bcd882f425b5e4479d48f77bfc6f32aa [1,0,0,0,0,0|2,0,1]=4 17 B10R1.66 C=C(Br)CNc1ccco1 46cb655391dd7ee0099e3f68361df23b [1,0,0,0,0,0|2,0,1]=4 18 B10R1.66 C=C(Br)COc1ccco1 d0b6cd16dd8f8a048de010b54cb1126a [1,0,0,0,0,0|2,0,1]=4 19 B10R1.66 C=C(C)CNc1cccs1 d16c7a810bce5bfe2c251346fc272f1b [1,0,0,0,0,0|2,1,0]=4 20 B10R1.66 C=C(C)CNc1ccno1 e81af668258a6501f050fe1cde60bb8a [1,0,0,0,0,0|3,0,0]=4 21 B10R1.66 C=C(C)CNc1ncco1 0ca709ff7fbabcdc574e2630eee794e2 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.66 C=C(C)COc1ccco1 b3f905ff0261eb167bbdc638ad76153d [1,0,0,0,0,0|2,0,0]=3 23 B10R1.66 C=C(C)COc1cccs1 ba490c6192f94efd35b9a3807f014ce8 [1,0,0,0,0,0|2,1,0]=4 24 B10R1.66 C=C(Cl)COc1ccco1 aba02f3358eca90651a93a5b886bb155 [1,0,0,0,0,0|2,0,1]=4 25 B10R1.66 C=C(F)COc1ccco1 a2f9f6f7135fa61d0ed061da3bb59ad7 [1,0,0,0,0,0|2,0,1]=4 26 B10R1.66 CC(=O)CNc1c[nH]cn1 be2bea778bbeba0f31cba71636f977f9 [1,0,0,0,0,0|3,0,0]=4 27 B10R1.66 CC(=O)CNc1ccco1 a59c8e4ff03257d947231d2e71f4d6c9 [1,0,0,0,0,0|1,0,0]=2 28 B10R1.66 CC(=O)CNc1cccs1 cd83157d86433e62c17b868e5fb1470c [1,0,0,0,0,0|1,1,0]=3 29 B10R1.66 CC(=O)CNc1ccns1 8a92cdd13240b83844dafa37c1c87abc [1,0,0,0,0,0|2,1,0]=4 30 B10R1.66 CC(=O)CNc1ccoc1 f96f84316e97865366e82ff70b21a405 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.66 CC(=O)CNc1ccsc1 264cfd5bd6905699df6036299a4d94ea [1,0,0,0,0,0|3,0,0]=4 32 B10R1.66 CC(=O)CNc1cncs1 08e34da9bd442eefd33450d52d14bc76 [1,0,0,0,0,0|2,1,0]=4 33 B10R1.66 CC(=O)CNc1cscn1 482c21989e7459cf1cfac3954fb324f0 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.66 CC(=O)CNc1nccs1 77a4f07613bba7bf49318b232ac5c431 [1,0,0,0,0,0|2,1,0]=4 35 B10R1.66 CC(=O)NCc1ccco1 88956646aad494b49b38617dc9c4b71b [1,0,0,0,0,0|1,0,1]=3 36 B10R1.66 CC(=O)NCc1cccs1 f628a56aae62b1b399cb045563e5a584 [1,0,0,0,0,0|1,1,1]=4 37 B10R1.66 CC(=O)NCc1ccno1 23171c461f7c76fb2a080276054f467a [1,0,0,0,0,0|2,0,1]=4 38 B10R1.66 CC(=O)NCc1cnco1 2f9cdc814f8776fe414302b1109682db [1,0,0,0,0,0|2,0,1]=4 39 B10R1.66 CC(=O)NCc1ncco1 6519ae7ebb18199243fcd7f03af8a730 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.66 CC(C)COc1ccco1 9a23c54afcd88900faea26a95d44c122 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.66 CN(C)COc1ccco1 c10f1087d88a829336b344ddc05de043 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.66 NC(=O)CNc1ccco1 382c54ff125dc94771cf8fb1720983d9 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.66 NC(=O)CNc1cccs1 c1848d6f8f82234eb7410dbb98641bc4 [1,0,0,0,0,0|2,1,0]=4 44 B10R1.66 NC(=O)CNc1ccno1 9acc666c5eefa558f126b1961e956b46 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.66 NC(=O)CNc1ncco1 fbf6a938366b6f1a796a59255db001be [1,0,0,0,0,0|3,0,0]=4 46 B10R1.66 NC(=O)COc1ccco1 1a2e54051ed18393ef61d43ef5486554 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.66 NC(=O)COc1cccs1 6d788ab9a430fdaac4ae196a6438a596 [1,0,0,0,0,0|2,1,0]=4 48 B10R1.66 O=C(O)CNc1cccs1 4058449a8cebe920b6e952aa38581266 [1,0,0,0,0,0|2,1,0]=4 49 B10R1.66 O=C(O)CNc1ccno1 375180111439d2c3a881638818b3cb4d [1,0,0,0,0,0|3,0,0]=4 50 B10R1.66 O=C(O)CNc1ncco1 9cee89407c4dddbde9fb6861286ad5b4 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.66 O=C(O)COc1ccco1 6b958b8d422d5fb1092e70422390022e [1,0,0,0,0,0|2,0,0]=3 52 B10R1.66 O=C(O)COc1cccs1 21851641d4378df5c5d5c2979c3c711b [1,0,0,0,0,0|2,1,0]=4 53 B10R1.66 O=[N+]([O-])COc1ccco1 539b21af5fa1c2f96f80cb505519c8fc [1,0,0,0,0,0|3,0,0]=4 54 B12R1.15 C#CC(C)NC(=O)c1ccco1 acf53c64bda85bed11fa26ffb2321f92 [0,1,0,0,0,0|2,0,1]=4 55 B12R1.15 C#C[C@@H](C)NC(=O)c1ccco1 dee126210f4701577e628e6489df5887 [0,1,0,0,0,0|2,0,1]=4 56 B12R1.15 C#C[C@H](C)NC(=O)c1ccco1 e45622daf661591711a8ed3e6663f0d5 [0,1,0,0,0,0|2,0,1]=4 57 B12R1.15 C=CC(C)NC(=O)c1ccco1 0acb30d584490b4bbf12c94896988d7a [0,1,0,0,0,0|2,0,1]=4 58 B12R1.15 CC(C#N)NC(=O)c1ccco1 1c7a072ee7435cff8596ab3d9845cb31 [0,1,0,0,0,0|2,0,1]=4 59 B12R1.15 CC(CO)NC(=O)c1ccco1 4a09a19799d9a4d27122c3d98b299696 [0,1,0,0,0,0|1,0,2]=4 60 B12R1.15 CC(NC(=O)CF)c1ccco1 5e633ec784282814b9f5c4e2597cc847 [0,1,0,0,0,0|2,0,1]=4 61 B12R1.15 CC(NC(=O)CO)c1ccco1 b272aaefa5de1b54c344dea91536a18c [0,1,0,0,0,0|2,0,1]=4 62 B12R1.15 CC(NC(=O)CS)c1ccco1 7c057b94321345652be575f5e6b2176e [0,1,0,0,0,0|2,0,1]=4 63 B12R1.15 CCC(=O)CN(C)c1ncco1 b170ffb704b688ba476b3025464022a0 [0,1,0,0,0,0|3,0,0]=4 64 B12R1.15 CCC(=O)NC(C)c1ccco1 00d62021e0fd2bcc7006d596e064ba6b [0,1,0,0,0,0|2,0,1]=4 65 B12R1.15 CCC(=O)N[C@H](C)c1ccco1 dc83c0eb3e3d4a456d7d8dad5a07d713 [0,1,0,0,0,0|2,0,1]=4 66 B12R1.15 CCC(C)NC(=O)c1ccco1 9665ddfcb4b3c896f44fb86f6afbd5cf [0,1,0,0,0,0|2,0,1]=4 67 B12R1.15 CCN(C)CC(=O)c1ccco1 505744ad759f03e4af74801b751476bf [0,1,0,0,0,0|2,0,0]=3 68 B12R1.15 CCN(C)CC(=O)c1cccs1 59fa2fceece6e869d9632d0cc65b7c6d [0,1,0,0,0,0|2,1,0]=4 69 B12R1.15 CCN(C)CC(=O)c1ncco1 ed52c5b0c09b3eb8922812d4d6100499 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.15 CC[C@@H](C)NC(=O)c1ccco1 7cce0a31f715a783bbfc17be073e3d9e [0,1,0,0,0,0|2,0,1]=4 71 B12R1.15 CC[C@H](C)NC(=O)c1ccco1 d9059dc6c8f32d289f868af6109bc5c9 [0,1,0,0,0,0|2,0,1]=4 72 B12R1.15 CN(CC(=O)CO)c1ncco1 a5c5648cbf02c08b681606088bef2946 [0,1,0,0,0,0|3,0,0]=4 73 B12R1.15 CNC(=O)CC(=O)N1CC=CC1 1807d0c4f01be89b05dd06e4dbaf8ea9 [0,1,0,0,0,0|2,0,1]=4 74 B12R1.15 CNC(=O)CN(C)c1cccs1 86fa4aa3ae804ce5816ba80b9c248769 [0,1,0,0,0,0|2,1,0]=4 75 B12R1.15 CNC(=O)CN(C)c1ncco1 f949e5d17cbf21ddaa96554494606bcc [0,1,0,0,0,0|3,0,0]=4 76 B12R1.15 COC(=O)CC(=O)N1CC=CC1 03e7fb6aee2723462c796716fd9e13db [0,1,0,0,0,0|2,0,1]=4 77 B12R1.15 COC(=O)CN(C)c1ncco1 89a34aad746e046c9b33c74bfd328bbc [0,1,0,0,0,0|3,0,0]=4 78 B12R1.15 C[C@@H](CO)NC(=O)c1ccco1 e6b66bec19c7310b3d33eb9d8584c367 [0,1,0,0,0,0|1,0,2]=4 79 B12R1.15 C[C@@H](NC(=O)CF)c1ccco1 b4c6293c435fc4b4ffb1a509699e6474 [0,1,0,0,0,0|2,0,1]=4 80 B12R1.15 C[C@@H](NC(=O)CO)c1ccco1 b0705173842a282141b325a99d26a5c8 [0,1,0,0,0,0|2,0,1]=4 81 B12R1.15 C[C@@H](NC(=O)CS)c1ccco1 e5a2a0ac4db12c038403570952bbabfe [0,1,0,0,0,0|2,0,1]=4 82 B12R1.15 C[C@H](CO)NC(=O)c1ccco1 4017f7669408328ed0b90687e2d43bf7 [0,1,0,0,0,0|1,0,2]=4 83 B12R1.103 CC(=O)NC(C)c1ccc(o1)C 14a20018db4e1debf3fe6aa5b76e92ac [0,1,0,0,0,0|2,0,1]=4 84 B12R1.103 CC(=O)N[C@H](C)c1ccc(o1)C faeeb9777d1dcbea4d54f534cc0e11d3 [0,1,0,0,0,0|2,0,1]=4 85 B12R1.103 Cc1ccc(o1)N(C)CC(=O)N 2629a8faad891af35e0284b4019069e3 [0,1,0,0,0,0|3,0,0]=4 86 B12R1.120 CC(C)N(C)C(=O)c1ccco1 166c7398253de6f6adc88896bebe3df4 [0,1,0,0,0,0|2,0,1]=4 87 B12R1.265 CC(C)(C)NC(=O)c1ccco1 f2cdedf9e74652b03262a09a34d90932 [0,1,0,0,0,0|2,0,1]=4 88 B12R1.476 CCC(NC(=O)C)c1ccco1 6906981556ee166cd75b44fafb7d0ffe [0,1,0,0,0,0|2,0,1]=4 89 B10R0.6 C=CCCNC(=O)CC(=O)C 5e75550a389bab4b2bd99b10efaa4a13 [0,0,1,0,0,0|2,0,1]=4 90 B10R0.6 CC=CCNC(=O)CC(=O)C eaeeb509dcd628c7741b66da9638db15 [0,0,1,0,0,0|2,0,1]=4 91 B10R0.32 C=CCN(C)C(=O)CC(=O)C e5e819cda017818cc8d686be0dbe1e50 [0,0,1,0,0,0|2,0,1]=4 92 B12R2.6 Cc1c[nH]c(n1)c2ccco2 4fcc7c99e08cd67b888dd54e5b56b4f2 [0,0,0,1,0,0|3,0,0]=4 93 B12R2.6 Cc1cc(c[nH]1)c2ccco2 6b7aaf37fb5833ef0a5e5f415431c6e6 [0,0,0,1,0,0|2,0,1]=4 94 B12R2.6 Cc1cc(cs1)c2ccco2 4e9de336fcd30bd116c1d4cf4b6bdc49 [0,0,0,1,0,0|1,1,1]=4 95 B12R2.6 Cc1cc(n[nH]1)c2ccco2 5deefb012aa29f3ab0858a4ff50fd774 [0,0,0,1,0,0|2,0,1]=4 96 B12R2.6 Cc1cc(no1)c2ccco2 8f5b8119be6cbb02855165876da80708 [0,0,0,1,0,0|1,0,2]=4 97 B12R2.6 Cc1cc(ns1)c2ccco2 5d652dadc822270a4be4453187f9994a [0,0,0,1,0,0|1,1,1]=4 98 B12R2.6 Cc1cc(on1)c2ccco2 146b8326a572d0384ad6a76dd911328a [0,0,0,1,0,0|1,0,2]=4 99 B12R2.6 Cc1cc(sn1)c2ccco2 6d914703e0ee7b89adcaa3779fb10d90 [0,0,0,1,0,0|1,1,1]=4 100 B12R2.6 Cc1ccc([nH]1)c2ccco2 be20a8dd5c20aacff8a9af94b73250af [0,0,0,1,0,0|3,0,0]=4 101 B12R2.6 Cc1ccc(o1)c2ccco2 70f4ed5d66ca8d1ecdf510f32db5cb72 [0,0,0,1,0,0|3,0,0]=4 102 B12R2.6 Cc1ccc(s1)c2ccco2 8f12764b6c183bdcfed2f58307bf9203 [0,0,0,1,0,0|3,0,0]=4 103 B12R2.6 Cc1cnc(o1)c2ccco2 0861075cf8b3f68301ce019eeaed3872 [0,0,0,1,0,0|3,0,0]=4 104 B12R2.6 Cc1cnc(s1)c2ccco2 8bb1160bed4293d18945f7109e8e4176 [0,0,0,1,0,0|3,0,0]=4 105 B12R2.6 Cc1coc(c1)c2ccco2 db75051b4573f30c30630eb6f53362ca [0,0,0,1,0,0|1,0,2]=4 106 B12R2.6 Cc1coc(n1)c2ccco2 42bb5c9c3360d1a727112bad2f523cbf [0,0,0,1,0,0|2,0,1]=4 107 B12R2.6 Cc1csc(c1)c2ccco2 3a0f49632a265669f7beb2e44ebf88ea [0,0,0,1,0,0|1,1,1]=4 108 B12R2.6 Cc1csc(n1)c2ccco2 300cd8762efdd1e0d44b0f6f6c3aa061 [0,0,0,1,0,0|2,1,0]=4 109 B12R2.6 Cc1nc(c[nH]1)c2ccco2 4a26529f7a9c9ed8ba03ca4ad2cb346c [0,0,0,1,0,0|3,0,0]=4 110 B12R2.6 Cc1nc(co1)c2ccco2 124edffc2590d4abee60a5dc157382e5 [0,0,0,1,0,0|2,0,1]=4 111 B12R2.6 Cc1nc(cs1)c2ccco2 e687eec462faf3376d62b05144a64055 [0,0,0,1,0,0|2,1,0]=4 112 B12R2.6 Cc1nc(n[nH]1)c2ccco2 ec00a2affb3cc34e69442b2a1ce0cc7d [0,0,0,1,0,0|3,0,0]=4 113 B12R2.6 Cc1nc(no1)c2ccco2 2df6ffd2519553f08ceffef9cbfaf3cf [0,0,0,1,0,0|2,0,1]=4 114 B12R2.6 Cc1nc(ns1)c2ccco2 4c2242d003001c95bb49a1eeb116577a [0,0,0,1,0,0|2,1,0]=4 115 B12R2.6 Cc1ncc(o1)c2ccco2 7e19f279b447e4b083a8f5a476e203f8 [0,0,0,1,0,0|3,0,0]=4 116 B12R2.6 Cc1ncc(s1)c2ccco2 25f56ef7e678efba3ea340be6363495d [0,0,0,1,0,0|3,0,0]=4 117 B12R2.6 Cc1nnc(o1)c2ccco2 f85685d423e50398ed544089acc85318 [0,0,0,1,0,0|3,0,0]=4 118 B12R2.6 Cc1nnc(s1)c2ccco2 16c574c3f0fb2569d2fa234ce22e6287 [0,0,0,1,0,0|3,0,0]=4 119 B12R2.6 Cc1noc(n1)c2ccco2 4c4f46e2715ffbd1de267b914852dfc3 [0,0,0,1,0,0|2,0,1]=4 120 B12R2.6 Cc1nsc(n1)c2ccco2 a21ee9ca7b110766d69346cac2312604 [0,0,0,1,0,0|2,1,0]=4 121 B12R2.2074 O=C(NC1CC1)c2ccco2 b9a16304db843f7b4241c371a07368e1 [0,0,0,1,0,0|2,0,1]=4 122 B10R1.23 CC(=O)C(=O)N1CC=CC1 97eceee3057184d739dc68b3efe3f646 [0,0,0,0,1,0|2,0,1]=4 123 B10R1.23 CC(=O)N(C)c1ncco1 fbef3ee7d925bf7234b315644b4968be [0,0,0,0,1,0|3,0,0]=4 124 B12R1.54 C=C(Br)CNC(=O)c1ccco1 cce07c146e882649625fdb23df6f8457 [0,0,0,0,0,1|1,0,1]=3 125 B12R1.54 C=C(Br)CNC(=O)c1cccs1 ec1bd5f62fde471ca7bf728d4e068b27 [0,0,0,0,0,1|1,1,1]=4 126 B12R1.54 C=C(Br)CNC(=O)c1ccno1 82f96eb69a789954b9d207347a5f73d0 [0,0,0,0,0,1|2,0,1]=4 127 B12R1.54 C=C(Br)CNC(=O)c1cnco1 b34f53eab39d3dfa00ecabc4f1d421af [0,0,0,0,0,1|2,0,1]=4 128 B12R1.54 C=C(Br)CNC(=O)c1ncco1 950a665b1bccc3a6f5a8959212ff1536 [0,0,0,0,0,1|2,0,1]=4 129 B12R1.54 C=C(C)CNC(=O)c1ccco1 752f4ba6ec69df06823be272bf8de6cc [0,0,0,0,0,1|1,0,0]=2 130 B12R1.54 C=C(C)CNC(=O)c1cccs1 2320e6e113e1bc31a109255aad33a6de [0,0,0,0,0,1|1,1,0]=3 131 B12R1.54 C=C(C)CNC(=O)c1ccno1 3adf80e804e7373dd88d276f2d97ba9c [0,0,0,0,0,1|2,0,0]=3 132 B12R1.54 C=C(C)CNC(=O)c1ccns1 d3d32f073c491d629e976722efdc2120 [0,0,0,0,0,1|2,1,0]=4 133 B12R1.54 C=C(C)CNC(=O)c1ccoc1 c12dea8b46bcb318c2067927e8f7afb4 [0,0,0,0,0,1|3,0,0]=4 134 B12R1.54 C=C(C)CNC(=O)c1ccon1 71864cc24f2c8af1edf05d740e7a0b35 [0,0,0,0,0,1|3,0,0]=4 135 B12R1.54 C=C(C)CNC(=O)c1ccsc1 f53e69031b973d728f5e28ec8312f3f8 [0,0,0,0,0,1|3,0,0]=4 136 B12R1.54 C=C(C)CNC(=O)c1ccsn1 2461a2455d93f06b83d2557cc32e3e6f [0,0,0,0,0,1|3,0,0]=4 137 B12R1.54 C=C(C)CNC(=O)c1cnco1 690be135dd036870ec561586d43ee29a [0,0,0,0,0,1|2,0,0]=3 138 B12R1.54 C=C(C)CNC(=O)c1cncs1 ea24be4b4c98202411c7e425328cc895 [0,0,0,0,0,1|2,1,0]=4 139 B12R1.54 C=C(C)CNC(=O)c1cocn1 72f6f2cdbead16a4755db158f17e4600 [0,0,0,0,0,1|3,0,0]=4 140 B12R1.54 C=C(C)CNC(=O)c1cscn1 807ba2665351987e06dcf2f210fd0c79 [0,0,0,0,0,1|3,0,0]=4 141 B12R1.54 C=C(C)CNC(=O)c1ncco1 1ab49c2fc02e153551a1889147cb12c5 [0,0,0,0,0,1|2,0,0]=3 142 B12R1.54 C=C(C)CNC(=O)c1nccs1 efecedf6e948794b6d446a27becfd363 [0,0,0,0,0,1|2,1,0]=4 143 B12R1.54 C=C(C)CNC(=O)c1nnco1 9be670cd3cf63163ea50ae855a794a0c [0,0,0,0,0,1|3,0,0]=4 144 B12R1.54 C=C(C)CNC(C)c1ccco1 c9e5d4a874da072240ab08c3788f7fea [0,0,0,0,0,1|2,0,1]=4 145 B12R1.54 C=C(C)CN[C@H](C)c1ccco1 62851749aa26266a0cd2cecf98346857 [0,0,0,0,0,1|2,0,1]=4 146 B12R1.54 C=C(C)COC(C)c1ccco1 bac10378e397b117724d2383af60247a [0,0,0,0,0,1|2,0,1]=4 147 B12R1.54 C=C(C)CO[C@H](C)c1ccco1 f7d362fcddb233d0a64f8741beba9c2f [0,0,0,0,0,1|2,0,1]=4 148 B12R1.54 CC(=O)CCC(=O)N1CC=CC1 587bb6227dc889c95aca1b23385fd4fd [0,0,0,0,0,1|2,0,1]=4 149 B12R1.54 CC(=O)CCN(C)c1ncco1 187f9286d54bab41b0001714145cb5bd [0,0,0,0,0,1|3,0,0]=4 150 B12R1.54 CC(=O)CNC(=O)C1=CCCC1 e8a685e30805362db5d18eaee059cfb8 [0,0,0,0,0,1|1,0,2]=4 151 B12R1.54 CC(=O)CNC(=O)C1=CCOC1 ab2c634753716314b72a9610e4ad6bae [0,0,0,0,0,1|2,0,1]=4 152 B12R1.54 CC(=O)CNC(=O)C1=COCC1 3bc7dafdd0131699b6822c3b6c683f75 [0,0,0,0,0,1|2,0,1]=4 153 B12R1.54 CC(=O)CNC(=O)N1CC=CC1 644dfaf133f1f544f00af6e9a7b8ce03 [0,0,0,0,0,1|2,0,1]=4 154 B12R1.54 CC(=O)CNC(=O)c1ccco1 56654b89a8dfbd72cd379dbeb9d1b7b7 [0,0,0,0,0,1|0,0,0]=1 155 B12R1.54 CC(=O)CNC(=O)c1cccs1 fe215c13eefaa2b3c150fade8c32cef7 [0,0,0,0,0,1|0,1,0]=2 156 B12R1.54 CC(=O)CNC(=O)c1ccno1 1c79ea6cd80917f1f1bedea0f3721d92 [0,0,0,0,0,1|1,0,0]=2 157 B12R1.54 CC(=O)CNC(=O)c1ccns1 19fa892f8160ef9e68ded530e8aabb12 [0,0,0,0,0,1|1,1,0]=3 158 B12R1.54 CC(=O)CNC(=O)c1ccoc1 912fd4eec2253989b7ceedb8b6e2ba8f [0,0,0,0,0,1|2,0,0]=3 159 B12R1.54 CC(=O)CNC(=O)c1ccon1 8202865f6553f9f7a79f8e593897f3b3 [0,0,0,0,0,1|2,0,0]=3 160 B12R1.54 CC(=O)CNC(=O)c1ccsc1 e020f6649240f93de16027fe5e1ac1c7 [0,0,0,0,0,1|2,0,0]=3 161 B12R1.54 CC(=O)CNC(=O)c1ccsn1 b4338499f9ae3994451cc497eb7a3311 [0,0,0,0,0,1|2,0,0]=3 162 B12R1.54 CC(=O)CNC(=O)c1cnco1 1b135ac91161c17ce956cbe0b85c44f7 [0,0,0,0,0,1|1,0,0]=2 163 B12R1.54 CC(=O)CNC(=O)c1cncs1 ce795bccb7dcee06791ed2a8a5855278 [0,0,0,0,0,1|1,1,0]=3 164 B12R1.54 CC(=O)CNC(=O)c1cnns1 12411eea2eca821888a39adbcfb0733d [0,0,0,0,0,1|2,1,0]=4 165 B12R1.54 CC(=O)CNC(=O)c1cnoc1 2fe99276c4d14a6ad59f91c2fd9b0566 [0,0,0,0,0,1|3,0,0]=4 166 B12R1.54 CC(=O)CNC(=O)c1cnon1 6dfbe23a409cb5c687c71b45637bfbfc [0,0,0,0,0,1|3,0,0]=4 167 B12R1.54 CC(=O)CNC(=O)c1cnsc1 fef6525605c62b579c7c6e6166e39125 [0,0,0,0,0,1|3,0,0]=4 168 B12R1.54 CC(=O)CNC(=O)c1cnsn1 051a8621d016ff16e19fd059ff441250 [0,0,0,0,0,1|3,0,0]=4 169 B12R1.54 CC(=O)CNC(=O)c1cocn1 7d0e111705db4dde05fcd3590f4a89fe [0,0,0,0,0,1|2,0,0]=3 170 B12R1.54 CC(=O)CNC(=O)c1cscn1 b0cbbc5e8ade2541db95a10106f85a9e [0,0,0,0,0,1|2,0,0]=3 171 B12R1.54 CC(=O)CNC(=O)c1csnn1 039cde2438e42b89e0739eb089800900 [0,0,0,0,0,1|3,0,0]=4 172 B12R1.54 CC(=O)CNC(=O)c1ncco1 61dcf8f0a01e0a143701fa96502f453a [0,0,0,0,0,1|1,0,0]=2 173 B12R1.54 CC(=O)CNC(=O)c1nccs1 bfd946350d2f49fd363b00a6b997b54c [0,0,0,0,0,1|1,1,0]=3 174 B12R1.54 CC(=O)CNC(=O)c1ncns1 d2f9be8355f5e2093f5e5bb0e2e43c3b [0,0,0,0,0,1|2,1,0]=4 175 B12R1.54 CC(=O)CNC(=O)c1ncon1 61a820eec7fcbf2b74985a029dff2912 [0,0,0,0,0,1|3,0,0]=4 176 B12R1.54 CC(=O)CNC(=O)c1nnco1 b32964e876873cd42b0015f55986a157 [0,0,0,0,0,1|2,0,0]=3 177 B12R1.54 CC(=O)NCC(=O)N1CC=CC1 66fd53190d96ceaabdf456cd085887ce [0,0,0,0,0,1|2,0,1]=4 178 B12R1.54 CC(=O)NCC(O)c1ccco1 f2e81afc8e8304b7e3ab1869a2593ba5 [0,0,0,0,0,1|0,0,2]=3 179 B12R1.54 CC(=O)NCC(O)c1cccs1 43262675cb0d43f197929195cc595e21 [0,0,0,0,0,1|0,1,2]=4 180 B12R1.54 CC(=O)OCC(=O)N1CC=CC1 a8b82026e7d4576535c877ce305c2206 [0,0,0,0,0,1|2,0,1]=4 181 B12R1.54 CC(=O)OCN(C)c1ncco1 1f6705c88a25f80e90f5d33f3e51ed50 [0,0,0,0,0,1|3,0,0]=4 182 B12R1.54 CC(=O)SCC(=O)N1CC=CC1 562dfe75eb476bc27197c6efa5ec49c4 [0,0,0,0,0,1|2,0,1]=4 183 B12R1.54 CC(C)CNC(=O)c1ccco1 30af187b533e7dcd58f9654a3fbfb2e8 [0,0,0,0,0,1|1,0,1]=3 184 B12R1.54 CC(C)CNC(=O)c1cccs1 d824d6664b7180afb486efdf0caa6926 [0,0,0,0,0,1|1,1,1]=4 185 B12R1.54 CC(C)CNC(=O)c1ccno1 2c33878bfe5ddb51408756bd3fda599b [0,0,0,0,0,1|2,0,1]=4 186 B12R1.54 CC(C)CNC(=O)c1cnco1 9c42c082067405e1fa5458d447bfbff0 [0,0,0,0,0,1|2,0,1]=4 187 B12R1.54 CC(C)CNC(=O)c1ncco1 0aff257a1efc8a19247afa628d51386b [0,0,0,0,0,1|2,0,1]=4 188 B12R1.54 CC(C)OCC(=O)c1ccco1 155a55d88c82b5f16ab2135ef10deadb [0,0,0,0,0,1|1,0,1]=3 189 B12R1.54 CC(C)OCC(=O)c1cccs1 22cb4ffc6a69bfbbdf24fe51b56bf0b4 [0,0,0,0,0,1|1,1,1]=4 190 B12R1.54 CC(C)OCC(=O)c1ncco1 cd749e65345f298a720d3f4756ba10f6 [0,0,0,0,0,1|2,0,1]=4 191 B12R1.54 CC(NCC(=O)N)c1ccco1 eff112b2b40dd8e7050d780004cd011f [0,0,0,0,0,1|2,0,1]=4 192 B12R1.54 CC(NCC(=O)O)c1ccco1 551a5ae64bc1aa1551a5133c7605b454 [0,0,0,0,0,1|2,0,1]=4 193 B12R1.54 CC(O)CNC(=O)c1ccco1 b7e4e5216645de54f94e7fb629df1a34 [0,0,0,0,0,1|0,0,2]=3 194 B12R1.54 CC(O)CNC(=O)c1cccs1 cdfdcdf46f08693accb4106ce1e91018 [0,0,0,0,0,1|0,1,2]=4 195 B12R1.54 CC(O)CNC(=O)c1ccno1 1ff3a464d6890f841e8ef60b61d0e806 [0,0,0,0,0,1|1,0,2]=4 196 B12R1.54 CC(O)CNC(=O)c1cnco1 c9128278f2ce67d827571e47ac6bb9c5 [0,0,0,0,0,1|1,0,2]=4 197 B12R1.54 CC(O)CNC(=O)c1ncco1 5f49082dda60b5d70fa62025ce3aedca [0,0,0,0,0,1|1,0,2]=4 198 B12R1.54 CC(OCC(=O)N)c1ccco1 6963a82be71f242c2caf0b6c9446a69b [0,0,0,0,0,1|2,0,1]=4 199 B12R1.54 CC(OCC(=O)O)c1ccco1 e1b893df3f06a2c21df1c6ee9f70db06 [0,0,0,0,0,1|2,0,1]=4 200 B12R1.54 C[C@@H](NCC(=O)N)c1ccco1 eab8f4d76044cc453219a84f95d8cf23 [0,0,0,0,0,1|2,0,1]=4 201 B12R1.54 C[C@@H](NCC(=O)O)c1ccco1 baa4be98371dbe86dd2ea9b78b1ecd76 [0,0,0,0,0,1|2,0,1]=4 202 B12R1.54 C[C@@H](O)CNC(=O)c1ccco1 5926c2efa2547655c572071cb8d069c8 [0,0,0,0,0,1|0,0,2]=3 203 B12R1.54 C[C@@H](O)CNC(=O)c1cccs1 b86c98bf9140f52b4849047d1da5b7d6 [0,0,0,0,0,1|0,1,2]=4 204 B12R1.54 C[C@@H](O)CNC(=O)c1ccno1 ac7fae23aaecb18106daf48443aa9e09 [0,0,0,0,0,1|1,0,2]=4 205 B12R1.54 C[C@@H](O)CNC(=O)c1cnco1 4d4ad91213b0d737aa0350d899295470 [0,0,0,0,0,1|1,0,2]=4 206 B12R1.54 C[C@@H](O)CNC(=O)c1ncco1 e684fe7bbab3a665bbc0a7c937155755 [0,0,0,0,0,1|1,0,2]=4 207 B12R1.54 C[C@@H](OCC(=O)N)c1ccco1 bb68bad85358dd7e87a2ab14dde2f0f9 [0,0,0,0,0,1|2,0,1]=4 208 B12R1.54 C[C@@H](OCC(=O)O)c1ccco1 ce6ad5d380ace876e3e2d1f8389170f2 [0,0,0,0,0,1|2,0,1]=4 209 B12R1.54 C[C@H](O)CNC(=O)c1ccco1 f272a77f774565904d7bf39600f7f013 [0,0,0,0,0,1|0,0,2]=3 210 B12R1.54 C[C@H](O)CNC(=O)c1cccs1 0eb61a8a58e9a53a93ac302bcf8b3be4 [0,0,0,0,0,1|0,1,2]=4 211 B12R1.54 C[C@H](O)CNC(=O)c1ccno1 226efbfcbd85164783e44f160e48ae31 [0,0,0,0,0,1|1,0,2]=4 212 B12R1.54 C[C@H](O)CNC(=O)c1cnco1 94ce443470bdc27639a25f4ab7069a9a [0,0,0,0,0,1|1,0,2]=4 213 B12R1.54 C[C@H](O)CNC(=O)c1ncco1 d7137c963af89afc6fa7178229b90a6a [0,0,0,0,0,1|1,0,2]=4 214 B12R1.54 NC(=O)CNC(=O)c1ccco1 4ef9b84faefe7b2b9eb9cf8ed8b1626f [0,0,0,0,0,1|1,0,0]=2 215 B12R1.54 NC(=O)CNC(=O)c1cccs1 47a8684bd48b2a992466116c19091c29 [0,0,0,0,0,1|1,1,0]=3 216 B12R1.54 NC(=O)CNC(=O)c1ccno1 d658fadb9e880023f14165772534875f [0,0,0,0,0,1|2,0,0]=3 217 B12R1.54 NC(=O)CNC(=O)c1ccns1 0fb82fcccf18d2ca9db8f7209dd40e2c [0,0,0,0,0,1|2,1,0]=4 218 B12R1.54 NC(=O)CNC(=O)c1ccoc1 94e4021e5cfc8c7711fc54e254c11481 [0,0,0,0,0,1|3,0,0]=4 219 B12R1.54 NC(=O)CNC(=O)c1ccon1 beffbce66b0010262c7b4c44765b5dbf [0,0,0,0,0,1|3,0,0]=4 220 B12R1.54 NC(=O)CNC(=O)c1ccsc1 6137fe55fa5437c02912a69e44cefca5 [0,0,0,0,0,1|3,0,0]=4 221 B12R1.54 NC(=O)CNC(=O)c1ccsn1 2d900fc53a587bca4c2127880776f0cc [0,0,0,0,0,1|3,0,0]=4 222 B12R1.54 NC(=O)CNC(=O)c1cnco1 206e71278ba4f035a125da7ccd01d226 [0,0,0,0,0,1|2,0,0]=3 223 B12R1.54 NC(=O)CNC(=O)c1cncs1 e41cdd0d986f541047c83fb624c7c5ce [0,0,0,0,0,1|2,1,0]=4 224 B12R1.54 NC(=O)CNC(=O)c1cocn1 da1df2188ea92837751f629bce0529aa [0,0,0,0,0,1|3,0,0]=4 225 B12R1.54 NC(=O)CNC(=O)c1cscn1 fd755655de565b8b6d5389d2b92b138d [0,0,0,0,0,1|3,0,0]=4 226 B12R1.54 NC(=O)CNC(=O)c1ncco1 47ad7723a2f55d471a83c117d16c4d21 [0,0,0,0,0,1|2,0,0]=3 227 B12R1.54 NC(=O)CNC(=O)c1nccs1 6f2823cc9986dcef6cdbab26f1887aa6 [0,0,0,0,0,1|2,1,0]=4 228 B12R1.54 NC(=O)CNC(=O)c1nnco1 25380b8f8200a619bd864741f660db06 [0,0,0,0,0,1|3,0,0]=4 229 B12R1.54 O=C(NCC(F)F)c1ccco1 1f3de6c272fac0080247cb24d2711ab6 [0,0,0,0,0,1|2,0,1]=4 230 B12R1.107 CC(=O)CC(=O)N1CC=CCC1 afdc79916d100d52eebf361275572c5e [0,0,0,0,0,1|2,0,1]=4 231 B12R1.260 C/C(=C/C(=O)Nc1cccs1)/Cl 315f4b11febccf71176fdd09d4794d86 [0,0,0,0,0,1|1,1,1]=4 232 B12R1.260 C/C(=C/C(=O)Nc1cccs1)/I 24962e4b557dfbf7e05664b7c2c549b3 [0,0,0,0,0,1|1,1,1]=4 233 B12R1.260 C/C(=C/C(=O)Nc1ccno1)/Cl 445be1f90009d8db667d83bf114458b0 [0,0,0,0,0,1|2,0,1]=4 234 B12R1.260 C/C(=C/C(=O)Nc1ccno1)/I 5addf4b23d80e9278be84827b6d89b28 [0,0,0,0,0,1|2,0,1]=4 235 B12R1.260 C/C(=C/C(=O)Nc1ncco1)/Cl 1feee4b0462d6ee1db8457dd69bd202c [0,0,0,0,0,1|2,0,1]=4 236 B12R1.260 C/C(=C/C(=O)Nc1ncco1)/I 0f5e05f7298b28aa7e3ff92c588a02f4 [0,0,0,0,0,1|2,0,1]=4 237 B12R1.260 C/C(=C\C(=O)Nc1cccs1)/Cl 0fe3277ec751213e2eb88616547c5cee [0,0,0,0,0,1|1,1,1]=4 238 B12R1.260 C/C(=C\C(=O)Nc1ccno1)/Cl d726952b81e5a9d4dc512d0735a0addf [0,0,0,0,0,1|2,0,1]=4 239 B12R1.260 C/C(=C\C(=O)Nc1ncco1)/Cl 7622becfa8fa2c00511d3cd1d2f94678 [0,0,0,0,0,1|2,0,1]=4 240 B12R1.260 C=C(C)CC(=O)Nc1cccs1 5bcd63023167a9baf2cae08f8a91ee9c [0,0,0,0,0,1|1,1,0]=3 241 B12R1.260 C=C(C)CC(=O)Nc1ccno1 214b03b57398de0a00fcf042393398de [0,0,0,0,0,1|2,0,0]=3 242 B12R1.260 C=C(C)CC(=O)Nc1ccns1 c47c23ade1b011e8a3b2b56487c96371 [0,0,0,0,0,1|2,1,0]=4 243 B12R1.260 C=C(C)CC(=O)Nc1ccsc1 f97ce1f1db87cca2357c90c1c2749475 [0,0,0,0,0,1|3,0,0]=4 244 B12R1.260 C=C(C)CC(=O)Nc1cncs1 74291d0883c69f9bcb69a19f686651fa [0,0,0,0,0,1|2,1,0]=4 245 B12R1.260 C=C(C)CC(=O)Nc1cocn1 a1917b39b10a3344f3dc9f070f0ed681 [0,0,0,0,0,1|3,0,0]=4 246 B12R1.260 C=C(C)CC(=O)Nc1cscn1 686815ae29408132837f86bc331cbb37 [0,0,0,0,0,1|3,0,0]=4 247 B12R1.260 C=C(C)CC(=O)Nc1ncco1 0ef91ebb33969c60ea62d306e74e9109 [0,0,0,0,0,1|2,0,0]=3 248 B12R1.260 C=C(C)CC(=O)Nc1nccs1 357be2f6f9bf4c6136b27c7fd1919b95 [0,0,0,0,0,1|2,1,0]=4 249 B12R1.260 C=C(C)CN(C)Cc1ccco1 79a1ace72ff7879138e9244db56f276a [0,0,0,0,0,1|3,0,0]=4 250 B12R1.260 CC(=CC(=O)Nc1cccs1)C c4a1cc809cecf97b2532b030a12ac3d9 [0,0,0,0,0,1|1,1,1]=4 251 B12R1.260 CC(=CC(=O)Nc1cccs1)I 7c93bebc4dcff7769167998e1a663ddd [0,0,0,0,0,1|1,1,1]=4 252 B12R1.260 CC(=CC(=O)Nc1ccno1)C 024783994f48062bee05f5e4d2b8a583 [0,0,0,0,0,1|2,0,1]=4 253 B12R1.260 CC(=CC(=O)Nc1ccno1)I 4fc15f70f1f5929293b1b7dff88af114 [0,0,0,0,0,1|2,0,1]=4 254 B12R1.260 CC(=CC(=O)Nc1ncco1)C a1f0baeba7668c845cbcd2d274ea22e2 [0,0,0,0,0,1|2,0,1]=4 255 B12R1.260 CC(=CC(=O)Nc1ncco1)I eccf17cca7cb640b1374dcca5602397c [0,0,0,0,0,1|2,0,1]=4 256 B12R1.260 CC(=O)CC(=O)NC1CC=CC1 36adf8d18fdb6acf5cc95579a5ff3fea [0,0,0,0,0,1|1,0,2]=4 257 B12R1.260 CC(=O)CC(=O)Nc1cccs1 295928ed900f5dc722303083794707f0 [0,0,0,0,0,1|0,1,0]=2 258 B12R1.260 CC(=O)CC(=O)Nc1ccno1 21f974b5f2a7658b4915e02d83d193d5 [0,0,0,0,0,1|1,0,0]=2 259 B12R1.260 CC(=O)CC(=O)Nc1ccns1 c778c863f2815aea32d9a4f47cd44fed [0,0,0,0,0,1|1,1,0]=3 260 B12R1.260 CC(=O)CC(=O)Nc1ccsc1 24bf6b887c8b75fc2ddd967911e659e1 [0,0,0,0,0,1|2,0,0]=3 261 B12R1.260 CC(=O)CC(=O)Nc1cncs1 066f7b28b5e1f8fb342062bc8b423901 [0,0,0,0,0,1|1,1,0]=3 262 B12R1.260 CC(=O)CC(=O)Nc1cnoc1 3e5274070f52afd64fbf08f5870027e5 [0,0,0,0,0,1|3,0,0]=4 263 B12R1.260 CC(=O)CC(=O)Nc1cnon1 27b6f09ec484d6f994a5ec1136d94889 [0,0,0,0,0,1|3,0,0]=4 264 B12R1.260 CC(=O)CC(=O)Nc1cnsc1 9c5081669b51d70001e7770bfcc6c363 [0,0,0,0,0,1|3,0,0]=4 265 B12R1.260 CC(=O)CC(=O)Nc1cocn1 471fe6744eebff8a83464cfaeb9943a9 [0,0,0,0,0,1|2,0,0]=3 266 B12R1.260 CC(=O)CC(=O)Nc1cscn1 6af3f93953080fca467f55fd3139e450 [0,0,0,0,0,1|2,0,0]=3 267 B12R1.260 CC(=O)CC(=O)Nc1ncco1 97cb3e2fb2ecc22d9efae809c80bcc6f [0,0,0,0,0,1|1,0,0]=2 268 B12R1.260 CC(=O)CC(=O)Nc1nccs1 cb7c185308d4859aff764ffe407435fc [0,0,0,0,0,1|1,1,0]=3 269 B12R1.260 CC(=O)CC(=O)Nc1ncns1 d89e9939d542947a59aa08eda0b33770 [0,0,0,0,0,1|2,1,0]=4 270 B12R1.260 CC(=O)NC(C)Cc1ccco1 6cb720845f829a0cf0aeb92e5ca9c2a4 [0,0,0,0,0,1|2,0,1]=4 271 B12R1.260 CC(=O)OC(C)Oc1ccco1 07baab0a0b9e646211d1cabdfe3102a5 [0,0,0,0,0,1|2,0,1]=4 272 B12R1.260 CC(C)CC(=O)Nc1cccs1 9dd319e52f58759155187a762c025382 [0,0,0,0,0,1|1,1,1]=4 273 B12R1.260 CC(C)CC(=O)Nc1ccno1 87cd2950dbd04fa53003869cb55f7d47 [0,0,0,0,0,1|2,0,1]=4 274 B12R1.260 CC(C)CC(=O)Nc1ncco1 0ed71cc9c02d90eb060dc5ee4a0ecd83 [0,0,0,0,0,1|2,0,1]=4 275 B12R1.260 CC(O)CC(=O)Nc1cccs1 cd687747919f339800ca0670ccb74eaa [0,0,0,0,0,1|0,1,2]=4 276 B12R1.260 CC(O)CC(=O)Nc1ccno1 a567933def167315d30ade1f65509f88 [0,0,0,0,0,1|1,0,2]=4 277 B12R1.260 CC(O)CC(=O)Nc1ncco1 74729442a9810d24b6e87bb7ba6946c8 [0,0,0,0,0,1|1,0,2]=4 278 B12R1.260 CN(C)CC(=O)Nc1cccs1 df433e8908eeb27d2e1015d20288f85a [0,0,0,0,0,1|2,1,0]=4 279 B12R1.260 CN(C)CC(=O)Nc1ccno1 afe8962c5e8f9712006d5fa936828a99 [0,0,0,0,0,1|3,0,0]=4 280 B12R1.260 CN(C)CC(=O)Nc1ncco1 404cc071b23ea1aee350a4836af3588b [0,0,0,0,0,1|3,0,0]=4 281 B12R1.260 CN(CC(=O)N)Cc1ccco1 80bdecd1903c0982366e396a6dfba2e2 [0,0,0,0,0,1|3,0,0]=4 282 B12R1.260 CN(CC(=O)O)Cc1ccco1 1c964894c2f7db8f3f04c51d8682d0ae [0,0,0,0,0,1|3,0,0]=4 283 B12R1.260 C[C@@H](O)CC(=O)Nc1cccs1 d936c1e8ad5916af2aea8eadb0bd86a8 [0,0,0,0,0,1|0,1,2]=4 284 B12R1.260 C[C@@H](O)CC(=O)Nc1ccno1 7d1e8b4c707ac97c0e6323659d7befc2 [0,0,0,0,0,1|1,0,2]=4 285 B12R1.260 C[C@@H](O)CC(=O)Nc1ncco1 f392fafdab4de9a1b25f5bddf5ec8126 [0,0,0,0,0,1|1,0,2]=4 286 B12R1.260 C[C@H](O)CC(=O)Nc1cccs1 ab3a3ac2a6c8fd1bf80de7d3683f465f [0,0,0,0,0,1|0,1,2]=4 287 B12R1.260 C[C@H](O)CC(=O)Nc1ccno1 4ffb353fec289e8625d842b42d8e3b8f [0,0,0,0,0,1|1,0,2]=4 288 B12R1.260 C[C@H](O)CC(=O)Nc1ncco1 76835a5de6f834a86cf84186d0b9cf57 [0,0,0,0,0,1|1,0,2]=4 289 B12R1.260 NC(=O)CC(=O)Nc1cccs1 5eaa6a937f9bb31fdc6a1f281eb04927 [0,0,0,0,0,1|1,1,0]=3 290 B12R1.260 NC(=O)CC(=O)Nc1ccno1 e487b952c5121f6335e7daf2d87618ea [0,0,0,0,0,1|2,0,0]=3 291 B12R1.260 NC(=O)CC(=O)Nc1ccns1 40d3d88c6de6d2a0574516333b58f17e [0,0,0,0,0,1|2,1,0]=4 292 B12R1.260 NC(=O)CC(=O)Nc1ccsc1 88d3f1b0b1aeb62a7ae54de39e8cd483 [0,0,0,0,0,1|3,0,0]=4 293 B12R1.260 NC(=O)CC(=O)Nc1cocn1 966951efa0d3c0c60fce7f9868261b16 [0,0,0,0,0,1|3,0,0]=4 294 B12R1.260 NC(=O)CC(=O)Nc1cscn1 b7a23719dd48c09194b2d1ed9d24fcf9 [0,0,0,0,0,1|3,0,0]=4 295 B12R1.260 NC(=O)CC(=O)Nc1ncco1 fcf9bedf553198fd3edc7086ffc805c0 [0,0,0,0,0,1|2,0,0]=3 296 B12R1.260 NC(=O)CC(=O)Nc1nccs1 a63914419890765e73868f7388f3381f [0,0,0,0,0,1|2,1,0]=4 297 B9R1.12 C=CCOc1ccco1 718f2f5554bee89c19d4febc6556b9e4 [2,0,0,0,0,0|1,0,1]=4 298 B9R1.12 CCCOc1ccco1 892ad9a1c4eda1b2e579e57ab16386c6 [2,0,0,0,0,0|1,0,1]=4 299 B9R1.12 COCOc1ccco1 e04897991e5b5a23be25371e2fdd1455 [2,0,0,0,0,0|2,0,0]=4 300 B9R1.12 CSCOc1ccco1 1390e2388610ba4d2a6a9c5a27789bf5 [2,0,0,0,0,0|2,0,0]=4 301 B9R1.12 O=CCNc1cccs1 60a129f7ce0ed47960cff2a58ff45c1c [2,0,0,0,0,0|1,1,0]=4 302 B9R1.12 O=CCNc1ccno1 d89beb34e7299bb5546d81c088f021b3 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.12 O=CCNc1ncco1 a903c622426cd77e9fe9761a3cc7b9bd [2,0,0,0,0,0|2,0,0]=4 304 B9R1.12 O=CCOc1ccco1 1e74f64104a9bfe1c6a709b4cd3c3941 [2,0,0,0,0,0|1,0,0]=3 305 B9R1.12 O=CCOc1cccs1 8bfa681cbb01e0a1759e3c960c15aeb1 [2,0,0,0,0,0|1,1,0]=4 306 B9R1.12 O=CNCc1ccco1 500b938a7f3d3a911f6dbf809f17e808 [2,0,0,0,0,0|1,0,1]=4 307 B11R1.29 C#CCNC(=O)c1ccco1 54ff4fbf94cdf57e102cd95c169c2b22 [1,1,0,0,0,0|0,0,2]=4 308 B11R1.29 CC(NCC=O)c1ccco1 0e1e5093d955a35b015ca7d7478c2677 [1,1,0,0,0,0|1,0,1]=4 309 B11R1.29 CC(OCC=O)c1ccco1 2859252ddbb59c60ccf7b6e831653341 [1,1,0,0,0,0|1,0,1]=4 310 B11R1.29 CCCNC(=O)c1ccco1 d8640482dae316c354eef2e19d31ea28 [1,1,0,0,0,0|0,0,1]=3 311 B11R1.29 CCCNC(=O)c1cccs1 1ae41568b1bb950c7d429998b0d28b35 [1,1,0,0,0,0|0,1,1]=4 312 B11R1.29 CCCNC(=O)c1ccno1 c77a86055203fe3167c7545c3ffd5006 [1,1,0,0,0,0|1,0,1]=4 313 B11R1.29 CCCNC(=O)c1cnco1 4fd1ce58de56a0a6274075bcec5acbfd [1,1,0,0,0,0|1,0,1]=4 314 B11R1.29 CCCNC(=O)c1ncco1 ae748957f37f8038ea8711a85c12e485 [1,1,0,0,0,0|1,0,1]=4 315 B11R1.29 CCOCC(=O)c1ccco1 914a75ebe3137d0727414a3562da2864 [1,1,0,0,0,0|0,0,1]=3 316 B11R1.29 C[C@@H](NCC=O)c1ccco1 ebe7825b8377cd14ca66ed9d1bf50ad5 [1,1,0,0,0,0|1,0,1]=4 317 B11R1.29 C[C@@H](OCC=O)c1ccco1 8fbb243121b95f54b54f196c652a89bc [1,1,0,0,0,0|1,0,1]=4 318 B11R1.29 N#CCNC(=O)c1ccco1 d313d8b0ce76d9c99b94fac6efbe655d [1,1,0,0,0,0|1,0,1]=4 319 B11R1.29 N#CNCC(=O)c1ccco1 7d006b99701e12406ebdf274950972cb [1,1,0,0,0,0|1,0,1]=4 320 B11R1.29 O=C(COCF)c1ccco1 17b6d760525bf4481cd14a7fa5054d49 [1,1,0,0,0,0|1,0,0]=3 321 B11R1.29 O=C(NCCBr)c1ccco1 a0a02576173476b1d0f57aa98df99ffa [1,1,0,0,0,0|1,0,1]=4 322 B11R1.29 O=C(NCCF)c1ccco1 3debe2a549207ec0880069641356d391 [1,1,0,0,0,0|1,0,1]=4 323 B11R1.29 O=C(NCCI)c1ccco1 5f8d286413b9d386aa5f26a345db8e0d [1,1,0,0,0,0|1,0,1]=4 324 B11R1.29 O=C(NCCO)c1ccco1 d1dff333f1685197c7717060e53f80c8 [1,1,0,0,0,0|0,0,2]=4 325 B11R1.29 O=C(NCCS)c1ccco1 32077be75d73ebb14fb9991bd123b7cd [1,1,0,0,0,0|0,1,1]=4 326 B11R1.29 O=CNCC(O)c1ccco1 6bc0d1377efb6eaf73117839a38c77b5 [1,1,0,0,0,0|0,0,2]=4 327 B11R1.31 CCN(C)C(=O)c1ccco1 1b82eb35c96b085b915540c07bac3920 [1,1,0,0,0,0|1,0,1]=4 328 B11R1.25 C=C(CC)COc1ccco1 8404942ce0c127109105c4a4a2ae6d42 [1,1,0,0,0,0|2,0,0]=4 329 B11R1.25 C=C(COc1ccco1)OC 2bb75599a2450eeb215a4f785b4688eb [1,1,0,0,0,0|2,0,0]=4 330 B11R1.25 CCC(=O)CNc1cccs1 b4fbace754947742811c99821187431d [1,1,0,0,0,0|1,1,0]=4 331 B11R1.25 CCC(=O)CNc1ccno1 88b6fa67dbfd5e0c949f8969664ed5d2 [1,1,0,0,0,0|2,0,0]=4 332 B11R1.25 CCC(=O)CNc1ncco1 76440fc14e6f7ad0dd7140ac3ef610d7 [1,1,0,0,0,0|2,0,0]=4 333 B11R1.25 CCC(=O)COc1ccco1 84a63c846c70eaac9456a85969f85a7b [1,1,0,0,0,0|1,0,0]=3 334 B11R1.25 CCC(=O)COc1cccs1 62a1dd7ee9a489d60b74777043a9f2b4 [1,1,0,0,0,0|1,1,0]=4 335 B11R1.25 CCC(=O)NCc1ccco1 83a3424c0a2cb7e1166334a3685172c7 [1,1,0,0,0,0|1,0,1]=4 336 B11R1.25 CNC(=O)CNc1ccco1 9fb8fe20e0faec38b11cfc6e904e8b91 [1,1,0,0,0,0|1,0,0]=3 337 B11R1.25 CNC(=O)CNc1cccs1 6f087d70dc1595761c626ef8cc8ed2e1 [1,1,0,0,0,0|1,1,0]=4 338 B11R1.25 CNC(=O)CNc1ccno1 7de6ef8f9830186d017f4e880d3de9ba [1,1,0,0,0,0|2,0,0]=4 339 B11R1.25 CNC(=O)CNc1ncco1 ceeb9335263c80021a1974fd2776fefd [1,1,0,0,0,0|2,0,0]=4 340 B11R1.25 CNC(=O)COc1ccco1 8de653ac0ba8299d76630db6851014dc [1,1,0,0,0,0|1,0,0]=3 341 B11R1.25 CNC(=O)COc1cccs1 591444907ff3d0e617e25662bdc82222 [1,1,0,0,0,0|1,1,0]=4 342 B11R1.25 COC(=O)CNc1ccco1 3a8934ef990493a0e0bc38424c480317 [1,1,0,0,0,0|1,0,0]=3 343 B11R1.25 COC(=O)CNc1cccs1 59d52dc657b50ac2b04e7700320d3026 [1,1,0,0,0,0|1,1,0]=4 344 B11R1.25 COC(=O)CNc1ccno1 2d1a89cf719dc404cd856267b5c680c3 [1,1,0,0,0,0|2,0,0]=4 345 B11R1.25 COC(=O)CNc1ncco1 feededd87b0a92f1d612ca2091d69650 [1,1,0,0,0,0|2,0,0]=4 346 B11R1.25 COC(=O)COc1ccco1 7e5bb533074d72185d76d28364661292 [1,1,0,0,0,0|1,0,0]=3 347 B11R1.25 COC(=O)COc1cccs1 700d40abb2597ef2d3922f15e3e62a6a [1,1,0,0,0,0|1,1,0]=4 348 B11R1.25 O=C(CF)NCc1ccco1 84588230b201d06c07b9a063871937ae [1,1,0,0,0,0|1,0,1]=4 349 B11R1.25 O=C(CNc1ccco1)NO 0a52081a67fc28cf2437bd0732b582b4 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.25 O=C(CO)CNc1cccs1 2fa55ac8bbb5c873ad00e48a9966c29f [1,1,0,0,0,0|1,1,0]=4 351 B11R1.25 O=C(CO)CNc1ccno1 194d740518c48fa3d3bb3b01365770e1 [1,1,0,0,0,0|2,0,0]=4 352 B11R1.25 O=C(CO)CNc1ncco1 a77c7f1da0fa7ae8f9927e6aed614ed2 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.25 O=C(CO)NCc1ccco1 df70aa8594e340b9ca90aef387447fda [1,1,0,0,0,0|1,0,1]=4 354 B11R1.25 O=C(CS)NCc1ccco1 cd6653eaf0be7fe394f59c7de3df0476 [1,1,0,0,0,0|1,0,1]=4 355 B11R1.35 CC(=O)C(C)Nc1ccno1 95b34b55777b87672e923fe19e39c761 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.35 CC(=O)C(C)Nc1ncco1 775586ee3024e3c0d67456f36e102a07 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.35 CC(=O)C(C)Oc1ccco1 a56d48d537b56e6d77399f0c0c673bb2 [1,1,0,0,0,0|1,0,0]=3 358 B11R1.35 CC(=O)N(C)Cc1ccco1 595130f102a13741ef8c5e6d70797c2c [1,1,0,0,0,0|1,0,1]=4 359 B11R1.35 CC(Nc1ccco1)C(=O)N 21482bd34d4a2dafa2d3162f804897b0 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.35 CC(Oc1ccco1)C(=O)N 0ef6af18494e5b6ec1eeb7dff9bb07b6 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.35 C[C@@H](Nc1ccco1)C(=O)N d8f34946d3e641ebfbd2e95882ef9923 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.35 C[C@H](Nc1ccco1)C(=O)N 30436b14ff4e5a5172c84caee18f519a [1,1,0,0,0,0|2,0,0]=4 363 B11R1.35 NC(=O)C(F)Oc1ccco1 d0138be09905b3b17d03bc038e7cdb64 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.75 C=C(C)CNc1cc(co1)C 9a824af34ef512c1875933c4ffb872d0 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.75 C=C(C)CNc1ccc(o1)C 38f43c55846fca3b94b16190a890c79f [1,1,0,0,0,0|2,0,0]=4 366 B11R1.75 CC(=O)CNc1ccc(o1)C a2d4efbcab84d7259315a868deaaa873 [1,1,0,0,0,0|1,0,0]=3 367 B11R1.75 CC(=O)CNc1ccc(s1)C dc48b32a35ca60a3449a92a01b93fb89 [1,1,0,0,0,0|1,1,0]=4 368 B11R1.75 CC(=O)CNc1ccc(s1)F 8479726e6cdfee7e3880572c1d14a94a [1,1,0,0,0,0|1,1,0]=4 369 B11R1.75 CC(=O)NCc1cc(co1)C c264239ea631634196e8ffbc272a6263 [1,1,0,0,0,0|1,0,1]=4 370 B11R1.75 CC(=O)NCc1ccc(o1)Br 6e710dbc8a7ab5ca5f302eac2d542d29 [1,1,0,0,0,0|1,0,1]=4 371 B11R1.75 CC(=O)NCc1ccc(o1)C b13cd0bd40ca6cf6e3c39d68d12bdda4 [1,1,0,0,0,0|1,0,1]=4 372 B11R1.75 Cc1ccc(o1)NCC(=O)N cac804fda3ef34d781c21678c0228f2a [1,1,0,0,0,0|2,0,0]=4 373 B11R1.75 Cc1coc(c1)NCC(=O)N 639b98bc124c078d87642ebf525476d2 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.90 CC(=O)NCc1occc1C 6dcfcfae995904333b31ef08b1e3652a [1,1,0,0,0,0|1,0,1]=4 375 B11R1.510 CS(=O)(=O)COc1ccco1 fab2391845fe5dee14e862d0bd72b65e [1,1,0,0,0,0|2,0,0]=4 376 B13R1.129 C=C(Br)CNC(=O)c1cc(co1)Br 350a55c4d1e9aba52b40e2ccda823815 [0,1,0,0,0,1|1,0,1]=4 377 B13R1.129 C=C(Br)CNC(=O)c1cc(co1)C 3756ed83b697b0a19bedc07e7cddd2a9 [0,1,0,0,0,1|1,0,1]=4 378 B13R1.129 C=C(Br)CNC(=O)c1cc(co1)Cl 8c635d30c8527194f6518b18d52ccbad [0,1,0,0,0,1|1,0,1]=4 379 B13R1.129 C=C(Br)CNC(=O)c1ccc(o1)Br 624eccc8716c6d7bd2c1754abd0a9326 [0,1,0,0,0,1|1,0,1]=4 380 B13R1.129 C=C(Br)CNC(=O)c1ccc(o1)C b02ddb6c8daf24a7548a5a7b02296698 [0,1,0,0,0,1|1,0,1]=4 381 B13R1.129 C=C(Br)CNC(=O)c1ccc(o1)Cl 817e37ef8ea739a2d28634929d22d104 [0,1,0,0,0,1|1,0,1]=4 382 B13R1.129 C=C(Br)CNC(=O)c1ccc(o1)F 6bc87bfc9c1205ecb9008f4ce334a090 [0,1,0,0,0,1|1,0,1]=4 383 B13R1.129 C=C(Br)CNC(=O)c1ccc(o1)I 1580d7f63f4de3eb7af771d4766cf5e2 [0,1,0,0,0,1|1,0,1]=4 384 B13R1.129 C=C(C)CNC(=O)c1cc(co1)Br b1f0cd6adcc1b654123cc49c1deba85f [0,1,0,0,0,1|1,0,0]=3 385 B13R1.129 C=C(C)CNC(=O)c1cc(co1)C a8fbfba2ebca3d7d957450cc8cf27101 [0,1,0,0,0,1|1,0,0]=3 386 B13R1.129 C=C(C)CNC(=O)c1cc(co1)Cl 49b7ab3b03ab4d0a20bccdc80ff6498f [0,1,0,0,0,1|1,0,0]=3 387 B13R1.129 C=C(C)CNC(=O)c1cc(cs1)Br 155670aafe0f9a01f1c1f71cc6d230e4 [0,1,0,0,0,1|1,1,0]=4 388 B13R1.129 C=C(C)CNC(=O)c1cc(cs1)C 8acc35cbfc1773c947a01c2efe8c847d [0,1,0,0,0,1|1,1,0]=4 389 B13R1.129 C=C(C)CNC(=O)c1cc(cs1)Cl 912c8f3c67a77949ae233b307e284657 [0,1,0,0,0,1|1,1,0]=4 390 B13R1.129 C=C(C)CNC(=O)c1cc(cs1)F 010a06e8bc8e59a3f75fb466d1b742ac [0,1,0,0,0,1|1,1,0]=4 391 B13R1.129 C=C(C)CNC(=O)c1cc(cs1)O d53bb5f21f8c2950852fc084367f5c51 [0,1,0,0,0,1|1,1,0]=4 392 B13R1.129 C=C(C)CNC(=O)c1cc(no1)Br 6c6ae4bcb0b0e660d5acacaddeaed9f8 [0,1,0,0,0,1|2,0,0]=4 393 B13R1.129 C=C(C)CNC(=O)c1cc(no1)C 303343f59741f9f03633103639ea9404 [0,1,0,0,0,1|2,0,0]=4 394 B13R1.129 C=C(C)CNC(=O)c1cc(no1)Cl 1f9b5ff29f02bda786f369018d93ff53 [0,1,0,0,0,1|2,0,0]=4 395 B13R1.129 C=C(C)CNC(=O)c1cc(no1)O 2498866f75f6dababbaebc2531d4a38f [0,1,0,0,0,1|2,0,0]=4 396 B13R1.129 C=C(C)CNC(=O)c1ccc(o1)Br 1fbe79bc6da8c57c8643dd88489a6fe0 [0,1,0,0,0,1|1,0,0]=3 397 B13R1.129 C=C(C)CNC(=O)c1ccc(o1)C 1299ce790b68359e03648ce1a01b8cbc [0,1,0,0,0,1|1,0,0]=3 398 B13R1.129 C=C(C)CNC(=O)c1ccc(o1)Cl fcc075c343f52a7d010a48c72d5cb7ec [0,1,0,0,0,1|1,0,0]=3 399 B13R1.129 C=C(C)CNC(=O)c1ccc(o1)F e2d7700d2753502808633de2db44c3f8 [0,1,0,0,0,1|1,0,0]=3 400 B13R1.129 C=C(C)CNC(=O)c1ccc(o1)I c9b83464944ccfc453625c6d37083969 [0,1,0,0,0,1|1,0,0]=3 401 B13R1.129 C=C(C)CNC(=O)c1ccc(s1)Br 405d5323c073e17caafb6401d0f9d23b [0,1,0,0,0,1|1,1,0]=4 402 B13R1.129 C=C(C)CNC(=O)c1ccc(s1)C c46d9d213032bfbd93bfe5a0856750d6 [0,1,0,0,0,1|1,1,0]=4 403 B13R1.129 C=C(C)CNC(=O)c1ccc(s1)Cl ab707b7c51bbc3db0ecb2b6b4ac3e2f0 [0,1,0,0,0,1|1,1,0]=4 404 B13R1.129 C=C(C)CNC(=O)c1ccc(s1)F d4199343b518d74aaa6e620928611a41 [0,1,0,0,0,1|1,1,0]=4 405 B13R1.129 C=C(C)CNC(=O)c1ccc(s1)I 7e7adf36c749325c420c96f0dab1797f [0,1,0,0,0,1|1,1,0]=4 406 B13R1.129 C=C(C)CNC(=O)c1cnc(o1)Br 9ce9339fc09ade15883e82126205d3a9 [0,1,0,0,0,1|2,0,0]=4 407 B13R1.129 C=C(C)CNC(=O)c1cnc(o1)C 5f5c154a0d04d3e3b9ef88b576559d8e [0,1,0,0,0,1|2,0,0]=4 408 B13R1.129 C=C(C)CNC(=O)c1cnc(o1)Cl 72300e0c3f09a4fc45169c2c8f75f2f0 [0,1,0,0,0,1|2,0,0]=4 409 B13R1.129 C=C(C)CNC(=O)c1cnc(o1)I 51a373f244e7e6624efab0eab104fed9 [0,1,0,0,0,1|2,0,0]=4 410 B13R1.129 C=C(C)CNC(=O)c1cnc(o1)O b5d031990b7cebf01aafdfbe3abd7cb3 [0,1,0,0,0,1|2,0,0]=4 411 B13R1.129 C=C(C)CNC(=O)c1nc(co1)Br 2daf3ff91ac2d96c2ec52af10e7fa463 [0,1,0,0,0,1|2,0,0]=4 412 B13R1.129 C=C(C)CNC(=O)c1nc(co1)C cbba98f210a1d7e0c82360bac701e3e8 [0,1,0,0,0,1|2,0,0]=4 413 B13R1.129 C=C(C)CNC(=O)c1ncc(o1)Br ab91a3e9c5ec4e143055055268b853cc [0,1,0,0,0,1|2,0,0]=4 414 B13R1.129 C=C(C)CNC(=O)c1ncc(o1)C 149e96a084c810974de57c617cd44385 [0,1,0,0,0,1|2,0,0]=4 415 B13R1.129 CC(=O)CNC(=O)C1=CC(=O)CC1 60ba8d1a436cea99146bc294f6e9f27e [0,1,0,0,0,1|1,0,1]=4 416 B13R1.129 CC(=O)CNC(=O)c1cc(co1)Br 50270535b20e01b1d7233b2099148da5 [0,1,0,0,0,1|0,0,0]=2 417 B13R1.129 CC(=O)CNC(=O)c1cc(co1)C 3da513b3dd622d60b9a39bf08ccc1c24 [0,1,0,0,0,1|0,0,0]=2 418 B13R1.129 CC(=O)CNC(=O)c1cc(co1)Cl efefd054afd399c9a9d96f0ad55db2aa [0,1,0,0,0,1|0,0,0]=2 419 B13R1.129 CC(=O)CNC(=O)c1cc(cs1)Br f67a7a76e00feba90c4db3c1a39ee5f2 [0,1,0,0,0,1|0,1,0]=3 420 B13R1.129 CC(=O)CNC(=O)c1cc(cs1)C 44ef5c5a8087151650c68a46763c4f66 [0,1,0,0,0,1|0,1,0]=3 421 B13R1.129 CC(=O)CNC(=O)c1cc(cs1)Cl f301c55e9f565fa52d2e71fc4801d31f [0,1,0,0,0,1|0,1,0]=3 422 B13R1.129 CC(=O)CNC(=O)c1cc(cs1)F 27e50032d3e011d537e26b41bb86cdb5 [0,1,0,0,0,1|0,1,0]=3 423 B13R1.129 CC(=O)CNC(=O)c1cc(cs1)O 5a580d211ff99ea355149e1896666e05 [0,1,0,0,0,1|0,1,0]=3 424 B13R1.129 CC(=O)CNC(=O)c1cc(no1)Br 53a32a3ce91869cfaa0a5c62d1a568bb [0,1,0,0,0,1|1,0,0]=3 425 B13R1.129 CC(=O)CNC(=O)c1cc(no1)C c52314fa5c534514b93713c9286b8c78 [0,1,0,0,0,1|1,0,0]=3 426 B13R1.129 CC(=O)CNC(=O)c1cc(no1)Cl e8bdb28b6d4f549ae48f736b19505a2e [0,1,0,0,0,1|1,0,0]=3 427 B13R1.129 CC(=O)CNC(=O)c1cc(no1)O ceba0071e4f4464decf570f9153f63d3 [0,1,0,0,0,1|1,0,0]=3 428 B13R1.129 CC(=O)CNC(=O)c1cc(ns1)Br ac73125153e0040fe5697a3d0ec006ea [0,1,0,0,0,1|1,1,0]=4 429 B13R1.129 CC(=O)CNC(=O)c1cc(ns1)C b843c04fa9a11188c1c2dd1bfc26dea3 [0,1,0,0,0,1|1,1,0]=4 430 B13R1.129 CC(=O)CNC(=O)c1cc(ns1)Cl e5c912a9511bca9f0b3ca55b3ef91e25 [0,1,0,0,0,1|1,1,0]=4 431 B13R1.129 CC(=O)CNC(=O)c1cc(on1)C 179e3c42ac6e41163bf1077c4a4a28d2 [0,1,0,0,0,1|2,0,0]=4 432 B13R1.129 CC(=O)CNC(=O)c1cc(on1)Cl 2bef1e27f4dff363b58883bf1d329102 [0,1,0,0,0,1|2,0,0]=4 433 B13R1.129 CC(=O)CNC(=O)c1cc(on1)I 92c35c18e2ad1b61aa5230d84bf2a7b6 [0,1,0,0,0,1|2,0,0]=4 434 B13R1.129 CC(=O)CNC(=O)c1cc(sn1)Br 5c2eaed4df88b108096ca9fade82b32e [0,1,0,0,0,1|2,0,0]=4 435 B13R1.129 CC(=O)CNC(=O)c1cc(sn1)C 56da6f43d152fcaa1418b36e8e2574b9 [0,1,0,0,0,1|2,0,0]=4 436 B13R1.129 CC(=O)CNC(=O)c1ccc(o1)Br 82851dfef6b92c260925fd976fc34b04 [0,1,0,0,0,1|0,0,0]=2 437 B13R1.129 CC(=O)CNC(=O)c1ccc(o1)C 1774b9bb2f935ad71b79f902f28f953c [0,1,0,0,0,1|0,0,0]=2 438 B13R1.129 CC(=O)CNC(=O)c1ccc(o1)Cl 66265d34c8d84b7b0b286ff557d9687b [0,1,0,0,0,1|0,0,0]=2 439 B13R1.129 CC(=O)CNC(=O)c1ccc(o1)F 1abdf3a74fb5dba00eef985dc41ac06a [0,1,0,0,0,1|0,0,0]=2 440 B13R1.129 CC(=O)CNC(=O)c1ccc(o1)I 321cfdc285fe708403142dd6ef76a40e [0,1,0,0,0,1|0,0,0]=2 441 B13R1.129 CC(=O)CNC(=O)c1ccc(s1)Br 15a077836646b9bcf634276a96d82c50 [0,1,0,0,0,1|0,1,0]=3 442 B13R1.129 CC(=O)CNC(=O)c1ccc(s1)C e0ea13c8d0562dc7601f40bc503e49cd [0,1,0,0,0,1|0,1,0]=3 443 B13R1.129 CC(=O)CNC(=O)c1ccc(s1)Cl 50cb47d67304a6a3f01734c701fe8496 [0,1,0,0,0,1|0,1,0]=3 444 B13R1.129 CC(=O)CNC(=O)c1ccc(s1)F 3ffa08bbd3daffdfbb3f49d2f1eea8ee [0,1,0,0,0,1|0,1,0]=3 445 B13R1.129 CC(=O)CNC(=O)c1ccc(s1)I 9a99eb880f51ef0de5e2d9e938e43ec9 [0,1,0,0,0,1|0,1,0]=3 446 B13R1.129 CC(=O)CNC(=O)c1ccn(c1)C b0c921af3b36a270a8ac62b121efff7d [0,1,0,0,0,1|2,0,0]=4 447 B13R1.129 CC(=O)CNC(=O)c1ccn(n1)C 44cd34b2a170d4b6a8bdc27b03965869 [0,1,0,0,0,1|2,0,0]=4 448 B13R1.129 CC(=O)CNC(=O)c1cn(cn1)C 582a8adca21c5b706947141fb1b04e65 [0,1,0,0,0,1|2,0,0]=4 449 B13R1.129 CC(=O)CNC(=O)c1cnc(o1)Br 78ad9dcbc6f75d1f23ae1aa025b96446 [0,1,0,0,0,1|1,0,0]=3 450 B13R1.129 CC(=O)CNC(=O)c1cnc(o1)C a8bb032a69539f86242d2ad1a40bc91e [0,1,0,0,0,1|1,0,0]=3 451 B13R1.129 CC(=O)CNC(=O)c1cnc(o1)Cl 6aa97ddc45b3fd9348a26c3a0f0abbf0 [0,1,0,0,0,1|1,0,0]=3 452 B13R1.129 CC(=O)CNC(=O)c1cnc(o1)I b561ee00af2a26e20bfbb5d55ed867ed [0,1,0,0,0,1|1,0,0]=3 453 B13R1.129 CC(=O)CNC(=O)c1cnc(o1)O b332ddb0bb1ced1773e8d7cb2abc60d6 [0,1,0,0,0,1|1,0,0]=3 454 B13R1.129 CC(=O)CNC(=O)c1cnc(s1)Br 0d1de6724e85f280eb6de23864c19107 [0,1,0,0,0,1|1,1,0]=4 455 B13R1.129 CC(=O)CNC(=O)c1cnc(s1)C 620cab6cb96e32b86bccdab5977d474f [0,1,0,0,0,1|1,1,0]=4 456 B13R1.129 CC(=O)CNC(=O)c1cnc(s1)Cl 66aa89b768a513e97cba5967bea06552 [0,1,0,0,0,1|1,1,0]=4 457 B13R1.129 CC(=O)CNC(=O)c1coc(c1)Br 62d7cdae327a643db199d5d6685404b3 [0,1,0,0,0,1|2,0,0]=4 458 B13R1.129 CC(=O)CNC(=O)c1coc(c1)C 9f02a11b5af1b4bf46f985bd67ed9ed7 [0,1,0,0,0,1|2,0,0]=4 459 B13R1.129 CC(=O)CNC(=O)c1coc(n1)Br 66421a63f43c94214ff71a37171862eb [0,1,0,0,0,1|2,0,0]=4 460 B13R1.129 CC(=O)CNC(=O)c1coc(n1)C 611074ad6a7866addeab54e78f74a51b [0,1,0,0,0,1|2,0,0]=4 461 B13R1.129 CC(=O)CNC(=O)c1coc(n1)Cl b4f988c142e4e2dfd7305343289323a4 [0,1,0,0,0,1|2,0,0]=4 462 B13R1.129 CC(=O)CNC(=O)c1csc(c1)Br 54cf0901a0fedaff45e960537a56ecc8 [0,1,0,0,0,1|2,0,0]=4 463 B13R1.129 CC(=O)CNC(=O)c1csc(c1)C 4d90ffc493a782802f61a2fe2383e9cc [0,1,0,0,0,1|2,0,0]=4 464 B13R1.129 CC(=O)CNC(=O)c1csc(c1)Cl e46f492ed63a1ca284aafdbd8ba87cd3 [0,1,0,0,0,1|2,0,0]=4 465 B13R1.129 CC(=O)CNC(=O)c1csc(c1)I 0e6ae53d61ec04ca5464d8a80d1a5148 [0,1,0,0,0,1|2,0,0]=4 466 B13R1.129 CC(=O)CNC(=O)c1csc(n1)Br 3d2f4d684682943315c63033ae859a6f [0,1,0,0,0,1|2,0,0]=4 467 B13R1.129 CC(=O)CNC(=O)c1csc(n1)C 28f80bd9706e8dad791fe32a3dd2baf8 [0,1,0,0,0,1|2,0,0]=4 468 B13R1.129 CC(=O)CNC(=O)c1csc(n1)Cl 4ed2259dc187839aab88346d86f9ff96 [0,1,0,0,0,1|2,0,0]=4 469 B13R1.129 CC(=O)CNC(=O)c1csc(n1)I 243f6d0db81f518d9224fe72414131b7 [0,1,0,0,0,1|2,0,0]=4 470 B13R1.129 CC(=O)CNC(=O)c1nc(co1)Br f1aa0940286807c74cbdc8360a377505 [0,1,0,0,0,1|1,0,0]=3 471 B13R1.129 CC(=O)CNC(=O)c1nc(co1)C 79b767e92f9571c5a6dee560f86b6190 [0,1,0,0,0,1|1,0,0]=3 472 B13R1.129 CC(=O)CNC(=O)c1nc(cs1)Br 11f446a35ad9e316f244cf2dd4bf859e [0,1,0,0,0,1|1,1,0]=4 473 B13R1.129 CC(=O)CNC(=O)c1nc(cs1)C 1f5d41f4254d82eef2dc63f93a2780f3 [0,1,0,0,0,1|1,1,0]=4 474 B13R1.129 CC(=O)CNC(=O)c1nc(cs1)Cl 885b01a4f69138c03a54916c694e62e1 [0,1,0,0,0,1|1,1,0]=4 475 B13R1.129 CC(=O)CNC(=O)c1nc(no1)C 122d3f1e62e0000093030a96a4de5049 [0,1,0,0,0,1|2,0,0]=4 476 B13R1.129 CC(=O)CNC(=O)c1ncc(o1)Br bf63a4be012079093d5368a69bfa4e57 [0,1,0,0,0,1|1,0,0]=3 477 B13R1.129 CC(=O)CNC(=O)c1ncc(o1)C a19ab3eaf4456f7882e4c53db31b75cb [0,1,0,0,0,1|1,0,0]=3 478 B13R1.129 CC(=O)CNC(=O)c1ncc(s1)Br 7a43dfc9a9dd5d382401e809bc19e46a [0,1,0,0,0,1|1,1,0]=4 479 B13R1.129 CC(=O)CNC(=O)c1ncc(s1)C 3c5871d5499201c91ef6f216545e4fc3 [0,1,0,0,0,1|1,1,0]=4 480 B13R1.129 CC(=O)CNC(=O)c1nnc(o1)C fb8db911f39c60891fa7a424859e52ad [0,1,0,0,0,1|2,0,0]=4 481 B13R1.129 CC(C)CNC(=O)c1cc(co1)Br 21e70a7c08855ec3f088391ae7994470 [0,1,0,0,0,1|1,0,1]=4 482 B13R1.129 CC(C)CNC(=O)c1cc(co1)Cl 1997261a58d5936b3d85d336a6b51d14 [0,1,0,0,0,1|1,0,1]=4 483 B13R1.129 CC(C)CNC(=O)c1ccc(o1)Br 8a1282b4dd8f910715e19c25334fba12 [0,1,0,0,0,1|1,0,1]=4 484 B13R1.129 CC(C)CNC(=O)c1ccc(o1)Cl 0d3b36cae63c3d54492b49e863306d00 [0,1,0,0,0,1|1,0,1]=4 485 B13R1.129 CC(C)CNC(=O)c1ccc(o1)F 0388c397ef6f186a290916360b867428 [0,1,0,0,0,1|1,0,1]=4 486 B13R1.129 CC(C)CNC(=O)c1ccc(o1)I 3671d020ebfb98eee8926e9373da01b4 [0,1,0,0,0,1|1,0,1]=4 487 B13R1.129 CC(O)CNC(=O)c1cc(co1)Br b1b9eb7b4f4eac1274112062e5da664a [0,1,0,0,0,1|0,0,2]=4 488 B13R1.129 CC(O)CNC(=O)c1cc(co1)Cl 783b856f924706c1964ea483add17646 [0,1,0,0,0,1|0,0,2]=4 489 B13R1.129 CC(O)CNC(=O)c1ccc(o1)Br 546f5eeb94ce88bc26989ea28332fdbd [0,1,0,0,0,1|0,0,2]=4 490 B13R1.129 CC(O)CNC(=O)c1ccc(o1)Cl 1b8cc8a1835ee46a988cfb1e295e848e [0,1,0,0,0,1|0,0,2]=4 491 B13R1.129 CC(O)CNC(=O)c1ccc(o1)F 04e8b9d5e695c3d5b75f76fd5f1e0a7d [0,1,0,0,0,1|0,0,2]=4 492 B13R1.129 CC(O)CNC(=O)c1ccc(o1)I 6ddb97dad458872633d929398396d07f [0,1,0,0,0,1|0,0,2]=4 493 B13R1.129 C[C@@H](O)CNC(=O)c1cc(co1)Br bbe96606ef94e5787ec0e44350e63c71 [0,1,0,0,0,1|0,0,2]=4 494 B13R1.129 C[C@@H](O)CNC(=O)c1cc(co1)Cl 10daf8864e2d00a8e1abecc69696a57e [0,1,0,0,0,1|0,0,2]=4 495 B13R1.129 C[C@@H](O)CNC(=O)c1ccc(o1)Br c85ce33acaf5a3f182bcee312011013d [0,1,0,0,0,1|0,0,2]=4 496 B13R1.129 C[C@@H](O)CNC(=O)c1ccc(o1)Cl c7e588b48a103a889aaf75a1d2324ea1 [0,1,0,0,0,1|0,0,2]=4 497 B13R1.129 C[C@@H](O)CNC(=O)c1ccc(o1)F a98841eed37aa7ea766e6b49f5cebb38 [0,1,0,0,0,1|0,0,2]=4 498 B13R1.129 C[C@@H](O)CNC(=O)c1ccc(o1)I 827a4fd9942774a14d91f1ed380fadcf [0,1,0,0,0,1|0,0,2]=4 499 B13R1.129 C[C@H](O)CNC(=O)c1cc(co1)Br 0a893c9a630d729813d4e79c14c3a44b [0,1,0,0,0,1|0,0,2]=4 500 B13R1.129 C[C@H](O)CNC(=O)c1cc(co1)Cl ba3f945a6220d7917296cd214473f404 [0,1,0,0,0,1|0,0,2]=4 501 B13R1.129 C[C@H](O)CNC(=O)c1ccc(o1)Br d79b9e50f08b8dafa2e7ecd96a87b831 [0,1,0,0,0,1|0,0,2]=4 502 B13R1.129 C[C@H](O)CNC(=O)c1ccc(o1)Cl ee63d3271792f306b1d02f9f053f748a [0,1,0,0,0,1|0,0,2]=4 503 B13R1.129 C[C@H](O)CNC(=O)c1ccc(o1)F c2df04529acebdfc8b759c9e12268b64 [0,1,0,0,0,1|0,0,2]=4 504 B13R1.129 C[C@H](O)CNC(=O)c1ccc(o1)I ab12b9d31dda24f20f18482916511a02 [0,1,0,0,0,1|0,0,2]=4 505 B13R1.129 Cc1cc(on1)C(=O)NCC(=O)N 079fb94a2c05f0c5530b75f56a09773a [0,1,0,0,0,1|2,0,0]=4 506 B13R1.129 Cc1ccc(o1)C(=O)NCC(=O)N 2e8c8680aa18d71d50a97c0f01266d1f [0,1,0,0,0,1|1,0,0]=3 507 B13R1.129 Cc1ccc(o1)C(=O)NCC(C)C 6aca32e6c2e417fa546578b1c1a8ae87 [0,1,0,0,0,1|1,0,1]=4 508 B13R1.129 Cc1ccc(o1)C(=O)NCC(C)O 79853ae35f24f78626c670c5cd5ffd47 [0,1,0,0,0,1|0,0,2]=4 509 B13R1.129 Cc1ccc(o1)C(=O)NC[C@@H](C)O 87db4efdc5692bee2242d370977de27b [0,1,0,0,0,1|0,0,2]=4 510 B13R1.129 Cc1ccc(o1)C(=O)NC[C@H](C)O e4a8d12e6d49ae18d6e0d93c3a73cdb0 [0,1,0,0,0,1|0,0,2]=4 511 B13R1.129 Cc1ccc(s1)C(=O)NCC(=O)N 590137c1c645ef29c88d132f67af0ec9 [0,1,0,0,0,1|1,1,0]=4 512 B13R1.129 Cc1cnc(o1)C(=O)NCC(=O)N 7619037ccc5e702e6a8eb22f0d69e3d3 [0,1,0,0,0,1|2,0,0]=4 513 B13R1.129 Cc1coc(c1)C(=O)NCC(=O)N 0ce569954a60842d8b314071244940fd [0,1,0,0,0,1|1,0,0]=3 514 B13R1.129 Cc1coc(c1)C(=O)NCC(C)C 3213c61447c6000c24b640a44d01e8c8 [0,1,0,0,0,1|1,0,1]=4 515 B13R1.129 Cc1coc(c1)C(=O)NCC(C)O 6fb78f877254c3d3074e93496b6342aa [0,1,0,0,0,1|0,0,2]=4 516 B13R1.129 Cc1coc(c1)C(=O)NC[C@@H](C)O 0eab3bf54e9473b82d98e9db46cc7d61 [0,1,0,0,0,1|0,0,2]=4 517 B13R1.129 Cc1coc(c1)C(=O)NC[C@H](C)O aef66dec81da5d8af1e8883f6a6df5a8 [0,1,0,0,0,1|0,0,2]=4 518 B13R1.129 Cc1coc(n1)C(=O)NCC(=O)N ac76f1bdff0585654ae7660dee2fbc68 [0,1,0,0,0,1|2,0,0]=4 519 B13R1.129 Cc1csc(c1)C(=O)NCC(=O)N db0c89ced3c436355c01d091442a2b86 [0,1,0,0,0,1|1,1,0]=4 520 B13R1.129 Cc1ncc(o1)C(=O)NCC(=O)N d81533c1091f9a1c38536c0bc908fb1d [0,1,0,0,0,1|2,0,0]=4 521 B13R1.129 NC(=O)CNC(=O)c1cc(co1)Br 5832c1276c5656e64bf26ee45c54f8cc [0,1,0,0,0,1|1,0,0]=3 522 B13R1.129 NC(=O)CNC(=O)c1cc(co1)Cl 2726e6f2ad584240ff2702ff79b92251 [0,1,0,0,0,1|1,0,0]=3 523 B13R1.129 NC(=O)CNC(=O)c1cc(cs1)Br b5aee478c238ef9cce382d0772cf34e0 [0,1,0,0,0,1|1,1,0]=4 524 B13R1.129 NC(=O)CNC(=O)c1cc(cs1)Cl 0286d17f7d611e4c475ed9544096e37a [0,1,0,0,0,1|1,1,0]=4 525 B13R1.129 NC(=O)CNC(=O)c1cc(cs1)F 6300bbac0443efa3526bbefb645915d1 [0,1,0,0,0,1|1,1,0]=4 526 B13R1.129 NC(=O)CNC(=O)c1cc(cs1)O 990dc560fcdf6d3153e9f0809c8734f9 [0,1,0,0,0,1|1,1,0]=4 527 B13R1.129 NC(=O)CNC(=O)c1cc(no1)Br 9ad6407083bad9dd3e08e8dd89410ef6 [0,1,0,0,0,1|2,0,0]=4 528 B13R1.129 NC(=O)CNC(=O)c1cc(no1)Cl db09bcacd7c32ba90da9410d64e2add8 [0,1,0,0,0,1|2,0,0]=4 529 B13R1.129 NC(=O)CNC(=O)c1cc(no1)O 36f1627d30e1691ff149c0a365a7c4a1 [0,1,0,0,0,1|2,0,0]=4 530 B13R1.129 NC(=O)CNC(=O)c1ccc(o1)Br 67cf056b4941cbfadeadcf77125d6472 [0,1,0,0,0,1|1,0,0]=3 531 B13R1.129 NC(=O)CNC(=O)c1ccc(o1)Cl 8bd92c7c26be1d6f8ce301cd3e4ad8e7 [0,1,0,0,0,1|1,0,0]=3 532 B13R1.129 NC(=O)CNC(=O)c1ccc(o1)F 3bacc3ef915ee3b8f77d756745cad08e [0,1,0,0,0,1|1,0,0]=3 533 B13R1.129 NC(=O)CNC(=O)c1ccc(o1)I 3d9996cf2385815fc93f965941cc1c6a [0,1,0,0,0,1|1,0,0]=3 534 B13R1.129 NC(=O)CNC(=O)c1ccc(s1)Br 0d4c43fbb3851d070b713bd9ae1f369b [0,1,0,0,0,1|1,1,0]=4 535 B13R1.129 NC(=O)CNC(=O)c1ccc(s1)Cl 0829cc848369341fcdb1a69f9bb588ad [0,1,0,0,0,1|1,1,0]=4 536 B13R1.129 NC(=O)CNC(=O)c1ccc(s1)F 11e22c0219d52f0b3cac725078cde562 [0,1,0,0,0,1|1,1,0]=4 537 B13R1.129 NC(=O)CNC(=O)c1ccc(s1)I 2809d3c9c0caa09d99f466f69aed5a41 [0,1,0,0,0,1|1,1,0]=4 538 B13R1.129 NC(=O)CNC(=O)c1cnc(o1)Br 055f1cbb8859f23cbce500747e09f44f [0,1,0,0,0,1|2,0,0]=4 539 B13R1.129 NC(=O)CNC(=O)c1cnc(o1)Cl 1cf2253f757f14a47ade9b2e81a7080e [0,1,0,0,0,1|2,0,0]=4 540 B13R1.129 NC(=O)CNC(=O)c1cnc(o1)I 7ae20d5f03dd3282e170e1a24008c96b [0,1,0,0,0,1|2,0,0]=4 541 B13R1.129 NC(=O)CNC(=O)c1cnc(o1)O f0797f49242875d046c32e14da42af21 [0,1,0,0,0,1|2,0,0]=4 542 B13R1.129 NC(=O)CNC(=O)c1nc(co1)Br c0fee68a005e4fde604247d8dc9fe6f8 [0,1,0,0,0,1|2,0,0]=4 543 B13R1.129 NC(=O)CNC(=O)c1ncc(o1)Br 35ba1ebf89d8984dbecb6d359af8454b [0,1,0,0,0,1|2,0,0]=4 544 B13R1.162 C#CC(C)NCC(=O)c1ccco1 663f38425404e9d2420276d0b7a8c1da [0,1,0,0,0,1|1,0,1]=4 545 B13R1.162 C#CC(C)OCC(=O)c1ccco1 ba9dd2bc986f14007a6f496184b6f6bf [0,1,0,0,0,1|1,0,1]=4 546 B13R1.162 C#C[C@@H](C)NCC(=O)c1ccco1 be7f8214f73610780269894d6b7f74b3 [0,1,0,0,0,1|1,0,1]=4 547 B13R1.162 C#C[C@@H](C)OCC(=O)c1ccco1 75c1356e087bdf71674540e085251191 [0,1,0,0,0,1|1,0,1]=4 548 B13R1.162 C#C[C@H](C)NCC(=O)c1ccco1 6b000790f4288ab4dcc691af6be32e68 [0,1,0,0,0,1|1,0,1]=4 549 B13R1.162 C#C[C@H](C)OCC(=O)c1ccco1 16b67e4677d827df40b8be784ba83205 [0,1,0,0,0,1|1,0,1]=4 550 B13R1.162 C=C(C=O)OCC(=O)c1ccc[nH]1 d0ed376f08c92f7b2e4425896fb98162 [0,1,0,0,0,1|1,0,1]=4 551 B13R1.162 C=C(C=O)OCC(=O)c1ccco1 98e9e5cd114ac6a4af4631f06eb606d1 [0,1,0,0,0,1|0,0,1]=3 552 B13R1.162 C=C(C=O)OCC(=O)c1cccs1 26d8cbc4a6e64c6cb96c511fc4a33e31 [0,1,0,0,0,1|0,1,1]=4 553 B13R1.162 C=C(C=O)OCC(=O)c1ncco1 d4943c0eafefdc017af9c19735d42f74 [0,1,0,0,0,1|1,0,1]=4 554 B13R1.162 C=CC(C)NCC(=O)c1ccco1 b046226293a21572e40c72c031d33d7b [0,1,0,0,0,1|1,0,1]=4 555 B13R1.162 C=CC(C)OCC(=O)c1ccco1 50b88e875209b56a48a62657e9e53446 [0,1,0,0,0,1|1,0,1]=4 556 B13R1.162 C=C[C@H](C)OCC(=O)c1ccco1 7d3a93a00e0f0bc50782eb372771b487 [0,1,0,0,0,1|1,0,1]=4 557 B13R1.162 CC(C#N)CNC(=O)c1ccco1 dc8d9c1ed015dcee0aa606b2da68b473 [0,1,0,0,0,1|1,0,1]=4 558 B13R1.162 CC(C#N)NCC(=O)c1ccco1 710ac795cc296f3165b7493910e550fd [0,1,0,0,0,1|1,0,1]=4 559 B13R1.162 CC(C=O)OCC(=O)c1ccco1 22786e28a403f3c56f309dac7bb8f9a3 [0,1,0,0,0,1|0,0,1]=3 560 B13R1.162 CC(C=O)OCC(=O)c1cccs1 3263fb7e3d1d1a55b288c04692378af4 [0,1,0,0,0,1|0,1,1]=4 561 B13R1.162 CC(C=O)OCC(=O)c1ncco1 ca8afff16b4ec6bb0066cabd294430a3 [0,1,0,0,0,1|1,0,1]=4 562 B13R1.162 CC(CF)OCC(=O)c1ccco1 5c749b19b48b57257ada8d1d198739ed [0,1,0,0,0,1|1,0,1]=4 563 B13R1.162 CC(CO)CNC(=O)c1ccco1 ef589f6f8f49d505a3197753ba2678db [0,1,0,0,0,1|0,0,2]=4 564 B13R1.162 CC(CO)NCC(=O)c1ccco1 8a36631488c0ada44407e41d09db84ed [0,1,0,0,0,1|0,0,2]=4 565 B13R1.162 CC(CS)OCC(=O)c1ccco1 b07fc92194ef24242a7b601de9078d9f [0,1,0,0,0,1|0,1,1]=4 566 B13R1.162 CC(NCC(=O)CO)c1ccco1 31655143d5648a6168e57d79ea1bb59c [0,1,0,0,0,1|1,0,1]=4 567 B13R1.162 CCC(=O)CNC(C)c1ccco1 ec9320a5fe7f24696c8fb7249b701c07 [0,1,0,0,0,1|1,0,1]=4 568 B13R1.162 CCC(=O)CN[C@H](C)c1ccco1 d9fb4370d4392a11ce90d682692c862a [0,1,0,0,0,1|1,0,1]=4 569 B13R1.162 CCC(=O)COC(C)c1ccco1 fe8a1ed99c34000a5de7042e73f5af81 [0,1,0,0,0,1|1,0,1]=4 570 B13R1.162 CCC(=O)CO[C@H](C)c1ccco1 6afe3a4801bae2b0f6d8290b62a07aa0 [0,1,0,0,0,1|1,0,1]=4 571 B13R1.162 CCC(=O)NCC(O)c1ccco1 aee187a5b49cb65023e1761a9b14e28c [0,1,0,0,0,1|0,0,2]=4 572 B13R1.162 CCC(C)CNC(=O)c1ccco1 bb99c0b101b514bd961dd2677a5574c8 [0,1,0,0,0,1|1,0,1]=4 573 B13R1.162 CCC(C)NCC(=O)c1ccco1 695e7931f0e9bca0474543953cc3ca1e [0,1,0,0,0,1|1,0,1]=4 574 B13R1.162 CCC(C)OCC(=O)c1ccco1 cf01533b90a6aa97b270f883c2c10d8b [0,1,0,0,0,1|1,0,1]=4 575 B13R1.162 CCC(O)CNC(=O)c1ccco1 aedef666ed8e613b2ee1dd22417b9029 [0,1,0,0,0,1|0,0,2]=4 576 B13R1.162 CC[C@@H](C)NCC(=O)c1ccco1 635b06fbf6749d6ab3fdb4ad7eb4b4ae [0,1,0,0,0,1|1,0,1]=4 577 B13R1.162 CC[C@@H](C)OCC(=O)c1ccco1 0dd494330ccce2c37e424aff6c17e555 [0,1,0,0,0,1|1,0,1]=4 578 B13R1.162 CC[C@@H](O)CNC(=O)c1ccco1 38167f0092be489a2098169f0686c794 [0,1,0,0,0,1|0,0,2]=4 579 B13R1.162 CC[C@H](C)CNC(=O)c1ccco1 529040a2015b151a39a2583edb961967 [0,1,0,0,0,1|1,0,1]=4 580 B13R1.162 CC[C@H](C)NCC(=O)c1ccco1 7ee4c7e38c576c78db37cb0b2b37ba10 [0,1,0,0,0,1|1,0,1]=4 581 B13R1.162 CC[C@H](C)OCC(=O)c1ccco1 2872d9e5b39b97eafd5bb1c70335b266 [0,1,0,0,0,1|1,0,1]=4 582 B13R1.162 CNC(=O)CNC(=O)c1ccco1 c48a6d599fbe062c780169b4c6ef66bb [0,1,0,0,0,1|0,0,0]=2 583 B13R1.162 CNC(=O)CNC(=O)c1cccs1 c5b992820da7d63480360bb9e9a16a69 [0,1,0,0,0,1|0,1,0]=3 584 B13R1.162 CNC(=O)CNC(=O)c1ccno1 a6689644fe5414962e99bff81a306626 [0,1,0,0,0,1|1,0,0]=3 585 B13R1.162 CNC(=O)CNC(=O)c1ccns1 87f98ac949503edc4e3f640882bf9e28 [0,1,0,0,0,1|1,1,0]=4 586 B13R1.162 CNC(=O)CNC(=O)c1ccoc1 f9f9e5b82e28e149e296b28937026c0a [0,1,0,0,0,1|2,0,0]=4 587 B13R1.162 CNC(=O)CNC(=O)c1ccon1 2a1e76b376c158a62d00f212f1558c74 [0,1,0,0,0,1|2,0,0]=4 588 B13R1.162 CNC(=O)CNC(=O)c1ccsc1 85335ca1cc5960fb1ab123e405342f7e [0,1,0,0,0,1|2,0,0]=4 589 B13R1.162 CNC(=O)CNC(=O)c1ccsn1 cebaf864dc1281242cd4a9f9052ecb63 [0,1,0,0,0,1|2,0,0]=4 590 B13R1.162 CNC(=O)CNC(=O)c1cnco1 35abbce787a2a36a082ded672a7c6db2 [0,1,0,0,0,1|1,0,0]=3 591 B13R1.162 CNC(=O)CNC(=O)c1cncs1 e0fcdc66b99a6d3f048c1ff28f8ec0fa [0,1,0,0,0,1|1,1,0]=4 592 B13R1.162 CNC(=O)CNC(=O)c1cocn1 52cd4417c51069b8ed47f7c54d00a154 [0,1,0,0,0,1|2,0,0]=4 593 B13R1.162 CNC(=O)CNC(=O)c1cscn1 740537baa374b96483d6648c5298b31d [0,1,0,0,0,1|2,0,0]=4 594 B13R1.162 CNC(=O)CNC(=O)c1ncco1 1ca6f4fc863a858d96936fdf61b9ccf2 [0,1,0,0,0,1|1,0,0]=3 595 B13R1.162 CNC(=O)CNC(=O)c1nccs1 4c06cb8f500788b9eec9fff6be1c7a84 [0,1,0,0,0,1|1,1,0]=4 596 B13R1.162 CNC(=O)CNC(C)c1ccco1 765f5ce0eabb5057ed26e00017925571 [0,1,0,0,0,1|1,0,1]=4 597 B13R1.162 CNC(=O)CN[C@H](C)c1ccco1 c547088d0454f9083c99cb94674e1d03 [0,1,0,0,0,1|1,0,1]=4 598 B13R1.162 CNC(=O)COC(C)c1ccco1 be0cfed7cd510f9573d947480fe8b2ee [0,1,0,0,0,1|1,0,1]=4 599 B13R1.162 CNC(=O)CO[C@H](C)c1ccco1 418fea7322d8b89945476c2744daab2a [0,1,0,0,0,1|1,0,1]=4 600 B13R1.162 COC(=O)CNC(=O)c1ccco1 313eb12b3160e65910fff11309149879 [0,1,0,0,0,1|0,0,0]=2 601 B13R1.162 COC(=O)CNC(=O)c1cccs1 e973a8543054ce7f3c151b7d0855abf7 [0,1,0,0,0,1|0,1,0]=3 602 B13R1.162 COC(=O)CNC(=O)c1ccno1 a3a4cce9ca6f28d8ad7fbd643b7baf04 [0,1,0,0,0,1|1,0,0]=3 603 B13R1.162 COC(=O)CNC(=O)c1ccns1 e9b05de673470eb903a3d40e0b922f70 [0,1,0,0,0,1|1,1,0]=4 604 B13R1.162 COC(=O)CNC(=O)c1ccoc1 8263236102523529f7895702f30c11f5 [0,1,0,0,0,1|2,0,0]=4 605 B13R1.162 COC(=O)CNC(=O)c1ccon1 66518980f913c78e9facc5f11b3a3597 [0,1,0,0,0,1|2,0,0]=4 606 B13R1.162 COC(=O)CNC(=O)c1ccsc1 e8d480e4b9a4255ff39b5b78daf06235 [0,1,0,0,0,1|2,0,0]=4 607 B13R1.162 COC(=O)CNC(=O)c1ccsn1 43c29721cff6c9e659b24920bc926f37 [0,1,0,0,0,1|2,0,0]=4 608 B13R1.162 COC(=O)CNC(=O)c1cnco1 fa0be6e17cd74456f347db289563f7d5 [0,1,0,0,0,1|1,0,0]=3 609 B13R1.162 COC(=O)CNC(=O)c1cncs1 f71174ba87bb36f32a779e333492bf96 [0,1,0,0,0,1|1,1,0]=4 610 B13R1.162 COC(=O)CNC(=O)c1cocn1 9c15a597a1982dc7e1317e5babb4a9a3 [0,1,0,0,0,1|2,0,0]=4 611 B13R1.162 COC(=O)CNC(=O)c1cscn1 db92aa940b2517b7e78b2297ad630b4a [0,1,0,0,0,1|2,0,0]=4 612 B13R1.162 COC(=O)CNC(=O)c1ncco1 12bee67df51c3b6609d1fa4d828a2d49 [0,1,0,0,0,1|1,0,0]=3 613 B13R1.162 COC(=O)CNC(=O)c1nccs1 c7764390b7a63a9b7361ef9713fe92f7 [0,1,0,0,0,1|1,1,0]=4 614 B13R1.162 COC(=O)CNC(=O)c1nnco1 89d7352bd4094c6bfb54d28e0d9d02de [0,1,0,0,0,1|2,0,0]=4 615 B13R1.162 COC(=O)CNC(C)c1ccco1 e7da9071462755866a06c924e15d9897 [0,1,0,0,0,1|1,0,1]=4 616 B13R1.162 COC(=O)CN[C@H](C)c1ccco1 6c5d17a12bf80baff2ccc4408e278caa [0,1,0,0,0,1|1,0,1]=4 617 B13R1.162 COC(=O)COC(C)c1ccco1 3aeb8c37e43c985215dd744c6984a266 [0,1,0,0,0,1|1,0,1]=4 618 B13R1.162 COC(=O)CO[C@H](C)c1ccco1 e2ba4df2741f09a44f2201e605fc36cf [0,1,0,0,0,1|1,0,1]=4 619 B13R1.162 CO[C@@H](C)CNC(=O)c1ccco1 11045a02e176ebdf66072437020dee85 [0,1,0,0,0,1|0,0,2]=4 620 B13R1.162 CO[C@H](C)CNC(=O)c1ccco1 f7673e5b8bea27e5563b68caadae9cd0 [0,1,0,0,0,1|0,0,2]=4 621 B13R1.162 C[C@@H](CO)NCC(=O)c1ccco1 f53f4fad80cf84848f1d4cad4abd0424 [0,1,0,0,0,1|0,0,2]=4 622 B13R1.162 C[C@@H](NCC(=O)CO)c1ccco1 1857a816c0badbfa49c88b7caf592e5c [0,1,0,0,0,1|1,0,1]=4 623 B13R1.162 C[C@H](C=O)OCC(=O)c1ccco1 2d3fd984bd05340a5663858e53c814fc [0,1,0,0,0,1|0,0,1]=3 624 B13R1.162 C[C@H](CO)CNC(=O)c1ccco1 196167a4507a0b60435d3629f6c88a13 [0,1,0,0,0,1|0,0,2]=4 625 B13R1.162 C[C@H](CO)NCC(=O)c1ccco1 2213cf619ff9b5a3769d416394038404 [0,1,0,0,0,1|0,0,2]=4 626 B13R1.162 C[C@H](CS)OCC(=O)c1ccco1 627006a9488471055011e495dcd0799d [0,1,0,0,0,1|0,1,1]=4 627 B13R1.162 O=C(CF)NCC(O)c1ccco1 e5b846f4a7df52790c4fcc1d9d9ba40c [0,1,0,0,0,1|0,0,2]=4 628 B13R1.162 O=C(CNC(=O)c1ccco1)NO 5c95e00ca13183524cece3603fd78261 [0,1,0,0,0,1|1,0,0]=3 629 B13R1.162 O=C(CNC(=O)c1cccs1)NO d07523a8107fa207e791924a1f3a7b97 [0,1,0,0,0,1|1,1,0]=4 630 B13R1.162 O=C(CNC(=O)c1ccno1)NO 70b8023783eeddfa85782d2e69b714fb [0,1,0,0,0,1|2,0,0]=4 631 B13R1.162 O=C(CNC(=O)c1cnco1)NO 2ba7c1c053c7b90672b13b9bf30825ac [0,1,0,0,0,1|2,0,0]=4 632 B13R1.162 O=C(CNC(=O)c1ncco1)NO a93cab797a7d289f2e38530e467f3548 [0,1,0,0,0,1|2,0,0]=4 633 B13R1.162 O=C(CO)NCC(O)c1ccco1 eea6f4db891cc9d105cc840cc740455c [0,1,0,0,0,1|0,0,2]=4 634 B13R1.162 O=C(CS)NCC(O)c1ccco1 d21597cc83c9570e44dcdde87ab42d10 [0,1,0,0,0,1|0,0,2]=4 635 B13R1.162 O=C(NCC(Br)CBr)c1ccco1 169376d0a9ea6390e88fdbd134cb1ce5 [0,1,0,0,0,1|1,0,1]=4 636 B13R1.162 O=C(NCC(F)CO)c1ccco1 66dac165bf664b8438b0cb38e0a91f52 [0,1,0,0,0,1|1,0,1]=4 637 B13R1.162 O=C(NCC(O)CO)c1ccco1 d80a4f635cea256ff531e11ef648f1a7 [0,1,0,0,0,1|0,0,2]=4 638 B13R1.162 O=C(NC[C@@H](F)CO)c1ccco1 ce734fadfc614210c81f08834d578a75 [0,1,0,0,0,1|1,0,1]=4 639 B13R1.162 O=C(NC[C@@H](O)CO)c1ccco1 34bd18a98bacae68223816dbb899236a [0,1,0,0,0,1|0,0,2]=4 640 B13R1.162 O=C(NC[C@H](F)CO)c1ccco1 081c969a140ccd14137f3dc3179275d2 [0,1,0,0,0,1|1,0,1]=4 641 B13R1.162 O=C(NC[C@H](O)CO)c1ccco1 5a2e9e566c9083fd24b630da9417738f [0,1,0,0,0,1|0,0,2]=4 642 B13R1.168 C=C(Br)CNC(=O)c1occc1Br cac2593873ea80f34a85217be175c84c [0,1,0,0,0,1|1,0,1]=4 643 B13R1.168 C=C(Br)CNC(=O)c1occc1C 70b12d16611f75dccd20ab6854b1811e [0,1,0,0,0,1|1,0,1]=4 644 B13R1.168 C=C(C)CNC(=O)c1cccn1C 892503f2bdd288a9a0dfb7ca4f1176a0 [0,1,0,0,0,1|2,0,0]=4 645 B13R1.168 C=C(C)CNC(=O)c1occc1Br 5f7cca3de5217b3f0e18d3f0288ec5e9 [0,1,0,0,0,1|1,0,0]=3 646 B13R1.168 C=C(C)CNC(=O)c1occc1C 335acad21d09faaae4e925ada25daf7c [0,1,0,0,0,1|1,0,0]=3 647 B13R1.168 C=C(C)CNC(=O)c1ocnc1Br 1fd259545ec1dcff1a8c2c69efffeefa [0,1,0,0,0,1|2,0,0]=4 648 B13R1.168 C=C(C)CNC(=O)c1ocnc1C 4c03c05a822a694ba7df95eb4edb9d1b [0,1,0,0,0,1|2,0,0]=4 649 B13R1.168 C=C(C)CNC(=O)c1oncc1C 33a6bd39e0d99cc5eafcdffcc6dc9148 [0,1,0,0,0,1|2,0,0]=4 650 B13R1.168 C=C(C)CNC(=O)c1sccc1Br 6a12ab170df15b034b27373c97f54581 [0,1,0,0,0,1|1,1,0]=4 651 B13R1.168 C=C(C)CNC(=O)c1sccc1C 199625012323ad923c80c35c1a088bf4 [0,1,0,0,0,1|1,1,0]=4 652 B13R1.168 C=C(C)CNC(=O)c1sccc1Cl 21946c80ca915097941c132a4702c8d8 [0,1,0,0,0,1|1,1,0]=4 653 B13R1.168 C=C(C)CNC(=O)c1sccc1F c500b599c62501fb0cf5bc757bac49bf [0,1,0,0,0,1|1,1,0]=4 654 B13R1.168 C=C(C)CNC(=O)c1sccc1I 25c0c79946364e60cd304a70e14c6dad [0,1,0,0,0,1|1,1,0]=4 655 B13R1.168 C=C(C)CNC(=O)c1sccc1O 115a993d8e2659aaa224f663964ec613 [0,1,0,0,0,1|1,1,0]=4 656 B13R1.168 C=C(C)CNC(=O)c1sccc1S 256cba41a9c6569f0c9b2b715f3c43e0 [0,1,0,0,0,1|1,1,0]=4 657 B13R1.168 CC(=O)CNC(=O)c1cccn1C 782d8e5ded93022daab77e187675bd6e [0,1,0,0,0,1|1,0,0]=3 658 B13R1.168 CC(=O)CNC(=O)c1ccnn1C 521f8bbee150b9b49cfd8ec4f275be46 [0,1,0,0,0,1|2,0,0]=4 659 B13R1.168 CC(=O)CNC(=O)c1ccoc1Br b2550d076009d95b0d5a4b1e6e92df01 [0,1,0,0,0,1|2,0,0]=4 660 B13R1.168 CC(=O)CNC(=O)c1ccoc1C 88899ac5d43b07cf07353d4468201c73 [0,1,0,0,0,1|2,0,0]=4 661 B13R1.168 CC(=O)CNC(=O)c1ccoc1Cl c3a9ecdf934cc17011658907ecf3c46b [0,1,0,0,0,1|2,0,0]=4 662 B13R1.168 CC(=O)CNC(=O)c1ccoc1I 3d71fb18e85ce49c31d4443011797000 [0,1,0,0,0,1|2,0,0]=4 663 B13R1.168 CC(=O)CNC(=O)c1ccsc1Br 37e8f1ed3d2c5bb45851df5ffbb0102c [0,1,0,0,0,1|2,0,0]=4 664 B13R1.168 CC(=O)CNC(=O)c1ccsc1C 20a45407e97f3cd08d8797ed7fa87509 [0,1,0,0,0,1|2,0,0]=4 665 B13R1.168 CC(=O)CNC(=O)c1ccsc1Cl 6e1229a53a562662200c1f7e8c34ec6a [0,1,0,0,0,1|2,0,0]=4 666 B13R1.168 CC(=O)CNC(=O)c1ccsc1F 11e911e1f5288b1170c4e3897555b55f [0,1,0,0,0,1|2,0,0]=4 667 B13R1.168 CC(=O)CNC(=O)c1ccsc1I 47ac5e16b9882f4875af9a827230e6fd [0,1,0,0,0,1|2,0,0]=4 668 B13R1.168 CC(=O)CNC(=O)c1cncn1C 9c07e9cbd133c3e04d22d8e26e05f7d3 [0,1,0,0,0,1|2,0,0]=4 669 B13R1.168 CC(=O)CNC(=O)c1cocc1Br 23955fcf6b7258601fdd1164f46b0657 [0,1,0,0,0,1|2,0,0]=4 670 B13R1.168 CC(=O)CNC(=O)c1cocc1C 21efe6b7f588086dbdf8d8104c5c6057 [0,1,0,0,0,1|2,0,0]=4 671 B13R1.168 CC(=O)CNC(=O)c1cscc1Br 06d204d37f284cf2124310bfa8690dce [0,1,0,0,0,1|2,0,0]=4 672 B13R1.168 CC(=O)CNC(=O)c1cscc1C 71f2fc9e7d4c0b19483cba188b4f3677 [0,1,0,0,0,1|2,0,0]=4 673 B13R1.168 CC(=O)CNC(=O)c1cscc1Cl a83e1d1a90b5088005f12559b23b161c [0,1,0,0,0,1|2,0,0]=4 674 B13R1.168 CC(=O)CNC(=O)c1nccn1C 169c1a94a0c01b302ba250cf9bc76bb1 [0,1,0,0,0,1|2,0,0]=4 675 B13R1.168 CC(=O)CNC(=O)c1ncoc1C 50cdcd6414db3213f8e0395e18ec7487 [0,1,0,0,0,1|2,0,0]=4 676 B13R1.168 CC(=O)CNC(=O)c1ncsc1Br a1095b27d712a306ab6d6dd4f71413c0 [0,1,0,0,0,1|2,0,0]=4 677 B13R1.168 CC(=O)CNC(=O)c1ncsc1C dca8d0b94d0fbf59b67968b02ec02152 [0,1,0,0,0,1|2,0,0]=4 678 B13R1.168 CC(=O)CNC(=O)c1ncsc1Cl 082da38b464b486f25933ecd4493de28 [0,1,0,0,0,1|2,0,0]=4 679 B13R1.168 CC(=O)CNC(=O)c1nocc1Br 3e85a98dbfbc985ed4493e549ec2734c [0,1,0,0,0,1|2,0,0]=4 680 B13R1.168 CC(=O)CNC(=O)c1nocc1C 2f90c38d6d933c87382708f0c12d0c92 [0,1,0,0,0,1|2,0,0]=4 681 B13R1.168 CC(=O)CNC(=O)c1nscc1Br 1fa139965a6b51e63cbab722e7e52897 [0,1,0,0,0,1|2,0,0]=4 682 B13R1.168 CC(=O)CNC(=O)c1occc1Br fcfbb3b2c85c6c8759ed5962ff8664ad [0,1,0,0,0,1|0,0,0]=2 683 B13R1.168 CC(=O)CNC(=O)c1occc1C 8cdda9d9d63a19130c9fdb89a934cd87 [0,1,0,0,0,1|0,0,0]=2 684 B13R1.168 CC(=O)CNC(=O)c1ocnc1Br 5ecd042f8a07dce6faf66b49894adb12 [0,1,0,0,0,1|1,0,0]=3 685 B13R1.168 CC(=O)CNC(=O)c1ocnc1C b7477d06b9ce374f762b021c18c68025 [0,1,0,0,0,1|1,0,0]=3 686 B13R1.168 CC(=O)CNC(=O)c1oncc1C 37d86844e59f9d16b9b3fbbb0f994f91 [0,1,0,0,0,1|1,0,0]=3 687 B13R1.168 CC(=O)CNC(=O)c1sccc1Br 7992b173d0c75032d3e3b16a33566cca [0,1,0,0,0,1|0,1,0]=3 688 B13R1.168 CC(=O)CNC(=O)c1sccc1C 665ad327f5a565ca81791edafc8435ff [0,1,0,0,0,1|0,1,0]=3 689 B13R1.168 CC(=O)CNC(=O)c1sccc1Cl 27f8ad5f66943951cb954e702ab6bd68 [0,1,0,0,0,1|0,1,0]=3 690 B13R1.168 CC(=O)CNC(=O)c1sccc1F 0554d420817fb45c3f4d3e534a5514e2 [0,1,0,0,0,1|0,1,0]=3 691 B13R1.168 CC(=O)CNC(=O)c1sccc1I 3550a3b1cd5940e71976d804381577ea [0,1,0,0,0,1|0,1,0]=3 692 B13R1.168 CC(=O)CNC(=O)c1sccc1O 33211b25e9d6d1e334945576756107f4 [0,1,0,0,0,1|0,1,0]=3 693 B13R1.168 CC(=O)CNC(=O)c1sccc1S 7a238b73e6dd6d3157ddda9e8d7a74c1 [0,1,0,0,0,1|0,1,0]=3 694 B13R1.168 CC(=O)CNC(=O)c1scnc1Br a0a3ad4f71d9686a378567b9ed4d61a8 [0,1,0,0,0,1|1,1,0]=4 695 B13R1.168 CC(=O)CNC(=O)c1scnc1C 04c9c9713c898971e9f77f1b7cab49c8 [0,1,0,0,0,1|1,1,0]=4 696 B13R1.168 CC(=O)CNC(=O)c1scnc1Cl 1d9f4cabfa1e68c3b4f1d629dad361b0 [0,1,0,0,0,1|1,1,0]=4 697 B13R1.168 CC(=O)CNC(=O)c1sncc1Br 5f401eff6ff0981a3dac1638882aa944 [0,1,0,0,0,1|1,1,0]=4 698 B13R1.168 CC(=O)CNC(=O)c1sncc1C 79c96810ba093746fd830c8949ae507f [0,1,0,0,0,1|1,1,0]=4 699 B13R1.168 CC(=O)CNC(=O)c1sncc1Cl b0833dabba26d37983b55c42b064e742 [0,1,0,0,0,1|1,1,0]=4 700 B13R1.168 CC(C)CNC(=O)c1occc1Br 809c8229fd6e90d1e0d86cfa33fb5fdb [0,1,0,0,0,1|1,0,1]=4 701 B13R1.168 CC(O)CNC(=O)c1occc1Br e22c63d5b7d878dc968eb6d6786b8309 [0,1,0,0,0,1|0,0,2]=4 702 B13R1.168 C[C@@H](O)CNC(=O)c1occc1Br 11189bef14db5b944c11fb94dbbe5e75 [0,1,0,0,0,1|0,0,2]=4 703 B13R1.168 C[C@H](O)CNC(=O)c1occc1Br 93c53b08fad15ec49465cc6337b789aa [0,1,0,0,0,1|0,0,2]=4 704 B13R1.168 Cc1ccoc1C(=O)NCC(=O)N 6dcbec0204412c228b92f2622721a649 [0,1,0,0,0,1|1,0,0]=3 705 B13R1.168 Cc1ccoc1C(=O)NCC(C)C 8b12aa2c536b60bff82beb51943fdf65 [0,1,0,0,0,1|1,0,1]=4 706 B13R1.168 Cc1ccoc1C(=O)NCC(C)O c5ab550c11461318ca35cb56d7c077c3 [0,1,0,0,0,1|0,0,2]=4 707 B13R1.168 Cc1ccoc1C(=O)NC[C@@H](C)O c1ac9faa78d59e1961a070b323517d3a [0,1,0,0,0,1|0,0,2]=4 708 B13R1.168 Cc1ccoc1C(=O)NC[C@H](C)O 312bf0ac185a546be4fc8664116f09ab [0,1,0,0,0,1|0,0,2]=4 709 B13R1.168 Cc1ccsc1C(=O)NCC(=O)N 8e5b78fe158d9d29c4a608f981d2a134 [0,1,0,0,0,1|1,1,0]=4 710 B13R1.168 Cc1cnoc1C(=O)NCC(=O)N d528799fc3ece9f7e9f60f9e8fc24872 [0,1,0,0,0,1|2,0,0]=4 711 B13R1.168 Cc1ncoc1C(=O)NCC(=O)N 5203d017d35beb5384577277f3b7d338 [0,1,0,0,0,1|2,0,0]=4 712 B13R1.168 Cn1cccc1C(=O)NCC(=O)N fc334f178d2edd0e94d7d53fcb0abc29 [0,1,0,0,0,1|2,0,0]=4 713 B13R1.168 NC(=O)CNC(=O)c1occc1Br d39e3f52bcfa568001d9de814d49582c [0,1,0,0,0,1|1,0,0]=3 714 B13R1.168 NC(=O)CNC(=O)c1ocnc1Br 913770b0d144763553e7a0a4d2071054 [0,1,0,0,0,1|2,0,0]=4 715 B13R1.168 NC(=O)CNC(=O)c1sccc1Br 28fdce38d2596597a6906bf998927065 [0,1,0,0,0,1|1,1,0]=4 716 B13R1.168 NC(=O)CNC(=O)c1sccc1Cl 6825fa8b2eefc4e49c1bfc02a4116fd0 [0,1,0,0,0,1|1,1,0]=4 717 B13R1.168 NC(=O)CNC(=O)c1sccc1F 5d38ddf793a96cbf7afc5ed455a4b166 [0,1,0,0,0,1|1,1,0]=4 718 B13R1.168 NC(=O)CNC(=O)c1sccc1I 1c6eb763144e7b78626cbb923c785510 [0,1,0,0,0,1|1,1,0]=4 719 B13R1.168 NC(=O)CNC(=O)c1sccc1O 8a776301a1841f1c45a0fa31cd1d60e4 [0,1,0,0,0,1|1,1,0]=4 720 B13R1.168 NC(=O)CNC(=O)c1sccc1S 475c6dbdeba6e536ed5147c8bc30bee0 [0,1,0,0,0,1|1,1,0]=4 721 B13R1.339 CC(C)C(C)NC(=O)c1ccco1 f67f459d1f1bf124aac14b3614405d42 [0,1,0,0,0,1|1,0,1]=4 722 B13R1.339 CC(C)N(C)CC(=O)c1ccco1 9b87fa5ffe75ed04cafc3f017707dd60 [0,1,0,0,0,1|1,0,1]=4 723 B13R1.339 CC(C)[C@@H](C)NC(=O)c1ccco1 d10ff527e763694f72b42b3c650177fb [0,1,0,0,0,1|1,0,1]=4 724 B13R1.339 CC(C)[C@H](C)NC(=O)c1ccco1 704a110c7b0097fec16678a95e66644a [0,1,0,0,0,1|1,0,1]=4 725 B13R1.339 CC(NC(=O)c1ccco1)C(=O)N d6fe0b6099025b5e538fe004f53c997b [0,1,0,0,0,1|1,0,0]=3 726 B13R1.339 CC(NC(=O)c1cccs1)C(=O)N 042f220e24daccd28bf9407c9a839258 [0,1,0,0,0,1|1,1,0]=4 727 B13R1.339 CC(NC(=O)c1ccno1)C(=O)N 86cfb3ec3d81dccaac58ae595b9b0ffe [0,1,0,0,0,1|2,0,0]=4 728 B13R1.339 CC(NC(=O)c1cnco1)C(=O)N ff250b1ae4040b987db2dcccbe6cf4ff [0,1,0,0,0,1|2,0,0]=4 729 B13R1.339 CC(NC(=O)c1ncco1)C(=O)N c6c5ace3daeb4b510a20c6872ce72c89 [0,1,0,0,0,1|2,0,0]=4 730 B13R1.339 CC(O)C(C)NC(=O)c1ccco1 622a4ff46f6d317fdcf6f1de22350515 [0,1,0,0,0,1|0,0,2]=4 731 B13R1.339 C[C@@H](NC(=O)c1ccco1)C(=O)N 6d4237bff6a398062c57a8ad7f89f52a [0,1,0,0,0,1|1,0,0]=3 732 B13R1.339 C[C@@H](NC(=O)c1cccs1)C(=O)N 0d736bc258e49605adca9743f5a44f1a [0,1,0,0,0,1|1,1,0]=4 733 B13R1.339 C[C@@H](NC(=O)c1ccno1)C(=O)N cdd33ddde4891a7be0c2a96dee840d07 [0,1,0,0,0,1|2,0,0]=4 734 B13R1.339 C[C@@H](NC(=O)c1cnco1)C(=O)N 8ad4157a75c8ddc78f325bc638ef1a86 [0,1,0,0,0,1|2,0,0]=4 735 B13R1.339 C[C@@H](NC(=O)c1ncco1)C(=O)N 76932005ec42df2afb837bfb2656de0e [0,1,0,0,0,1|2,0,0]=4 736 B13R1.339 C[C@H](NC(=O)c1ccco1)C(=O)N cc40203ac6ec2864630af5f86cc81e7d [0,1,0,0,0,1|1,0,0]=3 737 B13R1.339 C[C@H](NC(=O)c1cccs1)C(=O)N fb4a232929a5993571b3a2a7a3ffc5ad [0,1,0,0,0,1|1,1,0]=4 738 B13R1.339 C[C@H](NC(=O)c1ccno1)C(=O)N c4f90d67d3330751eb79f9f2541c06a4 [0,1,0,0,0,1|2,0,0]=4 739 B13R1.339 C[C@H](NC(=O)c1cnco1)C(=O)N e7268e3882ae338295654f8523192fe3 [0,1,0,0,0,1|2,0,0]=4 740 B13R1.339 C[C@H](NC(=O)c1ncco1)C(=O)N 0f05245cb109fb43f8e791034163aa53 [0,1,0,0,0,1|2,0,0]=4 741 B13R1.340 CC(C)CN(C)C(=O)c1ccco1 8335d1df564ebd1e9631741de6b8d728 [0,1,0,0,0,1|1,0,1]=4 742 B13R1.340 CC(O)CN(C)C(=O)c1ccco1 e2f65f268a30036c4eff7486af1fd564 [0,1,0,0,0,1|0,0,2]=4 743 B13R1.340 CN(CC(=O)N)C(=O)c1ccco1 0f96bcaab610a3f1541f2cc22f08f953 [0,1,0,0,0,1|1,0,0]=3 744 B13R1.340 CN(CC(=O)N)C(=O)c1cccs1 6d9a101d8648041911c3d2d0104ef983 [0,1,0,0,0,1|1,1,0]=4 745 B13R1.340 CN(CC(=O)N)C(=O)c1ccno1 cae18fd9809c90ebdbd0a3ed764f1dac [0,1,0,0,0,1|2,0,0]=4 746 B13R1.340 CN(CC(=O)N)C(=O)c1cnco1 fb5d9389944c873d3b79e1ebefdeae74 [0,1,0,0,0,1|2,0,0]=4 747 B13R1.340 CN(CC(=O)N)C(=O)c1ncco1 7e40f3811ba82cd9d2ffa34ac00a870a [0,1,0,0,0,1|2,0,0]=4 748 B13R1.340 C[C@H](O)CN(C)C(=O)c1ccco1 bfc6b507cd11109742eb762dc8cd91a0 [0,1,0,0,0,1|0,0,2]=4 749 B13R1.2780 CC(C)(C)CNC(=O)c1ccco1 3fa6d10dfe9d95ef73d7bcea9df2cad3 [0,1,0,0,0,1|1,0,1]=4 750 B13R1.2780 CC(C)(C)NCC(=O)c1ccco1 971686396b2696eb2d70610e2f2d280f [0,1,0,0,0,1|1,0,1]=4 751 B13R1.2780 CC(C)(O)CNC(=O)c1ccco1 c1fc39e9c67d9114a0bd6be66138a823 [0,1,0,0,0,1|0,0,2]=4 752 B13R1.2780 CC(F)(F)CNC(=O)c1ccco1 0884940ff3822dfa7b657befb38b10c3 [0,1,0,0,0,1|1,0,1]=4 753 B13R1.2780 O=C(NCS(=O)(=O)O)c1ccco1 263245fccfc88ef80f46cbd601364f6a [0,1,0,0,0,1|2,0,0]=4 754 B13R1.282 CC(=O)CC(=O)Nc1ccnn1C 66c8d5758f882839c8d6385f94b19fe2 [0,1,0,0,0,1|2,0,0]=4 755 B13R1.282 CC(=O)CC(=O)Nc1ccsc1C d7d180fc85f2ebe7db019d1cc9e95d8d [0,1,0,0,0,1|2,0,0]=4 756 B13R1.282 CC(=O)CC(=O)Nc1cncn1C 05ef9dc592078c295f058efa771bfcca [0,1,0,0,0,1|2,0,0]=4 757 B13R1.282 CC(=O)CC(=O)Nc1nocc1C 0ac12a9bccfe02009976d46b20b84b09 [0,1,0,0,0,1|2,0,0]=4 758 B13R1.282 CC(=O)CC(=O)Nc1scnc1C bfb24f67c7e2f59740f7e6b325054ba7 [0,1,0,0,0,1|1,1,0]=4 759 B13R1.346 CC(=O)C(C)N(C)Cc1ccco1 156c97042ed3ce68c5f5b66884c9b5cb [0,1,0,0,0,1|2,0,0]=4 760 B13R1.545 CCC(=O)CN(C)Cc1ccco1 56d83840cf27ead719bb6621c2292562 [0,1,0,0,0,1|2,0,0]=4 761 B13R1.545 CN(CC(=O)CO)Cc1ccco1 d5081f12792c30f114ac192c9591de80 [0,1,0,0,0,1|2,0,0]=4 762 B13R1.545 CNC(=O)CC(=O)Nc1cccs1 599bb641dd35fdaa7439bf7da046706e [0,1,0,0,0,1|0,1,0]=3 763 B13R1.545 CNC(=O)CC(=O)Nc1ccno1 aaad3b53e9313e45d5fa62d2690a9320 [0,1,0,0,0,1|1,0,0]=3 764 B13R1.545 CNC(=O)CC(=O)Nc1ccns1 b4b9067c1e6498e020c7587f9881d739 [0,1,0,0,0,1|1,1,0]=4 765 B13R1.545 CNC(=O)CC(=O)Nc1ccsc1 9443396d5e5fd24c076a4582a7c20af7 [0,1,0,0,0,1|2,0,0]=4 766 B13R1.545 CNC(=O)CC(=O)Nc1cncs1 2107119f13013398ed0be4630b7fc880 [0,1,0,0,0,1|1,1,0]=4 767 B13R1.545 CNC(=O)CC(=O)Nc1cocn1 d526c5a40821b0c54e49db015f5a07d3 [0,1,0,0,0,1|2,0,0]=4 768 B13R1.545 CNC(=O)CC(=O)Nc1cscn1 bbfe0fa7d8a733a493fbe8cb2ac00dd0 [0,1,0,0,0,1|2,0,0]=4 769 B13R1.545 CNC(=O)CC(=O)Nc1ncco1 eb277ae1a8441fe0064a372211d62ba7 [0,1,0,0,0,1|1,0,0]=3 770 B13R1.545 CNC(=O)CC(=O)Nc1nccs1 9c263a0b138ab3f806fc4f917e92695b [0,1,0,0,0,1|1,1,0]=4 771 B13R1.545 CNC(=O)CN(C)Cc1ccco1 554594f960f65ffa731e743419a8efa8 [0,1,0,0,0,1|2,0,0]=4 772 B13R1.545 COC(=O)CC(=O)Nc1cccs1 7a326fc5e40f3891a2d94bb4f71da664 [0,1,0,0,0,1|0,1,0]=3 773 B13R1.545 COC(=O)CC(=O)Nc1ccno1 6507b22ce4cf22940baee6e6d54e3df5 [0,1,0,0,0,1|1,0,0]=3 774 B13R1.545 COC(=O)CC(=O)Nc1ccns1 5b2c68048f5a769bc1ba04536b021ea6 [0,1,0,0,0,1|1,1,0]=4 775 B13R1.545 COC(=O)CC(=O)Nc1ccsc1 61e96a8b5ee4c9755c5f03749ed22f01 [0,1,0,0,0,1|2,0,0]=4 776 B13R1.545 COC(=O)CC(=O)Nc1cncs1 951ca32384a6f59b44f3c3c06a31c687 [0,1,0,0,0,1|1,1,0]=4 777 B13R1.545 COC(=O)CC(=O)Nc1cocn1 c9811511ddeadcf5687f915165741752 [0,1,0,0,0,1|2,0,0]=4 778 B13R1.545 COC(=O)CC(=O)Nc1cscn1 a1800a20e03bb4e7d244ebf30fa1c220 [0,1,0,0,0,1|2,0,0]=4 779 B13R1.545 COC(=O)CC(=O)Nc1nccs1 fc92a8e21065ccad2a9380993a537d27 [0,1,0,0,0,1|1,1,0]=4 780 B13R1.545 COC(=O)CN(C)Cc1ccco1 30e685096f8d58edde3db70df13effd3 [0,1,0,0,0,1|2,0,0]=4 781 B13R1.1116 CS(=O)(=O)CC(=O)Nc1ccno1 313ef8ce3a187c0b2e94037375214957 [0,1,0,0,0,1|2,0,0]=4 782 B13R1.2007 CC(=O)CC(C)(C)Nc1ccco1 0d61789a795512618afbbf23bebc94b4 [0,1,0,0,0,1|1,0,1]=4 783 B13R1.3424 C=C(C)CC(=O)Nc1cc(no1)C ed4c7280134ba5162e752cd0f4ee173c [0,1,0,0,0,1|2,0,0]=4 784 B13R1.3424 C=C(C)CC(=O)Nc1cnc(o1)C 432560d1f6419952840b3e5fdd6daa75 [0,1,0,0,0,1|2,0,0]=4 785 B13R1.3424 C=C(C)CC(=O)Nc1nc(co1)Br c274f1b63c2f8a388d7435c80df5b4f0 [0,1,0,0,0,1|2,0,0]=4 786 B13R1.3424 C=C(C)CC(=O)Nc1nc(co1)C daf26d01204d06f0b2c58457bbd69519 [0,1,0,0,0,1|2,0,0]=4 787 B13R1.3424 C=C(C)CC(=O)Nc1ncc(o1)C 98b1e76777075d9d0eac6276cf3f4642 [0,1,0,0,0,1|2,0,0]=4 788 B13R1.3424 CC(=O)CC(=O)Nc1cc(no1)C 0f2254bc65d8fe0da3497ee0950995a0 [0,1,0,0,0,1|1,0,0]=3 789 B13R1.3424 CC(=O)CC(=O)Nc1cc(on1)C ed174ee1ec22d895508517a02bf08475 [0,1,0,0,0,1|2,0,0]=4 790 B13R1.3424 CC(=O)CC(=O)Nc1ccn(n1)C 128ce72674b31b16a2ee69b6ea2807db [0,1,0,0,0,1|2,0,0]=4 791 B13R1.3424 CC(=O)CC(=O)Nc1cn(cn1)C 4fdbe65d4c0a3b8635b4b3df1d576a22 [0,1,0,0,0,1|2,0,0]=4 792 B13R1.3424 CC(=O)CC(=O)Nc1cnc(o1)C f146a30684617f0c8c37d9e6f7c3c5b6 [0,1,0,0,0,1|1,0,0]=3 793 B13R1.3424 CC(=O)CC(=O)Nc1cnc(s1)C b9df91813978296af908f6309fbdf818 [0,1,0,0,0,1|1,1,0]=4 794 B13R1.3424 CC(=O)CC(=O)Nc1nc(co1)Br 933b0566bc2b71ec59dba849e561aa1b [0,1,0,0,0,1|1,0,0]=3 795 B13R1.3424 CC(=O)CC(=O)Nc1nc(co1)C 30c46a3a718d6f4a8591791ff1c094ee [0,1,0,0,0,1|1,0,0]=3 796 B13R1.3424 CC(=O)CC(=O)Nc1nc(cs1)C 17a4856889d5a5f33944d8bc3056f916 [0,1,0,0,0,1|1,1,0]=4 797 B13R1.3424 CC(=O)CC(=O)Nc1nc(cs1)O 7fea362c8a6431cd2efa7c903efeaa45 [0,1,0,0,0,1|1,1,0]=4 798 B13R1.3424 CC(=O)CC(=O)Nc1ncc(o1)C 8f446911693730ff13d14b09d94ddfae [0,1,0,0,0,1|1,0,0]=3 799 B13R1.3424 CC(=O)CC(=O)Nc1nnc(o1)Br 79d5009f4fc79f0b1ce9910434d31e8f [0,1,0,0,0,1|2,0,0]=4 800 B13R1.3424 CC(=O)CC(=O)Nc1nnc(o1)C 164864d32cbf833a6e919f57cdae7089 [0,1,0,0,0,1|2,0,0]=4 801 B13R1.3424 Cc1cnc(o1)NC(=O)CC(=O)N a733ebbb7f7c59c402366037e90a0cb5 [0,1,0,0,0,1|2,0,0]=4 802 B13R1.3424 Cc1coc(n1)NC(=O)CC(=O)N e1b6d78b996ed705b8a18ea1eaea7673 [0,1,0,0,0,1|2,0,0]=4 803 B13R1.3424 Cc1ncc(o1)NC(=O)CC(=O)N a9dc0efbc581752db6e2b185819c4f5d [0,1,0,0,0,1|2,0,0]=4 804 B13R1.3424 NC(=O)CC(=O)Nc1nc(co1)Br f946c787b9e8e7eaeabac390c60da985 [0,1,0,0,0,1|2,0,0]=4 805 B13R1.10 CNC(=O)CN(C)c1ccc(o1)C fc12d74dc1ae32e996c5cbbbb3100d21 [0,2,0,0,0,0|2,0,0]=4 806 B13R1.10 COC(=O)CN(C)c1ccc(o1)C 4e2be2848abc38661b714344feb2ede2 [0,2,0,0,0,0|2,0,0]=4 807 B13R1.33 C#CCN(C)CC(=O)c1ccco1 1090daa679e4ae7b8f574f6be6de5329 [0,2,0,0,0,0|2,0,0]=4 808 B13R1.33 C=CCN(C)CC(=O)c1ccco1 be1925829ff834c7f47ed2295fb099a1 [0,2,0,0,0,0|2,0,0]=4 809 B13R1.33 CCCN(C)CC(=O)c1ccco1 0ce3eb1aab53afd9604125c07357f98b [0,2,0,0,0,0|2,0,0]=4 810 B13R1.33 CN(CC#N)CC(=O)c1ccco1 6a89058cc3ab54f3e095f9174915d7be [0,2,0,0,0,0|2,0,0]=4 811 B13R1.33 CN(CCF)CC(=O)c1ccco1 d4bc894c0fce91be0e2478069039df7f [0,2,0,0,0,0|2,0,0]=4 812 B13R1.33 CN(CCO)CC(=O)c1ccco1 4a72047bf83ef9417fef1836cea2b3ce [0,2,0,0,0,0|1,0,1]=4 813 B11R1.157 CC(=O)Nc1cccc(c1)O 83fd7000bcb1a1edfb73e9c940896bf1 [0,0,1,1,0,0|2,0,0]=4 814 B11R1.157 CC(=O)Nc1cccc(n1)O 5ecee8ed76a0d083278d7db13fb46dc5 [0,0,1,1,0,0|2,0,0]=4 815 B11R1.86 CC(=O)Nc1ccccc1O e286e23dcc389b9a19e5097225c5ef71 [0,0,1,1,0,0|2,0,0]=4 816 B11R1.86 CC(=O)Nc1ncccc1O b5c4643233d4c0cd6f7c1f9da29da199 [0,0,1,1,0,0|2,0,0]=4 817 B13R2.195 CC1CC1NC(=O)c2ccco2 fe377ed60d5e1b8868ef0aef7544d3c0 [0,0,0,1,0,1|1,0,1]=4 818 B13R2.195 O=C(N[C@@H]1C[C@H]1F)c2ccco2 abad755442b7ed9cd1de0245c02a5be9 [0,0,0,1,0,1|1,0,1]=4 819 B13R2.195 O=C(N[C@H]1C[C@@H]1F)c2ccco2 a6bc7c97c06f948712bfefe053b55525 [0,0,0,1,0,1|1,0,1]=4 820 B13R2.195 O=C(N[C@H]1C[C@H]1F)c2ccco2 a0563257cf0491e2c3a2d3e85cb94767 [0,0,0,1,0,1|1,0,1]=4 821 B13R2.233 O=C(c1ccco1)N2CC(C2)F 3825d54b44b853a711c58ba39156fe2f [0,0,0,1,0,1|1,0,1]=4 822 B13R2.233 O=C(c1ccco1)N2CC(C2)O 18a12acd6a4877a240e4833d2f7cbac1 [0,0,0,1,0,1|0,0,2]=4 823 B13R2.443 O=C(CNC1CC1)c2ccco2 9e6789e8c52753e4b9f2a02a10aea884 [0,0,0,1,0,1|1,0,1]=4 824 B13R2.443 O=C(COC1CC1)c2ccco2 90a5de2bf5b314e225c4690f20ba7bbb [0,0,0,1,0,1|1,0,1]=4 825 B13R2.443 O=C(NCC1CC1)c2ccco2 9372acedc2525a31eaf6cb0bbc4a01c6 [0,0,0,1,0,1|1,0,1]=4 826 B13R2.6805 CC1(CN1C(=O)c2ccco2)C 83d95b37158f5365fdc59790a837ebb1 [0,0,0,1,0,1|1,0,1]=4 827 B13R2.149 Cn1nc([nH]c1=O)c2ccco2 680a9aa8439ae9ec3662a8d42b1a64bf [0,1,0,1,0,0|2,0,0]=4 828 B13R2.149 Cn1sc(cc1=O)c2ccco2 a00774de18c3630172e3629d9eb1667b [0,1,0,1,0,0|0,1,1]=4 829 B13R2.445 O=C(CN1CCC1)c2ccco2 1c49f7b7627aedc55b830357b9c2b4e9 [0,1,0,1,0,0|2,0,0]=4 830 B9R1.13 CC(=O)Nc1cccs1 f70dc40a2b7a68d7210198fbab697918 [1,0,0,0,1,0|1,1,0]=4 831 B9R1.13 CC(=O)Nc1ccno1 9ee4360e11764428c81b3574e3a5fbc0 [1,0,0,0,1,0|2,0,0]=4 832 B9R1.13 CC(=O)Nc1ncco1 b16f0a75e381dc1cebd6e7c0a9c2918e [1,0,0,0,1,0|2,0,0]=4 833 B11R0.46 C/C=C/C=C/C(=O)NCC(=O)C 55e8aa2bbc6bda5a1f90c83ba32cd74b [0,0,1,0,0,1|1,0,0]=3 834 B11R0.46 C/C=C/C=C/C(=O)NCC(=O)N 26008e2543b646d795d5c211546c35aa [0,0,1,0,0,1|2,0,0]=4 835 B11R0.46 C=C(C)CNC(=O)/C=C/C=C/C 759034da7dfc2c8d2ac7108e23409cf1 [0,0,1,0,0,1|2,0,0]=4 836 B11R0.46 C=C(C)CNC(=O)C=CC=CC b8a95b5f69c9b7e03156541fe5547bf9 [0,0,1,0,0,1|2,0,0]=4 837 B11R0.46 C=CCOCC(=O)NCC(=O)C d6b7f7bcbe8a3a0aedc9e2c367e237cc [0,0,1,0,0,1|0,0,2]=4 838 B11R0.46 CC=CC=CC(=O)NCC(=O)C 387a82866d3a06ea97d59a42fc319a01 [0,0,1,0,0,1|1,0,0]=3 839 B11R0.46 CC=CC=CC(=O)NCC(=O)N 6050a9de5b50bad5cf7e36d801723a0f [0,0,1,0,0,1|2,0,0]=4 840 B11R1.30 C/C=C/C(=O)Nc1cccs1 b88ce0f8a91c462affd137607d6d36dc [1,0,0,0,0,1|0,1,1]=4 841 B11R1.30 C/C=C/C(=O)Nc1ccno1 dd103a3b019bbf534605a01099f9a05d [1,0,0,0,0,1|1,0,1]=4 842 B11R1.30 C/C=C/C(=O)Nc1ncco1 1282f2efb1ed2f54cdb05b4beaae5228 [1,0,0,0,0,1|1,0,1]=4 843 B11R1.30 C=CCC(=O)Nc1cccs1 80873c7ca7742b806143be5b5d7a8ff3 [1,0,0,0,0,1|0,1,1]=4 844 B11R1.30 C=CCC(=O)Nc1ccno1 8b3d838b799f53f89d1d99f2bd844adb [1,0,0,0,0,1|1,0,1]=4 845 B11R1.30 C=CCC(=O)Nc1ncco1 6a48ea59766a33d08343dfa04e7b4269 [1,0,0,0,0,1|1,0,1]=4 846 B11R1.30 CCCC(=O)Nc1cccs1 e85255fe7df8b1c9d43477733b584e37 [1,0,0,0,0,1|0,1,1]=4 847 B11R1.30 CCCC(=O)Nc1ccno1 3ccccb7c8979c3bc22cc86bea1bddb28 [1,0,0,0,0,1|1,0,1]=4 848 B11R1.30 CCCC(=O)Nc1ncco1 c7577386937f7b8ea3029afe6bf848b7 [1,0,0,0,0,1|1,0,1]=4 849 B11R1.30 CN(CC=O)Cc1ccco1 d50f50c9a4477c3a85aa4a47080e9071 [1,0,0,0,0,1|2,0,0]=4 850 B11R1.30 COCC(=O)Nc1cccs1 fbca31af7a27ff67c42c92ab71bc8d63 [1,0,0,0,0,1|1,1,0]=4 851 B11R1.30 COCC(=O)Nc1ccno1 ddb40514378f2b62c4a994665b7aaf41 [1,0,0,0,0,1|2,0,0]=4 852 B11R1.30 COCC(=O)Nc1ncco1 d05d688c86611e685b1545d8fd8da624 [1,0,0,0,0,1|2,0,0]=4 853 B11R1.30 CSCC(=O)Nc1cccs1 e1a3f9b8048fdfd149d89cad894707fd [1,0,0,0,0,1|1,1,0]=4 854 B11R1.30 CSCC(=O)Nc1ccno1 996a28654f8080317ce92cab5c755621 [1,0,0,0,0,1|2,0,0]=4 855 B11R1.30 CSCC(=O)Nc1ncco1 c8b2ad450085c7437a61184460ef6a9d [1,0,0,0,0,1|2,0,0]=4 856 B11R1.30 O=CCC(=O)Nc1cccs1 aeae37596cd339d6deff0f806e2094ef [1,0,0,0,0,1|0,1,0]=3 857 B11R1.30 O=CCC(=O)Nc1ccno1 8cd5470b19b08ebc1944a71e1bd68b59 [1,0,0,0,0,1|1,0,0]=3 858 B11R1.30 O=CCC(=O)Nc1ccns1 a3dee7ddb4711de7aa8cfe23c4683b50 [1,0,0,0,0,1|1,1,0]=4 859 B11R1.30 O=CCC(=O)Nc1ccon1 9bfd04cd50a61fbe3beb37ccab360bed [1,0,0,0,0,1|2,0,0]=4 860 B11R1.30 O=CCC(=O)Nc1ccsc1 7de33a31e46dd04b010b502803fbb938 [1,0,0,0,0,1|2,0,0]=4 861 B11R1.30 O=CCC(=O)Nc1cncs1 deaa1adc60492f89cc32f8f15eb87743 [1,0,0,0,0,1|1,1,0]=4 862 B11R1.30 O=CCC(=O)Nc1cocn1 8aaad5747380fe8aa8cae419138ac710 [1,0,0,0,0,1|2,0,0]=4 863 B11R1.30 O=CCC(=O)Nc1cscn1 009f615b2f6cc0b9b3d833b2eec1f8c1 [1,0,0,0,0,1|2,0,0]=4 864 B11R1.30 O=CCC(=O)Nc1ncco1 0205ae2726a209552d24d926294a50fc [1,0,0,0,0,1|1,0,0]=3 865 B11R1.30 O=CCC(=O)Nc1nccs1 fc9f48a88aae4bdcca72f67a0ced5a9d [1,0,0,0,0,1|1,1,0]=4 866 B11R1.30 O=CCC(=O)Nc1nnco1 7094e313b9fb098570e7923a8d6bfd02 [1,0,0,0,0,1|2,0,0]=4 867 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [1,0,0,0,0,1|2,0,0]=4 868 B11R1.91 CC(=O)CNc1ccccn1 9ef5867d6e28a360f3e560522ae4c545 [1,0,0,0,0,1|2,0,0]=4 869 B11R1.91 CC(=O)CNc1cccnc1 35a6037a85b015cc869f557087769b5d [1,0,0,0,0,1|2,0,0]=4 870 B11R1.91 CC(=O)CNc1cccnn1 bd224fe4d75fd6299636314b2659cf40 [1,0,0,0,0,1|2,0,0]=4 871 B11R1.91 CC(=O)CNc1ccncc1 e7e1df2bfec9194a79bb5918ba94764c [1,0,0,0,0,1|2,0,0]=4 872 B11R1.91 CC(=O)CNc1ccncn1 4f817587489a7d067dc5afdf25fc5852 [1,0,0,0,0,1|2,0,0]=4 873 B11R1.91 CC(=O)CNc1cnccn1 f505fd1e568103e89908ef11d0b9c40c [1,0,0,0,0,1|2,0,0]=4 874 B11R1.91 CC(=O)CNc1ncccn1 f18694e3a51e6ffd47e70f441daa4c05 [1,0,0,0,0,1|2,0,0]=4 875 B11R1.172 C/C(=C/COc1ccco1)/I e7a7256bf0611df4a720252c02faadf1 [1,0,0,0,0,1|2,0,0]=4 876 B11R1.172 C/C(=C\COc1ccco1)/Cl 793a2f5d7b618d01d0ab06f1214f9f54 [1,0,0,0,0,1|2,0,0]=4 877 B11R1.172 C=C(C)CCNc1ccco1 d13ab3139578804f2db3f1bc827b21b8 [1,0,0,0,0,1|1,0,1]=4 878 B11R1.172 C=C(C)CCOc1ccco1 b5bfa72618728008bf7e5b105d505c14 [1,0,0,0,0,1|1,0,1]=4 879 B11R1.172 C=C(C)CNCc1ccco1 b8e84244edcb166dae9a2b7d3f4218dd [1,0,0,0,0,1|1,0,1]=4 880 B11R1.172 C=C(C)COCc1ccco1 ee5f525ea9421d6d2e16283e93cac648 [1,0,0,0,0,1|1,0,1]=4 881 B11R1.172 CC(=CCNc1ccco1)C facc7eca3dfd08a12a25c74be92a3245 [1,0,0,0,0,1|2,0,0]=4 882 B11R1.172 CC(=CCOc1ccco1)C 143f223a2771e7d2e271b2ebb556a34d [1,0,0,0,0,1|2,0,0]=4 883 B11R1.172 CC(=CCOc1ccco1)Cl f90b16e48a4ad6694cf3c5ebb6dba78f [1,0,0,0,0,1|2,0,0]=4 884 B11R1.172 CC(=CCOc1ccco1)I a8b941715521049c9f90a0e42181334c [1,0,0,0,0,1|2,0,0]=4 885 B11R1.172 CC(=O)CCNc1cccs1 3705e6b236dd0e242edc581b5639fa6d [1,0,0,0,0,1|0,1,1]=4 886 B11R1.172 CC(=O)CCNc1ccno1 abfc6c3a57c95c77d51b6355ee5e87dd [1,0,0,0,0,1|1,0,1]=4 887 B11R1.172 CC(=O)CCNc1ncco1 6db9a64456f72643bc08fa8bb5731698 [1,0,0,0,0,1|1,0,1]=4 888 B11R1.172 CC(=O)CCOc1ccco1 1304331aa569973df701f4c541cd36f9 [1,0,0,0,0,1|0,0,1]=3 889 B11R1.172 CC(=O)CCOc1cccs1 b63fa1eb430f81b21edb5306b25d0cdb [1,0,0,0,0,1|0,1,1]=4 890 B11R1.172 CC(=O)CNCc1ccco1 5349a004945f22466223fdea062b1a26 [1,0,0,0,0,1|0,0,1]=3 891 B11R1.172 CC(=O)CNCc1cccs1 b1e4a802d58216630369ed1cb1193c6c [1,0,0,0,0,1|0,1,1]=4 892 B11R1.172 CC(=O)CNCc1ccno1 9d433d4075491746a313ee42cd7c05da [1,0,0,0,0,1|1,0,1]=4 893 B11R1.172 CC(=O)CNCc1cnco1 99f78d679b27a44216bef491e144dcce [1,0,0,0,0,1|1,0,1]=4 894 B11R1.172 CC(=O)CNCc1ncco1 08548bfba2487e3629cbfdeac38ddfed [1,0,0,0,0,1|1,0,1]=4 895 B11R1.172 CC(=O)COCc1ccco1 eb376918d478215b7784a307211ac4b9 [1,0,0,0,0,1|0,0,1]=3 896 B11R1.172 CC(=O)COCc1cccs1 230c5eb2cad29c6e94ed984c95bb8914 [1,0,0,0,0,1|0,1,1]=4 897 B11R1.172 CC(=O)COCc1ccno1 c0aa8f40aff12f310b3637c4247f89a6 [1,0,0,0,0,1|1,0,1]=4 898 B11R1.172 CC(=O)COCc1ncco1 6392edc6fd8ff743b74fd77ae0ebc6d1 [1,0,0,0,0,1|1,0,1]=4 899 B11R1.172 CC(=O)NCCc1ccco1 f97fcd1be9cacf4675351753b4b97ccf [1,0,0,0,0,1|0,0,1]=3 900 B11R1.172 CC(=O)NCCc1cccs1 b2bccd28809b44ec5e70798b6aa4c45f [1,0,0,0,0,1|0,1,1]=4 901 B11R1.172 CC(=O)OCNc1cccs1 9bfb4558c6114317955d0a73b0c80837 [1,0,0,0,0,1|1,1,0]=4 902 B11R1.172 CC(=O)OCNc1ccno1 8b3ce7fe1a45c29dd7c984f3eae3a57e [1,0,0,0,0,1|2,0,0]=4 903 B11R1.172 CC(=O)OCNc1ncco1 5827ef4ddf2b1a5038d42cb3806f2688 [1,0,0,0,0,1|2,0,0]=4 904 B11R1.172 CC(=O)OCOc1ccco1 18a8842f6bf66d2e01121a7a178b294d [1,0,0,0,0,1|1,0,0]=3 905 B11R1.172 CC(=O)OCOc1cccs1 01a2361020ef2a379439fd07806b9e9d [1,0,0,0,0,1|1,1,0]=4 906 B11R1.172 CS(=O)CCNc1ccco1 b5c41bf9a4c4b4784e62738332f55e27 [1,0,0,0,0,1|1,0,1]=4 907 B11R1.172 CS(=O)CCOc1ccco1 ebae9dbe7878c9e08d546f06556993fc [1,0,0,0,0,1|1,0,1]=4 908 B11R1.172 NC(=O)CCNc1ccco1 ab32532f1c3dbe5d91a357acfbdf218d [1,0,0,0,0,1|1,0,1]=4 909 B11R1.172 NC(=O)CCOc1ccco1 62568bce3153cbd2dbe9e7f3e41fdb78 [1,0,0,0,0,1|1,0,1]=4 910 B11R1.172 NC(=O)CNCc1ccco1 66bbe09b4a4fd1abe2eabcc09ff61502 [1,0,0,0,0,1|1,0,1]=4 911 B11R1.172 NC(=O)COCc1ccco1 23772c88c899aa3b4db4adceab3b722e [1,0,0,0,0,1|1,0,1]=4 912 B11R1.172 NC(=O)SCOc1ccco1 b909ddeb0c2182be35eb564945d38c9f [1,0,0,0,0,1|2,0,0]=4 913 B11R1.172 O=C(O)CCOc1ccco1 21b91de83358b466cc7a22fde4a1f9b0 [1,0,0,0,0,1|1,0,1]=4 914 B11R1.172 O=C(O)CNCc1ccco1 4503a4764d3abcbc8a5487f0f255e772 [1,0,0,0,0,1|1,0,1]=4 915 B11R1.172 O=C(O)COCc1ccco1 86ba59a113605253dd8262c236f0c2b8 [1,0,0,0,0,1|1,0,1]=4 916 B11R1.346 CC(=O)CNC(=O)C1=CCC1 4833cad78825109f8cb5cae558492813 [0,0,0,0,1,1|0,0,2]=4 917 B13R1.45 C=C(C)CNC(=O)c1ccccc1 501e2a05800d61f4ca0cc324b49cc7ed [0,0,0,0,0,2|2,0,0]=4 918 B13R1.45 C=C(C)CNC(=O)c1ccccn1 1d9586380f5275556142e71c5dec346c [0,0,0,0,0,2|2,0,0]=4 919 B13R1.45 C=C(C)CNC(=O)c1cccnc1 8736572b24b95772b0d74261fd99973d [0,0,0,0,0,2|2,0,0]=4 920 B13R1.45 C=C(C)CNC(=O)c1cccnn1 8c76df55d666369e914546234bf98208 [0,0,0,0,0,2|2,0,0]=4 921 B13R1.45 C=C(C)CNC(=O)c1ccncc1 320a3eff1633e31dea83548746a7c3c9 [0,0,0,0,0,2|2,0,0]=4 922 B13R1.45 C=C(C)CNC(=O)c1ccncn1 06d708b64f904397c8842ee77a7c8f26 [0,0,0,0,0,2|2,0,0]=4 923 B13R1.45 C=C(C)CNC(=O)c1cnccn1 bd2b4b707df8382009dcb5baa327caca [0,0,0,0,0,2|2,0,0]=4 924 B13R1.45 C=C(C)CNC(=O)c1ncccn1 0a1669190e094d528ad73224bead4796 [0,0,0,0,0,2|2,0,0]=4 925 B13R1.45 CC(=O)CNC(=O)C1=CCCCO1 757de869f8d923b42a5b69594d143fe4 [0,0,0,0,0,2|0,0,2]=4 926 B13R1.45 CC(=O)CNC(=O)C1=CCCOC1 22458c8c99127a2a01743e1f4b91c220 [0,0,0,0,0,2|0,0,2]=4 927 B13R1.45 CC(=O)CNC(=O)C1=COCCO1 1a8e39d82583e90bee077235b25b200c [0,0,0,0,0,2|0,0,2]=4 928 B13R1.45 CC(=O)CNC(=O)C1CC=CCO1 79f580c9a80c4b16e14c26548766b592 [0,0,0,0,0,2|0,0,2]=4 929 B13R1.45 CC(=O)CNC(=O)c1ccccc1 32292083cf460878a8f6c885af5be522 [0,0,0,0,0,2|1,0,0]=3 930 B13R1.45 CC(=O)CNC(=O)c1ccccn1 867ca014f5e4ac0da56044dcb6058df0 [0,0,0,0,0,2|1,0,0]=3 931 B13R1.45 CC(=O)CNC(=O)c1cccnc1 028b74f30e6c4a1ccb190160c019d520 [0,0,0,0,0,2|1,0,0]=3 932 B13R1.45 CC(=O)CNC(=O)c1cccnn1 6a668579a853cbd509527e59c3536570 [0,0,0,0,0,2|1,0,0]=3 933 B13R1.45 CC(=O)CNC(=O)c1ccncc1 99f1b774507c828ff1f2a1a9af49ff78 [0,0,0,0,0,2|1,0,0]=3 934 B13R1.45 CC(=O)CNC(=O)c1ccncn1 e921beff91fee26e5b8c6a99a463a611 [0,0,0,0,0,2|1,0,0]=3 935 B13R1.45 CC(=O)CNC(=O)c1ccnnc1 87dd6aa7a149b3686ddf9381a0ef46d1 [0,0,0,0,0,2|2,0,0]=4 936 B13R1.45 CC(=O)CNC(=O)c1cnccn1 1662da3db1bf695ca937e7b4cbdd2235 [0,0,0,0,0,2|1,0,0]=3 937 B13R1.45 CC(=O)CNC(=O)c1cncnc1 55d3b0b5c7437f2d2aa5c7d1dad8d5a5 [0,0,0,0,0,2|2,0,0]=4 938 B13R1.45 CC(=O)CNC(=O)c1ncccn1 ac3f6e3a7365cfd84147c6217ef68471 [0,0,0,0,0,2|1,0,0]=3 939 B13R1.45 CC(=O)NCC(=O)c1ccccc1 5463d46259baec402dcd87c9456616e9 [0,0,0,0,0,2|1,0,0]=3 940 B13R1.45 NC(=O)CNC(=O)c1ccccc1 c1428cd43e0bed919c9014ecc82cce44 [0,0,0,0,0,2|2,0,0]=4 941 B13R1.45 NC(=O)CNC(=O)c1ccccn1 b98190268456512e36a54dafc42d8d29 [0,0,0,0,0,2|2,0,0]=4 942 B13R1.45 NC(=O)CNC(=O)c1cccnc1 8c119e081d264e798f143e77ecd6d2bc [0,0,0,0,0,2|2,0,0]=4 943 B13R1.45 NC(=O)CNC(=O)c1cccnn1 aed7d1fecdb8f64ba17c3f0fa7e5d03a [0,0,0,0,0,2|2,0,0]=4 944 B13R1.45 NC(=O)CNC(=O)c1ccncc1 edf117140f91b0b2264525ad5d04f159 [0,0,0,0,0,2|2,0,0]=4 945 B13R1.45 NC(=O)CNC(=O)c1ccncn1 143741381bf9f9ed1e5f7bcecfa145cc [0,0,0,0,0,2|2,0,0]=4 946 B13R1.45 NC(=O)CNC(=O)c1cnccn1 18a30f46091db70b9737fe33b13f58a5 [0,0,0,0,0,2|2,0,0]=4 947 B13R1.45 NC(=O)CNC(=O)c1ncccn1 5a6d2e85f6fd5b83ef34104e45d51bc9 [0,0,0,0,0,2|2,0,0]=4 948 B13R1.342 C=C(Br)CNCC(=O)c1ccco1 a9cc2c4b4ed59a55b55fabd15dfbea29 [0,0,0,0,0,2|1,0,1]=4 949 B13R1.342 C=C(Br)COCC(=O)c1ccco1 b35eca6ed1c28d5d7dcf0f573199a201 [0,0,0,0,0,2|1,0,1]=4 950 B13R1.342 C=C(C)CCNC(=O)c1ccco1 206a22ab1e5b1b4d6792e3432b442672 [0,0,0,0,0,2|1,0,0]=3 951 B13R1.342 C=C(C)CCNC(=O)c1cccs1 869ea04f053e7629f6a00af068bd8dcb [0,0,0,0,0,2|1,1,0]=4 952 B13R1.342 C=C(C)CCNC(=O)c1ccno1 eb389717350161beda98c11bf34dde72 [0,0,0,0,0,2|2,0,0]=4 953 B13R1.342 C=C(C)CCNC(=O)c1cnco1 1b15486afe5fd720946af6e130f6ed55 [0,0,0,0,0,2|2,0,0]=4 954 B13R1.342 C=C(C)CCNC(=O)c1ncco1 177ecd9e06db01673697868584e50076 [0,0,0,0,0,2|2,0,0]=4 955 B13R1.342 C=C(C)CNCC(=O)c1ccc[nH]1 8b716f5cc0da38aae4c719db2806ee85 [0,0,0,0,0,2|2,0,0]=4 956 B13R1.342 C=C(C)CNCC(=O)c1ccco1 400fce27148c35877fd40926b091943b [0,0,0,0,0,2|1,0,0]=3 957 B13R1.342 C=C(C)CNCC(=O)c1cccs1 38ef4a8855cfc1ef267e3f069ea22118 [0,0,0,0,0,2|1,1,0]=4 958 B13R1.342 C=C(C)CNCC(=O)c1ncco1 4daef01f7ca0105b1a7996f32cb2b1d4 [0,0,0,0,0,2|2,0,0]=4 959 B13R1.342 C=C(C)COCC(=O)c1ccco1 774978ddc0a41f6fca019aeafb713d60 [0,0,0,0,0,2|1,0,0]=3 960 B13R1.342 C=C(C)COCC(=O)c1cccs1 1d6b989b5fe9e50a5f254f7489ec56d2 [0,0,0,0,0,2|1,1,0]=4 961 B13R1.342 C=C(C)COCC(=O)c1ncco1 8aae0b25894078d8b254995716297347 [0,0,0,0,0,2|2,0,0]=4 962 B13R1.342 C=C(Cl)COCC(=O)c1ccco1 17731439524c0e8928b412b17c2790a6 [0,0,0,0,0,2|1,0,1]=4 963 B13R1.342 C=C(F)COCC(=O)c1ccco1 14f6b16b4bb762d89f5d7e7747e44c06 [0,0,0,0,0,2|1,0,1]=4 964 B13R1.342 C=C(I)COCC(=O)c1ccco1 06e74ac85eefe500d778fa966de325a6 [0,0,0,0,0,2|1,0,1]=4 965 B13R1.342 CC(=CCNC(=O)c1ccco1)C f9eddaee791038e74504af3ef136349a [0,0,0,0,0,2|1,0,0]=3 966 B13R1.342 CC(=CCNC(=O)c1cccs1)C e824f838c9ad6032b55d7d01416a0329 [0,0,0,0,0,2|1,1,0]=4 967 B13R1.342 CC(=CCNC(=O)c1ccno1)C 72b1a93c6407177da69a67848cdc8e84 [0,0,0,0,0,2|2,0,0]=4 968 B13R1.342 CC(=CCNC(=O)c1cnco1)C 42fbc092156802b2e96beb0e18bb0c5a [0,0,0,0,0,2|2,0,0]=4 969 B13R1.342 CC(=CCNC(=O)c1ncco1)C d67b533a700dcfc83b2a0437cb673363 [0,0,0,0,0,2|2,0,0]=4 970 B13R1.342 CC(=O)CCNC(C)c1ccco1 7cb31a0984ba610652fffea2d4049870 [0,0,0,0,0,2|1,0,1]=4 971 B13R1.342 CC(=O)CCN[C@H](C)c1ccco1 245da303d4a7dbf2f5c67c3baa92f37b [0,0,0,0,0,2|1,0,1]=4 972 B13R1.342 CC(=O)CCOC(C)c1ccco1 63eebef20c72b15a1f71fe28a57eb04a [0,0,0,0,0,2|1,0,1]=4 973 B13R1.342 CC(=O)CCO[C@H](C)c1ccco1 020b684564ef87a0b46bf578c9671523 [0,0,0,0,0,2|1,0,1]=4 974 B13R1.342 CC(=O)CNCC(=O)c1ccco1 17749e0aa12b9da516045bff116a624d [0,0,0,0,0,2|0,0,0]=2 975 B13R1.342 CC(=O)CNCC(=O)c1cccs1 efd232f5a7fb1516bf18b19ce38e0e93 [0,0,0,0,0,2|0,1,0]=3 976 B13R1.342 CC(=O)CNCC(=O)c1ccsc1 330ea292a16fe159e59e990c3c3d43cf [0,0,0,0,0,2|2,0,0]=4 977 B13R1.342 CC(=O)CNCC(=O)c1cocn1 bd7dd984af4c0c4d62b65512ec6d35c6 [0,0,0,0,0,2|2,0,0]=4 978 B13R1.342 CC(=O)CNCC(=O)c1ncco1 7e25433b8efe8e4df40fe2d673298df2 [0,0,0,0,0,2|1,0,0]=3 979 B13R1.342 CC(=O)CNCC(=O)c1nccs1 1a14613fedf5b6d82953700fa7177d15 [0,0,0,0,0,2|1,1,0]=4 980 B13R1.342 CC(=O)CNCC(=O)n1cccn1 99f6a3865aa3372a3b9ef762fd119ec7 [0,0,0,0,0,2|2,0,0]=4 981 B13R1.342 CC(=O)COCC(=O)c1ccco1 a518f7c77d894c5cb512b248b957cd35 [0,0,0,0,0,2|0,0,0]=2 982 B13R1.342 CC(=O)COCC(=O)c1cccs1 1a95a0ba5377e6a48732a0b79f4430cf [0,0,0,0,0,2|0,1,0]=3 983 B13R1.342 CC(=O)COCC(=O)c1ccsc1 9e6e0f451f522392dcd479514f279d95 [0,0,0,0,0,2|2,0,0]=4 984 B13R1.342 CC(=O)COCC(=O)c1cocn1 553c24e7d304281b40a51d607f6abd03 [0,0,0,0,0,2|2,0,0]=4 985 B13R1.342 CC(=O)COCC(=O)c1ncco1 3ea7052eb3ccc4184928d136fb5d24b2 [0,0,0,0,0,2|1,0,0]=3 986 B13R1.342 CC(=O)COCC(=O)c1nccs1 9f666dd52319fbea8ed578c22a8cfa99 [0,0,0,0,0,2|1,1,0]=4 987 B13R1.342 CC(=O)COCC(=O)n1cccn1 7ff45abf65c16bd63c05505625eef0e9 [0,0,0,0,0,2|2,0,0]=4 988 B13R1.342 CC(=O)OCNC(C)c1ccco1 2e1cfb3e03aaecf858c7b40b6cea5e6f [0,0,0,0,0,2|1,0,1]=4 989 B13R1.342 CC(=O)OCN[C@H](C)c1ccco1 f650b6705c58bc21d8a614e64ff35d16 [0,0,0,0,0,2|1,0,1]=4 990 B13R1.342 CC(=O)OCOC(C)c1ccco1 cba978e9d5adf8c1d6301a40c5dbc408 [0,0,0,0,0,2|1,0,1]=4 991 B13R1.342 CC(=O)OCO[C@H](C)c1ccco1 566f09c670e806877d4a2aaeb38107ed [0,0,0,0,0,2|1,0,1]=4 992 B13R1.342 CC(C)CCNC(=O)c1ccco1 b640792c0ad8faef4fd1eca30144a1d9 [0,0,0,0,0,2|1,0,1]=4 993 B13R1.342 CC(C)CNCC(=O)c1ccco1 4c896a59f005e9214454b4a8c350f92d [0,0,0,0,0,2|1,0,1]=4 994 B13R1.342 CC(C)COCC(=O)c1ccco1 8deba3824af57b38720105304740f64e [0,0,0,0,0,2|1,0,1]=4 995 B13R1.342 CC(F)COCC(=O)c1ccco1 c72b2a98a9dd1ade5279ed1dc8c34e6a [0,0,0,0,0,2|1,0,1]=4 996 B13R1.342 CC(O)CCNC(=O)c1ccco1 624072387adbb85cab7f416a93c55439 [0,0,0,0,0,2|0,0,2]=4 997 B13R1.342 CC(O)CNCC(=O)c1ccco1 ec3911c9935634413dbe053cfe9ba00b [0,0,0,0,0,2|0,0,2]=4 998 B13R1.342 CC(S)COCC(=O)c1ccco1 f40a226fcc3669a99426f61c887a78ac [0,0,0,0,0,2|0,1,1]=4 999 B13R1.342 CN(C)CCNC(=O)c1ccco1 68a08fff251ef860caf1ae644fed93b1 [0,0,0,0,0,2|2,0,0]=4 1000 B13R1.342 CN(C)COCC(=O)c1ccco1 13d51e67a05d6723d7d904c01b65a5fb [0,0,0,0,0,2|2,0,0]=4 1001 B13R1.342 CS(=O)CCNC(=O)c1ccco1 02ae8ead90f05a063b322b603891d5ff [0,0,0,0,0,2|1,0,0]=3 1002 B13R1.342 CS(=O)CCNC(=O)c1cccs1 8635f168b9dbfc95df0f8416e1fdddd0 [0,0,0,0,0,2|1,1,0]=4 1003 B13R1.342 CS(=O)CCNC(=O)c1ccno1 7df5705e4f4e3056c90b0427a65c5351 [0,0,0,0,0,2|2,0,0]=4 1004 B13R1.342 CS(=O)CCNC(=O)c1cnco1 6a37b9c473a65edfd85b7b7167539306 [0,0,0,0,0,2|2,0,0]=4 1005 B13R1.342 CS(=O)CCNC(=O)c1ncco1 c707a92aff1b6af897276453bfd821d9 [0,0,0,0,0,2|2,0,0]=4 1006 B13R1.342 C[C@@H](F)COCC(=O)c1ccco1 7c94587038fdafa0d4acb8ffbea1ac13 [0,0,0,0,0,2|1,0,1]=4 1007 B13R1.342 C[C@@H](O)CCNC(=O)c1ccco1 49c4ebc5df832faf9194b3a3a17eebc5 [0,0,0,0,0,2|0,0,2]=4 1008 B13R1.342 C[C@@H](O)CNCC(=O)c1ccco1 59812e41a69953547e77d87426512143 [0,0,0,0,0,2|0,0,2]=4 1009 B13R1.342 C[C@H](F)COCC(=O)c1ccco1 bc3732f90ff60f249c0e5c1f4cf0c6b5 [0,0,0,0,0,2|1,0,1]=4 1010 B13R1.342 C[C@H](O)CCNC(=O)c1ccco1 7efd01f455eae3822a68d411f46a03c5 [0,0,0,0,0,2|0,0,2]=4 1011 B13R1.342 C[C@H](O)CNCC(=O)c1ccco1 8f6021be57bc7bccbf7a1efb6dc7f8a7 [0,0,0,0,0,2|0,0,2]=4 1012 B13R1.342 NC(=O)CCNC(=O)c1ccco1 8667e23d3512fdfc9fdfbd11419250e2 [0,0,0,0,0,2|1,0,0]=3 1013 B13R1.342 NC(=O)CCNC(=O)c1cccs1 182208b5cc4a08bb2d5609c0e16372eb [0,0,0,0,0,2|1,1,0]=4 1014 B13R1.342 NC(=O)CCNC(=O)c1ccno1 d92d08e2f42e2c5565c6fe9140ec782d [0,0,0,0,0,2|2,0,0]=4 1015 B13R1.342 NC(=O)CCNC(=O)c1cnco1 8c55a2482ffa1d392a08a27947319dd9 [0,0,0,0,0,2|2,0,0]=4 1016 B13R1.342 NC(=O)CCNC(=O)c1ncco1 44a3d7a17c48e3dba25bb11a4eb7d17a [0,0,0,0,0,2|2,0,0]=4 1017 B13R1.342 NC(=O)CNCC(=O)c1ccc[nH]1 335a4df96aa2a292a567f047c4a705eb [0,0,0,0,0,2|2,0,0]=4 1018 B13R1.342 NC(=O)CNCC(=O)c1ccco1 36c1273b286b6b05afd5ce6fec3457e0 [0,0,0,0,0,2|1,0,0]=3 1019 B13R1.342 NC(=O)CNCC(=O)c1cccs1 e056169c889ecd537dda58a4cdcbc269 [0,0,0,0,0,2|1,1,0]=4 1020 B13R1.342 NC(=O)CNCC(=O)c1ncco1 1af8e12d61f7520d5b1811eb6ee54c1f [0,0,0,0,0,2|2,0,0]=4 1021 B13R1.342 NC(=O)COCC(=O)c1ccco1 9cb889d428b305becafc56c2b03efa27 [0,0,0,0,0,2|1,0,0]=3 1022 B13R1.342 NC(=O)COCC(=O)c1cccs1 ec6b3da892217200908fb583d59da3cb [0,0,0,0,0,2|1,1,0]=4 1023 B13R1.342 NC(=O)COCC(=O)c1ncco1 79bf06bb56dacfbe554c45ae718b7eb2 [0,0,0,0,0,2|2,0,0]=4 1024 B13R1.342 NC(=S)CCNC(=O)c1ccco1 019aa6748d5b5ff373e32719742018c6 [0,0,0,0,0,2|1,1,0]=4 1025 B13R1.342 NC(=S)COCC(=O)c1ccco1 b74b92fea0bba779696af173239d6eee [0,0,0,0,0,2|1,1,0]=4 1026 B13R1.342 O=C(COCS(=O)O)c1ccco1 88882f1bd9e8fb34f8ff5fd44610e56e [0,0,0,0,0,2|2,0,0]=4 1027 B13R1.342 O=C(COC[N+](=O)[O-])c1ccco1 204720673f908797162a7af5355144d4 [0,0,0,0,0,2|2,0,0]=4 1028 B13R1.342 O=C(NCCS(=O)O)c1ccco1 5e17c1f9ae8cf6ea5499c916b41db00e [0,0,0,0,0,2|2,0,0]=4 1029 B13R1.342 O=C(O)CNCC(=O)c1ccco1 1af5ccb17b12e50db2b80ed2f43b25c8 [0,0,0,0,0,2|1,0,0]=3 1030 B13R1.342 O=C(O)CNCC(=O)c1cccs1 19289d3c63e4510a75d09e983d7f93fc [0,0,0,0,0,2|1,1,0]=4 1031 B13R1.342 O=C(O)CNCC(=O)c1ncco1 1d0f84cf1fcd0720453f652786be4ea8 [0,0,0,0,0,2|2,0,0]=4 1032 B13R1.342 O=C(O)COCC(=O)c1ccco1 4d9bec38486a734c7d1548960173e4ef [0,0,0,0,0,2|1,0,0]=3 1033 B13R1.342 O=C(O)COCC(=O)c1cccs1 cd66f590f6d398d8ef44fe95c3b92ef9 [0,0,0,0,0,2|1,1,0]=4 1034 B13R1.342 O=C(O)COCC(=O)c1ncco1 0078cb23e64400bcee05ecf65cd72d89 [0,0,0,0,0,2|2,0,0]=4 1035 B13R1.344 C=C(Br)CNC(=O)Cc1ccco1 ac1f43f991db20e4207c7582a417a00b [0,0,0,0,0,2|1,0,1]=4 1036 B13R1.344 C=C(C)CCC(=O)Nc1cccs1 8083b85f72c4435dcebe0fa63237b1b8 [0,0,0,0,0,2|1,1,0]=4 1037 B13R1.344 C=C(C)CCC(=O)Nc1ccno1 0122c9e37727b2d72699016f9d84d39f [0,0,0,0,0,2|2,0,0]=4 1038 B13R1.344 C=C(C)CCC(=O)Nc1ncco1 2d6676dc188d3420832a44ecbdaf379f [0,0,0,0,0,2|2,0,0]=4 1039 B13R1.344 C=C(C)CNC(=O)Cc1ccco1 c5c1505db0b34f3634af283f7594a511 [0,0,0,0,0,2|1,0,0]=3 1040 B13R1.344 C=C(C)CNC(=O)Cc1cccs1 47b23ef603f66cba6e741ee9e5023591 [0,0,0,0,0,2|1,1,0]=4 1041 B13R1.344 C=C(C)CNC(=O)Cc1ccno1 10c30aab0452970bb0cedd55c1908206 [0,0,0,0,0,2|2,0,0]=4 1042 B13R1.344 C=C(C)CNC(=O)Cc1cnco1 d9be8b40a5df803c02c43f722cb93121 [0,0,0,0,0,2|2,0,0]=4 1043 B13R1.344 C=C(C)CNC(=O)Nc1ccno1 7dc0542b0fca92a182785c258548434e [0,0,0,0,0,2|2,0,0]=4 1044 B13R1.344 C=C(C)CNC(=O)Nc1ncco1 b238c6891cf8b6a796b0e5fee3a9ab30 [0,0,0,0,0,2|2,0,0]=4 1045 B13R1.344 CC(=CCC(=O)Nc1cccs1)C dce8c62859ca90ac074fe50d5b652d44 [0,0,0,0,0,2|1,1,0]=4 1046 B13R1.344 CC(=CCC(=O)Nc1ccno1)C 04c5db346eca83840388019e7a0c41b8 [0,0,0,0,0,2|2,0,0]=4 1047 B13R1.344 CC(=CCC(=O)Nc1ncco1)C 5f91c584e7ef81fcc0ea640ff7db8080 [0,0,0,0,0,2|2,0,0]=4 1048 B13R1.344 CC(=O)/C=C/C(=O)Nc1cccs1 0bba35aad2cb5dbd04762f0282360dff [0,0,0,0,0,2|0,1,1]=4 1049 B13R1.344 CC(=O)/C=C/C(=O)Nc1ccno1 8f28783a27ebe64023582122fd39488a [0,0,0,0,0,2|1,0,1]=4 1050 B13R1.344 CC(=O)/C=C/C(=O)Nc1ncco1 d46d3c63dea3789006c10e8a36ae7d69 [0,0,0,0,0,2|1,0,1]=4 1051 B13R1.344 CC(=O)C=CC(=O)Nc1cccs1 d9b07502b0295ac24fd209dc35304471 [0,0,0,0,0,2|0,1,1]=4 1052 B13R1.344 CC(=O)C=CC(=O)Nc1ccno1 1d9e9ac3884dd7277145520bc8b18ca0 [0,0,0,0,0,2|1,0,1]=4 1053 B13R1.344 CC(=O)C=CC(=O)Nc1ncco1 6b1e1c80678877728fd5c0a2601893be [0,0,0,0,0,2|1,0,1]=4 1054 B13R1.344 CC(=O)CCC(=O)Nc1cccs1 2bbf40697fa8bcf776db3b7c7b541446 [0,0,0,0,0,2|0,1,0]=3 1055 B13R1.344 CC(=O)CCC(=O)Nc1ccno1 d89f4c38df0a76d1dc8fec4f0edbc6cf [0,0,0,0,0,2|1,0,0]=3 1056 B13R1.344 CC(=O)CCC(=O)Nc1ccns1 cd7427fb4bc521fcd9a0b1df3b1c3bd6 [0,0,0,0,0,2|1,1,0]=4 1057 B13R1.344 CC(=O)CCC(=O)Nc1ccsc1 cd9b4d4e3f0acb99ef0e63e52441bb0d [0,0,0,0,0,2|2,0,0]=4 1058 B13R1.344 CC(=O)CCC(=O)Nc1cncs1 965c8d99864c7839c13f8e358fc16d4b [0,0,0,0,0,2|1,1,0]=4 1059 B13R1.344 CC(=O)CCC(=O)Nc1cocn1 6f5536d08d66087920c21e16e8aaeb87 [0,0,0,0,0,2|2,0,0]=4 1060 B13R1.344 CC(=O)CCC(=O)Nc1cscn1 cf203969158f960c3ed5ee2e181dc00f [0,0,0,0,0,2|2,0,0]=4 1061 B13R1.344 CC(=O)CCC(=O)Nc1ncco1 fdbc1e34e45acf24d62558fa2a2ed1f0 [0,0,0,0,0,2|1,0,0]=3 1062 B13R1.344 CC(=O)CCC(=O)Nc1nccs1 73239f1a6ed891bc1953071ebe1a2282 [0,0,0,0,0,2|1,1,0]=4 1063 B13R1.344 CC(=O)CCN(C)Cc1ccco1 6114370f10a9ded71ab23b85f50d3c2f [0,0,0,0,0,2|2,0,0]=4 1064 B13R1.344 CC(=O)CNC(=O)Cc1ccco1 dfef17279d0bd7ae508e6d8d86afb2c7 [0,0,0,0,0,2|0,0,0]=2 1065 B13R1.344 CC(=O)CNC(=O)Cc1cccs1 afe94779f8143aa55a604568370c0da0 [0,0,0,0,0,2|0,1,0]=3 1066 B13R1.344 CC(=O)CNC(=O)Cc1ccno1 961e2d8bd341d94120aad3be5877a024 [0,0,0,0,0,2|1,0,0]=3 1067 B13R1.344 CC(=O)CNC(=O)Cc1ccoc1 697f798351ba69c8bf5075bb127fb2aa [0,0,0,0,0,2|2,0,0]=4 1068 B13R1.344 CC(=O)CNC(=O)Cc1ccon1 a7fcf5865df1ac344d24b61acbe8ce94 [0,0,0,0,0,2|2,0,0]=4 1069 B13R1.344 CC(=O)CNC(=O)Cc1ccsc1 7e34f44656683139e37dc0e379f2675b [0,0,0,0,0,2|2,0,0]=4 1070 B13R1.344 CC(=O)CNC(=O)Cc1cnco1 65ed5a8d3de05b89e5ed77593cbb5f08 [0,0,0,0,0,2|1,0,0]=3 1071 B13R1.344 CC(=O)CNC(=O)Cc1cncs1 e3b487dfa2b72665a3f6ae27414f453f [0,0,0,0,0,2|1,1,0]=4 1072 B13R1.344 CC(=O)CNC(=O)Cc1cscn1 bd8b77d8b5c7e71d1e7c12d437fee9bb [0,0,0,0,0,2|2,0,0]=4 1073 B13R1.344 CC(=O)CNC(=O)Cc1nccs1 ecffec3f2a6da18e5084c51f9a99bb08 [0,0,0,0,0,2|1,1,0]=4 1074 B13R1.344 CC(=O)CNC(=O)Cc1nnco1 465fe065466171ec66429fdf6386131f [0,0,0,0,0,2|2,0,0]=4 1075 B13R1.344 CC(=O)CNC(=O)Cn1cccc1 d03bd74e7da3622df507553e68cd0e71 [0,0,0,0,0,2|2,0,0]=4 1076 B13R1.344 CC(=O)CNC(=O)Cn1cccn1 c7dd416d95d64f34305f4217a123f2ed [0,0,0,0,0,2|2,0,0]=4 1077 B13R1.344 CC(=O)CNC(=O)Nc1cc[nH]n1 fb3db2410f941f9dbceaa8fdef87e5ed [0,0,0,0,0,2|2,0,0]=4 1078 B13R1.344 CC(=O)CNC(=O)Nc1ccno1 2e994c7dea62514d1bf645f71cedcfc2 [0,0,0,0,0,2|1,0,0]=3 1079 B13R1.344 CC(=O)CNC(=O)Nc1ccns1 7c496c23364e4b38ad1414a37ad69ef8 [0,0,0,0,0,2|1,1,0]=4 1080 B13R1.344 CC(=O)CNC(=O)Nc1ccsc1 3dc00560e4e7d6f1c26efb8d052accd3 [0,0,0,0,0,2|2,0,0]=4 1081 B13R1.344 CC(=O)CNC(=O)Nc1cscn1 060df2fc1bd18cf25495638aa190a363 [0,0,0,0,0,2|2,0,0]=4 1082 B13R1.344 CC(=O)CNC(=O)Nc1ncco1 a9ed266e1d47fa6168e7b98b3b5e7171 [0,0,0,0,0,2|1,0,0]=3 1083 B13R1.344 CC(=O)CNC(=O)Nc1nccs1 897e5f26d4ae07e5e5433c7d37fee19f [0,0,0,0,0,2|1,1,0]=4 1084 B13R1.344 CC(=O)CNC(=S)Nc1cccs1 1e179da0672e1465d1f95fd7ff8d72b9 [0,0,0,0,0,2|0,2,0]=4 1085 B13R1.344 CC(=O)CNC(=S)Nc1ccno1 246697251c2817e2d948ad91464f868c [0,0,0,0,0,2|1,1,0]=4 1086 B13R1.344 CC(=O)CNC(=S)Nc1ncco1 4981cb0d09a14b8ca7753ad8c0e25eb6 [0,0,0,0,0,2|1,1,0]=4 1087 B13R1.344 CC(=O)NCC(=O)Nc1cccs1 e1b1c33128ff3e40e1e10e4ca0bffa5d [0,0,0,0,0,2|0,1,0]=3 1088 B13R1.344 CC(=O)NCC(=O)Nc1ccno1 ac20dfba8e031a638b2fe9a430af06ad [0,0,0,0,0,2|1,0,0]=3 1089 B13R1.344 CC(=O)NCC(=O)Nc1ccns1 ffcefa455e4bd94fc02fadd7d1a798ef [0,0,0,0,0,2|1,1,0]=4 1090 B13R1.344 CC(=O)NCC(=O)Nc1ccsc1 87be311bcc5a5a9e27021c31b92972c6 [0,0,0,0,0,2|2,0,0]=4 1091 B13R1.344 CC(=O)NCC(=O)Nc1cocn1 c4e393f5b43896b802f5808df55a86ec [0,0,0,0,0,2|2,0,0]=4 1092 B13R1.344 CC(=O)NCC(=O)Nc1cscn1 efa4cf5fd325681a16723e8b1b00b21f [0,0,0,0,0,2|2,0,0]=4 1093 B13R1.344 CC(=O)NCC(=O)Nc1ncco1 f8491a2faab4987c4c09711dec611fab [0,0,0,0,0,2|1,0,0]=3 1094 B13R1.344 CC(=O)NCC(=O)Nc1nccs1 92ec6042bfac2af537f2477ee9629085 [0,0,0,0,0,2|1,1,0]=4 1095 B13R1.344 CC(=O)OCC(=O)Nc1cccs1 e754b1830a003a67f0681af34a94451f [0,0,0,0,0,2|0,1,0]=3 1096 B13R1.344 CC(=O)OCC(=O)Nc1ccno1 e3d9afdf598c864042e0426c6e1cdde7 [0,0,0,0,0,2|1,0,0]=3 1097 B13R1.344 CC(=O)OCC(=O)Nc1ccns1 8569b91c4239f0885acea38bdae577ba [0,0,0,0,0,2|1,1,0]=4 1098 B13R1.344 CC(=O)OCC(=O)Nc1ccsc1 ec346090ffb7dd6e5281a7ba5283c77a [0,0,0,0,0,2|2,0,0]=4 1099 B13R1.344 CC(=O)OCC(=O)Nc1cncs1 eac55d4635ae742614d954b3cfa5fd99 [0,0,0,0,0,2|1,1,0]=4 1100 B13R1.344 CC(=O)OCC(=O)Nc1cocn1 c53a17ed2e4b8ffc092033238f533009 [0,0,0,0,0,2|2,0,0]=4 1101 B13R1.344 CC(=O)OCC(=O)Nc1cscn1 d1c6a029f45b131019127ed076a4cf4e [0,0,0,0,0,2|2,0,0]=4 1102 B13R1.344 CC(=O)OCC(=O)Nc1ncco1 64daf90ab71608277c1987aaaba3a4d4 [0,0,0,0,0,2|1,0,0]=3 1103 B13R1.344 CC(=O)OCC(=O)Nc1nccs1 072267f22b1711b62816829afe95eca8 [0,0,0,0,0,2|1,1,0]=4 1104 B13R1.344 CC(=O)OCN(C)Cc1ccco1 5431b37e27e5c125abb5644d556b0d1e [0,0,0,0,0,2|2,0,0]=4 1105 B13R1.344 CC(=O)SCC(=O)Nc1cccs1 8d21621d717144c623bb0ac5a05cc925 [0,0,0,0,0,2|0,1,0]=3 1106 B13R1.344 CC(=O)SCC(=O)Nc1ccno1 ea0684d14b6dd0a7c087a8da70bd3b72 [0,0,0,0,0,2|1,0,0]=3 1107 B13R1.344 CC(=O)SCC(=O)Nc1ccns1 f251029316c2a31f4333840a4e8e5044 [0,0,0,0,0,2|1,1,0]=4 1108 B13R1.344 CC(=O)SCC(=O)Nc1ccsc1 c99b9d2fc8328580e448bf688b54a8c6 [0,0,0,0,0,2|2,0,0]=4 1109 B13R1.344 CC(=O)SCC(=O)Nc1cncs1 c0e8bd40339423a2ad51617126dffb3d [0,0,0,0,0,2|1,1,0]=4 1110 B13R1.344 CC(=O)SCC(=O)Nc1cocn1 797a9697281701d114d906f7210b287f [0,0,0,0,0,2|2,0,0]=4 1111 B13R1.344 CC(=O)SCC(=O)Nc1cscn1 0d769cf42d0e4f45292d36d014661441 [0,0,0,0,0,2|2,0,0]=4 1112 B13R1.344 CC(=O)SCC(=O)Nc1ncco1 20b4f98774e233eaf03726c0139d008c [0,0,0,0,0,2|1,0,0]=3 1113 B13R1.344 CC(=O)SCC(=O)Nc1nccs1 00a86c005e295723d34ffd0074348781 [0,0,0,0,0,2|1,1,0]=4 1114 B13R1.344 CC(=S)NCC(=O)Nc1cccs1 d8587092f932522fba6c933f44c86fae [0,0,0,0,0,2|0,2,0]=4 1115 B13R1.344 CC(=S)NCC(=O)Nc1ccno1 86a8df7b0c840c699f0611957f613422 [0,0,0,0,0,2|1,1,0]=4 1116 B13R1.344 CC(=S)NCC(=O)Nc1ncco1 3d5f4db11d10efd2300df8da64534471 [0,0,0,0,0,2|1,1,0]=4 1117 B13R1.344 CC(C)CNC(=O)Cc1ccco1 741b3b77658e13842a567e54b7e3ae92 [0,0,0,0,0,2|1,0,1]=4 1118 B13R1.344 CC(O)CNC(=O)Cc1ccco1 d2dbbcc47736cad7c884ae608c9ea2d5 [0,0,0,0,0,2|0,0,2]=4 1119 B13R1.344 CS(=O)CCC(=O)Nc1cccs1 0f732899e4508042a4953db5161d6149 [0,0,0,0,0,2|1,1,0]=4 1120 B13R1.344 CS(=O)CCC(=O)Nc1ccno1 a149e9986ef25d28be38f6455323c7ca [0,0,0,0,0,2|2,0,0]=4 1121 B13R1.344 CS(=O)CCC(=O)Nc1ncco1 d2352b0fe0753243f9b6641dc73b6bd1 [0,0,0,0,0,2|2,0,0]=4 1122 B13R1.344 C[C@@H](O)CNC(=O)Cc1ccco1 d01a4f4904d256d90d9ac484490f0dc1 [0,0,0,0,0,2|0,0,2]=4 1123 B13R1.344 C[C@H](O)CNC(=O)Cc1ccco1 5259b5bf20fca19aff68663be4c36263 [0,0,0,0,0,2|0,0,2]=4 1124 B13R1.344 NC(=O)CCC(=O)Nc1cccs1 a8001de377fbfb5beb16ea9422479731 [0,0,0,0,0,2|1,1,0]=4 1125 B13R1.344 NC(=O)CCC(=O)Nc1ccno1 e97d644341fa07094f72962566bc1935 [0,0,0,0,0,2|2,0,0]=4 1126 B13R1.344 NC(=O)CCC(=O)Nc1ncco1 64fd176449cae881fcde868abd95aa7f [0,0,0,0,0,2|2,0,0]=4 1127 B13R1.344 NC(=O)CNC(=O)Cc1ccco1 b78b5413849c83346a90932ad07a1a42 [0,0,0,0,0,2|1,0,0]=3 1128 B13R1.344 NC(=O)CNC(=O)Cc1cccs1 6dd987373ca95264130f9034878c6aed [0,0,0,0,0,2|1,1,0]=4 1129 B13R1.344 NC(=O)CNC(=O)Cc1ccno1 ab16ba1bbd3fd8f1d2ad144b913c5db2 [0,0,0,0,0,2|2,0,0]=4 1130 B13R1.344 NC(=O)CNC(=O)Cc1cnco1 558e0f3f977c56d6845f30bc6145d944 [0,0,0,0,0,2|2,0,0]=4 1131 B13R1.344 NC(=O)CNC(=O)Nc1ccno1 c7c96d667be5312b732f8b8371dafbe9 [0,0,0,0,0,2|2,0,0]=4 1132 B13R1.344 NC(=O)NCC(=O)Nc1cccs1 5edf4470a9a77215058c515eb0af1c0d [0,0,0,0,0,2|1,1,0]=4 1133 B13R1.344 NC(=O)NCC(=O)Nc1ccno1 b1fa0f0217f24b4f3a692aadbbd59602 [0,0,0,0,0,2|2,0,0]=4 1134 B13R1.344 NC(=O)NCC(=O)Nc1ncco1 ec06cb0f0025ee7ecf6971068156e9d3 [0,0,0,0,0,2|2,0,0]=4 1135 B13R1.348 C=C(C)CC(=O)Nc1ccccn1 4674ae180c2e2a7956b96de1443f12ff [0,0,0,0,0,2|2,0,0]=4 1136 B13R1.348 C=C(C)CC(=O)Nc1cccnc1 7de7f097984ba97769d9b815260512c5 [0,0,0,0,0,2|2,0,0]=4 1137 B13R1.348 C=C(C)CC(=O)Nc1cccnn1 02f673ef6d2a4bf1b30d240b86fc7dac [0,0,0,0,0,2|2,0,0]=4 1138 B13R1.348 C=C(C)CC(=O)Nc1ccncc1 583d70b1367045c0f79f31171613f561 [0,0,0,0,0,2|2,0,0]=4 1139 B13R1.348 C=C(C)CC(=O)Nc1ccncn1 2967abc85c4e1caafa8cd31b7188d94a [0,0,0,0,0,2|2,0,0]=4 1140 B13R1.348 C=C(C)CC(=O)Nc1cnccn1 6b5d8965839b2f0260058fb7501cf39e [0,0,0,0,0,2|2,0,0]=4 1141 B13R1.348 CC(=O)CC(=O)Nc1ccccn1 98b87191b1f1046eb74c8eb91daca8b5 [0,0,0,0,0,2|1,0,0]=3 1142 B13R1.348 CC(=O)CC(=O)Nc1cccnc1 cf7e80314cb04aa2c50b43ed477895f4 [0,0,0,0,0,2|1,0,0]=3 1143 B13R1.348 CC(=O)CC(=O)Nc1cccnn1 23587cbaa19b60e2d8f213bd33e25836 [0,0,0,0,0,2|1,0,0]=3 1144 B13R1.348 CC(=O)CC(=O)Nc1ccncn1 cdb07c01c6af231236c6c6e6731fc12f [0,0,0,0,0,2|1,0,0]=3 1145 B13R1.348 CC(=O)CC(=O)Nc1cnccn1 2017a49a5aee1e66a6342a7074bdf75e [0,0,0,0,0,2|1,0,0]=3 1146 B13R1.348 NC(=O)CC(=O)Nc1ccccn1 703165524300fa15a2b7070496956571 [0,0,0,0,0,2|2,0,0]=4 1147 B13R1.348 NC(=O)CC(=O)Nc1cccnc1 a0eb2502a84c8704f76276ae2bca8bb1 [0,0,0,0,0,2|2,0,0]=4 1148 B13R1.348 NC(=O)CC(=O)Nc1cccnn1 5f96354609efbd7060803cad34cce52b [0,0,0,0,0,2|2,0,0]=4 1149 B13R1.348 NC(=O)CC(=O)Nc1ccncn1 9f4b679c21d2738718c748e4ea09d70c [0,0,0,0,0,2|2,0,0]=4 1150 B13R1.348 NC(=O)CC(=O)Nc1cnccn1 c88919dceb2b9485b82bc0a583edd606 [0,0,0,0,0,2|2,0,0]=4 1151 B13R1.593 C/C(=C/C(=O)NCc1ccco1)/Cl 93b4a066be685994ff8cc7f79959163c [0,0,0,0,0,2|1,0,1]=4 1152 B13R1.593 C/C(=C/C(=O)NCc1ccco1)/I f91988adb7ce47983f96f7ae6570e8c6 [0,0,0,0,0,2|1,0,1]=4 1153 B13R1.593 C/C(=C\C(=O)NCc1ccco1)/Cl c1d83077ce7082f1e836d7489eed7ceb [0,0,0,0,0,2|1,0,1]=4 1154 B13R1.593 C=C(C)CC(=O)NCc1ccco1 db1cc5b85f9658af6603690981184c22 [0,0,0,0,0,2|1,0,0]=3 1155 B13R1.593 C=C(C)CC(=O)NCc1cccs1 b0e50ba7e588c8019b3c545bfa9fb869 [0,0,0,0,0,2|1,1,0]=4 1156 B13R1.593 C=C(C)CC(=O)NCc1ccno1 4496bfb99f16e0e2921c799d80a8ba56 [0,0,0,0,0,2|2,0,0]=4 1157 B13R1.593 C=C(C)CC(=O)NCc1cnco1 d244d68ef9d4665576b9a634cbe76f43 [0,0,0,0,0,2|2,0,0]=4 1158 B13R1.593 C=C(C)CC(=O)NCc1ncco1 4060bb23c8e72704b009821ab42d5507 [0,0,0,0,0,2|2,0,0]=4 1159 B13R1.593 CC(=CC(=O)NCc1ccco1)C 822286f27cb83919ee1f37adc9f2f6b5 [0,0,0,0,0,2|1,0,1]=4 1160 B13R1.593 CC(=CC(=O)NCc1ccco1)I 82cb9a38711a7f5acf0a59757ea7e6f1 [0,0,0,0,0,2|1,0,1]=4 1161 B13R1.593 CC(=O)CC(=O)NCc1ccco1 fc5a105f274ceb29d377685f1e627007 [0,0,0,0,0,2|0,0,0]=2 1162 B13R1.593 CC(=O)CC(=O)NCc1cccs1 77b0446d634732ceb8ad445860c29fc0 [0,0,0,0,0,2|0,1,0]=3 1163 B13R1.593 CC(=O)CC(=O)NCc1ccno1 3fbdc5016e278717b9369cded60334d7 [0,0,0,0,0,2|1,0,0]=3 1164 B13R1.593 CC(=O)CC(=O)NCc1ccns1 e03feda1e7eca49daf4188d2dae1cb49 [0,0,0,0,0,2|1,1,0]=4 1165 B13R1.593 CC(=O)CC(=O)NCc1ccoc1 41f01f4112d17a5b01512045c6d05486 [0,0,0,0,0,2|2,0,0]=4 1166 B13R1.593 CC(=O)CC(=O)NCc1ccon1 46b0742899ddbaac86be625a5ed681b5 [0,0,0,0,0,2|2,0,0]=4 1167 B13R1.593 CC(=O)CC(=O)NCc1ccsc1 b7ababe0838d55b5c1a4b49e8f5323d7 [0,0,0,0,0,2|2,0,0]=4 1168 B13R1.593 CC(=O)CC(=O)NCc1ccsn1 9da48d28e96b416899b838a91445407d [0,0,0,0,0,2|2,0,0]=4 1169 B13R1.593 CC(=O)CC(=O)NCc1cnco1 3d7d6de224859978ce6a2ed6c7e1d4cc [0,0,0,0,0,2|1,0,0]=3 1170 B13R1.593 CC(=O)CC(=O)NCc1cncs1 2ae2d5d2f6f054d5bdfc6a320eb736ff [0,0,0,0,0,2|1,1,0]=4 1171 B13R1.593 CC(=O)CC(=O)NCc1cocn1 8cf2299912d56b5f8d9664892b6efb9c [0,0,0,0,0,2|2,0,0]=4 1172 B13R1.593 CC(=O)CC(=O)NCc1cscn1 03b9bc86ce715a1ab273949b12b8de10 [0,0,0,0,0,2|2,0,0]=4 1173 B13R1.593 CC(=O)CC(=O)NCc1ncco1 bfd905b2537b52264dce22415c1d2895 [0,0,0,0,0,2|1,0,0]=3 1174 B13R1.593 CC(=O)CC(=O)NCc1nccs1 0f9dfe28081c669c5174e947c4a39665 [0,0,0,0,0,2|1,1,0]=4 1175 B13R1.593 CC(=O)NC(=O)CNc1ccno1 4ceefb4343d9e0b0dfe6e18c2f27f730 [0,0,0,0,0,2|2,0,0]=4 1176 B13R1.593 CC(=O)NC(=O)CNc1ncco1 fa7c6ac4bcfd7dc2b0cdcc9454a1d59c [0,0,0,0,0,2|2,0,0]=4 1177 B13R1.593 CC(=O)NC(=O)COc1ccco1 40c3926db4b1603249ec0183754ed713 [0,0,0,0,0,2|1,0,0]=3 1178 B13R1.593 CC(C)CC(=O)COc1ccco1 490096ce8183f66b6e8d9e28faf9f29a [0,0,0,0,0,2|1,0,1]=4 1179 B13R1.593 CC(C)CC(=O)NCc1ccco1 04fcc632b4246975f52701cb7eeffa76 [0,0,0,0,0,2|1,0,1]=4 1180 B13R1.593 CC(O)CC(=O)NCc1ccco1 e1fd6c5a1f983bcab7ac42d63f85c57c [0,0,0,0,0,2|0,0,2]=4 1181 B13R1.593 CN(C)CC(=O)NCc1ccco1 aeca374124ca6ee412ddc2a89f2e3cdd [0,0,0,0,0,2|2,0,0]=4 1182 B13R1.593 C[C@@H](O)CC(=O)NCc1ccco1 a172cc37ce60704ec9dfcf65a432cc32 [0,0,0,0,0,2|0,0,2]=4 1183 B13R1.593 C[C@H](O)CC(=O)NCc1ccco1 dcc5483cafc6a426fad536973fc97797 [0,0,0,0,0,2|0,0,2]=4 1184 B13R1.593 NC(=O)CC(=O)NCc1ccco1 666686966d0aed4f2012aea7388621da [0,0,0,0,0,2|1,0,0]=3 1185 B13R1.593 NC(=O)CC(=O)NCc1cccs1 842c97f7920de8570ef2903fde9d22e6 [0,0,0,0,0,2|1,1,0]=4 1186 B13R1.593 NC(=O)CC(=O)NCc1ccno1 62f6c54c82324f46d0804e6e187e0cc6 [0,0,0,0,0,2|2,0,0]=4 1187 B13R1.593 NC(=O)CC(=O)NCc1ncco1 f610005fd56a4833587695bd23f59f79 [0,0,0,0,0,2|2,0,0]=4 1188 B13R1.593 NC(=O)NC(=O)COc1ccco1 30e27cbab71e8226f92d2c185b870915 [0,0,0,0,0,2|2,0,0]=4 1189 B13R1.593 O=C(O)CC(=O)CNc1ccno1 5eaecaebf9f451572eb49029059efc0d [0,0,0,0,0,2|2,0,0]=4 1190 B13R1.593 O=C(O)CC(=O)CNc1ncco1 ba079cd2002923574aa1bde4ba683e1b [0,0,0,0,0,2|2,0,0]=4 1191 B13R1.593 O=C(O)CC(=O)COc1ccco1 f3f21e99d3b00b7a6baa63bca289108f [0,0,0,0,0,2|1,0,0]=3