0 B10R1.66 CC(=O)NCc1ccc[nH]1 AIFCHEM-94605343937 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.66 CC(=O)NCc1cccs1 AIFCHEM-6123944273 [0,0,0,0,0,0|2,1,1]=4 2 B10R1.66 CC(C)CNc1ccsc1 AIFCHEM-94568866788 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.66 CC(C)CNc1cncs1 AIFCHEM-94572976233 [0,0,0,0,0,0|3,1,0]=4 4 B10R1.66 CC(C)CNc1cscn1 AIFCHEM-94557119663 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.66 CC(C)NCc1ccoc1 AIFCHEM-94520540440 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.66 CC(C)NCc1ccsc1 AIFCHEM-94520540441 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.12 CCNCc1ccco1 AIFCHEM-94594829503 [1,0,0,0,0,0|1,0,0]=2 8 B9R1.12 CCNCc1cocn1 AIFCHEM-94553456429 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.25 CC(CF)NCc1cscn1 AIFCHEM-6127587364 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.25 CC(CO)NCc1cccs1 AIFCHEM-94562635155 [0,1,0,0,0,0|1,1,0]=3 11 B11R1.25 CC(CO)NCc1ccoc1 AIFCHEM-6145837237 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.25 CC(CO)NCc1ncco1 AIFCHEM-5896911606 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.25 C[C@@H](CF)NCc1cscn1 AIFCHEM-6033644390 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.25 C[C@@H](CF)NCc1nccs1 AIFCHEM-6011483820 [0,1,0,0,0,0|2,1,0]=4 15 B11R1.25 C[C@@H](CO)NCc1cccs1 AIFCHEM-6432870219 [0,1,0,0,0,0|1,1,0]=3 16 B11R1.25 C[C@@H](CO)NCc1ccoc1 AIFCHEM-6432724326 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.25 C[C@@H](CO)NCc1ncco1 AIFCHEM-6463448831 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.25 C[C@H](CF)NCc1cscn1 AIFCHEM-6109783518 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.25 C[C@H](CF)NCc1nccs1 AIFCHEM-6089164822 [0,1,0,0,0,0|2,1,0]=4 20 B11R1.25 C[C@H](CO)NCc1cccs1 AIFCHEM-6395146224 [0,1,0,0,0,0|1,1,0]=3 21 B11R1.25 C[C@H](CO)NCc1ccoc1 AIFCHEM-6477229276 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.25 C[C@H](CO)NCc1ncco1 AIFCHEM-6477090630 [0,1,0,0,0,0|2,0,0]=3 23 B11R1.35 CC(C)N(C)Cc1ccoc1 AIFCHEM-94547939389 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.35 CC(C)N(C)Cc1cocn1 AIFCHEM-94547935858 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.35 CC(C)N(C)Cc1ncco1 AIFCHEM-94547940363 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.75 CC(=O)NCc1ccc(o1)Br AIFCHEM-94535592842 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.75 CC(C)NCc1csc(c1)Br AIFCHEM-94520538448 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.75 CC(C)NCc1csc(n1)Cl AIFCHEM-94520540561 [0,1,0,0,0,0|3,0,0]=4 29 B11R1.75 CC(C)NCc1ncc(s1)Br AIFCHEM-94520542746 [0,1,0,0,0,0|2,1,0]=4 30 B11R1.75 Cc1csc(n1)CNC(C)C AIFCHEM-94520537571 [0,1,0,0,0,0|2,1,0]=4 31 B11R1.75 Cc1ncc(o1)CNC(C)C AIFCHEM-94520542429 [0,1,0,0,0,0|2,0,0]=3 32 B11R1.75 Cc1ncc(s1)CNC(C)C AIFCHEM-94520536274 [0,1,0,0,0,0|2,1,0]=4 33 B11R1.77 CC(C)NC(=O)c1ccc[nH]1 AIFCHEM-94520550346 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.90 CC(C)NCc1ccsc1Br AIFCHEM-94520538426 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.90 CC(C)NCc1ncsc1Br AIFCHEM-94520542750 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.90 CC(C)NCc1occc1Br AIFCHEM-94520537820 [0,1,0,0,0,0|1,0,0]=2 37 B11R1.90 CC(C)NCc1scnc1Cl AIFCHEM-94520536462 [0,1,0,0,0,0|2,1,0]=4 38 B11R1.510 CC(C)(C)C=Cc1ccco1 AIFCHEM-94557635146 [0,1,0,0,0,0|1,0,1]=3 39 B11R1.510 CC(C)(C)C=Cc1cccs1 AIFCHEM-94564042213 [0,1,0,0,0,0|1,1,1]=4 40 B11R1.510 CC(C)(C)NCc1ccoc1 AIFCHEM-94527118678 [0,1,0,0,0,0|3,0,0]=4 41 B11R1.510 CC(C)(C)NCc1cocn1 AIFCHEM-94527115147 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.510 CC(C)(C)NCc1cscn1 AIFCHEM-94527117895 [0,1,0,0,0,0|3,0,0]=4 43 B11R2.385 C(=CC1CC1)c2ccco2 AIFCHEM-94569116302 [0,0,0,1,0,0|1,0,1]=3 44 B11R2.385 C(=CC1CC1)c2cnco2 AIFCHEM-6325635689 [0,0,0,1,0,0|2,0,1]=4 45 B11R2.385 C(=CC1CC1)c2ncco2 AIFCHEM-6315975781 [0,0,0,1,0,0|2,0,1]=4 46 B11R2.385 c1csc(c1)CNC2CC2 AIFCHEM-94573318906 [0,0,0,1,0,0|1,1,0]=3 47 B11R2.385 c1csc(n1)CNC2CC2 AIFCHEM-94573312387 [0,0,0,1,0,0|2,1,0]=4 48 B11R2.385 c1nc(c[nH]1)CNC2CC2 AIFCHEM-94573315468 [0,0,0,1,0,0|3,0,0]=4 49 B11R2.385 c1nc(co1)CNC2CC2 AIFCHEM-94573312922 [0,0,0,1,0,0|3,0,0]=4 50 B9R1.13 CC(=Cc1cccs1)C AIFCHEM-94564040356 [0,0,0,0,1,0|0,1,2]=4 51 B11R1.91 CC(C)CNc1ccccn1 AIFCHEM-94572981495 [0,0,0,0,0,1|3,0,0]=4 52 B11R1.91 CC(C)CNc1cccnc1 AIFCHEM-94572981207 [0,0,0,0,0,1|3,0,0]=4 53 B11R1.91 CC(C)NCc1cccnc1 AIFCHEM-94520540451 [0,0,0,0,0,1|2,0,0]=3 54 B11R1.91 CC(C)NCc1cncnc1 AIFCHEM-94520536301 [0,0,0,0,0,1|3,0,0]=4 55 B11R1.172 CC(C)CNCc1cocn1 AIFCHEM-94572971302 [0,0,0,0,0,1|3,0,0]=4 56 B11R1.172 CC(C)CNCc1cscn1 AIFCHEM-94547319480 [0,0,0,0,0,1|3,0,0]=4 57 B11R1.172 CC(C)CNCc1nccs1 AIFCHEM-94572982190 [0,0,0,0,0,1|2,1,0]=4 58 B11R1.172 CC(O)CNCc1cnco1 AIFCHEM-6417392794 [0,0,0,0,0,1|3,0,0]=4 59 B11R1.172 CN(C)CCNc1ncco1 AIFCHEM-94564766578 [0,0,0,0,0,1|3,0,0]=4 60 B11R1.172 C[C@@H](O)CNCc1cnco1 AIFCHEM-6491190597 [0,0,0,0,0,1|3,0,0]=4 61 B11R1.172 C[C@H](O)CNCc1cnco1 AIFCHEM-6500782137 [0,0,0,0,0,1|3,0,0]=4 62 B10R1.11 CCN[C@H](C)c1ccco1 AIFCHEM-94537422471 [1,1,0,0,0,0|1,0,0]=3 63 B10R1.21 CCCCNc1ncco1 AIFCHEM-94523038147 [1,1,0,0,0,0|2,0,0]=4 64 B10R1.21 CCCNCc1ccno1 AIFCHEM-94569018772 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.21 CCCNCc1cnco1 AIFCHEM-94521366295 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.21 FCCNCc1cccs1 AIFCHEM-5853698665 [1,1,0,0,0,0|1,1,0]=4 67 B10R1.21 N#CCNCc1ccco1 AIFCHEM-94540088190 [1,1,0,0,0,0|1,0,1]=4 68 B10R1.21 OCCNCc1cnco1 AIFCHEM-6481664221 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.27 CCN(C)Cc1ccco1 AIFCHEM-94537421946 [1,1,0,0,0,0|1,0,0]=3 70 B10R1.27 CCN(C)Cc1cnco1 AIFCHEM-94563255382 [1,1,0,0,0,0|2,0,0]=4 71 B12R1.21 CC(C)NCc1ccc(cc1)Br AIFCHEM-94520536724 [0,1,0,0,0,1|2,0,0]=4 72 B12R1.21 CC(C)NCc1ccc(nc1)Br AIFCHEM-94520537856 [0,1,0,0,0,1|2,0,0]=4 73 B12R1.21 CC(C)NCc1ccc(nc1)F AIFCHEM-94520541532 [0,1,0,0,0,1|2,0,0]=4 74 B12R1.27 CC(CF)NCc1ccncc1 AIFCHEM-6106353417 [0,1,0,0,0,1|2,0,0]=4 75 B12R1.27 CC(CF)NCc1cnccn1 AIFCHEM-6128659395 [0,1,0,0,0,1|2,0,0]=4 76 B12R1.27 CC(CO)NCc1cccnn1 AIFCHEM-6411322817 [0,1,0,0,0,1|2,0,0]=4 77 B12R1.27 C[C@@H](CF)NCc1ccncc1 AIFCHEM-6033408698 [0,1,0,0,0,1|2,0,0]=4 78 B12R1.27 C[C@@H](CF)NCc1cnccn1 AIFCHEM-6011665275 [0,1,0,0,0,1|2,0,0]=4 79 B12R1.27 C[C@@H](CO)NCc1cccnn1 AIFCHEM-6436821149 [0,1,0,0,0,1|2,0,0]=4 80 B12R1.27 C[C@H](CF)NCc1ccncc1 AIFCHEM-6088513543 [0,1,0,0,0,1|2,0,0]=4 81 B12R1.27 C[C@H](CF)NCc1cnccn1 AIFCHEM-6089310118 [0,1,0,0,0,1|2,0,0]=4 82 B12R1.27 C[C@H](CO)NCc1cccnn1 AIFCHEM-6461011387 [0,1,0,0,0,1|2,0,0]=4 83 B12R1.43 CC(C)N(C)Cc1cccnc1 AIFCHEM-94547939400 [0,1,0,0,0,1|2,0,0]=4 84 B12R1.43 CC(C)N(C)Cc1ccncn1 AIFCHEM-94547938012 [0,1,0,0,0,1|2,0,0]=4 85 B12R1.125 CC(C)NCc1ccccc1O AIFCHEM-94532460180 [0,1,0,0,0,1|2,0,0]=4 86 B12R1.125 CC(C)NCc1cccnc1O AIFCHEM-94541098053 [0,1,0,0,0,1|2,0,0]=4 87 B12R1.125 CC(C)NCc1ccncc1O AIFCHEM-94520538410 [0,1,0,0,0,1|2,0,0]=4 88 B12R1.125 CC(C)NCc1cnccc1O AIFCHEM-94520542511 [0,1,0,0,0,1|2,0,0]=4 89 B12R1.125 CC(C)NCc1ncccc1Br AIFCHEM-94520540091 [0,1,0,0,0,1|2,0,0]=4 90 B12R1.125 Cc1cccnc1CNC(C)C AIFCHEM-94520540832 [0,1,0,0,0,1|2,0,0]=4 91 B12R1.226 CC(C)NCc1cccc(c1)Br AIFCHEM-94520539518 [0,1,0,0,0,1|2,0,0]=4 92 B12R1.226 CC(C)NCc1cccc(c1)I AIFCHEM-94520541615 [0,1,0,0,0,1|2,0,0]=4 93 B12R1.226 CC(C)NCc1cncc(c1)Br AIFCHEM-94520536752 [0,1,0,0,0,1|2,0,0]=4 94 B12R1.226 Cc1ccnc(c1)CNC(C)C AIFCHEM-94520540677 [0,1,0,0,0,1|2,0,0]=4 95 B12R1.54 CC(C)CNC(=O)c1ccco1 AIFCHEM-6162410015 [0,1,0,0,0,1|1,0,1]=4 96 B12R1.105 CC(C)CNCc1cc(cs1)O AIFCHEM-94571802304 [0,1,0,0,0,1|1,1,0]=4 97 B12R1.105 Cc1ccc(o1)CNCC(C)O AIFCHEM-6395815492 [0,1,0,0,0,1|2,0,0]=4 98 B12R1.105 Cc1ccc(o1)CNC[C@@H](C)O AIFCHEM-6509526074 [0,1,0,0,0,1|2,0,0]=4 99 B12R1.105 Cc1ccc(o1)CNC[C@H](C)O AIFCHEM-6500519723 [0,1,0,0,0,1|2,0,0]=4 100 B12R1.130 CC(C)CNCc1occc1Br AIFCHEM-94563720197 [0,1,0,0,0,1|1,0,0]=3 101 B12R1.260 CC(C)CN(C)Cc1ccco1 AIFCHEM-94540089238 [0,1,0,0,0,1|1,0,0]=3 102 B12R1.260 CC(C)NC(=O)Cc1ccc[nH]1 AIFCHEM-94520551225 [0,1,0,0,0,1|2,0,0]=4 103 B12R1.264 CC(C)C(=O)NCc1ccco1 AIFCHEM-94594838836 [0,1,0,0,0,1|1,0,0]=3 104 B12R1.264 CC(C)C(=O)NCc1cccs1 AIFCHEM-94562649536 [0,1,0,0,0,1|1,1,0]=4 105 B12R1.264 CC(C)C(=O)NCc1ncco1 AIFCHEM-94545040841 [0,1,0,0,0,1|2,0,0]=4 106 B12R1.264 CC(C)C(C)NCc1ccco1 AIFCHEM-94557349416 [0,1,0,0,0,1|1,0,0]=3 107 B12R1.264 CC(C)C(C)NCc1cnco1 AIFCHEM-6214707041 [0,1,0,0,0,1|2,0,0]=4 108 B12R1.264 CC(C)C(C)NCc1ncco1 AIFCHEM-6189656038 [0,1,0,0,0,1|2,0,0]=4 109 B12R1.264 CC(C)[C@@H](C)NCc1ccco1 AIFCHEM-94576823774 [0,1,0,0,0,1|1,0,0]=3 110 B12R1.264 CC(C)[C@@H](C)NCc1cnco1 AIFCHEM-94576817792 [0,1,0,0,0,1|2,0,0]=4 111 B12R1.264 CC(C)[C@@H](C)NCc1ncco1 AIFCHEM-94576822296 [0,1,0,0,0,1|2,0,0]=4 112 B12R1.264 CC(O)C(C)NCc1ccco1 AIFCHEM-94547072196 [0,1,0,0,0,1|2,0,0]=4 113 B12R1.477 CC(CO)CNCc1ccco1 AIFCHEM-94540081585 [0,1,0,0,0,1|1,0,0]=3 114 B12R1.477 CC(CO)CNCc1cccs1 AIFCHEM-94540296854 [0,1,0,0,0,1|1,1,0]=4 115 B12R1.477 CC(CO)CNCc1cnco1 AIFCHEM-94540290871 [0,1,0,0,0,1|2,0,0]=4 116 B12R1.477 CC(CO)CNCc1ncco1 AIFCHEM-94540295375 [0,1,0,0,0,1|2,0,0]=4 117 B12R1.477 OCC(O)CNCc1ccco1 AIFCHEM-94594828484 [0,1,0,0,0,1|2,0,0]=4 118 B12R1.477 OC[C@@H](F)CNCc1ccco1 AIFCHEM-94540086049 [0,1,0,0,0,1|2,0,0]=4 119 B12R1.477 OC[C@@H](O)CNCc1ccco1 AIFCHEM-94594827927 [0,1,0,0,0,1|2,0,0]=4 120 B12R1.477 OC[C@H](F)CNCc1ccco1 AIFCHEM-94540086048 [0,1,0,0,0,1|2,0,0]=4 121 B12R1.477 OC[C@H](O)CNCc1ccco1 AIFCHEM-94540089711 [0,1,0,0,0,1|2,0,0]=4 122 B12R1.890 CC(C)(C)CCNc1ncco1 AIFCHEM-6254252832 [0,1,0,0,0,1|2,0,0]=4 123 B12R1.890 CC(C)(C)CNCc1ccco1 AIFCHEM-94540088701 [0,1,0,0,0,1|1,0,0]=3 124 B12R1.890 CC(C)(F)CNCc1ncco1 AIFCHEM-5760103396 [0,1,0,0,0,1|2,0,0]=4 125 B12R1.890 CC(C)(O)CNCc1cnco1 AIFCHEM-6464971987 [0,1,0,0,0,1|2,0,0]=4 126 B12R1.15 CC(N[C@@H](C)CF)c1ncco1 AIFCHEM-6011840351 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.15 CC(N[C@H](C)CF)c1ncco1 AIFCHEM-6116343721 [0,2,0,0,0,0|2,0,0]=4 128 B12R1.26 CC(C#N)NCc1cc(co1)Br AIFCHEM-6510365352 [0,2,0,0,0,0|1,0,1]=4 129 B12R1.26 CC(CF)NCc1cc(cs1)O AIFCHEM-94571804034 [0,2,0,0,0,0|1,1,0]=4 130 B12R1.26 CC(CO)NCc1cc(co1)Br AIFCHEM-5875954847 [0,2,0,0,0,0|1,0,0]=3 131 B12R1.26 CC(CO)NCc1cc(cs1)O AIFCHEM-94571800482 [0,2,0,0,0,0|1,1,0]=4 132 B12R1.26 CC(CO)NCc1cc(no1)Br AIFCHEM-94596491767 [0,2,0,0,0,0|2,0,0]=4 133 B12R1.26 CC(CO)NCc1ccc(o1)I AIFCHEM-6411126312 [0,2,0,0,0,0|1,0,0]=3 134 B12R1.26 CC(CO)NCc1ccc(s1)Cl AIFCHEM-6431902230 [0,2,0,0,0,0|1,1,0]=4 135 B12R1.26 C[C@@H](CF)NCc1cc(cs1)O AIFCHEM-94571798749 [0,2,0,0,0,0|1,1,0]=4 136 B12R1.26 C[C@@H](CO)NCc1cc(co1)Br AIFCHEM-6446649689 [0,2,0,0,0,0|1,0,0]=3 137 B12R1.26 C[C@@H](CO)NCc1cc(cs1)O AIFCHEM-94571796478 [0,2,0,0,0,0|1,1,0]=4 138 B12R1.26 C[C@@H](CO)NCc1cc(no1)Br AIFCHEM-6419503144 [0,2,0,0,0,0|2,0,0]=4 139 B12R1.26 C[C@@H](CO)NCc1ccc(o1)I AIFCHEM-6418527707 [0,2,0,0,0,0|1,0,0]=3 140 B12R1.26 C[C@@H](CO)NCc1ccc(s1)Cl AIFCHEM-6437018242 [0,2,0,0,0,0|1,1,0]=4 141 B12R1.26 C[C@H](CF)NCc1cc(cs1)O AIFCHEM-94571796454 [0,2,0,0,0,0|1,1,0]=4 142 B12R1.26 C[C@H](CO)NCc1cc(co1)Br AIFCHEM-6460847132 [0,2,0,0,0,0|1,0,0]=3 143 B12R1.26 C[C@H](CO)NCc1cc(cs1)O AIFCHEM-94571797545 [0,2,0,0,0,0|1,1,0]=4 144 B12R1.26 C[C@H](CO)NCc1cc(no1)Br AIFCHEM-6452892552 [0,2,0,0,0,0|2,0,0]=4 145 B12R1.26 C[C@H](CO)NCc1ccc(o1)I AIFCHEM-6414205434 [0,2,0,0,0,0|1,0,0]=3 146 B12R1.26 C[C@H](CO)NCc1ccc(s1)Cl AIFCHEM-6414456283 [0,2,0,0,0,0|1,1,0]=4 147 B12R1.26 Cc1ccc(o1)CN[C@H](C)CF AIFCHEM-6116197301 [0,2,0,0,0,0|1,0,0]=3 148 B12R1.26 Cc1ncc(o1)CNC(C)CO AIFCHEM-6432082036 [0,2,0,0,0,0|2,0,0]=4 149 B12R1.26 Cc1ncc(o1)CN[C@@H](C)CF AIFCHEM-6055426952 [0,2,0,0,0,0|2,0,0]=4 150 B12R1.26 Cc1ncc(o1)CN[C@@H](C)CO AIFCHEM-6463566596 [0,2,0,0,0,0|2,0,0]=4 151 B12R1.26 Cc1ncc(o1)CN[C@H](C)CO AIFCHEM-6414815707 [0,2,0,0,0,0|2,0,0]=4 152 B12R1.51 CC(CC#N)NCc1cccs1 AIFCHEM-94562637430 [0,2,0,0,0,0|1,1,0]=4 153 B12R1.51 CC(CCO)NCc1ccco1 AIFCHEM-94540085290 [0,2,0,0,0,0|1,0,0]=3 154 B12R1.51 CCCC(C)NCc1ccco1 AIFCHEM-94557345122 [0,2,0,0,0,0|1,0,0]=3 155 B12R1.51 CCCC(C)NCc1ncco1 AIFCHEM-94606108439 [0,2,0,0,0,0|2,0,0]=4 156 B12R1.51 CCC[C@@H](C)NCc1ccco1 AIFCHEM-94540076933 [0,2,0,0,0,0|1,0,0]=3 157 B12R1.51 CCC[C@@H](C)NCc1ncco1 AIFCHEM-6031908931 [0,2,0,0,0,0|2,0,0]=4 158 B12R1.51 CCC[C@H](C)NCc1ccco1 AIFCHEM-94540083968 [0,2,0,0,0,0|1,0,0]=3 159 B12R1.51 CCC[C@H](C)NCc1ncco1 AIFCHEM-5638056710 [0,2,0,0,0,0|2,0,0]=4 160 B12R1.51 COCC(C)NCc1ccco1 AIFCHEM-94540086418 [0,2,0,0,0,0|1,0,0]=3 161 B12R1.51 COCC(C)NCc1ccno1 AIFCHEM-5889956812 [0,2,0,0,0,0|2,0,0]=4 162 B12R1.51 COC[C@@H](C)NCc1ccco1 AIFCHEM-94540093327 [0,2,0,0,0,0|1,0,0]=3 163 B12R1.51 COC[C@H](C)NCc1ccco1 AIFCHEM-94540078169 [0,2,0,0,0,0|1,0,0]=3 164 B12R1.51 C[C@@H](CC#N)NCc1cccs1 AIFCHEM-6049407368 [0,2,0,0,0,0|1,1,0]=4 165 B12R1.51 C[C@@H](CCO)NCc1ccco1 AIFCHEM-94540089100 [0,2,0,0,0,0|1,0,0]=3 166 B12R1.51 C[C@H](CC#N)NCc1cccs1 AIFCHEM-6266974090 [0,2,0,0,0,0|1,1,0]=4 167 B12R1.51 C[C@H](CCO)NCc1ccco1 AIFCHEM-94540089101 [0,2,0,0,0,0|1,0,0]=3 168 B12R1.108 CC(CO)N(C)Cc1ccco1 AIFCHEM-94537395448 [0,2,0,0,0,0|1,0,0]=3 169 B12R1.108 CC(CO)N(C)Cc1cccs1 AIFCHEM-6480287164 [0,2,0,0,0,0|1,1,0]=4 170 B12R1.108 CCC(C)N(C)Cc1ccco1 AIFCHEM-94540090849 [0,2,0,0,0,0|1,0,0]=3 171 B12R1.108 CCN(C)C(=O)Cc1ccco1 AIFCHEM-94563266169 [0,2,0,0,0,0|2,0,0]=4 172 B12R1.108 C[C@@H](CO)N(C)Cc1ccco1 AIFCHEM-94590941775 [0,2,0,0,0,0|1,0,0]=3 173 B12R1.108 C[C@@H](CO)N(C)Cc1cccs1 AIFCHEM-94590941776 [0,2,0,0,0,0|1,1,0]=4 174 B12R1.108 C[C@H](CO)N(C)Cc1ccco1 AIFCHEM-94540081447 [0,2,0,0,0,0|1,0,0]=3 175 B12R1.108 C[C@H](CO)N(C)Cc1cccs1 AIFCHEM-6446457572 [0,2,0,0,0,0|1,1,0]=4 176 B12R1.196 CC(C)(CO)NCc1cnco1 AIFCHEM-94576811110 [0,2,0,0,0,0|2,0,0]=4 177 B12R1.297 CCC(CC)NCc1ccco1 AIFCHEM-94540089116 [0,2,0,0,0,0|1,0,0]=3 178 B12R1.297 CCC(CO)NCc1ccco1 AIFCHEM-94594828136 [0,2,0,0,0,0|1,0,0]=3 179 B12R1.297 CCC(CO)NCc1ccno1 AIFCHEM-5979294228 [0,2,0,0,0,0|2,0,0]=4 180 B12R1.297 CCC(CO)NCc1cnco1 AIFCHEM-6443624268 [0,2,0,0,0,0|2,0,0]=4 181 B12R1.297 CC[C@@H](CO)NCc1ccco1 AIFCHEM-94540088760 [0,2,0,0,0,0|1,0,0]=3 182 B12R1.297 CC[C@@H](CO)NCc1cnco1 AIFCHEM-6505917180 [0,2,0,0,0,0|2,0,0]=4 183 B12R1.297 CC[C@H](CO)NCc1ccco1 AIFCHEM-94540088761 [0,2,0,0,0,0|1,0,0]=3 184 B12R1.297 CC[C@H](CO)NCc1cnco1 AIFCHEM-6439542403 [0,2,0,0,0,0|2,0,0]=4 185 B12R1.297 OCC(CO)NCc1cccs1 AIFCHEM-6449205780 [0,2,0,0,0,0|1,1,0]=4 186 B12R1.297 OCC(CO)NCc1ncco1 AIFCHEM-6440443161 [0,2,0,0,0,0|2,0,0]=4 187 B12R1.353 CC(CF)NCc1sccc1Br AIFCHEM-6106512642 [0,2,0,0,0,0|1,1,0]=4 188 B12R1.353 CC(CO)NCc1occc1Br AIFCHEM-6411134038 [0,2,0,0,0,0|1,0,0]=3 189 B12R1.353 C[C@@H](CF)NCc1sccc1Br AIFCHEM-6055273356 [0,2,0,0,0,0|1,1,0]=4 190 B12R1.353 C[C@@H](CO)NCc1occc1Br AIFCHEM-6446533717 [0,2,0,0,0,0|1,0,0]=3 191 B12R1.353 C[C@H](CO)NCc1occc1Br AIFCHEM-6452440861 [0,2,0,0,0,0|1,0,0]=3 192 B12R1.104 CC(C)N(C)Cc1cc(no1)Br AIFCHEM-94547937820 [0,2,0,0,0,0|2,0,0]=4 193 B12R1.104 CC(C)N(C)Cc1ccc(o1)I AIFCHEM-94547938193 [0,2,0,0,0,0|1,0,0]=3 194 B12R1.104 Cc1ncc(o1)CN(C)C(C)C AIFCHEM-94547941378 [0,2,0,0,0,0|2,0,0]=4 195 B12R1.145 CC(C)N(C)Cc1occc1Br AIFCHEM-94547936769 [0,2,0,0,0,0|1,0,0]=3 196 B12R1.145 CC(C)N(C)Cc1sccc1Cl AIFCHEM-94547940466 [0,2,0,0,0,0|1,1,0]=4 197 B12R1.145 Cc1ccsc1CN(C)C(C)C AIFCHEM-94547939946 [0,2,0,0,0,0|1,1,0]=4 198 B12R1.59 CCc1ccc(s1)CNC(C)C AIFCHEM-94520539873 [0,2,0,0,0,0|1,1,0]=4 199 B12R1.59 COc1ccc(s1)CNC(C)C AIFCHEM-94520539767 [0,2,0,0,0,0|1,1,0]=4 200 B12R1.103 CC(C)NC(=O)c1cc(co1)Br AIFCHEM-94520548272 [0,2,0,0,0,0|1,0,1]=4 201 B12R1.103 CC(C)NC(=O)c1ccc(o1)Cl AIFCHEM-94520550218 [0,2,0,0,0,0|1,0,1]=4 202 B12R1.110 Cc1cc(oc1C)CNC(C)C AIFCHEM-94520540595 [0,2,0,0,0,0|1,0,0]=3 203 B12R1.110 Cc1sc(cc1Br)CNC(C)C AIFCHEM-94520539393 [0,2,0,0,0,0|1,1,0]=4 204 B12R1.836 CC(C)(C)NCc1cc(cs1)O AIFCHEM-94571788115 [0,2,0,0,0,0|1,1,0]=4 205 B12R1.836 CC(C)(C)NCc1ccc(o1)I AIFCHEM-94527117482 [0,2,0,0,0,0|1,0,0]=3 206 B12R1.836 CC(C)(C)NCc1ccc(s1)Br AIFCHEM-94589406520 [0,2,0,0,0,0|1,1,0]=4 207 B12R1.836 Cc1ccc(o1)CNC(C)(C)C AIFCHEM-94589407393 [0,2,0,0,0,0|1,0,0]=3 208 B12R1.836 Cc1csc(c1)CNC(C)(C)C AIFCHEM-94589407278 [0,2,0,0,0,0|1,1,0]=4 209 B12R1.861 Cc1cc(c(s1)CNC(C)C)Br AIFCHEM-94520539840 [0,2,0,0,0,0|1,1,0]=4 210 B12R1.129 CC(C)(C)NCc1occc1Br AIFCHEM-94589403991 [0,2,0,0,0,0|1,0,0]=3 211 B12R2.2057 c1cc(ccn1)CNC2CC2 AIFCHEM-6108865476 [0,0,0,1,0,1|2,0,0]=4 212 B12R2.2057 c1cnc(nc1)CNC2CC2 AIFCHEM-94573315291 [0,0,0,1,0,1|2,0,0]=4 213 B12R2.2057 c1cncc(c1)CNC2CC2 AIFCHEM-94573316464 [0,0,0,1,0,1|2,0,0]=4 214 B12R2.2057 c1cnnc(c1)CNC2CC2 AIFCHEM-6109237002 [0,0,0,1,0,1|2,0,0]=4 215 B12R2.20 C[C@@H]1C[C@H]1NCc2cccs2 AIFCHEM-94559011912 [0,0,0,1,0,1|1,1,0]=4 216 B12R2.20 FC1CC1NCc2ccco2 AIFCHEM-94597363839 [0,0,0,1,0,1|2,0,0]=4 217 B12R2.20 F[C@@H]1C[C@@H]1NCc2ccco2 AIFCHEM-94540080768 [0,0,0,1,0,1|2,0,0]=4 218 B12R2.20 F[C@@H]1C[C@H]1NCc2ccco2 AIFCHEM-94540077937 [0,0,0,1,0,1|2,0,0]=4 219 B12R2.20 F[C@H]1C[C@@H]1NCc2ccco2 AIFCHEM-94540081991 [0,0,0,1,0,1|2,0,0]=4 220 B12R2.20 F[C@H]1C[C@H]1NCc2ccco2 AIFCHEM-94540080769 [0,0,0,1,0,1|2,0,0]=4 221 B12R2.2383 c1coc(c1)CNCC2CC2 AIFCHEM-94557346397 [0,0,0,1,0,1|1,0,0]=3 222 B12R2.2056 c1coc(c1)CNC2CCC2 AIFCHEM-94540084748 [0,1,0,1,0,0|1,0,0]=3 223 B12R2.2056 c1coc(c1)CNC2CSC2 AIFCHEM-94540079789 [0,1,0,1,0,0|1,0,0]=3 224 B12R2.2298 Brc1ccc(s1)CNC2CC2 AIFCHEM-94573316362 [0,1,0,1,0,0|1,1,0]=4 225 B12R2.2298 Brc1csc(c1)CNC2CC2 AIFCHEM-6108553776 [0,1,0,1,0,0|1,1,0]=4 226 B12R2.2298 Clc1csc(c1)CNC2CC2 AIFCHEM-94573316950 [0,1,0,1,0,0|1,1,0]=4 227 B12R2.2298 Oc1csc(c1)CNC2CC2 AIFCHEM-94571802121 [0,1,0,1,0,0|1,1,0]=4 228 B12R2.466 Brc1ccoc1CNC2CC2 AIFCHEM-6108914728 [0,1,0,1,0,0|1,0,0]=3 229 B12R2.466 Clc1ccsc1CNC2CC2 AIFCHEM-6133521977 [0,1,0,1,0,0|1,1,0]=4 230 B10R1.17 CCNCc1ccccn1 AIFCHEM-94537420895 [1,0,0,0,0,1|2,0,0]=4 231 B10R1.17 CCNCc1cnccn1 AIFCHEM-94537417821 [1,0,0,0,0,1|2,0,0]=4 232 B12R1.252 CC(C)CNCc1ccccn1 AIFCHEM-94572980232 [0,0,0,0,0,2|2,0,0]=4 233 B12R1.252 CC(C)CNCc1ccncn1 AIFCHEM-6162129461 [0,0,0,0,0,2|2,0,0]=4