0 B9R1.13 CC(=Cc1cccs1)C AIFCHEM-94564040356 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.13 CC(=Cc1ncc[nH]1)C AIFCHEM-6485154680 [0,0,0,0,0,0|1,0,2]=3 2 B9R1.13 CC(=Cc1ncns1)C AIFCHEM-6328954991 [0,0,0,0,0,0|1,0,2]=3 3 B9R1.13 CC(=O)Nc1ncco1 AIFCHEM-6274686839 [0,0,0,0,0,0|2,1,1]=4 4 B9R1.13 CC(=O)Nc1ncns1 AIFCHEM-5960419462 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.8 CC=Cc1ncc[nH]1 AIFCHEM-6407688555 [1,0,0,0,0,0|1,0,2]=4 6 B8R1.8 CCNc1cscn1 AIFCHEM-94537423279 [1,0,0,0,0,0|3,0,0]=4 7 B8R1.8 CCNc1nnco1 AIFCHEM-94537420944 [1,0,0,0,0,0|2,1,0]=4 8 B10R1.27 CCN(C)Cc1ccco1 AIFCHEM-94537421946 [0,1,0,0,0,0|2,1,0]=4 9 B10R1.27 CCN(C)Cc1cscn1 AIFCHEM-94563258129 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.27 O=C(CO)Nc1nccs1 AIFCHEM-94524297920 [0,1,0,0,0,0|2,0,1]=4 11 B10R1.54 CC(=O)Nc1nc(cs1)C AIFCHEM-94608701896 [0,1,0,0,0,0|2,0,1]=4 12 B10R1.54 CC(=O)Nc1nc(cs1)Cl AIFCHEM-6199665532 [0,1,0,0,0,0|2,0,1]=4 13 B10R1.64 CC(=Cc1sccc1C)C AIFCHEM-6323591551 [0,1,0,0,0,0|1,0,2]=4 14 B10R1.66 CC(=O)NCc1cccs1 AIFCHEM-6123944273 [0,0,0,0,0,1|2,0,1]=4 15 B10R1.66 CC(C)CNc1ccsc1 AIFCHEM-94568866788 [0,0,0,0,0,1|3,0,0]=4 16 B10R1.66 CC(C)CNc1cncs1 AIFCHEM-94572976233 [0,0,0,0,0,1|2,0,0]=3 17 B10R1.66 CC(C)CNc1cscn1 AIFCHEM-94557119663 [0,0,0,0,0,1|2,0,0]=3 18 B10R1.66 CC(C)NCc1ccoc1 AIFCHEM-94520540440 [0,0,0,0,0,1|3,0,0]=4 19 B10R1.66 CC(C)NCc1ccsc1 AIFCHEM-94520540441 [0,0,0,0,0,1|3,0,0]=4 20 B9R1.7 CC=Cc1nc(cs1)C AIFCHEM-6293789631 [1,1,0,0,0,0|0,0,2]=4 21 B9R1.7 CCNc1nc(cs1)Br AIFCHEM-94537422116 [1,1,0,0,0,0|1,0,0]=3 22 B9R1.7 CCNc1nnc(s1)Br AIFCHEM-94537420919 [1,1,0,0,0,0|2,0,0]=4 23 B9R1.11 C/C=C(\C)/c1nccs1 AIFCHEM-94584217073 [1,1,0,0,0,0|0,0,2]=4 24 B9R1.12 CCCNc1cncs1 AIFCHEM-94535760097 [1,1,0,0,0,0|2,0,0]=4 25 B9R1.12 CCCNc1cscn1 AIFCHEM-94557114815 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.12 CCNCc1ccco1 AIFCHEM-94594829503 [1,1,0,0,0,0|1,1,0]=4 27 B9R1.12 CCNCc1cocn1 AIFCHEM-94553456429 [1,1,0,0,0,0|2,0,0]=4 28 B9R1.12 OCC=Cc1nccs1 AIFCHEM-6314170789 [1,1,0,0,0,0|0,0,2]=4 29 B11R1.40 CCN(C)Cc1cccnc1 AIFCHEM-94537417880 [0,1,0,0,0,1|2,0,0]=4 30 B11R1.25 CC(CF)NCc1cscn1 AIFCHEM-6127587364 [0,1,0,0,0,1|2,0,0]=4 31 B11R1.25 CC(CO)NCc1cccs1 AIFCHEM-94562635155 [0,1,0,0,0,1|1,0,0]=3 32 B11R1.25 CC(CO)NCc1ncco1 AIFCHEM-5896911606 [0,1,0,0,0,1|0,1,0]=3 33 B11R1.25 CCC(C)CNc1cncs1 AIFCHEM-94535765857 [0,1,0,0,0,1|2,0,0]=4 34 B11R1.25 C[C@@H](CF)NCc1cscn1 AIFCHEM-6033644390 [0,1,0,0,0,1|2,0,0]=4 35 B11R1.25 C[C@@H](CF)NCc1nccs1 AIFCHEM-6011483820 [0,1,0,0,0,1|0,0,0]=2 36 B11R1.25 C[C@@H](CO)NCc1cccs1 AIFCHEM-6432870219 [0,1,0,0,0,1|1,0,0]=3 37 B11R1.25 C[C@@H](CO)NCc1ncco1 AIFCHEM-6463448831 [0,1,0,0,0,1|0,1,0]=3 38 B11R1.25 C[C@H](CF)NCc1cscn1 AIFCHEM-6109783518 [0,1,0,0,0,1|2,0,0]=4 39 B11R1.25 C[C@H](CF)NCc1nccs1 AIFCHEM-6089164822 [0,1,0,0,0,1|0,0,0]=2 40 B11R1.25 C[C@H](CO)NCc1cccs1 AIFCHEM-6395146224 [0,1,0,0,0,1|1,0,0]=3 41 B11R1.25 C[C@H](CO)NCc1ncco1 AIFCHEM-6477090630 [0,1,0,0,0,1|0,1,0]=3 42 B11R1.25 OCC(O)CNc1nccs1 AIFCHEM-94524287569 [0,1,0,0,0,1|1,0,0]=3 43 B11R1.25 OC[C@@H](O)CNc1nccs1 AIFCHEM-94590868519 [0,1,0,0,0,1|1,0,0]=3 44 B11R1.35 CC(C)C(=O)Nc1ncns1 AIFCHEM-94536745447 [0,1,0,0,0,1|1,0,1]=4 45 B11R1.35 CC(C)N(C)Cc1cocn1 AIFCHEM-94547935858 [0,1,0,0,0,1|2,0,0]=4 46 B11R1.35 CC(C)N(C)Cc1ncco1 AIFCHEM-94547940363 [0,1,0,0,0,1|0,1,0]=3 47 B11R1.75 CC(C)CNc1cn(cn1)C AIFCHEM-94572986001 [0,1,0,0,0,1|2,0,0]=4 48 B11R1.75 CC(C)NCc1csc(n1)Cl AIFCHEM-94520540561 [0,1,0,0,0,1|2,0,0]=4 49 B11R1.75 CC(C)NCc1ncc(s1)Br AIFCHEM-94520542746 [0,1,0,0,0,1|0,0,0]=2 50 B11R1.75 Cc1cc(no1)NCC(C)C AIFCHEM-94572971294 [0,1,0,0,0,1|2,0,0]=4 51 B11R1.75 Cc1cnc(s1)NCC(C)C AIFCHEM-94572984216 [0,1,0,0,0,1|0,0,0]=2 52 B11R1.75 Cc1csc(n1)CNC(C)C AIFCHEM-94520537571 [0,1,0,0,0,1|0,0,0]=2 53 B11R1.75 Cc1ncc(s1)CNC(C)C AIFCHEM-94520536274 [0,1,0,0,0,1|2,0,0]=4 54 B11R1.77 CC(C)NC(=O)c1ncc[nH]1 AIFCHEM-94520545556 [0,1,0,0,0,1|1,0,1]=4 55 B11R1.90 CC(C)NCc1ncsc1Br AIFCHEM-94520542750 [0,1,0,0,0,1|2,0,0]=4 56 B11R1.90 CC(C)NCc1occc1Br AIFCHEM-94520537820 [0,1,0,0,0,1|1,1,0]=4 57 B11R1.90 CC(C)NCc1scnc1Cl AIFCHEM-94520536462 [0,1,0,0,0,1|2,0,0]=4 58 B11R1.510 CC(C)(C)C=Cc1cccs1 AIFCHEM-94564042213 [0,1,0,0,0,1|1,0,1]=4 59 B11R1.510 CC(C)(C)NCc1cocn1 AIFCHEM-94527115147 [0,1,0,0,0,1|2,0,0]=4 60 B11R1.510 CC(C)(C)NCc1cscn1 AIFCHEM-94527117895 [0,1,0,0,0,1|2,0,0]=4 61 B11R1.510 CC(C)(O)C=Cc1ncc[nH]1 AIFCHEM-6407486584 [0,1,0,0,0,1|1,0,1]=4 62 B11R1.510 CC(C)(O)C=Cc1ncns1 AIFCHEM-6300948482 [0,1,0,0,0,1|1,0,1]=4 63 B11R1.30 CCCN(C)Cc1ncco1 AIFCHEM-5878772510 [0,2,0,0,0,0|1,1,0]=4 64 B11R1.30 CN(CCO)Cc1cccs1 AIFCHEM-6388930207 [0,2,0,0,0,0|2,0,0]=4 65 B11R1.39 CCN(C)Cc1cc(cs1)O AIFCHEM-94571800581 [0,2,0,0,0,0|2,0,0]=4 66 B11R1.39 CCN(C)Cc1ccc(s1)C AIFCHEM-94563256011 [0,2,0,0,0,0|2,0,0]=4 67 B11R1.39 CCN(C)Cc1nc(cs1)C AIFCHEM-6099406476 [0,2,0,0,0,0|1,0,0]=3 68 B11R1.39 CCN(C)Cc1ncc(s1)Br AIFCHEM-94563261218 [0,2,0,0,0,0|1,0,0]=3 69 B11R1.39 CCN(C)Cc1ncc(s1)Cl AIFCHEM-94563259528 [0,2,0,0,0,0|1,0,0]=3 70 B11R1.228 CCN(C)Cc1sccc1Cl AIFCHEM-6119870541 [0,2,0,0,0,0|2,0,0]=4 71 B11R2.385 C(=CC1CC1)c2ncco2 AIFCHEM-6315975781 [0,0,0,1,0,1|0,1,1]=4 72 B11R2.385 C(=CC1CC1)c2nccs2 AIFCHEM-6314044845 [0,0,0,1,0,1|0,0,1]=3 73 B11R2.385 C(=CC1CC1)c2ncns2 AIFCHEM-6300817664 [0,0,0,1,0,1|1,0,1]=4 74 B11R2.385 c1csc(c1)CNC2CC2 AIFCHEM-94573318906 [0,0,0,1,0,1|1,0,0]=3 75 B11R2.385 c1csc(n1)CNC2CC2 AIFCHEM-94573312387 [0,0,0,1,0,1|0,0,0]=2 76 B11R2.385 c1nc(c[nH]1)CNC2CC2 AIFCHEM-94573315468 [0,0,0,1,0,1|2,0,0]=4 77 B11R2.385 c1nc(co1)CNC2CC2 AIFCHEM-94573312922 [0,0,0,1,0,1|2,0,0]=4 78 B11R2.385 c1nnc(s1)NCC2CC2 AIFCHEM-5967563177 [0,0,0,1,0,1|1,0,0]=3 79 B11R2.237 C(=C1CCC1)c2nccs2 AIFCHEM-6313239043 [0,1,0,1,0,0|0,0,2]=4 80 B11R2.237 c1csc(c1)CN2CCC2 AIFCHEM-6042461841 [0,1,0,1,0,0|2,0,0]=4 81 B9R1.8 CCNc1ccccn1 AIFCHEM-94537422158 [1,0,0,0,0,1|2,0,0]=4 82 B9R1.8 CCNc1cnccn1 AIFCHEM-94537422176 [1,0,0,0,0,1|2,0,0]=4 83 B9R1.8 CCNc1nccnn1 AIFCHEM-94537412256 [1,0,0,0,0,1|2,0,0]=4 84 B11R1.91 CC(C)CNc1ccccn1 AIFCHEM-94572981495 [0,0,0,0,0,2|1,0,0]=3 85 B11R1.91 CC(C)CNc1cccnc1 AIFCHEM-94572981207 [0,0,0,0,0,2|1,0,0]=3 86 B11R1.91 CC(C)NCc1cccnc1 AIFCHEM-94520540451 [0,0,0,0,0,2|1,0,0]=3 87 B11R1.91 CC(C)NCc1cncnc1 AIFCHEM-94520536301 [0,0,0,0,0,2|2,0,0]=4 88 B11R1.172 CC(C)CNCc1cocn1 AIFCHEM-94572971302 [0,0,0,0,0,2|2,0,0]=4 89 B11R1.172 CC(C)CNCc1cscn1 AIFCHEM-94547319480 [0,0,0,0,0,2|2,0,0]=4 90 B11R1.172 CC(C)CNCc1nccs1 AIFCHEM-94572982190 [0,0,0,0,0,2|0,0,0]=2 91 B11R1.172 CN(C)CCNc1ncco1 AIFCHEM-94564766578 [0,0,0,0,0,2|1,1,0]=4