0 B7R1.1 O=CN1CC=CC1 00c83ff9220e787a4c487ae8b9d72ecb [1,0,0,0,0,0|2,0,1]=4 1 B9R1.7 CCNc1ccc(s1)C 6cc2b61cb21c538e8a3c4748615dc171 [0,1,0,0,0,0|1,1,1]=4 2 B9R1.7 CCNc1cnc(o1)C 48c2ec697b2d1d60215d854942b5fe7d [0,1,0,0,0,0|2,0,1]=4 3 B9R1.7 CCNc1ncc(o1)C b4b13cff670e86276ca545bfd94c7840 [0,1,0,0,0,0|2,0,1]=4 4 B9R1.7 Cc1cc(no1)NC=O bf631c79ac525df2584360d647175e83 [0,1,0,0,0,0|3,0,0]=4 5 B9R1.7 Cc1cc(on1)NC=O d4b400827f85b5f4b64cbe4ce8aa9608 [0,1,0,0,0,0|3,0,0]=4 6 B9R1.7 Cc1cc(sn1)NC=O f66e70d9d313733e3bf0f6207334f5a1 [0,1,0,0,0,0|3,0,0]=4 7 B9R1.7 Cc1ccc(s1)NC=O 745d01ed2a45b7ddb9d308ef71450e7f [0,1,0,0,0,0|0,1,0]=2 8 B9R1.7 Cc1ccc(s1)NCF 5db800a47823e0633ec93352d97a19cb [0,1,0,0,0,0|1,1,1]=4 9 B9R1.7 Cc1ccc(s1)NCO 00e2af5e98f8ffe71855be0007a81a6f [0,1,0,0,0,0|0,1,2]=4 10 B9R1.7 Cc1cnc(o1)NC=O cfd6ebc730ca2ded602ff2e8f15b7668 [0,1,0,0,0,0|1,0,0]=2 11 B9R1.7 Cc1cnc(o1)NCF 944c667424fa7a587182482cf2da5615 [0,1,0,0,0,0|2,0,1]=4 12 B9R1.7 Cc1cnc(o1)NCO 9d3768940882696bf956725be6113a23 [0,1,0,0,0,0|1,0,2]=4 13 B9R1.7 Cc1cnc(s1)NC=O 0129d50917e204a50a7b21c3ab1c3c7b [0,1,0,0,0,0|1,1,0]=3 14 B9R1.7 Cc1coc(n1)NC=O 9359b762456878c5b3737907ddf92820 [0,1,0,0,0,0|2,0,0]=3 15 B9R1.7 Cc1csc(n1)NC=O 20c056fd0d5e033b6f24c2f4659777ed [0,1,0,0,0,0|2,0,0]=3 16 B9R1.7 Cc1ncc(o1)NC=O 594291c6d8efef3a72f3614adbbcb38d [0,1,0,0,0,0|1,0,0]=2 17 B9R1.7 Cc1ncc(o1)NCF 100609943c408a5007543f16c70987b0 [0,1,0,0,0,0|2,0,1]=4 18 B9R1.7 Cc1ncc(o1)NCO 2ed7cecb25e96ca1af6f4fcac58c786f [0,1,0,0,0,0|1,0,2]=4 19 B9R1.7 Cc1ncc(s1)NC=O 2a6ba0f633322aad4e3b1e001a194cf3 [0,1,0,0,0,0|1,1,0]=3 20 B9R1.7 Cc1nnc(o1)NC=O 19ce13f1b4b2c9fbb6da7f73798c7b9c [0,1,0,0,0,0|2,0,0]=3 21 B9R1.7 Cc1nnc(s1)NC=O ca4cbfd2ec1cee60676a69da04f91ebb [0,1,0,0,0,0|2,1,0]=4 22 B9R1.7 Cc1noc(n1)NC=O b63975c59f9df6e62c02a16ca8a03b53 [0,1,0,0,0,0|3,0,0]=4 23 B9R1.7 Cn1cc(cn1)NC=O 2f4badbd11cb60f12dda13181c63dfab [0,1,0,0,0,0|3,0,0]=4 24 B9R1.7 Cn1ccc(n1)NC=O 4782ae68cef7067e3c0806462693daa0 [0,1,0,0,0,0|2,0,0]=3 25 B9R1.7 Cn1cnc(c1)NC=O d2de1fec2e6ba48b03b2185635a291f9 [0,1,0,0,0,0|3,0,0]=4 26 B9R1.7 Cn1ncc(n1)NC=O e4f3875f941809895c1803c38b54ff65 [0,1,0,0,0,0|3,0,0]=4 27 B9R1.7 O=CNc1ccc(s1)Br 9427143fc022e49d6cf1694ed7ebfc41 [0,1,0,0,0,0|1,1,0]=3 28 B9R1.7 O=CNc1cnc(s1)Br 768ca288f577e4b7269e6c0ba63be791 [0,1,0,0,0,0|2,1,0]=4 29 B9R1.7 O=CNc1cnc(s1)S 869d8b7e5586fa03ecd747aa1c8f78e4 [0,1,0,0,0,0|2,1,0]=4 30 B9R1.7 O=CNc1nc(co1)Br 048e00242d82b3daee28f42561c91504 [0,1,0,0,0,0|3,0,0]=4 31 B9R1.7 O=CNc1nc(cs1)Br ecef530c5278544f0cfc39ff002721be [0,1,0,0,0,0|3,0,0]=4 32 B9R1.7 O=CNc1nc(cs1)Cl 9e635e2c8b9e0c07b182220eef20574f [0,1,0,0,0,0|3,0,0]=4 33 B9R1.7 O=CNc1ncc(s1)Cl 2f60767d598edfde42a1eb7ba959b7c4 [0,1,0,0,0,0|2,1,0]=4 34 B9R1.7 O=CNc1ncc(s1)F cdbc0212ad99d6d49d41231bc794dd13 [0,1,0,0,0,0|2,1,0]=4 35 B9R1.7 O=CNc1nnc(o1)Br 73b9305da37d3811dd1b7f893920613e [0,1,0,0,0,0|3,0,0]=4 36 B7R0.2 C=C(C=O)OC(C)C 1024bdfd369573a0f4c5c31da01d34c1 [0,0,1,0,0,0|0,0,2]=3 37 B7R0.3 C=C(C=O)OCC=O d72a2d0abab614f8d0895b26ef9c5aa1 [0,0,1,0,0,0|1,0,2]=4 38 B7R0.3 C=CC(C)NCC=O 39b14e3f69e0eb05b9593b7c40c09aad [0,0,1,0,0,0|1,0,2]=4 39 B7R0.3 C=CC(C)OCC=O cb8ab1e26c946580cb2eacb238eceadb [0,0,1,0,0,0|0,0,2]=3 40 B7R0.3 C=CCOC(C)C=C a1650d51ca3c5bc9bbb4242a057bd09a [0,0,1,0,0,0|1,0,2]=4 41 B7R0.3 C=CCO[C@@H](C)C=C 346d3a0f77fdd9102666716758056241 [0,0,1,0,0,0|1,0,2]=4 42 B7R0.3 C=C[C@H](C)OCC=O 1b1ed3039c6605fda21f2d5059ac888e [0,0,1,0,0,0|0,0,2]=3 43 B7R0.3 CC(C=O)OCC=O 216dc0b62aef64aacebb34095641e5d6 [0,0,1,0,0,0|1,0,2]=4 44 B7R0.4 CC(=CCNC=O)C aa6f8132c2b4d81390aba70f51f750c7 [0,0,1,0,0,0|2,0,1]=4 45 B7R0.12 C=CC(C=C)OCC 7de0118a4df6b31edc8ac929ff93e6e2 [0,0,1,0,0,0|1,0,2]=4 46 B6R0.1 C=C(C=O)OCC 64c18fcc04a22b045ebc35a9eb4d4363 [1,0,1,0,0,0|0,0,1]=3 47 B6R0.1 C=C(C=O)OCF d1643e67cfe1838c4e32b694bc3648e2 [1,0,1,0,0,0|1,0,1]=4 48 B6R0.1 C=CC(C)NC=O ea3bd8a0f1437d84f5ea96318c16e9bd [1,0,1,0,0,0|1,0,1]=4 49 B6R0.4 C=C(C)CNC=O 0d0687e6ed98c39501c4c0fd9c1a287e [1,0,1,0,0,0|2,0,0]=4 50 B6R0.6 CC=CCNC=O 4f8730c7216653a335fe81630ffa3901 [1,0,1,0,0,0|1,0,1]=4 51 B8R0.19 C#CC(C)OC(=C)C=O 72ff59a7b8bf041862425e6ee1e157bf [0,1,1,0,0,0|0,0,2]=4 52 B8R0.19 C=C(C=O)OC(C)C#N ae3fd085eaad5d67f89cbb0689252127 [0,1,1,0,0,0|0,0,2]=4 53 B8R0.19 C=C(C=O)OC(C)C=O 6e9083411ab06f5ff102a1878674aff6 [0,1,1,0,0,0|0,0,1]=3 54 B8R0.19 C=C(C=O)OC(C)CC c5f7d9036a8fdea0d25979e46bb39add [0,1,1,0,0,0|0,0,2]=4 55 B8R0.19 C=C(C=O)O[C@H](C)C=O 3fdae7cafda354e38a1eb1ee59854785 [0,1,1,0,0,0|0,0,1]=3 56 B8R0.19 C=CC(C)OC(=C)C=O 8c192ba855365988a6d73bd92d3bddfc [0,1,1,0,0,0|0,0,1]=3 57 B8R0.1 C/C=C/C(C)OCC=O 3c462d15fec3dcb51b9371f8065dab9e [0,1,1,0,0,0|0,0,2]=4 58 B8R0.1 C=CCC(C)OCC=O 805d006448d647b16a227c84124f8a54 [0,1,1,0,0,0|0,0,2]=4 59 B8R0.1 C=CC[C@@H](C)OCC=O a0e388fab32588efe0b0ae569bdc0661 [0,1,1,0,0,0|0,0,2]=4 60 B8R0.1 C=CC[C@H](C)OCC=O b16f0951e117256fa250913579de0fe1 [0,1,1,0,0,0|0,0,2]=4 61 B8R0.1 CC=CC(C)OCC=O afa81202fb8927469e80733dc589551c [0,1,1,0,0,0|0,0,2]=4 62 B8R0.6 C/C(=C\I)/COCC=O d24ecd4e9d90b27c0cfbb39972f8ce8c [0,1,1,0,0,0|1,0,1]=4 63 B8R0.6 C=C(C=O)OC/C=C/C 2dcc3110c86a6a555816f9e93568f805 [0,1,1,0,0,0|1,0,1]=4 64 B8R0.6 C=C(C=O)OC/C=C\C 93550c76437bdb34f8fb27ee7eff4467 [0,1,1,0,0,0|1,0,1]=4 65 B8R0.6 C=CC(C)COCC=O 6e7f92fb51e32c59e36957f0b0308468 [0,1,1,0,0,0|0,0,2]=4 66 B8R0.6 C=CC(C)OC/C=C/C aebdee5aafe913b6df3bb26f25910347 [0,1,1,0,0,0|1,0,1]=4 67 B8R0.6 C=CC(C)OC/C=C/Cl 98e85a62405098586fe856f7d93d8b28 [0,1,1,0,0,0|1,0,1]=4 68 B8R0.6 C=CC(C)OC/C=C\C 3a53396281882a624be088094f92c47f [0,1,1,0,0,0|1,0,1]=4 69 B8R0.6 C=CC(C)OC/C=C\Cl a2bbf4aee7b64ad0e13f709c5a8f51ee [0,1,1,0,0,0|1,0,1]=4 70 B8R0.6 C=CC(C)OCC=CC 9191e9101695b30a824edf8bbd483f58 [0,1,1,0,0,0|1,0,1]=4 71 B8R0.6 C=CC(C)OCC=CCl 10877dadf45616c9425651abd81a8157 [0,1,1,0,0,0|1,0,1]=4 72 B8R0.6 C=CC(C)OCCC=O c2fb39e17e89251aad102f8067a79d7c [0,1,1,0,0,0|0,0,2]=4 73 B8R0.6 C=C[C@H](C)OC/C=C/C d9c811e78410ea96eb828b68e437a452 [0,1,1,0,0,0|1,0,1]=4 74 B8R0.6 C=C[C@H](C)OC/C=C/Cl 03cee5f29b8b794ffb513503cea8c2a3 [0,1,1,0,0,0|1,0,1]=4 75 B8R0.6 C=C[C@H](C)OC/C=C\C 736906b3237f70f0c6c14fbb4b396053 [0,1,1,0,0,0|1,0,1]=4 76 B8R0.6 C=C[C@H](C)OC/C=C\Cl dab31589fbf614d1affd5b7fc5985e85 [0,1,1,0,0,0|1,0,1]=4 77 B8R0.6 C=C[C@H](C)OCCC=O d2528d5f8182afb1ad2ed844bb3b4d34 [0,1,1,0,0,0|0,0,2]=4 78 B8R0.6 CC(=CI)COCC=O 8c68d906ad094a22395e991c01c39108 [0,1,1,0,0,0|1,0,1]=4 79 B8R0.6 CC=CCNC(=O)C=O 2619bd06651b9bd7fad594d339b07422 [0,1,1,0,0,0|0,0,2]=4 80 B8R0.9 C=CC(C)OCC(=O)C 9ad41a13855017a691d90b159b9e2ebc [0,1,1,0,0,0|0,0,2]=4 81 B8R0.9 C=CC(C)OCC(=O)N 0d06a7ddf76614144a3227f608d154b8 [0,1,1,0,0,0|0,0,2]=4 82 B8R0.9 C=CC(C)OCC(=O)O a247bec38dd53f48038da06d8390c9f2 [0,1,1,0,0,0|0,0,2]=4 83 B8R0.9 C=C[C@H](C)OCC(=O)N ba49805e8ed0d5d0e00a52526e184ffd [0,1,1,0,0,0|0,0,2]=4 84 B8R0.9 C=C[C@H](C)OCC(=O)O 11d6db631afaf24abf76538c811f1efa [0,1,1,0,0,0|0,0,2]=4 85 B8R0.11 C=CC(CC)OCC=O bcc08209503a879d155ff76cac2817f1 [0,1,1,0,0,0|0,0,2]=4 86 B8R0.15 C/C=C(\OCC)/C(=O)O ed3460e0bbe0f0b117145ec3b6c6a2c3 [0,1,1,0,0,0|0,0,2]=4 87 B8R1.8 CCOc1ccco1 e09af78840aa7c50339c3ce236ba2f4c [1,1,0,0,0,0|1,0,1]=4 88 B8R1.8 FCOc1ccco1 51ab89c071216f5af135b7cd9684c569 [1,1,0,0,0,0|1,0,1]=4 89 B8R1.8 O=CNc1cccs1 ba17c251fb0707a83067f3ecf6d1d996 [1,1,0,0,0,0|0,1,0]=3 90 B8R1.8 O=CNc1ccno1 aae61b9cd3ebc97474890d3f855206e4 [1,1,0,0,0,0|1,0,0]=3 91 B8R1.8 O=CNc1ccns1 ce5df5142e91fb4f21bc04e2f907948a [1,1,0,0,0,0|1,1,0]=4 92 B8R1.8 O=CNc1ccon1 cca691a48b26a4c8aa46cb0c5d0b373e [1,1,0,0,0,0|2,0,0]=4 93 B8R1.8 O=CNc1ccsc1 0a6858906ba6a8fe50b8bca40778ed89 [1,1,0,0,0,0|2,0,0]=4 94 B8R1.8 O=CNc1cncs1 2fc027c30eccc6d6784fdd08eb71b5dd [1,1,0,0,0,0|1,1,0]=4 95 B8R1.8 O=CNc1cocn1 fa7501fc60eefe5acd9d7f72446662b1 [1,1,0,0,0,0|2,0,0]=4 96 B8R1.8 O=CNc1cscn1 dc58d2c2a66d8256ef5e7a147170c401 [1,1,0,0,0,0|2,0,0]=4 97 B8R1.8 O=CNc1ncco1 6995c12eff18399819f86d155261d936 [1,1,0,0,0,0|1,0,0]=3 98 B8R1.8 O=CNc1nccs1 390a57e714801d3a9ba2a25dd47bacc9 [1,1,0,0,0,0|1,1,0]=4 99 B10R1.1 Cc1ccc(cc1)NC=O 744bdaf803f21c7628c38778fb4c30d0 [0,1,0,0,0,1|1,0,0]=3 100 B10R1.1 Cc1ccc(cn1)NC=O 489ceb64e1ca1dffde423b287e55343b [0,1,0,0,0,1|1,0,0]=3 101 B10R1.1 Cc1ccc(nc1)NC=O 787d7b6b5dd94952a200592a41c8b8b9 [0,1,0,0,0,1|1,0,0]=3 102 B10R1.1 Cc1ccc(nn1)NC=O a0c3d2b6c57084a347604d5a876b8f5b [0,1,0,0,0,1|1,0,0]=3 103 B10R1.1 Cc1cnc(cn1)NC=O e9e57b2c428d760f4b8aeaa154812af8 [0,1,0,0,0,1|2,0,0]=4 104 B10R1.1 Cc1ncc(cn1)NC=O 37d565fb8ea2c9e131f98e0f4c687cdb [0,1,0,0,0,1|2,0,0]=4 105 B10R1.1 O=CNc1ccc(cc1)Br d7ce2fc8367b9f0ab0f2e59514baf831 [0,1,0,0,0,1|2,0,0]=4 106 B10R1.1 O=CNc1ccc(cc1)Cl 6958240b257559c57e66b733208a1fd9 [0,1,0,0,0,1|2,0,0]=4 107 B10R1.1 O=CNc1ccc(cc1)F bd58d24daf145acc5a6089d95f60a456 [0,1,0,0,0,1|2,0,0]=4 108 B10R1.1 O=CNc1ccc(cc1)I 477097145ec69bf5f94c911c47fa12c8 [0,1,0,0,0,1|2,0,0]=4 109 B10R1.1 O=CNc1ccc(cc1)S 4a89cce61b79984a4f73e03ba9acee66 [0,1,0,0,0,1|2,0,0]=4 110 B10R1.1 O=CNc1ccc(cn1)Cl d3d35b3132865a697b3ce3a5e150069b [0,1,0,0,0,1|2,0,0]=4 111 B10R1.1 O=CNc1ccc(cn1)F 810dde12c9284662b8355faf968b2a7a [0,1,0,0,0,1|2,0,0]=4 112 B10R1.1 O=CNc1ccc(cn1)I 4eaa73ecd6461fe1e6744e3306f8ab5f [0,1,0,0,0,1|2,0,0]=4 113 B10R1.1 O=CNc1ccc(nc1)Br 7f0fdfd14a461c68caddf7a3c7637111 [0,1,0,0,0,1|2,0,0]=4 114 B10R1.1 O=CNc1ccc(nc1)Cl d34b7188e9c6fc7bd4c519ab891fd1ef [0,1,0,0,0,1|2,0,0]=4 115 B10R1.1 O=CNc1ccc(nc1)F bc035562c1b2f653b687ca5d53853c33 [0,1,0,0,0,1|2,0,0]=4 116 B10R1.1 O=CNc1ccc(nc1)I 7e72d8482a5c98b4a6b518f418650f35 [0,1,0,0,0,1|2,0,0]=4 117 B10R1.1 O=CNc1ccc(nn1)F cd00cec90096c775120fee4ecabc3690 [0,1,0,0,0,1|2,0,0]=4 118 B10R1.1 O=CNc1ccc(nn1)I 2e418ae87a76eebe599130e3d9369b0a [0,1,0,0,0,1|2,0,0]=4 119 B10R1.10 Cc1cc(ccn1)NC=O a1b570429a4635d83924ed4666c430bc [0,1,0,0,0,1|1,0,0]=3 120 B10R1.10 Cc1cccc(c1)NC=O 05038cbe055575047c41b1e8757f2545 [0,1,0,0,0,1|1,0,0]=3 121 B10R1.10 Cc1cccc(n1)NC=O ed2cb43abfa9e18c06399d497b7d9003 [0,1,0,0,0,1|1,0,0]=3 122 B10R1.10 Cc1ccnc(c1)NC=O eb3abfd32da8586a758691536bf07486 [0,1,0,0,0,1|1,0,0]=3 123 B10R1.10 Cc1cncc(c1)NC=O 95a870ee7a047f48cb87dd1c0e78a9ee [0,1,0,0,0,1|1,0,0]=3 124 B10R1.10 Cc1cncc(n1)NC=O 25b6fe1ae28318b79ebde191ccd7cd48 [0,1,0,0,0,1|1,0,0]=3 125 B10R1.10 Cc1cnnc(c1)NC=O 5ae21a3f77bb0697c6057ea9281edc46 [0,1,0,0,0,1|2,0,0]=4 126 B10R1.10 Cc1nccc(n1)NC=O e84c30325902b0646d151aa501bd82b0 [0,1,0,0,0,1|1,0,0]=3 127 B10R1.10 O=CNc1cc(ccn1)Cl 6b6c85f18ba607a083fcc35e13622e19 [0,1,0,0,0,1|2,0,0]=4 128 B10R1.10 O=CNc1cc(ccn1)F 22e5ac79b9d0cc27ef6263b1646d5601 [0,1,0,0,0,1|2,0,0]=4 129 B10R1.10 O=CNc1cc(ccn1)O f7c20b6003f2bd2dd1237de57a7e5881 [0,1,0,0,0,1|2,0,0]=4 130 B10R1.10 O=CNc1cccc(c1)Br 5eb9518e9956f7a348d0a646a73a1e32 [0,1,0,0,0,1|2,0,0]=4 131 B10R1.10 O=CNc1cccc(c1)Cl 7fe4ac55882b67bb145106257f99a127 [0,1,0,0,0,1|2,0,0]=4 132 B10R1.10 O=CNc1cccc(c1)F 078b99782fd4caa299ab4bc2089ca8ec [0,1,0,0,0,1|2,0,0]=4 133 B10R1.10 O=CNc1cccc(c1)I 0ca8a7d6d3dcba43e51377ba593dcc41 [0,1,0,0,0,1|2,0,0]=4 134 B10R1.10 O=CNc1cccc(c1)O b7034720bcdfb6e36ba15c0a5abf2a37 [0,1,0,0,0,1|2,0,0]=4 135 B10R1.10 O=CNc1cccc(c1)S 605dde1db165209334662244eb37bfa5 [0,1,0,0,0,1|2,0,0]=4 136 B10R1.10 O=CNc1cccc(n1)Br d0a5a21929b617be7b84c1c911470bf6 [0,1,0,0,0,1|2,0,0]=4 137 B10R1.10 O=CNc1cccc(n1)Cl ac0e9eb68a34eabe5b0113dfee26506e [0,1,0,0,0,1|2,0,0]=4 138 B10R1.10 O=CNc1cccc(n1)F 7f6b4bf345efc87d793d80dd4ecfe368 [0,1,0,0,0,1|2,0,0]=4 139 B10R1.10 O=CNc1cccc(n1)I b8d564702983298e228006f730a723d0 [0,1,0,0,0,1|2,0,0]=4 140 B10R1.10 O=CNc1ccnc(c1)Br 7d8391d7349e0baba7101dcad63499bd [0,1,0,0,0,1|2,0,0]=4 141 B10R1.10 O=CNc1ccnc(c1)Cl d8d3b27a1d645fa8f7ac255717dc5e9d [0,1,0,0,0,1|2,0,0]=4 142 B10R1.10 O=CNc1ccnc(c1)F 6e3376358f7c018fac14dfa72e615522 [0,1,0,0,0,1|2,0,0]=4 143 B10R1.10 O=CNc1ccnc(c1)I 1c4dda9c715dd9fe3b927608e58e2909 [0,1,0,0,0,1|2,0,0]=4 144 B10R1.10 O=CNc1ccnc(c1)O fac658cfc4c685e81e63118107e23109 [0,1,0,0,0,1|2,0,0]=4 145 B10R1.10 O=CNc1ccnc(n1)Br e8d9c6e3a6a905647a1f935fb2206cbe [0,1,0,0,0,1|2,0,0]=4 146 B10R1.10 O=CNc1ccnc(n1)Cl e279712feafca9bbff4e592a947221f1 [0,1,0,0,0,1|2,0,0]=4 147 B10R1.10 O=CNc1ccnc(n1)F 015d08238df74f91fe8ad1598bec7413 [0,1,0,0,0,1|2,0,0]=4 148 B10R1.10 O=CNc1ccnc(n1)S 2940e0f041077b147ae7f55d8e180d06 [0,1,0,0,0,1|2,0,0]=4 149 B10R1.10 O=CNc1cncc(c1)Cl 6d418a989dcc249129d9ecf8231bde00 [0,1,0,0,0,1|2,0,0]=4 150 B10R1.10 O=CNc1cncc(c1)F c1b15bdb8b54842fb529d27afe0a8448 [0,1,0,0,0,1|2,0,0]=4 151 B10R1.10 O=CNc1cncc(c1)I ffdc4eb6863604810b48b838ef206cc9 [0,1,0,0,0,1|2,0,0]=4 152 B10R1.10 O=CNc1cncc(c1)O 626df693a598a70ed1c051a8db581956 [0,1,0,0,0,1|2,0,0]=4 153 B10R1.10 O=CNc1cncc(n1)Br 475bb1b17cab64494efd83a794fa42df [0,1,0,0,0,1|2,0,0]=4 154 B10R1.10 O=CNc1cncc(n1)Cl 9b5f2db0ce0bbbe7637d6165f6139469 [0,1,0,0,0,1|2,0,0]=4 155 B10R1.10 O=CNc1cncc(n1)F 865df80447df4ebd0d1b0310671b79b8 [0,1,0,0,0,1|2,0,0]=4 156 B10R1.14 CCN(C)c1ccc(o1)C 756b5c8d5f9750ba36120da486b7ea4d [0,2,0,0,0,0|1,0,1]=4 157 B10R1.14 Cc1csc(n1)N(C)C=O f02723a7096f245a3feb7fb4e980a086 [0,2,0,0,0,0|2,0,0]=4 158 B10R1.16 C=CCNc1ccc(s1)C 36f82754d5b8acd0c2df40fa4df39e81 [0,2,0,0,0,0|1,1,0]=4 159 B10R1.16 C=CCNc1cnc(o1)C 6753b7383d8a8908b46401e2bd43002c [0,2,0,0,0,0|2,0,0]=4 160 B10R1.16 C=CCNc1ncc(o1)C f51373c0779d8ea5a2075f6708f02da8 [0,2,0,0,0,0|2,0,0]=4 161 B10R1.16 CCCNc1ccc(o1)C c15cbb66fc0595155ee50bd4d65f2e30 [0,2,0,0,0,0|1,0,1]=4 162 B10R1.16 CCNCc1ccc(o1)C 16b5b202870b0088f6ce61a25808ad7d [0,2,0,0,0,0|1,0,1]=4 163 B10R1.16 CCOCc1ccc(o1)C 7cf8410aa18fcbf976c33b2a6864e0bc [0,2,0,0,0,0|0,0,2]=4 164 B10R1.16 Cc1ccc(o1)CNC=O 02731b87228ef2993aa4f8004ecf0c06 [0,2,0,0,0,0|0,0,0]=2 165 B10R1.16 Cc1ccc(o1)CNCF 13f986aeea8b775a60238e693104a65f [0,2,0,0,0,0|1,0,1]=4 166 B10R1.16 Cc1ccc(o1)CNCO d041abacf9ec57978eefc828a709cf3e [0,2,0,0,0,0|0,0,2]=4 167 B10R1.16 Cc1ccc(o1)COCF b0346ecdfb2d15ace5ee263215c686ed [0,2,0,0,0,0|0,0,2]=4 168 B10R1.16 Cc1ccc(o1)NCC#N 190cf4c657df20698b87afd68e2d6f67 [0,2,0,0,0,0|1,0,1]=4 169 B10R1.16 Cc1ccc(o1)NCCBr 94c6919c892b86247ed83a8027489e92 [0,2,0,0,0,0|1,0,1]=4 170 B10R1.16 Cc1ccc(o1)NCCF 5157fb3f16887366e8eb971894b56115 [0,2,0,0,0,0|1,0,1]=4 171 B10R1.16 Cc1ccc(o1)NCCI f698b019425ec2fdad0493a890dbe883 [0,2,0,0,0,0|1,0,1]=4 172 B10R1.16 Cc1ccc(o1)NCCO 0ad3b90a9625fc21f82fe655b7cdc742 [0,2,0,0,0,0|0,0,2]=4 173 B10R1.16 Cc1ccc(o1)NCCS 5aa97c71f850e633340c564b9c419f25 [0,2,0,0,0,0|0,1,1]=4 174 B10R1.16 Cc1ccc(s1)CNC=O fc6468575008e634f5c5946401a36ed1 [0,2,0,0,0,0|0,1,0]=3 175 B10R1.16 Cc1ccc(s1)NCC=O 02b8353e4c3f1d484a232c81960dccc1 [0,2,0,0,0,0|0,1,0]=3 176 B10R1.16 Cc1cnc([nH]1)NCC=O e8981f3e3ac375ce8344537c104520d5 [0,2,0,0,0,0|2,0,0]=4 177 B10R1.16 Cc1cnc(o1)CNC=O f7b0625438ac26ada645342eaa0f99c5 [0,2,0,0,0,0|1,0,0]=3 178 B10R1.16 Cc1cnc(o1)NCC=O 94dd205e7c3bd60120f3e99e6c3aca45 [0,2,0,0,0,0|1,0,0]=3 179 B10R1.16 Cc1cnc(s1)CNC=O c36f1cd1a52cdbb69a5f17c3a0a982a7 [0,2,0,0,0,0|1,1,0]=4 180 B10R1.16 Cc1cnc(s1)NCC=O 3831e9a5fc6176b264d4174c2504fedf [0,2,0,0,0,0|1,1,0]=4 181 B10R1.16 Cc1coc(c1)CNC=O 314a057a6471b418ab58d9c60bd4c733 [0,2,0,0,0,0|2,0,0]=4 182 B10R1.16 Cc1coc(n1)CNC=O a760e55a2923bab45dbb87f6cd85c646 [0,2,0,0,0,0|2,0,0]=4 183 B10R1.16 Cc1coc(n1)NCC=O 3a7ebe089242d0d55db3fec7ac466ccc [0,2,0,0,0,0|2,0,0]=4 184 B10R1.16 Cc1csc(c1)CNC=O aea632179bec77ae7bed276c7bfa4320 [0,2,0,0,0,0|2,0,0]=4 185 B10R1.16 Cc1csc(c1)OCC=O 575999b474300732ec947b01c3f08f8f [0,2,0,0,0,0|2,0,0]=4 186 B10R1.16 Cc1csc(n1)CNC=O 89fd956e1a15f8ffab4fe8206c32d803 [0,2,0,0,0,0|2,0,0]=4 187 B10R1.16 Cc1csc(n1)NCC=O e91afffb99741295f1bfd4c3a589af91 [0,2,0,0,0,0|2,0,0]=4 188 B10R1.16 Cc1nc(co1)CNC=O 549dd3580932963f2c1f626de28559c8 [0,2,0,0,0,0|2,0,0]=4 189 B10R1.16 Cc1nc(cs1)CNC=O 732ecbc4b257bef5c5bd60d1ed8929db [0,2,0,0,0,0|2,0,0]=4 190 B10R1.16 Cc1ncc(o1)CNC=O 574700874a763c6bca5c22d37610c2de [0,2,0,0,0,0|1,0,0]=3 191 B10R1.16 Cc1ncc(o1)NCC=O c951de74d2a852d38b790fd6d3825f7b [0,2,0,0,0,0|1,0,0]=3 192 B10R1.16 Cc1ncc(s1)CNC=O a84ade2c738c56b85610d6b0b61f6940 [0,2,0,0,0,0|1,1,0]=4 193 B10R1.16 Cc1ncc(s1)NCC=O 1809915a9c95721b39f592a92c778918 [0,2,0,0,0,0|1,1,0]=4 194 B10R1.16 Cc1nnc(o1)CNC=O 0e7a10a7f581efbb46e9a110d0a18eb2 [0,2,0,0,0,0|2,0,0]=4 195 B10R1.16 Cc1nnc(o1)NCC=O 989c3c3500eddb89f09ccbfbfcfb58db [0,2,0,0,0,0|2,0,0]=4 196 B10R1.16 Cn1ccc(n1)CNC=O adc52603a7a12b74f2548573adfbbf3b [0,2,0,0,0,0|2,0,0]=4 197 B10R1.16 Cn1ccc(n1)NCC=O f6c59d5691255bdb43cb4c323c27f2b9 [0,2,0,0,0,0|2,0,0]=4 198 B10R1.16 Cn1ccc(n1)OCC=O 52ac89417e9fbeb31af7b89b29966fee [0,2,0,0,0,0|2,0,0]=4 199 B10R1.16 O=CCNc1ccc(s1)Br a45e132bc2a4eafe3405aa14559be107 [0,2,0,0,0,0|1,1,0]=4 200 B10R1.16 O=CCOC1C=CC(=O)O1 70ad90111339cee0b4b8e4ca8b783dae [0,2,0,0,0,0|1,0,1]=4 201 B10R1.16 O=CCOc1ccc(s1)Br 9ce17bef9fde7aca4ca6092b23dc75e4 [0,2,0,0,0,0|1,1,0]=4 202 B10R1.16 O=CNCc1ccc(o1)Br 757e0e439181d815d74ee7edde717301 [0,2,0,0,0,0|1,0,0]=3 203 B10R1.16 O=CNCc1ccc(s1)Br 6d558d768515f9ea2d6134d57133a8dd [0,2,0,0,0,0|1,1,0]=4 204 B10R1.16 O=CNCc1ccc(s1)Cl f3b25be17f4504a4a45886eb369c45ef [0,2,0,0,0,0|1,1,0]=4 205 B10R1.16 O=CNCc1ccc(s1)F f9e754f12ea44d05bb249ef27e9efe9e [0,2,0,0,0,0|1,1,0]=4 206 B10R1.16 O=CNCc1ncc(o1)Br 389cfec1ee945bd3db9e0cc903f9ce9d [0,2,0,0,0,0|2,0,0]=4 207 B10R1.54 CC(=O)Nc1ccn(n1)C 903af2560c1c678177a5924d68c95644 [0,2,0,0,0,0|2,0,0]=4 208 B10R1.54 CC(=O)Nc1cnc(o1)C abc73c25d4867826ef3bfc13f8c7316c [0,2,0,0,0,0|1,0,0]=3 209 B10R1.54 CC(=O)Nc1cnc(s1)C f0db43659dd3987c1ef02f00c56b566f [0,2,0,0,0,0|1,1,0]=4 210 B10R1.54 CC(=O)Nc1nc(co1)C 57a302d71eb45e267d8631f9449ec3ea [0,2,0,0,0,0|2,0,0]=4 211 B10R1.54 CC(=O)Nc1nc(cs1)C 3e571b68a826de29c87d5649816bf01d [0,2,0,0,0,0|2,0,0]=4 212 B10R1.54 CC(=O)Nc1ncc(o1)C bf46992bdf79173921a665869350e14e [0,2,0,0,0,0|1,0,0]=3 213 B10R1.54 CC(=O)Nc1nnc(o1)C eb99e2ee1070a359576f1280a0602a7f [0,2,0,0,0,0|2,0,0]=4 214 B10R1.96 CCNc1nc(cs1)C=O affc5d33f2f9552fa24ef2ac37fd4f57 [0,2,0,0,0,0|2,0,0]=4 215 B10R1.96 CCNc1ncc(s1)C=O dce1da526516ed9a0970f01dd1717969 [0,2,0,0,0,0|1,1,0]=4 216 B10R1.96 CCOc1csc(c1)C=O 487cd3d62bad684d0c5e11d294237264 [0,2,0,0,0,0|2,0,0]=4 217 B10R1.96 CCc1ccc(o1)NC#N d2dddeb57ae619429ace598d42e02eb0 [0,2,0,0,0,0|1,0,1]=4 218 B10R1.96 CCc1cnc(s1)NC=O 664a197db1825f95bda60b5cd9009aee [0,2,0,0,0,0|1,1,0]=4 219 B10R1.96 CCc1csc(n1)NC=O 02168ffa4243f2537751af843d1dc7df [0,2,0,0,0,0|2,0,0]=4 220 B10R1.96 CCc1nnc(o1)NC=O 89077021614ef8197b82c303c9b46d1e [0,2,0,0,0,0|2,0,0]=4 221 B10R1.96 CCn1ccc(n1)NC=O 38bbd4739076f542be8448e88f1e870e [0,2,0,0,0,0|2,0,0]=4 222 B10R1.96 COc1cnc(s1)NC=O 1e5b9aab610718e069b800712abd5132 [0,2,0,0,0,0|1,1,0]=4 223 B10R1.96 COc1ncc(s1)NC=O 27ed293b9888c729590b63af1bb8db0b [0,2,0,0,0,0|1,1,0]=4 224 B10R1.96 CSc1cnc(s1)NC=O c7f8b50f016fd75e948930293ff1d2a6 [0,2,0,0,0,0|1,1,0]=4 225 B10R1.96 N#CNc1ccc(o1)C=O 9a5ec75140362f3c2d9e9074f0191050 [0,2,0,0,0,0|0,0,1]=3 226 B10R1.96 N#CNc1ccc(o1)CO 9c3b603b130ce558dcf51d4fbfc7172b [0,2,0,0,0,0|1,0,1]=4 227 B10R1.96 N#CNc1ccc(s1)C=O cc3db0d985ab5cd445b2a7ee0f9f69ef [0,2,0,0,0,0|0,1,1]=4 228 B10R1.96 N#CNc1cnc(o1)C=O ab7d54e5c7d7fc2f6747e33ebbe8591c [0,2,0,0,0,0|1,0,1]=4 229 B10R1.96 O=CNc1nc(co1)CO 915df625cfd003890b28f3197433b05f [0,2,0,0,0,0|2,0,0]=4 230 B10R1.96 O=CNc1nc(cs1)CCl 83b5d30897758ba7a397ab08b282c0b8 [0,2,0,0,0,0|2,0,0]=4 231 B10R1.96 O=CNc1nc(cs1)CO 35f477493267a95b105f723e8a970188 [0,2,0,0,0,0|2,0,0]=4 232 B10R1.96 O=CNc1ncc(s1)CO 1d8428f4c76ec71c839067630256d1fa [0,2,0,0,0,0|1,1,0]=4 233 B10R1.96 O=Cc1cc(cs1)OCF 1b6f8c42bd0aa96530f649d0e1a93353 [0,2,0,0,0,0|2,0,0]=4 234 B10R1.96 O=Cc1cnc(s1)NCF 87323f5f5c3f9093c995513471cc11ea [0,2,0,0,0,0|1,1,0]=4 235 B10R1.96 O=Cc1cnc(s1)NCO 621686051a9e84f3ada82e55c02dc555 [0,2,0,0,0,0|1,1,0]=4 236 B10R1.96 O=Cc1csc(n1)NCF 9928f566e2aaf8f04bbf2bd961a6eb22 [0,2,0,0,0,0|2,0,0]=4 237 B10R1.96 O=Cc1csc(n1)NCO b07c95f7e266d8b3a71c106f7dee398d [0,2,0,0,0,0|2,0,0]=4 238 B10R1.130 Cc1cn(nc1NC=O)C 73d4f847f8b601951c86b1312ae9f3e8 [0,2,0,0,0,0|2,0,0]=4 239 B10R1.130 Cn1cc(c(n1)NC=O)Cl a69d5080bcafb47adc3010fc14c069b1 [0,2,0,0,0,0|2,0,0]=4 240 B10R1.130 Cn1cc(c(n1)NC=O)I 8953676dff47b713381166c7705df558 [0,2,0,0,0,0|2,0,0]=4 241 B10R1.131 Cc1cc(nn1C)NC=O c8d27e645c21331069c9f313932ace49 [0,2,0,0,0,0|2,0,0]=4 242 B10R1.131 Cc1nc(oc1C)NC=O f400ebc04b5d01804b8df190c0d15a1e [0,2,0,0,0,0|1,0,0]=3 243 B10R1.131 Cc1nc(sc1I)NC=O 40cb7c37cc10c052cb0612a2083f6f92 [0,2,0,0,0,0|2,0,0]=4 244 B10R1.131 Cn1nc(cc1Br)NC=O e7287a72cb33d59407f85a35479d12f4 [0,2,0,0,0,0|2,0,0]=4 245 B10R1.131 Cn1nc(cc1Cl)NC=O 3a8508ed12f90c511698792c835ab117 [0,2,0,0,0,0|2,0,0]=4 246 B8R1.40 C=C(C=O)OC1CC1 b9ffb3a59a8a9a3920997cae2c377c7b [0,0,1,1,0,0|0,0,2]=4