0 B23R3.1974194 c1ccc(cc1)C(NCC2CCCCC2)c3ccccn3 AIFCHEM-5935277574 [0,0,0,0,0,0|3,0,0]=3 1 B24R3.6559 CC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-6008985279 [0,1,0,0,0,0|2,0,0]=3 2 B24R3.6559 CN(CC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-5596031349 [0,1,0,0,0,0|2,0,0]=3 3 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CC=CCC3 AIFCHEM-5918300062 [0,1,0,0,0,0|0,0,3]=4 4 B24R3.6559 O=C(CC(c1ccccc1)c2ccccc2)N3CCCOC3 AIFCHEM-5689576138 [0,1,0,0,0,0|1,0,1]=3 5 B24R3.21177 Brc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-5617161618 [0,1,0,0,0,0|2,0,0]=3 6 B24R3.21177 Brc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 AIFCHEM-5655968158 [0,1,0,0,0,0|3,0,0]=4 7 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-94577588257 [0,1,0,0,0,0|2,0,0]=3 8 B24R3.21177 Clc1cccc(c1)C(NCC2CCCCO2)c3ccccc3 AIFCHEM-94560314511 [0,1,0,0,0,0|3,0,0]=4 9 B24R3.21177 Clc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 AIFCHEM-94577590089 [0,1,0,0,0,0|3,0,0]=4 10 B24R3.21177 Fc1cccc(c1)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-6267277513 [0,1,0,0,0,0|2,0,0]=3 11 B24R3.21177 Fc1cccc(c1)C(NCC2CCOCC2)c3ccccc3 AIFCHEM-6266883248 [0,1,0,0,0,0|3,0,0]=4 12 B24R3.21177 Fc1cccc(c1)C(NCC2CCSCC2)c3ccccc3 AIFCHEM-6245909071 [0,1,0,0,0,0|3,0,0]=4 13 B24R3.21837 Brc1ccccc1C(NCC2CCOCC2)c3ccccc3 AIFCHEM-5834887261 [0,1,0,0,0,0|3,0,0]=4 14 B24R3.35684 CC1CCCCC1NCC(c2ccccc2)c3ccccc3 AIFCHEM-5645156247 [0,1,0,0,0,0|2,0,0]=3 15 B24R3.35684 C[C@@H]1CCCC[C@@H]1NCC(c2ccccc2)c3ccccc3 AIFCHEM-5812899946 [0,1,0,0,0,0|2,0,0]=3 16 B24R3.35684 C[C@@H]1CCCC[C@H]1NCC(c2ccccc2)c3ccccc3 AIFCHEM-5718717221 [0,1,0,0,0,0|2,0,0]=3 17 B24R3.35684 C[C@H]1CCCC[C@H]1NCC(c2ccccc2)c3ccccc3 AIFCHEM-94605787790 [0,1,0,0,0,0|2,0,0]=3 18 B24R3.35684 O[C@@H]1CCOC[C@H]1NCC(c2ccccc2)c3ccccc3 AIFCHEM-94604674908 [0,1,0,0,0,0|3,0,0]=4 19 B24R3.35684 O[C@H]1CCOC[C@@H]1NCC(c2ccccc2)c3ccccc3 AIFCHEM-94606107764 [0,1,0,0,0,0|3,0,0]=4 20 B24R3.67298 CC(NC1CCCCC1)C(c2ccccc2)c3ccccc3 AIFCHEM-94539529333 [0,1,0,0,0,0|2,0,0]=3 21 B24R3.67298 CC(NC1CCSCC1)C(c2ccccc2)c3ccccc3 AIFCHEM-94574184709 [0,1,0,0,0,0|3,0,0]=4 22 B24R3.67298 CN(CC1CCCCC1)C(c2ccccc2)c3ccccc3 AIFCHEM-5713813850 [0,1,0,0,0,0|2,0,0]=3 23 B24R3.89641 Brc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-94527709542 [0,1,0,0,0,0|2,0,0]=3 24 B24R3.89641 Brc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 AIFCHEM-94527711374 [0,1,0,0,0,0|3,0,0]=4 25 B24R3.89641 Cc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-5592895182 [0,1,0,0,0,0|2,0,0]=3 26 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-94539041075 [0,1,0,0,0,0|2,0,0]=3 27 B24R3.89641 Clc1ccc(cc1)C(NCC2CCCCC2)c3cccnc3 AIFCHEM-94523574803 [0,1,0,0,0,0|3,0,0]=4 28 B24R3.89641 Clc1ccc(cc1)C(NCC2CCSCC2)c3ccccc3 AIFCHEM-94539042907 [0,1,0,0,0,0|3,0,0]=4 29 B24R3.89641 Clc1ccc(cc1)[C@@H](NCC2CCCCC2)c3ccccc3 AIFCHEM-5924742650 [0,1,0,0,0,0|2,0,0]=3 30 B24R3.89641 Clc1ccc(cc1)[C@@H](NCC2CCSCC2)c3ccccc3 AIFCHEM-5940963117 [0,1,0,0,0,0|3,0,0]=4 31 B24R3.89641 Clc1ccc(cc1)[C@H](NCC2CCCCC2)c3ccccc3 AIFCHEM-6230766987 [0,1,0,0,0,0|2,0,0]=3 32 B24R3.89641 Clc1ccc(cc1)[C@H](NCC2CCSCC2)c3ccccc3 AIFCHEM-6233878361 [0,1,0,0,0,0|3,0,0]=4 33 B24R3.89641 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-5789442372 [0,1,0,0,0,0|2,0,0]=3 34 B24R3.89720 CN1CCC(CC1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-94583617046 [0,1,0,0,0,0|3,0,0]=4 35 B24R3.243784 OC1CCCC(C1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-6397826303 [0,1,0,0,0,0|2,0,0]=3 36 B24R3.243784 O[C@@H]1CCC[C@@H](C1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-6389295272 [0,1,0,0,0,0|2,0,0]=3 37 B24R3.243784 O[C@@H]1CCC[C@H](C1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-6465915450 [0,1,0,0,0,0|2,0,0]=3 38 B24R3.243784 O[C@H]1CCC[C@@H](C1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-94549110460 [0,1,0,0,0,0|2,0,0]=3 39 B24R3.243784 O[C@H]1CCC[C@H](C1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-6506455137 [0,1,0,0,0,0|2,0,0]=3 40 B24R3.1994292 CC(NCC1CCCCC1)(c2ccccc2)c3ccccc3 AIFCHEM-6241901152 [0,1,0,0,0,0|2,0,0]=3 41 B24R3.1994292 CC(NCC1CCOCC1)(c2ccccc2)c3ccccc3 AIFCHEM-6241398500 [0,1,0,0,0,0|3,0,0]=4 42 B22R2.15786 CCCCCCCNC(c1ccccc1)c2ccccc2 AIFCHEM-94589459929 [0,0,1,0,0,0|2,0,0]=3 43 B22R2.15786 CCCCCCNCC(c1ccccc1)c2ccccc2 AIFCHEM-6121660742 [0,0,1,0,0,0|2,0,0]=3 44 B22R2.15786 CCCCCNCCC(c1ccccc1)c2ccccc2 AIFCHEM-94551430228 [0,0,1,0,0,0|0,0,0]=1 45 B22R2.150464 CCCC[C@@H](C)NCC(c1ccccc1)c2ccccc2 AIFCHEM-94596954680 [0,0,1,0,0,0|2,0,0]=3 46 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2CNC4CCCSC4 AIFCHEM-6207688217 [0,0,0,1,0,0|3,0,0]=4 47 B24R4.1585413 c1ccc2c(c1)-c3ccccc3C2NCC4CCOCC4 AIFCHEM-5753729800 [0,0,0,1,0,0|3,0,0]=4 48 B22R3.3728 c1ccc(cc1)C(NC2CCCCC2)c3ccncc3 AIFCHEM-94601795398 [0,0,0,0,1,0|3,0,0]=4 49 B22R3.74289 c1ccc(cc1)C(CNC2CCCC2)c3ccccc3 AIFCHEM-94542379324 [0,0,0,0,1,0|2,0,0]=3 50 B22R3.74289 c1ccc(cc1)C(CNC2CCOC2)c3ccccc3 AIFCHEM-94559755209 [0,0,0,0,1,0|3,0,0]=4 51 B22R3.74289 c1ccc(cc1)C(CN[C@@H]2CCOC2)c3ccccc3 AIFCHEM-94564368588 [0,0,0,0,1,0|3,0,0]=4 52 B22R3.74289 c1ccc(cc1)C(CN[C@H]2CCOC2)c3ccccc3 AIFCHEM-94585472411 [0,0,0,0,1,0|3,0,0]=4 53 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccccc3 AIFCHEM-6036987916 [0,0,0,0,1,0|2,0,0]=3 54 B22R3.74289 c1ccc(cc1)C(NCC2CCCC2)c3ccncc3 AIFCHEM-5779700717 [0,0,0,0,1,0|3,0,0]=4 55 B24R3.5775 c1ccc(cc1)CN(CCC2CCCCC2)c3ccccc3 AIFCHEM-94523821799 [0,0,0,0,0,1|2,0,0]=3 56 B24R3.5791 c1ccc(cc1)C(CCNC2CCCCC2)c3ccccc3 AIFCHEM-94597080661 [0,0,0,0,0,1|1,0,0]=2 57 B24R3.5791 c1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-94593639346 [0,0,0,0,0,1|1,0,0]=2 58 B24R3.5791 c1ccc(cc1)C(NCCN2CCCCC2)c3ccccc3 AIFCHEM-94531647109 [0,0,0,0,0,1|0,0,0]=1 59 B24R3.5791 c1ccc(cc1)C(NCCN2CCSCC2)c3ccccn3 AIFCHEM-94571541337 [0,0,0,0,0,1|2,0,0]=3 60 B24R3.5791 c1ccc(nc1)C(NCCN2CCCCC2)c3ccccn3 AIFCHEM-94531648731 [0,0,0,0,0,1|2,0,0]=3 61 B24R3.5791 c1ccc(nc1)C(NCCN2CCSCC2)c3ccccn3 AIFCHEM-94571537251 [0,0,0,0,0,1|3,0,0]=4 62 B24R3.3681135 c1ccc(cc1)C(CNC2CCCCCC2)c3ccccc3 AIFCHEM-5669737903 [0,0,0,0,0,1|2,0,0]=3 63 B21R2.2905 CCCNCCCC(c1ccccc1)c2ccccc2 AIFCHEM-94569015661 [1,0,1,0,0,0|1,0,0]=3 64 B21R2.2905 CSCCCNCC(c1ccccc1)c2ccccc2 AIFCHEM-94529056889 [1,0,1,0,0,0|1,0,0]=3 65 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Br AIFCHEM-94589460273 [0,1,1,0,0,0|2,0,0]=4 66 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)Cl AIFCHEM-94589459930 [0,1,1,0,0,0|2,0,0]=4 67 B23R2.17646 CCCCCCCNC(c1ccccc1)c2cccc(c2)F AIFCHEM-94589460275 [0,1,1,0,0,0|2,0,0]=4 68 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Br AIFCHEM-94527707557 [0,1,1,0,0,0|2,0,0]=4 69 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)C AIFCHEM-94589459933 [0,1,1,0,0,0|2,0,0]=4 70 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)Cl AIFCHEM-94589457140 [0,1,1,0,0,0|2,0,0]=4 71 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)F AIFCHEM-94589460276 [0,1,1,0,0,0|2,0,0]=4 72 B23R2.17649 CCCCCCCNC(c1ccccc1)c2ccc(cc2)O AIFCHEM-94602882787 [0,1,1,0,0,0|2,0,0]=4 73 B23R2.17649 CCCCCCCN[C@@H](c1ccccc1)c2ccc(cc2)Cl AIFCHEM-94589459261 [0,1,1,0,0,0|2,0,0]=4 74 B23R2.17649 CCCCCCCN[C@H](c1ccccc1)c2ccc(cc2)Cl AIFCHEM-94589459262 [0,1,1,0,0,0|2,0,0]=4 75 B23R2.23257 CCCC(C)NCCCC(c1ccccc1)c2ccccc2 AIFCHEM-94606115310 [0,1,1,0,0,0|2,0,0]=4 76 B23R2.26823 CCC(C)CNCCCC(c1ccccc1)c2ccccc2 AIFCHEM-5732277071 [0,1,1,0,0,0|2,0,0]=4 77 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccccc2 AIFCHEM-6008121211 [0,1,1,0,0,0|1,0,0]=3 78 B23R2.28171 CCCCCCCCNC(c1ccccc1)c2ccncc2 AIFCHEM-5709267687 [0,1,1,0,0,0|2,0,0]=4 79 B23R2.28171 CCCCCNCCCC(c1ccccc1)c2ccccc2 AIFCHEM-94551430102 [0,1,1,0,0,0|0,0,0]=2 80 B23R2.28171 CSCCCNCCCC(c1ccccc1)c2ccccc2 AIFCHEM-94546179803 [0,1,1,0,0,0|1,0,0]=3 81 B23R2.33724 CCCCC(C)NCCC(c1ccccc1)c2ccccc2 AIFCHEM-94541401840 [0,1,1,0,0,0|0,0,0]=2 82 B23R2.62314 CCCCCCC(C)NC(c1ccccc1)c2ccccc2 AIFCHEM-6036996530 [0,1,1,0,0,0|2,0,0]=4 83 B23R2.62314 CCCCCCN(C)CC(c1ccccc1)c2ccccc2 AIFCHEM-6038828901 [0,1,1,0,0,0|2,0,0]=4 84 B23R2.62314 CCOCCNC(=O)CC(c1ccccc1)c2ccccc2 AIFCHEM-94548616258 [0,1,1,0,0,0|1,0,1]=4 85 B23R2.62314 CSCCCNC(=O)CC(c1ccccc1)c2ccccc2 AIFCHEM-94529064206 [0,1,1,0,0,0|1,0,1]=4 86 B23R2.63751 CCCCCCCN(C)C(c1ccccc1)c2ccccc2 AIFCHEM-94589453154 [0,1,1,0,0,0|2,0,0]=4 87 B23R2.63751 CCCCCCNC(C)C(c1ccccc1)c2ccccc2 AIFCHEM-6122757490 [0,1,1,0,0,0|2,0,0]=4 88 B23R2.151646 CCCCCCCNC(C)(c1ccccc1)c2ccccc2 AIFCHEM-94589455635 [0,1,1,0,0,0|2,0,0]=4 89 B23R2.178741 CCCCCN(C)CCC(c1ccccc1)c2ccccc2 AIFCHEM-94520246274 [0,1,1,0,0,0|0,0,0]=2 90 B23R2.485364 CCCCCCCNC(c1ccccc1)c2ccccc2Br AIFCHEM-94589460272 [0,1,1,0,0,0|2,0,0]=4 91 B23R2.78354 CCCC(C)N(C)CCC(c1ccccc1)c2ccccc2 AIFCHEM-94520246181 [0,1,1,0,0,0|0,0,0]=2 92 B23R2.763176 CCC(C)CN(C)CCC(c1ccccc1)c2ccccc2 AIFCHEM-94520252484 [0,1,1,0,0,0|0,0,0]=2 93 B23R2.973169 CCCC[C@@H](C)NC(C)C(c1ccccc1)c2ccccc2 AIFCHEM-94596953827 [0,1,1,0,0,0|2,0,0]=4 94 B23R2.35471 CCCN(CC)C(=O)CC(c1ccccc1)c2ccccc2 AIFCHEM-98364586790 [0,1,1,0,0,0|0,0,1]=3 95 B23R2.35471 CCN(CCF)C(=O)CC(c1ccccc1)c2ccccc2 AIFCHEM-98364620746 [0,1,1,0,0,0|1,0,1]=4 96 B23R2.485288 CCCN(CCC(c1ccccc1)c2ccccc2)C(=O)C AIFCHEM-94686347231 [0,1,1,0,0,0|0,0,1]=3 97 B23R2.529032 CCCC(CCC)NCC(c1ccccc1)c2ccccc2 AIFCHEM-5792977219 [0,1,1,0,0,0|2,0,0]=4 98 B23R2.1040931 CCC(=O)N(CC)CCC(c1ccccc1)c2ccccc2 AIFCHEM-95157518524 [0,1,1,0,0,0|0,0,1]=3 99 B23R2.1040931 CCN(CCC(c1ccccc1)c2ccccc2)C(=O)CO AIFCHEM-100298235215 [0,1,1,0,0,0|1,0,1]=4 100 B23R3.16362 Brc1cccc(c1)C(NC2CCCCC2)c3ccccc3 AIFCHEM-94601795043 [0,1,0,0,1,0|2,0,0]=4 101 B23R3.16362 Clc1cccc(c1)C(NC2CCCCC2)c3ccccc3 AIFCHEM-94601794700 [0,1,0,0,1,0|2,0,0]=4 102 B23R3.16468 O=C1CN(CCO1)CC(c2ccccc2)c3ccccc3 AIFCHEM-5821477497 [0,1,0,0,1,0|1,0,1]=4 103 B23R3.26514 C[C@@H]1CCCCN1CC(c2ccccc2)c3ccccc3 AIFCHEM-5693962344 [0,1,0,0,1,0|0,0,0]=2 104 B23R3.26514 C[C@H]1CCCCN1CC(c2ccccc2)c3ccccc3 AIFCHEM-94588088126 [0,1,0,0,1,0|0,0,0]=2 105 B23R3.38539 Brc1ccccc1C(NC2CCCCC2)c3ccccc3 AIFCHEM-94601795042 [0,1,0,0,1,0|2,0,0]=4 106 B23R3.68581 Brc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 AIFCHEM-94601795044 [0,1,0,0,1,0|2,0,0]=4 107 B23R3.68581 Cc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 AIFCHEM-94601794703 [0,1,0,0,1,0|2,0,0]=4 108 B23R3.68581 Clc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 AIFCHEM-94539039007 [0,1,0,0,1,0|2,0,0]=4 109 B23R3.68581 Clc1ccc(cc1)[C@@H](NC2CCCCC2)c3ccccc3 AIFCHEM-94601794031 [0,1,0,0,1,0|2,0,0]=4 110 B23R3.68581 Clc1ccc(cc1)[C@H](NC2CCCCC2)c3ccccc3 AIFCHEM-94601794032 [0,1,0,0,1,0|2,0,0]=4 111 B23R3.68581 Fc1ccc(cc1)C(NC2CCCCC2)c3ccccc3 AIFCHEM-94549724275 [0,1,0,0,1,0|2,0,0]=4 112 B23R3.1995413 CN(C1CCCCC1)C(c2ccccc2)c3ccccc3 AIFCHEM-94601787924 [0,1,0,0,1,0|2,0,0]=4 113 B23R3.1995413 O=C(C(c1ccccc1)c2ccccc2)N3CCCOC3 AIFCHEM-5771716774 [0,1,0,0,1,0|1,0,1]=4 114 B23R3.136526 Brc1cccc(c1)C(NCC2CCCC2)c3ccccc3 AIFCHEM-5644342169 [0,1,0,0,1,0|2,0,0]=4 115 B23R3.136526 Clc1cccc(c1)C(NCC2CCCC2)c3ccccc3 AIFCHEM-94577591907 [0,1,0,0,1,0|2,0,0]=4 116 B23R3.155183 Brc1ccccc1C(NCC2CCCC2)c3ccccc3 AIFCHEM-5795617764 [0,1,0,0,1,0|2,0,0]=4 117 B23R3.1300508 Brc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 AIFCHEM-94527713192 [0,1,0,0,1,0|2,0,0]=4 118 B23R3.1300508 Clc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 AIFCHEM-94539044725 [0,1,0,0,1,0|2,0,0]=4 119 B23R3.1300508 Clc1ccc(cc1)[C@@H](NCC2CCCC2)c3ccccc3 AIFCHEM-5895093002 [0,1,0,0,1,0|2,0,0]=4 120 B23R3.1300508 Clc1ccc(cc1)[C@H](NCC2CCCC2)c3ccccc3 AIFCHEM-6233161634 [0,1,0,0,1,0|2,0,0]=4 121 B23R3.1300508 Fc1ccc(cc1)C(NCC2CCCC2)c3ccccc3 AIFCHEM-5874853150 [0,1,0,0,1,0|2,0,0]=4 122 B23R3.10076806 CC1(CCCC1)CNC(c2ccccc2)c3ccccc3 AIFCHEM-6008319260 [0,1,0,0,1,0|2,0,0]=4 123 B25R3.24989 Brc1cccc(c1)CC(NCC2CCCCC2)c3ccccc3 AIFCHEM-94606651541 [0,1,0,0,0,1|2,0,0]=4 124 B25R3.25239 Brc1cccc(c1)N(CCC2CCCCC2)Cc3ccccc3 AIFCHEM-94567204314 [0,1,0,0,0,1|2,0,0]=4 125 B25R3.83042 C[C@@H](NC(Cc1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-94567560804 [0,1,0,0,0,1|2,0,0]=4 126 B25R3.83042 C[C@H](NC(Cc1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-94578247231 [0,1,0,0,0,1|2,0,0]=4 127 B25R3.114826 Oc1ccc(cc1)N(CCC2CCCCC2)Cc3ccccc3 AIFCHEM-94560142922 [0,1,0,0,0,1|2,0,0]=4 128 B25R3.20636 CC(NCC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-6117307199 [0,1,0,0,0,1|1,0,0]=3 129 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-94601791922 [0,1,0,0,0,1|1,0,0]=3 130 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCOCC3 AIFCHEM-5696852920 [0,1,0,0,0,1|2,0,0]=4 131 B25R3.20636 CN(CCC(c1ccccc1)c2ccccc2)C3CCSCC3 AIFCHEM-94520246186 [0,1,0,0,0,1|2,0,0]=4 132 B25R3.20636 C[C@@H](NCC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-94567563332 [0,1,0,0,0,1|1,0,0]=3 133 B25R3.20636 C[C@H](NCC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-94578249759 [0,1,0,0,0,1|1,0,0]=3 134 B25R3.25375 CN1CCCC(C1)CNCC(c2ccccc2)c3ccccc3 AIFCHEM-94581118898 [0,1,0,0,0,1|2,0,0]=4 135 B25R3.25375 C[C@@H]1CCCC(C1)NCCC(c2ccccc2)c3ccccc3 AIFCHEM-94588390313 [0,1,0,0,0,1|1,0,0]=3 136 B25R3.26173 CC1CCCCC1NCCC(c2ccccc2)c3ccccc3 AIFCHEM-94597085059 [0,1,0,0,0,1|1,0,0]=3 137 B25R3.61794 Brc1ccccc1C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-5877036849 [0,1,0,0,0,1|1,0,0]=3 138 B25R3.61794 Oc1ccccc1C(NCCN2CCCCC2)c3ccccc3 AIFCHEM-94531647055 [0,1,0,0,0,1|0,0,0]=2 139 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccccc3 AIFCHEM-94565014327 [0,1,0,0,0,1|1,0,0]=3 140 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccccn3 AIFCHEM-94565008598 [0,1,0,0,0,1|2,0,0]=4 141 B25R3.82807 CC(CC1CCCCC1)NC(c2ccccc2)c3ccncc3 AIFCHEM-94565010521 [0,1,0,0,0,1|2,0,0]=4 142 B25R3.82807 CN(CC1CCCCC1)CC(c2ccccc2)c3ccccc3 AIFCHEM-5711751042 [0,1,0,0,0,1|1,0,0]=3 143 B25R3.114844 CC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 AIFCHEM-5745035424 [0,1,0,0,0,1|1,0,0]=3 144 B25R3.114844 FC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 AIFCHEM-94597085613 [0,1,0,0,0,1|1,0,0]=3 145 B25R3.114844 OC1CCC(CC1)NCCC(c2ccccc2)c3ccccc3 AIFCHEM-5762834957 [0,1,0,0,0,1|1,0,0]=3 146 B25R3.114844 O[C@H]1CC[C@@H](CC1)CNCC(c2ccccc2)c3ccccc3 AIFCHEM-6505731494 [0,1,0,0,0,1|1,0,0]=3 147 B25R3.121526 Brc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-94527711753 [0,1,0,0,0,1|1,0,0]=3 148 B25R3.121526 Cc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-5592708666 [0,1,0,0,0,1|1,0,0]=3 149 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-5771379000 [0,1,0,0,0,1|1,0,0]=3 150 B25R3.121526 Clc1ccc(cc1)C(NCCC2CCCCC2)c3cccnc3 AIFCHEM-94523577014 [0,1,0,0,0,1|2,0,0]=4 151 B25R3.121526 Clc1ccc(cc1)C(NCCN2CCCCC2)c3ccccn3 AIFCHEM-94531651499 [0,1,0,0,0,1|1,0,0]=3 152 B25R3.121526 Clc1ccc(cc1)[C@@H](NCCC2CCCCC2)c3ccccc3 AIFCHEM-5925269690 [0,1,0,0,0,1|1,0,0]=3 153 B25R3.121526 Clc1ccc(cc1)[C@H](NCCC2CCCCC2)c3ccccc3 AIFCHEM-6209904444 [0,1,0,0,0,1|1,0,0]=3 154 B25R3.121526 Fc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-94549728554 [0,1,0,0,0,1|1,0,0]=3 155 B25R3.121526 Oc1ccc(cc1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-94602886983 [0,1,0,0,0,1|1,0,0]=3 156 B25R3.2033538 CC(NCC1CCCCC1)C(c2ccccc2)c3ccccc3 AIFCHEM-5742302297 [0,1,0,0,0,1|1,0,0]=3 157 B25R3.2033538 CN(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 AIFCHEM-5780594201 [0,1,0,0,0,1|1,0,0]=3 158 B25R3.2577903 Brc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-5663786000 [0,1,0,0,0,1|1,0,0]=3 159 B25R3.2577903 Clc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-94577590468 [0,1,0,0,0,1|1,0,0]=3 160 B25R3.2577903 Fc1cccc(c1)C(NCCC2CCCCC2)c3ccccc3 AIFCHEM-6245909074 [0,1,0,0,0,1|1,0,0]=3 161 B25R3.3975663 CC(NCCC1CCCCC1)(c2ccccc2)c3ccccc3 AIFCHEM-6241901158 [0,1,0,0,0,1|1,0,0]=3 162 B25R3.6509934 CN(CC(c1ccccc1)c2ccccc2)C3CCCCCC3 AIFCHEM-5860807255 [0,1,0,0,0,1|2,0,0]=4 163 B25R3.32596367 CC(NC1CCCCCC1)C(c2ccccc2)c3ccccc3 AIFCHEM-5606089921 [0,1,0,0,0,1|2,0,0]=4 164 B25R3.1136 CN(CC(c1ccccc1)c2ccccc2)C3CCC(CC3)O AIFCHEM-94607033314 [0,2,0,0,0,0|2,0,0]=4 165 B25R3.1136 CN(CC(c1ccccc1)c2ccccc2)[C@H]3CC[C@@H](CC3)O AIFCHEM-94580780306 [0,2,0,0,0,0|2,0,0]=4 166 B25R3.1136 CN1CCN(CC1)C(=O)CC(c2ccccc2)c3ccccc3 AIFCHEM-5845543710 [0,2,0,0,0,0|1,0,1]=4 167 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)Br)C3CCCCC3 AIFCHEM-94527712945 [0,2,0,0,0,0|2,0,0]=4 168 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 AIFCHEM-5771425674 [0,2,0,0,0,0|2,0,0]=4 169 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)F)C3CCCCC3 AIFCHEM-5852261061 [0,2,0,0,0,0|2,0,0]=4 170 B25R3.23513 CC(NC(c1ccccc1)c2ccc(cc2)O)C3CCCCC3 AIFCHEM-94602888175 [0,2,0,0,0,0|2,0,0]=4 171 B25R3.23513 CC(N[C@@H](c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 AIFCHEM-5895113807 [0,2,0,0,0,0|2,0,0]=4 172 B25R3.23513 CC(N[C@H](c1ccccc1)c2ccc(cc2)Cl)C3CCCCC3 AIFCHEM-6234006143 [0,2,0,0,0,0|2,0,0]=4 173 B25R3.23513 C[C@@H](NC(c1ccccc1)c2ccc(cc2)Br)C3CCCCC3 AIFCHEM-94567563070 [0,2,0,0,0,0|2,0,0]=4 174 B25R3.23513 Cc1ccc(cc1)C(NC(C)C2CCCCC2)c3ccccc3 AIFCHEM-5643410764 [0,2,0,0,0,0|2,0,0]=4 175 B25R3.24883 CCC(NC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-94593635199 [0,2,0,0,0,0|2,0,0]=4 176 B25R3.24883 CCN(CC(c1ccccc1)c2ccccc2)C3CCCCC3 AIFCHEM-5687204282 [0,2,0,0,0,0|2,0,0]=4 177 B25R3.25109 CC(NC(c1ccccc1)c2cccc(c2)Br)C3CCCCC3 AIFCHEM-5656018511 [0,2,0,0,0,0|2,0,0]=4 178 B25R3.25109 CC(NC(c1ccccc1)c2cccc(c2)Cl)C3CCCCC3 AIFCHEM-94577591660 [0,2,0,0,0,0|2,0,0]=4 179 B25R3.25109 CC(NC(c1ccccc1)c2cccc(c2)F)C3CCCCC3 AIFCHEM-6267055415 [0,2,0,0,0,0|2,0,0]=4 180 B25R3.25109 C[C@@H](NC(c1ccccc1)c2cccc(c2)Br)C3CCCCC3 AIFCHEM-94567556864 [0,2,0,0,0,0|2,0,0]=4 181 B25R3.25109 C[C@@H](NC(c1ccccc1)c2cccc(c2)Cl)C3CCCCC3 AIFCHEM-6180511356 [0,2,0,0,0,0|2,0,0]=4 182 B25R3.45469 CC(NC(c1ccccc1)c2ccccc2Br)C3CCCCC3 AIFCHEM-5876832385 [0,2,0,0,0,0|2,0,0]=4 183 B25R3.2609278 CC1COCCN1C(=O)CC(c2ccccc2)c3ccccc3 AIFCHEM-94530741432 [0,2,0,0,0,0|1,0,1]=4 184 B25R3.2609278 C[C@@H]1COCCN1C(=O)CC(c2ccccc2)c3ccccc3 AIFCHEM-94569775080 [0,2,0,0,0,0|1,0,1]=4 185 B25R3.2609278 C[C@H]1COCCN1C(=O)CC(c2ccccc2)c3ccccc3 AIFCHEM-5774009735 [0,2,0,0,0,0|1,0,1]=4 186 B25R3.117189 Clc1ccc(cc1Cl)C(NCC2CCCCC2)c3ccccc3 AIFCHEM-5726393554 [0,2,0,0,0,0|2,0,0]=4 187 B25R3.45336 CC1CCCC(C1NCC(c2ccccc2)c3ccccc3)C AIFCHEM-94569457455 [0,2,0,0,0,0|2,0,0]=4 188 B25R3.137631 COC1CCCCC1NCC(c2ccccc2)c3ccccc3 AIFCHEM-5946327173 [0,2,0,0,0,0|2,0,0]=4 189 B25R3.2958327 CC(N[C@@H]1CCCC[C@@H]1C)C(c2ccccc2)c3ccccc3 AIFCHEM-94605786937 [0,2,0,0,0,0|2,0,0]=4 190 B25R3.2958327 CC(N[C@@H]1CCCC[C@H]1C)C(c2ccccc2)c3ccccc3 AIFCHEM-5765315324 [0,2,0,0,0,0|2,0,0]=4 191 B25R3.2958327 CC(N[C@@H]1CCCC[C@H]1F)C(c2ccccc2)c3ccccc3 AIFCHEM-5810277814 [0,2,0,0,0,0|2,0,0]=4 192 B25R3.2958327 CC1CCCCC1NC(C)C(c2ccccc2)c3ccccc3 AIFCHEM-5636201838 [0,2,0,0,0,0|2,0,0]=4 193 B25R3.120105 CC(N[C@H]1CC[C@@H](CC1)C)C(c2ccccc2)c3ccccc3 AIFCHEM-94605980875 [0,2,0,0,0,0|2,0,0]=4 194 B25R3.120105 CC(N[C@H]1CC[C@H](CC1)C)C(c2ccccc2)c3ccccc3 AIFCHEM-5986053852 [0,2,0,0,0,0|2,0,0]=4 195 B25R3.120105 CC1CCC(CC1)NC(C)C(c2ccccc2)c3ccccc3 AIFCHEM-94564652759 [0,2,0,0,0,0|2,0,0]=4 196 B25R3.2580977 CC1CCCC(C1)NC(C)C(c2ccccc2)c3ccccc3 AIFCHEM-6228996259 [0,2,0,0,0,0|2,0,0]=4 197 B25R3.114827 Fc1ccc(cc1)C(NCC2CCCCC2)c3ccc(cc3)F AIFCHEM-5758875696 [0,2,0,0,0,0|2,0,0]=4 198 B25R3.31048 CCC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-5888270965 [0,2,0,0,0,0|2,0,0]=4 199 B25R3.31048 OCC1CCC(CC1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-6470779135 [0,2,0,0,0,0|2,0,0]=4 200 B25R3.31048 OC[C@H]1CC[C@@H](CC1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-6499465928 [0,2,0,0,0,0|2,0,0]=4 201 B25R3.31048 OC[C@H]1CC[C@H](CC1)NCC(c2ccccc2)c3ccccc3 AIFCHEM-6497541242 [0,2,0,0,0,0|2,0,0]=4 202 B25R3.17226985 CC1(CCC(CC1)NCC(c2ccccc2)c3ccccc3)C AIFCHEM-94588552189 [0,2,0,0,0,0|2,0,0]=4 203 B25R3.17226985 FC1(CCC(CC1)CNC(c2ccccc2)c3ccccc3)F AIFCHEM-6009167961 [0,2,0,0,0,0|2,0,0]=4 204 B23R3.1927729 c1ccc(cc1)C(NC2CCCCCC2)c3ccccc3 AIFCHEM-94529613790 [0,0,1,1,0,0|2,0,0]=4 205 B23R3.1974330 c1ccc(cc1)C(CCCNCC2CC2)c3ccccc3 AIFCHEM-5715383231 [0,0,1,1,0,0|2,0,0]=4 206 B23R3.3868848 c1ccc(cc1)C(CCCNC2CCC2)c3ccccc3 AIFCHEM-94576050835 [0,0,1,1,0,0|2,0,0]=4 207 B23R3.19744219 CCCCCCCNC1c2ccccc2-c3c1cccc3 AIFCHEM-94589459908 [0,0,1,1,0,0|2,0,0]=4 208 B23R3.96019 CN(CCC(c1ccccc1)c2ccccc2)C3CCC3 AIFCHEM-94576052139 [0,0,1,1,0,0|0,0,0]=2 209 B23R3.1996861 CCC(NCC(c1ccccc1)c2ccccc2)C3CC3 AIFCHEM-5663714312 [0,0,1,1,0,0|2,0,0]=4 210 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCCCC4 AIFCHEM-6266981078 [0,0,0,1,0,1|1,0,0]=3 211 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2CNCC4CCSCC4 AIFCHEM-6261321959 [0,0,0,1,0,1|2,0,0]=4 212 B25R4.1655245 c1ccc2c(c1)-c3ccccc3C2NCCC4CCCCC4 AIFCHEM-94563302920 [0,0,0,1,0,1|1,0,0]=3 213 B25R4.6446261 c1ccc2c(c1)-c3ccccc3C2CNC4CCCCCC4 AIFCHEM-94529611795 [0,0,0,1,0,1|2,0,0]=4 214 B25R4.8321664 c1ccc(cc1)C(CN2C3CCCC2CC3)c4ccccc4 AIFCHEM-6151141756 [0,0,0,1,0,1|2,0,0]=4 215 B25R4.54373159 CC(NC1c2ccccc2-c3c1cccc3)C4CCCCC4 AIFCHEM-5726360877 [0,1,0,1,0,0|2,0,0]=4 216 B25R4.8316760 c1ccc2c(c1)Oc3ccccc3C2NCC4CCCCC4 AIFCHEM-6217907658 [0,1,0,1,0,0|2,0,0]=4 217 B25R4.5851424 CC1CCC(CC1)NCC2c3ccccc3-c4c2cccc4 AIFCHEM-6260957218 [0,1,0,1,0,0|2,0,0]=4 218 B21R2.25778 COCCN(C)CC(c1ccccc1)c2ccccc2 AIFCHEM-6079434232 [0,0,1,0,1,0|1,0,0]=3 219 B21R3.47836 c1ccc(cc1)C(CN2CCSC2)c3ccccc3 AIFCHEM-94586212978 [0,0,0,0,2,0|1,0,0]=3 220 B21R3.47850 c1ccc(cc1)C(NCC2CCC2)c3ccccc3 AIFCHEM-94593637895 [0,0,0,0,2,0|2,0,0]=4 221 B23R3.4587 c1ccc(cc1)CN(CC2CCCCC2)c3ccccc3 AIFCHEM-94523819588 [0,0,0,0,1,1|2,0,0]=4 222 B25R3.6850 c1ccc(cc1)CC(Cc2ccccc2)NCC3CCCCC3 AIFCHEM-5744940302 [0,0,0,0,0,2|2,0,0]=4 223 B25R3.6850 c1ccc(cc1)CN(CCC2CCCCC2)Cc3ccccc3 AIFCHEM-94584314184 [0,0,0,0,0,2|2,0,0]=4 224 B25R3.6855 c1ccc(cc1)C(Cc2ccncc2)NCCN3CCCCC3 AIFCHEM-94530144565 [0,0,0,0,0,2|1,0,0]=3 225 B25R3.1946061 c1ccc(cc1)CC(NCC2CCCCCC2)c3ccccc3 AIFCHEM-94532084301 [0,0,0,0,0,2|2,0,0]=4 226 B25R3.2065771 c1ccc(cc1)CCC(NCC2CCCCC2)c3ccccc3 AIFCHEM-94586726405 [0,0,0,0,0,2|2,0,0]=4 227 B25R3.6854 c1ccc(cc1)C(CCCNC2CCCCC2)c3ccccc3 AIFCHEM-94601790831 [0,0,0,0,0,2|1,0,0]=3 228 B25R3.6854 c1ccc(cc1)C(CCCNC2CCCSC2)c3ccccc3 AIFCHEM-5732178485 [0,0,0,0,0,2|2,0,0]=4 229 B25R3.6854 c1ccc(cc1)C(CCCNC2CCSCC2)c3ccccc3 AIFCHEM-5732166777 [0,0,0,0,0,2|2,0,0]=4 230 B25R3.6854 c1ccc(cc1)C(CCNCC2CCCCC2)c3ccccc3 AIFCHEM-94597082729 [0,0,0,0,0,2|1,0,0]=3 231 B25R3.6854 c1ccc(cc1)C(CNCCN2CCCCC2)c3ccccc3 AIFCHEM-94531653011 [0,0,0,0,0,2|0,0,0]=2 232 B25R3.1946081 c1ccc(cc1)C(CCNC2CCCCCC2)c3ccccc3 AIFCHEM-94529610048 [0,0,0,0,0,2|1,0,0]=3 233 B25R3.1946081 c1ccc(cc1)C(CNCC2CCCCCC2)c3ccccc3 AIFCHEM-5781202606 [0,0,0,0,0,2|1,0,0]=3 234 B25R3.4239545 c1ccc(cc1)C(NCC2CCCCCCC2)c3ccccc3 AIFCHEM-94593639956 [0,0,0,0,0,2|2,0,0]=4