0 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccns2 AIFCHEM-45657010275 [0,0,0,0,0,0|3,0,0]=3 1 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccsn2 AIFCHEM-45656941638 [0,0,0,0,0,0|4,0,0]=4 2 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-45653785329 [0,0,0,0,0,0|1,1,0]=2 3 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-45653981040 [0,0,0,0,0,0|3,0,0]=3 4 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-91101718265 [0,0,0,0,0,0|3,0,0]=3 5 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nccs2 AIFCHEM-45654409129 [0,0,0,0,0,0|3,1,0]=4 6 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-45654337781 [0,0,0,0,0,0|3,0,0]=3 7 B23R2.496452 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-91123475918 [0,0,0,0,0,0|2,1,0]=3 8 B23R2.496452 COc1cc(ccc1c2cncs2)NC(=O)C(O)CCSC AIFCHEM-42745035277 [0,0,0,0,0,0|2,1,0]=3 9 B23R2.496452 COc1cc(ccc1c2cnsc2)NC(=O)C(O)CCSC AIFCHEM-42745161788 [0,0,0,0,0,0|4,0,0]=4 10 B23R2.496452 COc1cc(ccc1c2cscn2)NC(=O)C(O)CCSC AIFCHEM-79686788921 [0,0,0,0,0,0|4,0,0]=4 11 B23R2.496452 COc1cc(ccc1c2nncs2)NC(=O)C(O)CCSC AIFCHEM-79709242074 [0,0,0,0,0,0|3,1,0]=4 12 B22R2.62501 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccns2 AIFCHEM-40146196885 [1,0,0,0,0,0|3,0,0]=4 13 B22R2.62501 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5691607007 [1,0,0,0,0,0|1,0,0]=2 14 B22R2.62501 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-40144814559 [1,0,0,0,0,0|1,1,0]=3 15 B22R2.62501 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-40144941070 [1,0,0,0,0,0|3,0,0]=4 16 B22R2.62501 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-84942231651 [1,0,0,0,0,0|3,0,0]=4 17 B22R2.62501 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-40145161651 [1,0,0,0,0,0|3,0,0]=4 18 B22R2.62501 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-84957391584 [1,0,0,0,0,0|2,1,0]=4 19 B22R2.62501 CCOC(C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-44172332939 [1,0,0,0,0,0|2,1,0]=4 20 B22R2.143459 C#CCCCC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-44500333930 [1,0,0,0,0,0|0,1,2]=4 21 B22R2.143459 C#CCOCC(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5772328005 [1,0,0,0,0,0|1,0,2]=4 22 B22R2.143459 CC/C=C/CC(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-94599907205 [1,0,0,0,0,0|0,0,2]=3 23 B22R2.143459 CC/C=C/CC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-42614803271 [1,0,0,0,0,0|0,1,2]=4 24 B22R2.143459 CCCCCC(=O)Nc1ccc(c(c1)CC)c2cc[nH]c2 AIFCHEM-95288060887 [1,0,0,0,0,0|2,0,1]=4 25 B22R2.143459 CCCCCC(=O)Nc1ccc(c(c1)CC)c2ccco2 AIFCHEM-98043478554 [1,0,0,0,0,0|2,0,0]=3 26 B22R2.143459 CCCCCC(=O)Nc1ccc(c(c1)CC)c2ccoc2 AIFCHEM-97637038827 [1,0,0,0,0,0|3,0,0]=4 27 B22R2.143459 CCCCCC(=O)Nc1ccc(c(c1)CC)c2cn[nH]c2 AIFCHEM-99957639512 [1,0,0,0,0,0|3,0,0]=4 28 B22R2.143459 CCCCCC(=O)Nc1ccc(c(c1)CC)c2cnoc2 AIFCHEM-96537258528 [1,0,0,0,0,0|3,0,0]=4 29 B22R2.143459 CCCCCC(=O)Nc1ccc(c(c1)OC)c2cc[nH]n2 AIFCHEM-97004523708 [1,0,0,0,0,0|2,0,1]=4 30 B22R2.143459 CCCCNC(=O)Cc1ccc(c(c1)OC)c2ccco2 AIFCHEM-82182147046 [1,0,0,0,0,0|3,0,0]=4 31 B22R2.143459 CCCOCC(=O)Nc1ccc(c(c1)OC)c2ccns2 AIFCHEM-47408095158 [1,0,0,0,0,0|3,0,0]=4 32 B22R2.143459 CCCOCC(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-47405746363 [1,0,0,0,0,0|3,0,0]=4 33 B22R2.143459 CCCOCC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-89104037593 [1,0,0,0,0,0|3,0,0]=4 34 B22R2.143459 CCCOCC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-89104658242 [1,0,0,0,0,0|3,0,0]=4 35 B22R2.143459 CCCOCC(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-47406374464 [1,0,0,0,0,0|3,0,0]=4 36 B22R2.143459 CCCOCC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-89130415826 [1,0,0,0,0,0|2,1,0]=4 37 B22R2.143459 COc1cc(ccc1c2cncs2)NC(=O)CCCC#N AIFCHEM-42558142471 [1,0,0,0,0,0|1,1,1]=4 38 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cc[nH]c2 AIFCHEM-95288105817 [1,0,0,0,0,0|2,0,1]=4 39 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2ccco2 AIFCHEM-98043495424 [1,0,0,0,0,0|2,0,0]=3 40 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2ccns2 AIFCHEM-45654302990 [1,0,0,0,0,0|3,0,0]=4 41 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2ccoc2 AIFCHEM-97637055697 [1,0,0,0,0,0|3,0,0]=4 42 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cn[nH]c2 AIFCHEM-97715478694 [1,0,0,0,0,0|3,0,0]=4 43 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cncs2 AIFCHEM-45656886162 [1,0,0,0,0,0|1,1,0]=3 44 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cnoc2 AIFCHEM-96537275418 [1,0,0,0,0,0|3,0,0]=4 45 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cscn2 AIFCHEM-91116993973 [1,0,0,0,0,0|3,0,0]=4 46 B22R2.371727 CCCCC(C)C(=O)Nc1ccc(c(c1)F)c2cncs2 AIFCHEM-45657119038 [1,0,0,0,0,0|2,1,0]=4 47 B24R2.634115 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cc(ns2)C AIFCHEM-45657076685 [0,1,0,0,0,0|3,0,0]=4 48 B24R2.634115 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnc(s2)C AIFCHEM-45654331288 [0,1,0,0,0,0|1,1,0]=3 49 B24R2.634115 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2csc(n2)C AIFCHEM-45654107742 [0,1,0,0,0,0|3,0,0]=4 50 B24R2.634115 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nc(ns2)C AIFCHEM-45654049864 [0,1,0,0,0,0|3,0,0]=4 51 B24R2.634115 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-95046482745 [0,1,0,0,0,0|2,0,0]=3 52 B24R2.634115 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nnc(s2)C AIFCHEM-45654129592 [0,1,0,0,0,0|2,1,0]=4 53 B24R2.634115 CCCCC(O)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-98877753208 [0,1,0,0,0,0|2,0,0]=3 54 B24R2.634115 COc1cc(ccc1c2cnc(s2)C)NC(=O)C(O)CCSC AIFCHEM-42745378536 [0,1,0,0,0,0|2,1,0]=4 55 B24R2.634115 COc1cc(ccc1c2nnc(o2)C)NC(=O)C(O)CCSC AIFCHEM-99529965284 [0,1,0,0,0,0|3,0,0]=4 56 B24R2.1036335 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccns2 AIFCHEM-38798884555 [0,1,0,0,0,0|3,0,0]=4 57 B24R2.1036335 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-38794801829 [0,1,0,0,0,0|1,1,0]=3 58 B24R2.1036335 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-38794928340 [0,1,0,0,0,0|3,0,0]=4 59 B24R2.1036335 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-88337326625 [0,1,0,0,0,0|3,0,0]=4 60 B24R2.1036335 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-38795246721 [0,1,0,0,0,0|3,0,0]=4 61 B24R2.1036335 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-88349566418 [0,1,0,0,0,0|2,1,0]=4 62 B24R2.3796789 CCCCC(CC)C(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-43958504068 [0,1,0,0,0,0|3,0,0]=4 63 B24R2.3796789 CCCCC(CC)C(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-81923484567 [0,1,0,0,0,0|3,0,0]=4 64 B24R2.3796789 CCCCC(CC)C(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-43958807969 [0,1,0,0,0,0|3,0,0]=4 65 B24R2.3796789 CCCCC(CC)C(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-79817465403 [0,1,0,0,0,0|2,1,0]=4 66 B24R2.6666897 CCCCC(C)(C)C(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-93369348233 [0,1,0,0,0,0|3,0,0]=4 67 B24R2.12453797 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncn2C AIFCHEM-91116864380 [0,1,0,0,0,0|2,0,0]=3 68 B24R2.12453797 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnoc2C AIFCHEM-91117092855 [0,1,0,0,0,0|3,0,0]=4 69 B24R2.12453797 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2scnc2C AIFCHEM-45653951683 [0,1,0,0,0,0|1,1,0]=3 70 B24R2.12453797 CCCCC(O)C(=O)Nc1ccc(c(c1)OC)c2cnoc2C AIFCHEM-82361772149 [0,1,0,0,0,0|3,0,0]=4 71 B24R2.12453797 COc1cc(ccc1c2scnc2C)NC(=O)C(O)CCSC AIFCHEM-42745143011 [0,1,0,0,0,0|2,1,0]=4 72 B24R3.7054 COc1cc(ccc1c2cc[nH]c2)NC(=O)C3CCCCC3 AIFCHEM-42227582618 [0,0,0,1,0,0|2,0,1]=4 73 B24R3.7054 COc1cc(ccc1c2ccns2)NC(=O)C3CCCCC3 AIFCHEM-42227525311 [0,0,0,1,0,0|3,0,0]=4 74 B24R3.7054 COc1cc(ccc1c2ccns2)NC(=O)C3CCCCO3 AIFCHEM-39086884367 [0,0,0,1,0,0|3,0,0]=4 75 B24R3.7054 COc1cc(ccc1c2cn[nH]c2)NC(=O)C3CCCCC3 AIFCHEM-42227522887 [0,0,0,1,0,0|3,0,0]=4 76 B24R3.7054 COc1cc(ccc1c2cn[nH]c2)NC(=O)C3CCCCO3 AIFCHEM-39086882543 [0,0,0,1,0,0|3,0,0]=4 77 B24R3.7054 COc1cc(ccc1c2cncs2)NC(=O)C3CCOCC3 AIFCHEM-46589649165 [0,0,0,1,0,0|2,1,0]=4 78 B24R3.7054 COc1cc(ccc1c2cncs2)NC(=O)C3CCSCC3 AIFCHEM-39907746155 [0,0,0,1,0,0|2,1,0]=4 79 B24R3.7054 COc1cc(ccc1c2cncs2)NC(=O)C3COCCO3 AIFCHEM-42957387031 [0,0,0,1,0,0|2,1,0]=4 80 B24R3.7054 COc1cc(ccc1c2cncs2)NC(=O)C3SCCCS3 AIFCHEM-44641556647 [0,0,0,1,0,0|2,1,0]=4 81 B24R3.7054 COc1cc(ccc1c2cncs2)NC(=O)[C@@H]3COCCO3 AIFCHEM-45364902105 [0,0,0,1,0,0|2,1,0]=4 82 B24R3.7054 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3COCCO3 AIFCHEM-44973126667 [0,0,0,1,0,0|2,1,0]=4 83 B24R3.7054 COc1cc(ccc1c2cnsc2)NC(=O)C3CCCCC3 AIFCHEM-42224624696 [0,0,0,1,0,0|3,0,0]=4 84 B24R3.7054 COc1cc(ccc1c2cnsc2)NC(=O)C3CCCCO3 AIFCHEM-39084055132 [0,0,0,1,0,0|3,0,0]=4 85 B24R3.7054 COc1cc(ccc1c2cscn2)NC(=O)C3CCCCC3 AIFCHEM-88169266774 [0,0,0,1,0,0|3,0,0]=4 86 B24R3.7054 COc1cc(ccc1c2cscn2)NC(=O)C3CCCCO3 AIFCHEM-90168475715 [0,0,0,1,0,0|3,0,0]=4 87 B24R3.7054 COc1cc(ccc1c2ncn[nH]2)NC(=O)C3CCCCC3 AIFCHEM-88169489903 [0,0,0,1,0,0|3,0,0]=4 88 B24R3.7054 COc1cc(ccc1c2ncn[nH]2)NC(=O)C3CCCCO3 AIFCHEM-90169345384 [0,0,0,1,0,0|3,0,0]=4 89 B24R3.7054 COc1cc(ccc1c2ncns2)NC(=O)C3CCCCC3 AIFCHEM-42224845277 [0,0,0,1,0,0|3,0,0]=4 90 B24R3.7054 COc1cc(ccc1c2ncns2)NC(=O)C3CCCCO3 AIFCHEM-39084439793 [0,0,0,1,0,0|3,0,0]=4 91 B24R3.7054 COc1cc(ccc1c2nncs2)NC(=O)C3CCCCC3 AIFCHEM-88186705627 [0,0,0,1,0,0|2,1,0]=4 92 B24R3.7054 COc1cc(ccc1c2nncs2)NC(=O)C3CCCCO3 AIFCHEM-90188758288 [0,0,0,1,0,0|2,1,0]=4 93 B24R3.1651188 CCN1CC(C1)C(=O)Nc2ccc(c(c2)OC)c3cnco3 AIFCHEM-99295226815 [0,0,0,1,0,0|2,0,0]=3 94 B24R3.1651188 COc1cc(ccc1c2cncs2)NC(=O)C3CC(C3)OC AIFCHEM-41083052093 [0,0,0,1,0,0|2,1,0]=4 95 B24R3.1651188 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3C[C@@H](C3)OC AIFCHEM-46493007537 [0,0,0,1,0,0|2,1,0]=4 96 B24R3.2058222 COc1cc(ccc1c2ccns2)NC(=O)C3CCC(C3)C AIFCHEM-46565884867 [0,0,0,1,0,0|3,0,0]=4 97 B24R3.2058222 COc1cc(ccc1c2cn[nH]c2)NC(=O)C3CCC(C3)C AIFCHEM-46565883783 [0,0,0,1,0,0|3,0,0]=4 98 B24R3.2058222 COc1cc(ccc1c2cncs2)NC(=O)C3CCC(=O)N3 AIFCHEM-44073094013 [0,0,0,1,0,0|1,1,1]=4 99 B24R3.2058222 COc1cc(ccc1c2cncs2)NC(=O)C3CCC(C3)C AIFCHEM-46560848121 [0,0,0,1,0,0|1,1,0]=3 100 B24R3.2058222 COc1cc(ccc1c2cncs2)NC(=O)[C@@H]3CCC(=O)N3 AIFCHEM-42566355849 [0,0,0,1,0,0|1,1,1]=4 101 B24R3.2058222 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CCC(=O)N3 AIFCHEM-44964244237 [0,0,0,1,0,0|1,1,1]=4 102 B24R3.2058222 COc1cc(ccc1c2cnsc2)NC(=O)C3CCC(C3)C AIFCHEM-46560974632 [0,0,0,1,0,0|3,0,0]=4 103 B24R3.2058222 COc1cc(ccc1c2cscn2)NC(=O)C3CCC(C3)C AIFCHEM-86949581679 [0,0,0,1,0,0|3,0,0]=4 104 B24R3.2058222 COc1cc(ccc1c2ncn[nH]2)NC(=O)C3CCC(C3)C AIFCHEM-86950007508 [0,0,0,1,0,0|3,0,0]=4 105 B24R3.2058222 COc1cc(ccc1c2ncns2)NC(=O)C3CCC(C3)C AIFCHEM-46561195213 [0,0,0,1,0,0|3,0,0]=4 106 B24R3.2058222 COc1cc(ccc1c2nncs2)NC(=O)C3CCC(C3)C AIFCHEM-86966909292 [0,0,0,1,0,0|2,1,0]=4 107 B24R3.69653802 COc1cc(ccc1c2ccns2)NC(=O)C3(CCCC3)C AIFCHEM-40571758119 [0,0,0,1,0,0|3,0,0]=4 108 B24R3.69653802 COc1cc(ccc1c2ccns2)NC(=O)C3(CCCC3)O AIFCHEM-42685034027 [0,0,0,1,0,0|3,0,0]=4 109 B24R3.69653802 COc1cc(ccc1c2cncs2)NC(=O)C3(CCCC3)C AIFCHEM-40568187913 [0,0,0,1,0,0|1,1,0]=3 110 B24R3.69653802 COc1cc(ccc1c2cncs2)NC(=O)C3(CCCC3)O AIFCHEM-42681026561 [0,0,0,1,0,0|1,1,0]=3 111 B24R3.69653802 COc1cc(ccc1c2cnsc2)NC(=O)C3(CCCC3)C AIFCHEM-40568314424 [0,0,0,1,0,0|3,0,0]=4 112 B24R3.69653802 COc1cc(ccc1c2cnsc2)NC(=O)C3(CCCC3)O AIFCHEM-42681153072 [0,0,0,1,0,0|3,0,0]=4 113 B24R3.69653802 COc1cc(ccc1c2cscn2)NC(=O)C3(CCCC3)C AIFCHEM-93381824358 [0,0,0,1,0,0|3,0,0]=4 114 B24R3.69653802 COc1cc(ccc1c2cscn2)NC(=O)C3(CCCC3)O AIFCHEM-80108387117 [0,0,0,1,0,0|3,0,0]=4 115 B24R3.69653802 COc1cc(ccc1c2ncns2)NC(=O)C3(CCCC3)C AIFCHEM-40568535005 [0,0,0,1,0,0|3,0,0]=4 116 B24R3.69653802 COc1cc(ccc1c2ncns2)NC(=O)C3(CCCC3)O AIFCHEM-42681373653 [0,0,0,1,0,0|3,0,0]=4 117 B24R3.69653802 COc1cc(ccc1c2nncs2)NC(=O)C3(CCCC3)C AIFCHEM-93401339431 [0,0,0,1,0,0|2,1,0]=4 118 B24R3.69653802 COc1cc(ccc1c2nncs2)NC(=O)C3(CCCC3)O AIFCHEM-80123255230 [0,0,0,1,0,0|2,1,0]=4 119 B24R2.634114 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)C2=COCCO2 AIFCHEM-91101636665 [0,0,0,0,0,1|2,0,1]=4 120 B24R2.634114 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccccn2 AIFCHEM-14297414574 [0,0,0,0,0,1|3,0,0]=4 121 B24R2.634114 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cccnc2 AIFCHEM-45657115014 [0,0,0,0,0,1|2,0,0]=3 122 B24R2.634114 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnccn2 AIFCHEM-91116793048 [0,0,0,0,0,1|2,0,0]=3 123 B24R2.634114 COc1cc(ccc1c2cnccn2)NC(=O)C(O)CCSC AIFCHEM-79706011024 [0,0,0,0,0,1|3,0,0]=4 124 B24R2.1280985 CCCCC(C)C(=O)NCc1ccc(c(c1)OC)c2ccoc2 AIFCHEM-45657076910 [0,0,0,0,0,1|3,0,0]=4 125 B24R2.1280985 CCCCC(C)C(=O)NCc1ccc(c(c1)OC)c2cn[nH]c2 AIFCHEM-95047192297 [0,0,0,0,0,1|3,0,0]=4 126 B24R2.1280985 CCCCC(O)C(=O)NCc1ccc(c(c1)OC)c2ccoc2 AIFCHEM-39110531414 [0,0,0,0,0,1|3,0,0]=4 127 B24R2.1280985 CCCCC(O)C(=O)NCc1ccc(c(c1)OC)c2cn[nH]c2 AIFCHEM-98878317180 [0,0,0,0,0,1|3,0,0]=4 128 B21R2.39120 C#CCCC(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5757834340 [2,0,0,0,0,0|0,0,2]=4 129 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)CC)c2ccco2 AIFCHEM-95434896596 [2,0,0,0,0,0|2,0,0]=4 130 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cc[nH]c2 AIFCHEM-95288081728 [2,0,0,0,0,0|1,0,1]=4 131 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ccco2 AIFCHEM-98043485995 [2,0,0,0,0,0|1,0,0]=3 132 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ccoc2 AIFCHEM-99700686315 [2,0,0,0,0,0|2,0,0]=4 133 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ccsc2 AIFCHEM-95095166427 [2,0,0,0,0,0|2,0,0]=4 134 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cn[nH]c2 AIFCHEM-97715467565 [2,0,0,0,0,0|2,0,0]=4 135 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cnoc2 AIFCHEM-97448035421 [2,0,0,0,0,0|2,0,0]=4 136 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-79420777078 [2,0,0,0,0,0|2,0,0]=4 137 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-79421109587 [2,0,0,0,0,0|2,0,0]=4 138 B21R2.39120 CCCCC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-79432381291 [2,0,0,0,0,0|1,1,0]=4 139 B21R2.39120 COCCC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-39156358381 [2,0,0,0,0,0|1,1,0]=4 140 B21R2.39120 COc1cc(ccc1c2cncs2)NC(=O)CCSC AIFCHEM-39220892095 [2,0,0,0,0,0|1,1,0]=4 141 B21R2.41976 CCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5718279575 [2,0,0,0,0,0|1,0,0]=3 142 B21R2.41976 CC[C@@H](C)C(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5758159386 [2,0,0,0,0,0|1,0,0]=3 143 B21R2.41976 CC[C@@H](C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-45158461535 [2,0,0,0,0,0|1,1,0]=4 144 B21R2.41976 CC[C@H](C)C(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-5692031475 [2,0,0,0,0,0|1,0,0]=3 145 B21R2.41976 CC[C@H](C)C(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-43178653358 [2,0,0,0,0,0|1,1,0]=4 146 B21R2.46582 CCCC(C)C(=O)Nc1ccc(c(c1)C)c2ccco2 AIFCHEM-95434902917 [2,0,0,0,0,0|2,0,0]=4 147 B21R2.46582 CCCC(C)C(=O)Nc1ccc(c(c1)C)c2cncs2 AIFCHEM-40146072772 [2,0,0,0,0,0|1,1,0]=4 148 B21R2.46582 CCCC(O)C(=O)Nc1ccc(c(c1)C)c2ccco2 AIFCHEM-95434922113 [2,0,0,0,0,0|2,0,0]=4 149 B21R2.106518 CCCCCC(=O)Nc1ccc(c(c1)C)c2cc[nH]c2 AIFCHEM-95288053385 [2,0,0,0,0,0|1,0,1]=4 150 B21R2.106518 CCCCCC(=O)Nc1ccc(c(c1)C)c2cn[nH]c2 AIFCHEM-99957636850 [2,0,0,0,0,0|2,0,0]=4 151 B21R2.106518 CCCCCC(=O)Nc1ccc(c(c1)C)c2cnoc2 AIFCHEM-97448025318 [2,0,0,0,0,0|2,0,0]=4 152 B21R2.13688 CCCCC(C)C(=O)Nc1ccc(cc1)c2cnco2 AIFCHEM-45654203035 [2,0,0,0,0,0|1,0,0]=3 153 B21R2.13688 CCCCC(O)C(=O)Nc1ccc(cc1)c2ccco2 AIFCHEM-95434921363 [2,0,0,0,0,0|2,0,0]=4 154 B21R2.13688 CSCCC(O)C(=O)Nc1ccc(cc1)c2cnco2 AIFCHEM-42745300543 [2,0,0,0,0,0|2,0,0]=4 155 B23R2.66076 COc1cc(ccc1c2cnco2)NC(=O)[C@@H](O)CC(C)C AIFCHEM-94591602309 [1,1,0,0,0,0|1,0,0]=3 156 B23R2.78267 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnc(s2)C AIFCHEM-40145157818 [1,1,0,0,0,0|1,1,0]=4 157 B23R2.78267 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-99009828228 [1,1,0,0,0,0|2,0,0]=4 158 B23R2.78267 CCCC(O)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-99673732002 [1,1,0,0,0,0|2,0,0]=4 159 B23R2.3482313 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncn2C AIFCHEM-84953424946 [1,1,0,0,0,0|2,0,0]=4 160 B23R2.3482313 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2scnc2C AIFCHEM-40144922293 [1,1,0,0,0,0|1,1,0]=4 161 B23R2.66078 COc1cc(ccc1c2ccns2)NC(=O)CCCC(C)C AIFCHEM-45527077685 [1,1,0,0,0,0|2,0,0]=4 162 B23R2.66078 COc1cc(ccc1c2cnco2)NC(=O)CCSC(=O)C AIFCHEM-5741067581 [1,1,0,0,0,0|1,0,1]=4 163 B23R2.66078 COc1cc(ccc1c2cncs2)NC(=O)CCCC(=O)C AIFCHEM-37496476091 [1,1,0,0,0,0|0,1,1]=4 164 B23R2.66078 COc1cc(ccc1c2cncs2)NC(=O)CCCC(C)C AIFCHEM-45523898319 [1,1,0,0,0,0|0,1,0]=3 165 B23R2.66078 COc1cc(ccc1c2cncs2)NC(=O)COCC(C)C AIFCHEM-38692316775 [1,1,0,0,0,0|1,1,0]=4 166 B23R2.66078 COc1cc(ccc1c2cnsc2)NC(=O)CCCC(C)C AIFCHEM-45524078830 [1,1,0,0,0,0|2,0,0]=4 167 B23R2.66078 COc1cc(ccc1c2ncns2)NC(=O)CCCC(C)C AIFCHEM-45524299411 [1,1,0,0,0,0|2,0,0]=4 168 B23R2.66079 CCC(C)CCC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-90776444524 [1,1,0,0,0,0|2,0,0]=4 169 B23R2.66079 CCC(C)CCC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-90776834073 [1,1,0,0,0,0|2,0,0]=4 170 B23R2.66079 CCC(C)CCC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-90794905637 [1,1,0,0,0,0|1,1,0]=4 171 B23R2.102218 C#CCCCCC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-38526055014 [1,1,0,0,0,0|0,1,1]=4 172 B23R2.102218 CCCCCCC(=O)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-94521985223 [1,1,0,0,0,0|0,0,0]=2 173 B23R2.102218 CCCCCCC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-85585511213 [1,1,0,0,0,0|2,0,0]=4 174 B23R2.102218 CCCCCCC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-85585934622 [1,1,0,0,0,0|2,0,0]=4 175 B23R2.102218 CCCCCCC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-85601322746 [1,1,0,0,0,0|1,1,0]=4 176 B23R2.102218 CCCCOCC(=O)Nc1ccc(c(c1)OC)c2ccns2 AIFCHEM-42130001331 [1,1,0,0,0,0|2,0,0]=4 177 B23R2.102218 CCCCOCC(=O)Nc1ccc(c(c1)OC)c2cnsc2 AIFCHEM-42127745516 [1,1,0,0,0,0|2,0,0]=4 178 B23R2.102218 CCCCOCC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-81374005710 [1,1,0,0,0,0|2,0,0]=4 179 B23R2.102218 CCCCOCC(=O)Nc1ccc(c(c1)OC)c2ncn[nH]2 AIFCHEM-81374211439 [1,1,0,0,0,0|2,0,0]=4 180 B23R2.102218 CCCCOCC(=O)Nc1ccc(c(c1)OC)c2ncns2 AIFCHEM-42127966097 [1,1,0,0,0,0|2,0,0]=4 181 B23R2.102218 CCCCOCC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-81389106223 [1,1,0,0,0,0|1,1,0]=4 182 B23R2.102218 COc1cc(ccc1c2ccns2)NC(=O)CCCCCO AIFCHEM-46700334586 [1,1,0,0,0,0|2,0,0]=4 183 B23R2.102218 COc1cc(ccc1c2cncs2)NC(=O)CCCCCO AIFCHEM-46697544300 [1,1,0,0,0,0|0,1,0]=3 184 B23R2.102218 COc1cc(ccc1c2cncs2)NC(=O)CCOCCO AIFCHEM-45395366533 [1,1,0,0,0,0|1,1,0]=4 185 B23R2.102218 COc1cc(ccc1c2cnsc2)NC(=O)CCCCCO AIFCHEM-46697670811 [1,1,0,0,0,0|2,0,0]=4 186 B23R2.102218 COc1cc(ccc1c2cscn2)NC(=O)CCCCCO AIFCHEM-85680372834 [1,1,0,0,0,0|2,0,0]=4 187 B23R2.102218 COc1cc(ccc1c2ncns2)NC(=O)CCCCCO AIFCHEM-46697891392 [1,1,0,0,0,0|2,0,0]=4 188 B23R2.102218 COc1cc(ccc1c2nncs2)NC(=O)CCCCCO AIFCHEM-85701191707 [1,1,0,0,0,0|1,1,0]=4 189 B23R2.178647 CCCCCC(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-97004401257 [1,1,0,0,0,0|1,0,0]=3 190 B23R2.178647 CCCOCC(=O)Nc1ccc(c(c1)OC)c2cnc([nH]2)C AIFCHEM-47408412315 [1,1,0,0,0,0|2,0,0]=4 191 B23R2.178647 CCCOCC(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-97623301898 [1,1,0,0,0,0|2,0,0]=4 192 B23R2.640694 CCCC(C)CC(=O)Nc1ccc(c(c1)OC)c2cscn2 AIFCHEM-80915935853 [1,1,0,0,0,0|2,0,0]=4 193 B23R2.640694 CCCC(C)CC(=O)Nc1ccc(c(c1)OC)c2nncs2 AIFCHEM-80934195486 [1,1,0,0,0,0|1,1,0]=4 194 B23R2.640694 CCSC(C)CC(=O)Nc1ccc(c(c1)OC)c2cncs2 AIFCHEM-40365452051 [1,1,0,0,0,0|1,1,0]=4 195 B23R2.790361 CCCCCC(CC)Nc1ccc(c(c1)OC)c2cnco2 AIFCHEM-94563175664 [1,1,0,0,0,0|1,0,1]=4 196 B23R2.5129781 CCCCCC(=O)Nc1ccc(c(c1)CC)c2cncn2C AIFCHEM-95020977845 [1,1,0,0,0,0|2,0,0]=4 197 B23R2.5129781 CCCOCC(=O)Nc1ccc(c(c1)OC)c2cncn2C AIFCHEM-89118838288 [1,1,0,0,0,0|2,0,0]=4 198 B23R2.5129781 CCCOCC(=O)Nc1ccc(c(c1)OC)c2scnc2C AIFCHEM-47405704386 [1,1,0,0,0,0|1,1,0]=4 199 B23R2.496453 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2ccc(o2)C AIFCHEM-14296886597 [1,1,0,0,0,0|2,0,0]=4 200 B23R2.496453 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cnc(s2)C AIFCHEM-14296314587 [1,1,0,0,0,0|1,1,0]=4 201 B23R2.496453 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2nnc(o2)C AIFCHEM-95046879898 [1,1,0,0,0,0|2,0,0]=4 202 B23R2.780702 CCCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cncs2 AIFCHEM-10925117271 [1,1,0,0,0,0|1,1,0]=4 203 B23R2.9150047 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cncn2C AIFCHEM-95020994715 [1,1,0,0,0,0|2,0,0]=4 204 B23R2.9150047 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2scnc2C AIFCHEM-14296271740 [1,1,0,0,0,0|1,1,0]=4 205 B25R2.781982 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnc(cn2)C AIFCHEM-45657131166 [0,1,0,0,0,1|2,0,0]=4 206 B25R2.782003 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cc(ncn2)C AIFCHEM-45657112737 [0,1,0,0,0,1|2,0,0]=4 207 B25R2.782003 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccnc(c2)C AIFCHEM-45657068161 [0,1,0,0,0,1|2,0,0]=4 208 B25R2.782003 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccnc(n2)C AIFCHEM-45653946951 [0,1,0,0,0,1|2,0,0]=4 209 B25R2.782003 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncc(c2)C AIFCHEM-45657132004 [0,1,0,0,0,1|2,0,0]=4 210 B25R2.782003 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncc(n2)C AIFCHEM-91117025515 [0,1,0,0,0,1|2,0,0]=4 211 B25R2.782003 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnnc(c2)C AIFCHEM-45656902098 [0,1,0,0,0,1|2,0,0]=4 212 B25R2.1318073 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cccnc2 AIFCHEM-38798989294 [0,1,0,0,0,1|2,0,0]=4 213 B25R2.1318073 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnccn2 AIFCHEM-88345675368 [0,1,0,0,0,1|2,0,0]=4 214 B25R2.4425393 CCCCC(CC)C(=O)Nc1ccc(c(c1)OC)c2cnccn2 AIFCHEM-81934873370 [0,1,0,0,0,1|2,0,0]=4 215 B25R2.16860191 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnccc2F AIFCHEM-45654379512 [0,1,0,0,0,1|2,0,0]=4 216 B25R2.16860191 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nccnc2C AIFCHEM-91101523168 [0,1,0,0,0,1|2,0,0]=4 217 B25R2.1618388 CCCCC(C)C(=O)NCc1ccc(c(c1)OC)c2ccc(o2)C AIFCHEM-45654010016 [0,1,0,0,0,1|2,0,0]=4 218 B25R2.1618388 CCCCC(O)C(=O)NCc1ccc(c(c1)OC)c2ccc(o2)C AIFCHEM-39108260760 [0,1,0,0,0,1|2,0,0]=4 219 B25R2.1318074 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-99964884768 [0,2,0,0,0,0|2,0,0]=4 220 B25R2.1318074 CCCCCC(O)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-96780191568 [0,2,0,0,0,0|2,0,0]=4 221 B25R2.4425394 CCCCC(CC)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-98042382984 [0,2,0,0,0,0|2,0,0]=4 222 B25R2.8475353 CCCCC(C)(C)C(=O)Nc1ccc(c(c1)OC)c2nnc(o2)C AIFCHEM-99545052752 [0,2,0,0,0,0|2,0,0]=4 223 B25R2.16860192 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2ccc(o2)C#N AIFCHEM-73632633188 [0,2,0,0,0,0|2,0,0]=4 224 B25R2.16860192 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnc(s2)CO AIFCHEM-91116448052 [0,2,0,0,0,0|1,1,0]=4 225 B25R2.16860192 CCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnc(s2)OC AIFCHEM-95046838060 [0,2,0,0,0,0|1,1,0]=4 226 B25R2.16860192 CCCCC(O)C(=O)Nc1ccc(c(c1)OC)c2cnc(s2)OC AIFCHEM-98878075923 [0,2,0,0,0,0|1,1,0]=4 227 B25R2.24711477 CCCCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cncn2C AIFCHEM-88345701740 [0,2,0,0,0,0|2,0,0]=4 228 B25R2.40561256 CCCCC(CC)C(=O)Nc1ccc(c(c1)OC)c2cncn2C AIFCHEM-79811465465 [0,2,0,0,0,0|2,0,0]=4 229 B23R3.5529 COc1cc(ccc1c2cnco2)NC(=O)C3CCCS3 AIFCHEM-5772437487 [1,0,0,1,0,0|1,0,0]=3 230 B23R3.5529 COc1cc(ccc1c2cnco2)NC(=O)[C@@H]3CCOC3 AIFCHEM-5692133178 [1,0,0,1,0,0|2,0,0]=4 231 B23R3.5529 COc1cc(ccc1c2cnco2)NC(=O)[C@H]3CCOC3 AIFCHEM-5767246668 [1,0,0,1,0,0|2,0,0]=4 232 B23R3.5529 COc1cc(ccc1c2cncs2)NC(=O)C3CCCS3 AIFCHEM-46218371075 [1,0,0,1,0,0|1,1,0]=4 233 B23R3.5529 COc1cc(ccc1c2cncs2)NC(=O)[C@@H]3CCCO3 AIFCHEM-45446022853 [1,0,0,1,0,0|1,1,0]=4 234 B23R3.5529 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CCCO3 AIFCHEM-40984992579 [1,0,0,1,0,0|1,1,0]=4 235 B23R3.2000075 COc1cc(ccc1c2cnco2)NC(=O)C3CC(C3)F AIFCHEM-5767402769 [1,0,0,1,0,0|2,0,0]=4 236 B23R3.4399591 COc1cc(ccc1c2cncs2)NC(=O)C3(CCC3)C AIFCHEM-43480400931 [1,0,0,1,0,0|1,1,0]=4 237 B23R3.4399591 COc1cc(ccc1c2cncs2)NC(=O)C3(CCC3)O AIFCHEM-41014056711 [1,0,0,1,0,0|1,1,0]=4 238 B23R3.2000073 COc1cc(ccc1c2ccns2)NC(=O)CC3CCC3 AIFCHEM-44801684739 [1,0,0,1,0,0|2,0,0]=4 239 B23R3.2000073 COc1cc(ccc1c2cn[nH]c2)NC(=O)CC3CCC3 AIFCHEM-44801683655 [1,0,0,1,0,0|2,0,0]=4 240 B23R3.2000073 COc1cc(ccc1c2cncs2)NC(=O)CC3CCC3 AIFCHEM-44798497133 [1,0,0,1,0,0|0,1,0]=3 241 B23R3.2000073 COc1cc(ccc1c2cncs2)NC(=O)CC3COC3 AIFCHEM-45510757777 [1,0,0,1,0,0|1,1,0]=4 242 B23R3.2000073 COc1cc(ccc1c2cnsc2)NC(=O)CC3CCC3 AIFCHEM-44798829904 [1,0,0,1,0,0|2,0,0]=4 243 B23R3.2000073 COc1cc(ccc1c2cscn2)NC(=O)CC3CCC3 AIFCHEM-90482502342 [1,0,0,1,0,0|2,0,0]=4 244 B23R3.2000073 COc1cc(ccc1c2ncn[nH]2)NC(=O)CC3CCC3 AIFCHEM-90482841031 [1,0,0,1,0,0|2,0,0]=4 245 B23R3.2000073 COc1cc(ccc1c2ncns2)NC(=O)CC3CCC3 AIFCHEM-44799462085 [1,0,0,1,0,0|2,0,0]=4 246 B23R3.2000073 COc1cc(ccc1c2nncs2)NC(=O)CC3CCC3 AIFCHEM-90501871335 [1,0,0,1,0,0|1,1,0]=4 247 B23R3.2000076 COc1cc(ccc1c2ccns2)NC(=O)CCC3CC3 AIFCHEM-43727805517 [1,0,0,1,0,0|2,0,0]=4 248 B23R3.2000076 COc1cc(ccc1c2cn[nH]c2)NC(=O)CCC3CC3 AIFCHEM-43727804433 [1,0,0,1,0,0|2,0,0]=4 249 B23R3.2000076 COc1cc(ccc1c2cncs2)NC(=O)CCC3CC3 AIFCHEM-43724798951 [1,0,0,1,0,0|0,1,0]=3 250 B23R3.2000076 COc1cc(ccc1c2cnsc2)NC(=O)CCC3CC3 AIFCHEM-43724925462 [1,0,0,1,0,0|2,0,0]=4 251 B23R3.2000076 COc1cc(ccc1c2cscn2)NC(=O)CCC3CC3 AIFCHEM-85281050098 [1,0,0,1,0,0|2,0,0]=4 252 B23R3.2000076 COc1cc(ccc1c2ncn[nH]2)NC(=O)CCC3CC3 AIFCHEM-85281366407 [1,0,0,1,0,0|2,0,0]=4 253 B23R3.2000076 COc1cc(ccc1c2ncns2)NC(=O)CCC3CC3 AIFCHEM-43725146043 [1,0,0,1,0,0|2,0,0]=4 254 B23R3.2000076 COc1cc(ccc1c2nncs2)NC(=O)CCC3CC3 AIFCHEM-85299151931 [1,0,0,1,0,0|1,1,0]=4 255 B23R3.4399143 COc1cc(ccc1c2cnco2)NC3CCCCCC3 AIFCHEM-94529609109 [1,0,0,1,0,0|1,0,1]=4 256 B23R3.112152 Cc1cc(ccc1c2ccco2)NC(=O)C3CCC(C3)C AIFCHEM-95434903561 [1,0,0,1,0,0|2,0,0]=4 257 B23R3.112152 Cc1cc(ccc1c2cncs2)NC(=O)C3CCC(C3)C AIFCHEM-14005462567 [1,0,0,1,0,0|1,1,0]=4 258 B23R3.7571148 Cc1cc(ccc1c2ccco2)NC(=O)[C@H](O)CC3CC3 AIFCHEM-98043494523 [1,0,0,1,0,0|2,0,0]=4 259 B23R3.71031101 Cc1cc(ccc1c2ccco2)NC(=O)C3(CCCC3)C AIFCHEM-98043491758 [1,0,0,1,0,0|2,0,0]=4 260 B23R3.71031101 Cc1cc(ccc1c2ccco2)NC(=O)C3(CCCC3)O AIFCHEM-95434907844 [1,0,0,1,0,0|2,0,0]=4 261 B23R3.71031101 Cc1cc(ccc1c2cncs2)NC(=O)C3(CCCC3)C AIFCHEM-40571634006 [1,0,0,1,0,0|1,1,0]=4 262 B23R3.71031101 Cc1cc(ccc1c2cncs2)NC(=O)C3(CCCC3)O AIFCHEM-42684788114 [1,0,0,1,0,0|1,1,0]=4 263 B25R3.8508 COc1cc(ccc1c2ccncn2)NC(=O)C3CCCCC3 AIFCHEM-42227873316 [0,0,0,1,0,1|2,0,0]=4 264 B25R3.8508 COc1cc(ccc1c2ccncn2)NC(=O)C3CCCCO3 AIFCHEM-39087092272 [0,0,0,1,0,1|2,0,0]=4 265 B25R3.8508 COc1cc(ccc1c2cnccn2)NC(=O)C3CCCCC3 AIFCHEM-88179215037 [0,0,0,1,0,1|2,0,0]=4 266 B25R3.8508 COc1cc(ccc1c2cnccn2)NC(=O)C3CCCCO3 AIFCHEM-90180870638 [0,0,0,1,0,1|2,0,0]=4 267 B25R3.2122733 COc1cc(ccc1c2cccnc2)NC(=O)C3CCC(C3)C AIFCHEM-46565989606 [0,0,0,1,0,1|2,0,0]=4 268 B25R3.2122733 COc1cc(ccc1c2ccncn2)NC(=O)C3CCC(C3)C AIFCHEM-46566056872 [0,0,0,1,0,1|2,0,0]=4 269 B25R3.2122733 COc1cc(ccc1c2cnccn2)NC(=O)C3CCC(C3)C AIFCHEM-86962472362 [0,0,0,1,0,1|2,0,0]=4 270 B25R3.77197657 COc1cc(ccc1c2cccnc2)NC(=O)C3(CCCC3)C AIFCHEM-40571862858 [0,0,0,1,0,1|2,0,0]=4 271 B25R3.77197657 COc1cc(ccc1c2cccnc2)NC(=O)C3(CCCC3)O AIFCHEM-42685245046 [0,0,0,1,0,1|2,0,0]=4 272 B25R3.77197657 COc1cc(ccc1c2ccncn2)NC(=O)C3(CCCC3)C AIFCHEM-40571982404 [0,0,0,1,0,1|2,0,0]=4 273 B25R3.77197657 COc1cc(ccc1c2ccncn2)NC(=O)C3(CCCC3)O AIFCHEM-42685377832 [0,0,0,1,0,1|2,0,0]=4 274 B25R3.77197657 COc1cc(ccc1c2cnccn2)NC(=O)C3(CCCC3)C AIFCHEM-93395567861 [0,0,0,1,0,1|2,0,0]=4 275 B25R3.77197657 COc1cc(ccc1c2cnccn2)NC(=O)C3(CCCC3)O AIFCHEM-80118756060 [0,0,0,1,0,1|2,0,0]=4 276 B25R3.8450 COc1cc(ccc1c2cncs2)NC(=O)CC3CCCCO3 AIFCHEM-42659773831 [0,0,0,1,0,1|1,1,0]=4 277 B25R3.8451 COc1cc(ccc1c2cnco2)NC(=O)C3CCN(CC3)C AIFCHEM-94537294741 [0,1,0,1,0,0|2,0,0]=4 278 B25R3.8451 COc1cc(ccc1c2cncs2)NC(=O)C3CCC(CC3)O AIFCHEM-42407833826 [0,1,0,1,0,0|1,1,0]=4 279 B25R3.8451 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CC[C@@H](CC3)C AIFCHEM-45603028791 [0,1,0,1,0,0|1,1,0]=4 280 B25R3.8451 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CC[C@@H](CC3)O AIFCHEM-38262377865 [0,1,0,1,0,0|1,1,0]=4 281 B25R3.8451 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CC[C@H](CC3)O AIFCHEM-44480808933 [0,1,0,1,0,0|1,1,0]=4 282 B25R3.8692 COc1cc(ccc1c2nnc(o2)C)NC(=O)C3CCCCC3 AIFCHEM-98027366334 [0,1,0,1,0,0|2,0,0]=4 283 B25R3.8692 COc1cc(ccc1c2nnc(o2)C)NC(=O)C3CCCCO3 AIFCHEM-100200075900 [0,1,0,1,0,0|2,0,0]=4 284 B25R3.2126117 COc1cc(ccc1c2cnc(s2)C)NC(=O)C3CCC(C3)C AIFCHEM-46561191380 [0,1,0,1,0,0|1,1,0]=4 285 B25R3.2126117 COc1cc(ccc1c2nnc(o2)C)NC(=O)C3CCC(C3)C AIFCHEM-94884057828 [0,1,0,1,0,0|2,0,0]=4 286 B25R3.7186425 COc1cc(ccc1c2nnc(o2)C)NC(=O)[C@H](O)CC3CC3 AIFCHEM-100112046860 [0,1,0,1,0,0|2,0,0]=4 287 B25R3.77431750 COc1cc(ccc1c2cnc([nH]2)C)NC(=O)C3(CCCC3)C AIFCHEM-40571944416 [0,1,0,1,0,0|2,0,0]=4 288 B25R3.77431750 COc1cc(ccc1c2cnc([nH]2)C)NC(=O)C3(CCCC3)O AIFCHEM-42685339764 [0,1,0,1,0,0|2,0,0]=4 289 B25R3.77431750 COc1cc(ccc1c2cnc(s2)C)NC(=O)C3(CCCC3)C AIFCHEM-40568531172 [0,1,0,1,0,0|1,1,0]=4 290 B25R3.77431750 COc1cc(ccc1c2cnc(s2)C)NC(=O)C3(CCCC3)O AIFCHEM-42681369820 [0,1,0,1,0,0|1,1,0]=4 291 B25R3.77431750 COc1cc(ccc1c2nnc(o2)C)NC(=O)C3(CCCC3)C AIFCHEM-94683456428 [0,1,0,1,0,0|2,0,0]=4 292 B25R3.77431750 COc1cc(ccc1c2nnc(o2)C)NC(=O)C3(CCCC3)O AIFCHEM-97475334328 [0,1,0,1,0,0|2,0,0]=4 293 B25R3.2121906 COc1cc(ccc1c2cncs2)NC(=O)C3CCCC(=O)N3 AIFCHEM-45241920313 [0,1,0,1,0,0|0,1,1]=4 294 B25R3.2121906 COc1cc(ccc1c2cncs2)NC(=O)C3CCCC(C3)C AIFCHEM-41484394247 [0,1,0,1,0,0|1,1,0]=4 295 B25R3.2121906 COc1cc(ccc1c2cncs2)NC(=O)C3CCCC(C3)O AIFCHEM-43368635355 [0,1,0,1,0,0|1,1,0]=4 296 B25R3.2121906 COc1cc(ccc1c2cncs2)NC(=O)C3CCCN(C3)C AIFCHEM-39318237049 [0,1,0,1,0,0|1,1,0]=4 297 B25R3.2121906 COc1cc(ccc1c2cncs2)NC(=O)[C@@H]3CCCC(=O)N3 AIFCHEM-45746299281 [0,1,0,1,0,0|0,1,1]=4 298 B25R3.2121906 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CCCC(=O)N3 AIFCHEM-43140448949 [0,1,0,1,0,0|0,1,1]=4 299 B25R3.2121906 COc1cc(ccc1c2cncs2)NC(=O)[C@H]3CCC[C@H](C3)O AIFCHEM-42005213443 [0,1,0,1,0,0|1,1,0]=4 300 B25R3.2141227 CCN1CCC(C1)C(=O)Nc2ccc(c(c2)OC)c3cnco3 AIFCHEM-99295267603 [0,1,0,1,0,0|1,0,0]=3 301 B25R3.2141227 CCN1CC[C@@H](C1)C(=O)Nc2ccc(c(c2)OC)c3cnco3 AIFCHEM-99295113866 [0,1,0,1,0,0|1,0,0]=3 302 B25R3.2141227 CCN1CC[C@H](C1)C(=O)Nc2ccc(c(c2)OC)c3cnco3 AIFCHEM-99295392886 [0,1,0,1,0,0|1,0,0]=3 303 B25R3.3289665 COCC1CC(C1)C(=O)Nc2ccc(c(c2)OC)c3cncs3 AIFCHEM-45042014995 [0,1,0,1,0,0|1,1,0]=4 304 B25R3.7133225 COc1cc(ccc1c2cncs2)NC(=O)C3CCCCCC3 AIFCHEM-39255457829 [0,1,0,1,0,0|1,1,0]=4 305 B25R3.77154877 COc1cc(ccc1c2cncs2)NC(=O)C3(CCCCC3)C AIFCHEM-43283389329 [0,1,0,1,0,0|1,1,0]=4 306 B25R3.77154877 COc1cc(ccc1c2cncs2)NC(=O)C3(CCCCC3)O AIFCHEM-44636990177 [0,1,0,1,0,0|1,1,0]=4 307 B25R3.77154877 COc1cc(ccc1c2cncs2)NC(=O)C3(CCOCC3)C AIFCHEM-42160116285 [0,1,0,1,0,0|1,1,0]=4 308 B25R3.77154877 COc1cc(ccc1c2cncs2)NC(=O)C3(CCOCC3)O AIFCHEM-45098628403 [0,1,0,1,0,0|1,1,0]=4 309 B25R3.77154883 COc1cc(ccc1c2cncs2)NC(=O)C3(CCCC3)C#N AIFCHEM-47043032593 [0,1,0,1,0,0|0,1,1]=4 310 B25R3.8426 COc1cc(ccc1c2cncn2C)NC(=O)C3CCCCC3 AIFCHEM-88179264489 [0,1,0,1,0,0|2,0,0]=4 311 B25R3.8426 COc1cc(ccc1c2cncn2C)NC(=O)C3CCCCO3 AIFCHEM-90180897010 [0,1,0,1,0,0|2,0,0]=4 312 B25R3.8426 COc1cc(ccc1c2scnc2C)NC(=O)C3CCCCC3 AIFCHEM-42224605919 [0,1,0,1,0,0|1,1,0]=4 313 B25R3.8426 COc1cc(ccc1c2scnc2C)NC(=O)C3CCCCO3 AIFCHEM-39084025395 [0,1,0,1,0,0|1,1,0]=4 314 B25R3.2121610 COc1cc(ccc1c2cncn2C)NC(=O)C3CCC(C3)C AIFCHEM-86962498734 [0,1,0,1,0,0|2,0,0]=4 315 B25R3.2121610 COc1cc(ccc1c2scnc2C)NC(=O)C3CCC(C3)C AIFCHEM-46560955855 [0,1,0,1,0,0|1,1,0]=4 316 B25R3.77152955 COc1cc(ccc1c2cncn2C)NC(=O)C3(CCCC3)C AIFCHEM-93395645633 [0,1,0,1,0,0|2,0,0]=4 317 B25R3.77152955 COc1cc(ccc1c2cncn2C)NC(=O)C3(CCCC3)O AIFCHEM-80118782432 [0,1,0,1,0,0|2,0,0]=4 318 B25R3.77152955 COc1cc(ccc1c2scnc2C)NC(=O)C3(CCCC3)C AIFCHEM-40568295647 [0,1,0,1,0,0|1,1,0]=4 319 B25R3.77152955 COc1cc(ccc1c2scnc2C)NC(=O)C3(CCCC3)O AIFCHEM-42681134295 [0,1,0,1,0,0|1,1,0]=4 320 B25R4.9624102 COc1cc(ccc1c2cncs2)NC(=O)C3C4C3CCC4 AIFCHEM-39866804703 [0,0,0,2,0,0|1,1,0]=4 321 B25R4.118340946 COc1cc(ccc1c2cncs2)NC(=O)C3CC34CCC4 AIFCHEM-43327288167 [0,0,0,2,0,0|1,1,0]=4 322 B21R2.2261 CCCCNC(=O)c1ccc(c(c1)OC)c2cncs2 AIFCHEM-37196045540 [1,0,0,0,1,0|1,1,0]=4 323 B23R2.78266 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cccnc2 AIFCHEM-40146301624 [1,0,0,0,0,1|2,0,0]=4 324 B23R2.78266 CCCC(C)C(=O)Nc1ccc(c(c1)OC)c2cnccn2 AIFCHEM-84953350794 [1,0,0,0,0,1|2,0,0]=4 325 B23R2.178646 CCCCCC(=O)Nc1ccc(c(c1)CC)c2cccnc2 AIFCHEM-98585191485 [1,0,0,0,0,1|2,0,0]=4 326 B23R2.178646 CCCCCC(=O)Nc1ccc(c(c1)CC)c2ccncc2 AIFCHEM-99307916277 [1,0,0,0,0,1|2,0,0]=4 327 B23R2.178646 CCCCCC(=O)Nc1ccc(c(c1)CC)c2cncnc2 AIFCHEM-100245700057 [1,0,0,0,0,1|2,0,0]=4 328 B23R2.178646 CCCOCC(=O)Nc1ccc(c(c1)OC)c2ccncn2 AIFCHEM-47408471043 [1,0,0,0,0,1|2,0,0]=4 329 B23R2.178646 CCCOCC(=O)Nc1ccc(c(c1)OC)c2cnccn2 AIFCHEM-89118811916 [1,0,0,0,0,1|2,0,0]=4 330 B23R2.496448 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cccnc2 AIFCHEM-95742437308 [1,0,0,0,0,1|2,0,0]=4 331 B23R2.496448 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2ccncc2 AIFCHEM-96892807782 [1,0,0,0,0,1|2,0,0]=4 332 B23R2.496448 CCCCC(C)C(=O)Nc1ccc(c(c1)C)c2cncnc2 AIFCHEM-95126641980 [1,0,0,0,0,1|2,0,0]=4 333 B23R2.973347 CCCCC(C)C(=O)NCc1ccc(c(c1)C)c2ccco2 AIFCHEM-82181908869 [1,0,0,0,0,1|2,0,0]=4 334 B23R2.496215 CCCCC(C)C(=O)Nc1cc(cc(c1)c2cnco2)OC AIFCHEM-45654386899 [0,0,0,0,1,1|1,0,0]=3 335 B23R2.496215 CCCCC(C)C(=O)Nc1cc(cc(c1)c2cncs2)OC AIFCHEM-45657068791 [0,0,0,0,1,1|1,1,0]=4 336 B23R2.496215 COc1cc(cc(c1)c2cnco2)NC(=O)C(O)CCSC AIFCHEM-42745418467 [0,0,0,0,1,1|2,0,0]=4 337 B25R2.1618387 CCCCC(C)C(=O)NCc1ccc(c(c1)OC)c2cccnc2 AIFCHEM-45657019614 [0,0,0,0,0,2|2,0,0]=4 338 B25R2.1618387 CCCCC(C)C(=O)NCc1ccc(c(c1)OC)c2cncnc2 AIFCHEM-73632625163 [0,0,0,0,0,2|2,0,0]=4 339 B25R2.1618387 CCCCC(O)C(=O)NCc1ccc(c(c1)OC)c2cccnc2 AIFCHEM-39110436318 [0,0,0,0,0,2|2,0,0]=4