0 B22R3.29187 Cc1nc2cccnc2n1CCNC(=O)c3ccco3 AIFCHEM-94544459438 [0,0,0,0,0,0|2,1,1]=4 1 B23R3.7695790 Cc1ccc(s1)C(=O)NCCn2c(nc3c2nccc3)C AIFCHEM-94544454064 [0,1,0,0,0,0|2,0,1]=4 2 B23R3.7695790 Cc1nc2cccnc2n1CCNC(=O)c3cc(cs3)Cl AIFCHEM-94544457790 [0,1,0,0,0,0|2,0,1]=4 3 B23R3.9667003 Cc1ccsc1C(=O)NCCn2c(nc3c2nccc3)C AIFCHEM-94544454981 [0,1,0,0,0,0|2,0,1]=4 4 B23R3.9667003 Cc1nc2cccnc2n1CCNC(=O)c3sccc3Br AIFCHEM-94544458615 [0,1,0,0,0,0|2,0,1]=4 5 B21R2.14206 CC=Cc1ccccc1OCCNC(=O)c2ccc[nH]2 AIFCHEM-46621656183 [0,0,1,0,0,0|3,0,0]=4 6 B21R2.14206 CC=Cc1ccccc1OCCNC(=O)c2ccco2 AIFCHEM-91956278243 [0,0,1,0,0,0|2,1,0]=4 7 B21R2.14206 CC=Cc1ccccc1OCCNC(=O)c2cccs2 AIFCHEM-44122338915 [0,0,1,0,0,0|2,0,0]=3 8 B21R2.14206 CC=Cc1ccccc1OCCNC(=O)c2ccns2 AIFCHEM-46361293723 [0,0,1,0,0,0|3,0,0]=4 9 B21R2.14206 CC=Cc1ccccc1OCCNC(=O)c2cncs2 AIFCHEM-39624917720 [0,0,1,0,0,0|3,0,0]=4 10 B21R2.14206 CC=Cc1ccccc1OCCNC(=O)c2nccs2 AIFCHEM-47307512608 [0,0,1,0,0,0|3,0,0]=4 11 B23R4.3677401 O=C(c1cccs1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5932339608 [0,0,0,1,0,0|0,0,0]=1 12 B23R4.3677401 O=C(c1ccn[nH]1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5931927583 [0,0,0,1,0,0|2,0,0]=3 13 B23R4.3677401 O=C(c1ccns1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5943271664 [0,0,0,1,0,0|1,0,0]=2 14 B23R4.3677401 O=C(c1cncs1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5931974187 [0,0,0,1,0,0|1,0,0]=2 15 B23R4.3677401 O=C(c1cscn1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5985259434 [0,0,0,1,0,0|2,0,0]=3 16 B23R4.3677401 O=C(c1nc[nH]n1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5968731458 [0,0,0,1,0,0|3,0,0]=4 17 B21R3.19585 Cc1[nH]c2ccccc2c1CNC(C)c3nccs3 AIFCHEM-94559944157 [0,0,0,0,1,0|2,0,1]=4 18 B21R3.19585 Cc1sc2ccccc2c1CNC(C)c3cccs3 AIFCHEM-5857808973 [0,0,0,0,1,0|2,0,1]=4 19 B21R3.19585 Cc1sc2ccccc2c1CN[C@@H](C)c3cccs3 AIFCHEM-5635016000 [0,0,0,0,1,0|2,0,1]=4 20 B21R3.19585 Cc1sc2ccccc2c1CN[C@H](C)c3cccs3 AIFCHEM-5877196884 [0,0,0,0,1,0|2,0,1]=4 21 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2cc(cs2)Br AIFCHEM-40776335705 [0,1,1,0,0,0|2,0,0]=4 22 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2cc(cs2)C AIFCHEM-37682281527 [0,1,1,0,0,0|2,0,0]=4 23 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2cc(cs2)Cl AIFCHEM-38684524881 [0,1,1,0,0,0|2,0,0]=4 24 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2ccc(s2)Br AIFCHEM-43467500343 [0,1,1,0,0,0|2,0,0]=4 25 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2ccc(s2)C AIFCHEM-44397839219 [0,1,1,0,0,0|2,0,0]=4 26 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2ccc(s2)Cl AIFCHEM-44741746641 [0,1,1,0,0,0|2,0,0]=4 27 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2ccc(s2)F AIFCHEM-43266427783 [0,1,1,0,0,0|2,0,0]=4 28 B22R2.16760 CC=Cc1ccccc1OCCNC(=O)c2ccc(s2)I AIFCHEM-44712965465 [0,1,1,0,0,0|2,0,0]=4 29 B22R2.25317 C/C=C(\C)/c1ccccc1OCCNC(=O)c2cccs2 AIFCHEM-95966093442 [0,1,1,0,0,0|2,0,0]=4 30 B22R2.26961 CC(=Cc1ccccc1OCCNC(=O)c2cccs2)C AIFCHEM-44122313171 [0,1,1,0,0,0|2,0,0]=4 31 B22R2.389571 CC=Cc1ccccc1OCCNC(=O)c2sccc2Br AIFCHEM-41041489889 [0,1,1,0,0,0|2,0,0]=4 32 B22R2.389571 CC=Cc1ccccc1OCCNC(=O)c2sccc2C AIFCHEM-39608502363 [0,1,1,0,0,0|2,0,0]=4 33 B22R2.389571 CC=Cc1ccccc1OCCNC(=O)c2sccc2Cl AIFCHEM-44509387867 [0,1,1,0,0,0|2,0,0]=4 34 B22R2.389571 CC=Cc1ccccc1OCCNC(=O)c2sccc2F AIFCHEM-40092097164 [0,1,1,0,0,0|2,0,0]=4 35 B22R2.389571 CC=Cc1ccccc1OCCNC(=O)c2sccc2I AIFCHEM-42087214893 [0,1,1,0,0,0|2,0,0]=4 36 B22R2.147958 O=C(CCCNC(=O)c1sccc1F)Nc2ccccc2 AIFCHEM-5744427359 [0,1,1,0,0,0|1,0,1]=4 37 B22R3.28899 Cc1[nH]c2ccccc2c1CN(C)C(C)c3cccs3 AIFCHEM-6181048654 [0,1,0,0,1,0|1,0,1]=4 38 B22R3.5316392 Cc1[nH]c2ccccc2c1CNC(C)c3ccc(s3)Br AIFCHEM-5590540803 [0,1,0,0,1,0|1,0,1]=4 39 B22R3.5316392 Cc1[nH]c2ccccc2c1CNC(C)c3ccc(s3)Cl AIFCHEM-94536459841 [0,1,0,0,1,0|1,0,1]=4 40 B22R3.5316392 Cc1[nH]c2ccccc2c1CN[C@@H](C)c3cc(cs3)Br AIFCHEM-94575132909 [0,1,0,0,1,0|1,0,1]=4 41 B22R3.5316392 Cc1[nH]c2ccccc2c1CN[C@@H](C)c3ccc(s3)Cl AIFCHEM-5654305214 [0,1,0,0,1,0|1,0,1]=4 42 B22R3.5316392 Cc1[nH]c2ccccc2c1CN[C@H](C)c3ccc(s3)Br AIFCHEM-94574375898 [0,1,0,0,1,0|1,0,1]=4 43 B22R3.5316392 Cc1[nH]c2ccccc2c1CN[C@H](C)c3ccc(s3)Cl AIFCHEM-94570617719 [0,1,0,0,1,0|1,0,1]=4 44 B22R3.515925 CC=Cc1cccc2c1CCC2NC(=O)c3cccs3 AIFCHEM-44124377512 [0,0,1,1,0,0|1,0,1]=4 45 B22R3.515925 CC=Cc1cccc2c1CC[C@@H]2NC(=O)c3cccs3 AIFCHEM-74447091793 [0,0,1,1,0,0|1,0,1]=4 46 B22R3.18353 Cc1ccccc1C2=CCN(CC2)C(=O)c3ccc[nH]3 AIFCHEM-46621591046 [0,0,1,1,0,0|2,0,0]=4 47 B22R3.18353 Cc1ccccc1C2=CCN(CC2)C(=O)c3ccco3 AIFCHEM-39018695982 [0,0,1,1,0,0|1,1,0]=4 48 B22R3.18353 Cc1ccccc1C2=CCN(CC2)C(=O)c3cccs3 AIFCHEM-44122274598 [0,0,1,1,0,0|1,0,0]=3 49 B22R3.18353 Cc1ccccc1C2=CCN(CC2)C(=O)c3ccns3 AIFCHEM-46361262486 [0,0,1,1,0,0|2,0,0]=4 50 B22R3.18353 Cc1ccccc1C2=CCN(CC2)C(=O)c3cncs3 AIFCHEM-39624886483 [0,0,1,1,0,0|2,0,0]=4 51 B22R3.18353 Cc1ccccc1C2=CCN(CC2)C(=O)c3nccs3 AIFCHEM-47307481371 [0,0,1,1,0,0|2,0,0]=4 52 B22R3.18353 Cc1cccnc1C2=CCN(CC2)C(=O)c3cccs3 AIFCHEM-85450180641 [0,0,1,1,0,0|2,0,0]=4 53 B22R3.18353 Cc1cnccc1C2=CCN(CC2)C(=O)c3cccs3 AIFCHEM-36138892088 [0,0,1,1,0,0|2,0,0]=4 54 B22R3.18353 O=C(c1ccc[nH]1)N2CC=C(CC2)c3ccccc3F AIFCHEM-46621429550 [0,0,1,1,0,0|2,0,0]=4 55 B22R3.18353 O=C(c1ccco1)N2CC=C(CC2)c3ccccc3F AIFCHEM-39018603146 [0,0,1,1,0,0|1,1,0]=4 56 B22R3.18353 O=C(c1ccco1)N2CC=C(CC2)c3ccccc3O AIFCHEM-36859168096 [0,0,1,1,0,0|1,1,0]=4 57 B22R3.18353 O=C(c1cccs1)N2CC=C(CC2)c3ccccc3F AIFCHEM-44122115402 [0,0,1,1,0,0|1,0,0]=3 58 B22R3.18353 O=C(c1cccs1)N2CC=C(CC2)c3ccccc3O AIFCHEM-36138804995 [0,0,1,1,0,0|1,0,0]=3 59 B22R3.18353 O=C(c1cccs1)N2CC=C(CC2)c3ccncc3F AIFCHEM-85453639484 [0,0,1,1,0,0|2,0,0]=4 60 B22R3.18353 O=C(c1cccs1)N2CC=C(CC2)c3ccncc3O AIFCHEM-85442859065 [0,0,1,1,0,0|2,0,0]=4 61 B22R3.18353 O=C(c1cccs1)N2CC=C(CC2)c3cnccc3F AIFCHEM-36138911502 [0,0,1,1,0,0|2,0,0]=4 62 B22R3.18353 O=C(c1cccs1)N2CC=C(CC2)c3ncccc3O AIFCHEM-36138867304 [0,0,1,1,0,0|2,0,0]=4 63 B22R3.18353 O=C(c1ccns1)N2CC=C(CC2)c3ccccc3F AIFCHEM-46361169650 [0,0,1,1,0,0|2,0,0]=4 64 B22R3.18353 O=C(c1ccns1)N2CC=C(CC2)c3ccccc3O AIFCHEM-36583441750 [0,0,1,1,0,0|2,0,0]=4 65 B22R3.18353 O=C(c1cncs1)N2CC=C(CC2)c3ccccc3F AIFCHEM-39624793647 [0,0,1,1,0,0|2,0,0]=4 66 B22R3.18353 O=C(c1cncs1)N2CC=C(CC2)c3ccccc3O AIFCHEM-35979333503 [0,0,1,1,0,0|2,0,0]=4 67 B22R3.18353 O=C(c1nccs1)N2CC=C(CC2)c3ccccc3F AIFCHEM-47307388535 [0,0,1,1,0,0|2,0,0]=4 68 B22R3.18353 O=C(c1nccs1)N2CC=C(CC2)c3ccccc3O AIFCHEM-36636920607 [0,0,1,1,0,0|2,0,0]=4 69 B24R4.7253152 O=C(c1ncccn1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5931972952 [0,0,0,1,0,1|1,0,0]=3 70 B24R4.42106915 O=C(Cc1cccs1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5985361265 [0,0,0,1,0,1|0,0,0]=2 71 B24R4.42106915 O=C(Cc1cnc[nH]1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-94560444694 [0,0,0,1,0,1|2,0,0]=4 72 B24R4.42106915 O=C(Cc1cscn1)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5932552485 [0,0,0,1,0,1|2,0,0]=4 73 B24R4.42104961 O=C(NC1CCc2[nH]c3ccccc3c2C1)c4c[nH]cn4 AIFCHEM-5594624390 [0,1,0,1,0,0|2,0,0]=4 74 B24R4.42104961 O=C(NC1CCc2[nH]c3ccccc3c2C1)c4cocn4 AIFCHEM-5664247995 [0,1,0,1,0,0|2,0,0]=4 75 B24R4.42104961 O=C(NC1CCc2[nH]c3ccccc3c2C1)c4cscn4 AIFCHEM-5594362017 [0,1,0,1,0,0|2,0,0]=4 76 B24R4.42104961 O=C(N[C@@H]1CCc2[nH]c3ccccc3c2C1)c4c[nH]cn4 AIFCHEM-5758572046 [0,1,0,1,0,0|2,0,0]=4 77 B24R4.42104961 O=C(N[C@@H]1CCc2[nH]c3ccccc3c2C1)c4cscn4 AIFCHEM-5734486442 [0,1,0,1,0,0|2,0,0]=4 78 B24R4.42104961 O=C(N[C@H]1CCc2[nH]c3ccccc3c2C1)c4c[nH]cn4 AIFCHEM-5767953889 [0,1,0,1,0,0|2,0,0]=4 79 B24R4.42104961 O=C(N[C@H]1CCc2[nH]c3ccccc3c2C1)c4cocn4 AIFCHEM-5775342080 [0,1,0,1,0,0|2,0,0]=4 80 B24R4.42104961 O=C(N[C@H]1CCc2[nH]c3ccccc3c2C1)c4cscn4 AIFCHEM-5775103034 [0,1,0,1,0,0|2,0,0]=4 81 B24R4.13550018 Cc1cc(no1)C(=O)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5985363414 [0,1,0,1,0,0|2,0,0]=4 82 B24R4.13550018 Cc1csc(c1)C(=O)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5968701409 [0,1,0,1,0,0|0,0,0]=2 83 B24R4.13550018 Cc1nc(cs1)C(=O)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5985295590 [0,1,0,1,0,0|2,0,0]=4 84 B24R4.13550018 O=C(c1cc(no1)O)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5943231454 [0,1,0,1,0,0|1,1,0]=4 85 B24R4.13550018 O=C(c1ccc(s1)F)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5961607728 [0,1,0,1,0,0|0,0,0]=2 86 B24R4.13550018 O=C(c1nc(c[nH]1)Br)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-94588587802 [0,1,0,1,0,0|2,0,0]=4 87 B24R4.13550018 O=C(c1ncc(s1)Br)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5968554581 [0,1,0,1,0,0|1,0,0]=3 88 B24R4.15158860 Cc1cnoc1C(=O)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5968652937 [0,1,0,1,0,0|1,1,0]=4 89 B24R4.15158860 O=C(c1[nH]ncc1Br)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5961471925 [0,1,0,1,0,0|2,0,0]=4 90 B24R4.15158860 O=C(c1ccoc1Br)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5950796130 [0,1,0,1,0,0|2,0,0]=4 91 B24R4.15158860 O=C(c1ccsc1Cl)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5985249901 [0,1,0,1,0,0|2,0,0]=4 92 B24R4.15158860 O=C(c1cscc1Br)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5961643849 [0,1,0,1,0,0|2,0,0]=4 93 B24R4.15158860 O=C(c1occc1Br)N2CCc3c([nH]c4c3cccc4)C2 AIFCHEM-5951371545 [0,1,0,1,0,0|0,1,0]=3 94 B20R3.501 O=C(NCc1n[nH]c2c1cccc2)c3ccc[nH]3 AIFCHEM-94597332047 [1,0,0,0,1,0|2,0,0]=4 95 B20R3.501 O=C(NCc1n[nH]c2c1cccc2)c3cccs3 AIFCHEM-94597331246 [1,0,0,0,1,0|1,0,0]=3 96 B22R2.9440 CC=Cc1ccccc1OCCNC(=O)Cc2cccs2 AIFCHEM-46694179357 [0,0,1,0,0,1|2,0,0]=4 97 B22R3.3221 O=C(CCCc1c[nH]c2c1cccc2)Nc3cncs3 AIFCHEM-94535767600 [1,0,0,0,0,1|2,0,0]=4