0 B15R1.1081 CC(=O)CCNC(=O)Cc1ccccn1 AIFCHEM-94576239960 [0,0,0,0,0,0|3,0,1]=4 1 B15R1.1081 CC(C)CCCC(C)Nc1ccccc1 AIFCHEM-94552038163 [0,0,0,0,0,0|3,0,1]=4 2 B15R1.1081 CC(C)COCC(=O)Nc1ccccc1 AIFCHEM-94552042751 [0,0,0,0,0,0|3,0,0]=3 3 B15R1.1081 CC(C)COCC(=O)Nc1ccncc1 AIFCHEM-6172473925 [0,0,0,0,0,0|4,0,0]=4 4 B14R1.158 CCCCNC(=O)Cc1ccncn1 AIFCHEM-94570981189 [1,0,0,0,0,0|3,0,0]=4 5 B14R1.158 CCCCNC(=O)Cc1cncnc1 AIFCHEM-94570982623 [1,0,0,0,0,0|3,0,0]=4 6 B14R1.158 COCCNC(=O)Cc1ccncc1 AIFCHEM-94603098759 [1,0,0,0,0,0|3,0,0]=4 7 B14R1.158 CSCCNC(=O)Cc1cccnc1 AIFCHEM-94598931452 [1,0,0,0,0,0|3,0,0]=4 8 B14R1.422 CC(C)CCCNCc1cccnc1 AIFCHEM-5727447244 [1,0,0,0,0,0|3,0,0]=4 9 B14R1.422 CC(C)NCCOCc1ccccc1 AIFCHEM-94520541129 [1,0,0,0,0,0|3,0,0]=4 10 B16R1.613 CC(=CCNC(=O)C(C)c1ccccc1)C AIFCHEM-94550258285 [0,1,0,0,0,0|1,0,2]=4 11 B16R1.613 CC(=CCNC(=O)C(O)c1ccccc1)C AIFCHEM-5944374964 [0,1,0,0,0,0|1,0,2]=4 12 B16R1.613 CC(=CCNC(=O)[C@@H](C)c1ccccc1)C AIFCHEM-94550260228 [0,1,0,0,0,0|1,0,2]=4 13 B16R1.613 CC(=CCNC(=O)[C@@H](O)c1ccccc1)C AIFCHEM-94550254921 [0,1,0,0,0,0|1,0,2]=4 14 B16R1.613 CC(=CCNC(=O)[C@H](C)c1ccccc1)C AIFCHEM-5944186209 [0,1,0,0,0,0|1,0,2]=4 15 B16R1.613 CC(=CCNC(=O)[C@H](O)c1ccccc1)C AIFCHEM-94550259248 [0,1,0,0,0,0|1,0,2]=4 16 B16R1.613 CC(C(=O)NCCC(F)F)c1ccccc1 AIFCHEM-6213169576 [0,1,0,0,0,0|3,0,0]=4 17 B16R1.613 CC(C)CCNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-6098753438 [0,1,0,0,0,0|1,0,0]=2 18 B16R1.613 CC(C)CNCC(=O)N(C)c1ccccc1 AIFCHEM-94572973453 [0,1,0,0,0,0|3,0,0]=4 19 B16R1.613 CC(C)COCC(=O)N(C)c1ccccc1 AIFCHEM-94545186253 [0,1,0,0,0,0|3,0,0]=4 20 B16R1.613 C[C@@H](C(=O)NCCC(F)F)c1ccccc1 AIFCHEM-6210957888 [0,1,0,0,0,0|3,0,0]=4 21 B16R1.613 C[C@H](C(=O)NCCC(F)F)c1ccccc1 AIFCHEM-6191097849 [0,1,0,0,0,0|3,0,0]=4 22 B16R1.1067 CC(=CCNC(=O)Cc1ccc(cc1)C)C AIFCHEM-94550259334 [0,1,0,0,0,0|1,0,2]=4 23 B16R1.1067 CC(=CCNC(=O)Cc1ccc(cc1)I)C AIFCHEM-5968973500 [0,1,0,0,0,0|1,0,2]=4 24 B16R1.1067 CC(=O)CCNC(=O)Cc1ccc(cc1)Cl AIFCHEM-6235141827 [0,1,0,0,0,0|2,0,1]=4 25 B16R1.1067 CC(=O)CCNC(=O)Cc1ccc(cc1)I AIFCHEM-6215409667 [0,1,0,0,0,0|2,0,1]=4 26 B16R1.1067 CC(C)CCCC(=O)Nc1ccc(cc1)F AIFCHEM-94540074441 [0,1,0,0,0,0|2,0,0]=3 27 B16R1.1067 CC(C)CCNC(=O)Cc1ncc(cn1)Br AIFCHEM-6133239388 [0,1,0,0,0,0|3,0,0]=4 28 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)F AIFCHEM-94537684386 [0,1,0,0,0,0|2,0,0]=3 29 B16R1.1067 CN(C)CCNC(=O)Cc1ccc(cc1)I AIFCHEM-5962321528 [0,1,0,0,0,0|2,0,0]=3 30 B16R1.1067 Cc1ccc(cc1)NC(=O)CCCC(C)C AIFCHEM-94584238487 [0,1,0,0,0,0|2,0,0]=3 31 B16R1.1067 Cc1ccc(nc1)CC(=O)NCCC(C)C AIFCHEM-6094414080 [0,1,0,0,0,0|2,0,0]=3 32 B16R1.1284 CC(C)CCN(C)C(=O)Cc1ccncn1 AIFCHEM-6096923018 [0,1,0,0,0,0|3,0,0]=4 33 B16R1.1284 CC(C)CCN(C)C(=O)Cc1ncccn1 AIFCHEM-6159987414 [0,1,0,0,0,0|3,0,0]=4 34 B16R1.1284 CN(C)CCN(C)C(=O)Cc1ccncc1 AIFCHEM-94603101488 [0,1,0,0,0,0|3,0,0]=4 35 B16R1.6940 CC(CN(C)C)NC(=O)Cc1ccccn1 AIFCHEM-94576238266 [0,1,0,0,0,0|3,0,0]=4 36 B16R1.7414 CC(=CCNC(=O)Cc1ccccc1Br)C AIFCHEM-94550255288 [0,1,0,0,0,0|1,0,2]=4 37 B16R1.7414 CC(=CCNC(=O)Cc1ccccc1F)C AIFCHEM-5944030352 [0,1,0,0,0,0|1,0,2]=4 38 B16R1.7414 CC(=O)CCNC(=O)Cc1ccccc1C AIFCHEM-6218594635 [0,1,0,0,0,0|2,0,1]=4 39 B16R1.7414 CC(C)CCCC(=O)Nc1ccccc1I AIFCHEM-5899673340 [0,1,0,0,0,0|2,0,0]=3 40 B16R1.7414 CC(C)CCCC(=O)Nc1cccnc1O AIFCHEM-94551087165 [0,1,0,0,0,0|3,0,0]=4 41 B16R1.7414 CC(C)CCCC(=O)Nc1ccncc1F AIFCHEM-5958997731 [0,1,0,0,0,0|3,0,0]=4 42 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1F AIFCHEM-6098415413 [0,1,0,0,0,0|1,0,0]=2 43 B16R1.7414 CC(C)CCNC(=O)Cc1ccccc1I AIFCHEM-6132347021 [0,1,0,0,0,0|1,0,0]=2 44 B16R1.7414 CC(C)CCNC(=O)Cc1ncccc1Cl AIFCHEM-6135262449 [0,1,0,0,0,0|2,0,0]=3 45 B16R1.7414 CN(C)CCCC(=O)Nc1ccccc1Br AIFCHEM-94526566215 [0,1,0,0,0,0|3,0,0]=4 46 B16R1.7414 CN(C)CCCC(=O)Nc1ccccc1F AIFCHEM-94582114695 [0,1,0,0,0,0|3,0,0]=4 47 B16R1.7414 CN(C)CCCC(=O)Nc1ccccc1O AIFCHEM-94525234743 [0,1,0,0,0,0|3,0,0]=4 48 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1Cl AIFCHEM-94537682953 [0,1,0,0,0,0|2,0,0]=3 49 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1F AIFCHEM-94537684624 [0,1,0,0,0,0|2,0,0]=3 50 B16R1.7414 CN(C)CCNC(=O)Cc1ccccc1O AIFCHEM-5916620778 [0,1,0,0,0,0|2,0,0]=3 51 B16R1.7414 CN(C)CCNC(=O)Cc1cccnc1Cl AIFCHEM-5975476859 [0,1,0,0,0,0|3,0,0]=4 52 B16R1.7414 CN(C)CCNC(=O)Cc1ncccc1Br AIFCHEM-5915847537 [0,1,0,0,0,0|3,0,0]=4 53 B16R1.7414 CN(C)CCNC(=O)Cn1ccccc1=O AIFCHEM-5916288639 [0,1,0,0,0,0|3,0,0]=4 54 B16R1.7414 Cc1ccccc1CC(=O)NCCC(F)F AIFCHEM-6189733391 [0,1,0,0,0,0|3,0,0]=4 55 B16R1.7414 Cc1ccccc1NC(=O)CCCC(C)C AIFCHEM-5945722048 [0,1,0,0,0,0|2,0,0]=3 56 B16R1.7414 Cc1ccccc1NC(=O)CNCC(C)C AIFCHEM-94572975614 [0,1,0,0,0,0|3,0,0]=4 57 B16R1.7414 Cc1cccnc1NC(=O)CCCC(C)C AIFCHEM-6064588327 [0,1,0,0,0,0|3,0,0]=4 58 B16R1.7414 O=C(Cc1ccccc1Br)NCCC(F)F AIFCHEM-6213492422 [0,1,0,0,0,0|3,0,0]=4 59 B16R1.7414 O=C(Cc1ccccc1I)NCCC(F)F AIFCHEM-6191553173 [0,1,0,0,0,0|3,0,0]=4 60 B16R1.11236 CC(=CCNC(=O)Cc1cccc(c1)Cl)C AIFCHEM-5944139105 [0,1,0,0,0,0|1,0,2]=4 61 B16R1.11236 CC(=CCNC(=O)Cc1cccc(c1)F)C AIFCHEM-5962220987 [0,1,0,0,0,0|1,0,2]=4 62 B16R1.11236 CC(=O)CCNC(=O)Cc1cccc(c1)C AIFCHEM-6218364173 [0,1,0,0,0,0|2,0,1]=4 63 B16R1.11236 CC(C)CCCC(=O)Nc1cc(ccn1)O AIFCHEM-94535018381 [0,1,0,0,0,0|3,0,0]=4 64 B16R1.11236 CC(C)CCCC(=O)Nc1cncc(c1)O AIFCHEM-94532896922 [0,1,0,0,0,0|3,0,0]=4 65 B16R1.11236 CC(C)CCNC(=O)Cc1ccnc(c1)Cl AIFCHEM-6132338138 [0,1,0,0,0,0|2,0,0]=3 66 B16R1.11236 CC(C)COCC(=O)Nc1cccc(c1)Cl AIFCHEM-94552612281 [0,1,0,0,0,0|3,0,0]=4 67 B16R1.11236 CN(C)CCCC(=O)Nc1cccc(c1)Br AIFCHEM-94526562769 [0,1,0,0,0,0|3,0,0]=4 68 B16R1.11236 CN(C)CCCC(=O)Nc1cccc(c1)Cl AIFCHEM-94526556253 [0,1,0,0,0,0|3,0,0]=4 69 B16R1.11236 CN(C)CCNC(=O)Cc1cccc(c1)Cl AIFCHEM-5895867288 [0,1,0,0,0,0|2,0,0]=3 70 B16R1.11236 Cc1cccc(c1)CC(=O)NCCC(F)F AIFCHEM-6211016167 [0,1,0,0,0,0|3,0,0]=4 71 B16R1.11236 Cc1cccc(c1)NC(=O)COCC(C)C AIFCHEM-6128845598 [0,1,0,0,0,0|3,0,0]=4 72 B16R1.11236 Cc1ccnc(c1)NC(=O)CCCC(C)C AIFCHEM-5879521713 [0,1,0,0,0,0|3,0,0]=4 73 B16R1.11236 O=C(Cc1cccc(c1)Cl)NCCC(F)F AIFCHEM-6211018014 [0,1,0,0,0,0|3,0,0]=4 74 B16R1.11236 O=C(Cc1cccc(c1)I)NCCC(F)F AIFCHEM-6189878773 [0,1,0,0,0,0|3,0,0]=4 75 B16R1.11236 O=C(Cc1cccc(c1)O)NCCC(F)F AIFCHEM-6189957371 [0,1,0,0,0,0|3,0,0]=4 76 B16R1.59031 CC(C)(C)CCNC(=O)Cc1ccccn1 AIFCHEM-6202221919 [0,1,0,0,0,0|2,0,0]=3 77 B16R1.59031 CC(C)(C)CCNC(=O)Cc1cncnc1 AIFCHEM-6284008294 [0,1,0,0,0,0|3,0,0]=4 78 B16R2.2843 CC1CCN(C1)C(=O)Cc2ccncn2 AIFCHEM-5638646073 [0,0,0,1,0,0|3,0,0]=4 79 B16R2.2843 CC1CCN(C1)C(=O)Cc2cncnc2 AIFCHEM-5637953340 [0,0,0,1,0,0|3,0,0]=4 80 B16R2.2843 CC1CCN(C1)C(=O)Cc2ncccn2 AIFCHEM-5629023017 [0,0,0,1,0,0|3,0,0]=4 81 B16R2.2843 CN1CCC(C1)C(=O)Nc2ccccc2 AIFCHEM-94586409713 [0,0,0,1,0,0|3,0,0]=4 82 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ccncn2 AIFCHEM-5868155877 [0,0,0,1,0,0|3,0,0]=4 83 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2cncnc2 AIFCHEM-5792377560 [0,0,0,1,0,0|3,0,0]=4 84 B16R2.2843 C[C@@H]1CCN(C1)C(=O)Cc2ncccn2 AIFCHEM-5792170959 [0,0,0,1,0,0|3,0,0]=4 85 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ccncn2 AIFCHEM-5671809874 [0,0,0,1,0,0|3,0,0]=4 86 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2cncnc2 AIFCHEM-5657920137 [0,0,0,1,0,0|3,0,0]=4 87 B16R2.2843 C[C@H]1CCN(C1)C(=O)Cc2ncccn2 AIFCHEM-5666655807 [0,0,0,1,0,0|3,0,0]=4 88 B16R2.2843 O=C(Cc1ccccn1)N2CCC(C2)F AIFCHEM-94576231410 [0,0,0,1,0,0|3,0,0]=4 89 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@@H](C2)F AIFCHEM-5634211320 [0,0,0,1,0,0|3,0,0]=4 90 B16R2.2843 O=C(Cc1ccccn1)N2CC[C@H](C2)F AIFCHEM-94601062352 [0,0,0,1,0,0|3,0,0]=4 91 B16R2.3190 C[C@@H]1C[C@H]1CNC(=O)Cc2ccncc2 AIFCHEM-94599427618 [0,0,0,1,0,0|2,0,0]=3 92 B16R2.3190 C[C@@H]1C[C@H]1CNC(=O)Cc2ccncn2 AIFCHEM-94599425202 [0,0,0,1,0,0|3,0,0]=4 93 B16R2.3190 C[C@@H]1C[C@H]1CNC(=O)Cc2cnccn2 AIFCHEM-94599422055 [0,0,0,1,0,0|3,0,0]=4 94 B16R2.3334 CC1CC(C1)NC(=O)Cc2ccccn2 AIFCHEM-6177631910 [0,0,0,1,0,0|2,0,0]=3 95 B16R2.10947 O=C(Cc1ccccn1)NCCC2CC2 AIFCHEM-94576239539 [0,0,0,1,0,0|2,0,0]=3 96 B14R1.420 CC(C)CCNC(=O)c1cccnn1 AIFCHEM-6135462285 [0,0,0,0,1,0|3,0,0]=4 97 B14R1.420 CC(C)CCNC(=O)c1ccncc1 AIFCHEM-6135956601 [0,0,0,0,1,0|2,0,0]=3 98 B14R1.420 CC(C)CCNC(=O)c1ccnnc1 AIFCHEM-6098911069 [0,0,0,0,1,0|3,0,0]=4 99 B14R1.420 CC(C)CCNC(=O)c1cncnc1 AIFCHEM-6184271960 [0,0,0,0,1,0|3,0,0]=4 100 B14R1.420 CN(C)CCNC(=O)c1cccnc1 AIFCHEM-94537685640 [0,0,0,0,1,0|3,0,0]=4 101 B14R1.420 O=C(NCCC(F)F)c1ccccc1 AIFCHEM-94565572792 [0,0,0,0,1,0|3,0,0]=4 102 B14R1.423 CC(C)CCC(=O)Nc1ccccc1 AIFCHEM-94552045876 [0,0,0,0,1,0|1,0,0]=2 103 B14R1.423 CC(C)CNC(=O)Cc1ccccn1 AIFCHEM-94576235871 [0,0,0,0,1,0|2,0,0]=3 104 B14R1.423 CN(C)CCC(=O)Nc1cccnc1 AIFCHEM-94531015275 [0,0,0,0,1,0|3,0,0]=4 105 B14R1.810 CC(C)CCNC(=O)Cc1cccs1 AIFCHEM-6095350108 [0,0,0,0,1,0|2,0,0]=3 106 B16R1.608 CC(=CCNC(=O)CSc1ccccc1)C AIFCHEM-5944594439 [0,0,0,0,0,1|1,0,2]=4 107 B16R1.608 CC(C)CCCC(=O)NCc1cccnc1 AIFCHEM-6238931173 [0,0,0,0,0,1|2,0,0]=3 108 B16R1.608 CC(C)CCCC(=O)NCc1cnccn1 AIFCHEM-5844829360 [0,0,0,0,0,1|3,0,0]=4 109 B16R1.608 CC(C)CCCC(=O)NCc1ncccn1 AIFCHEM-94601448302 [0,0,0,0,0,1|3,0,0]=4 110 B16R1.608 CC(C)CCCC(C)NCc1ccccc1 AIFCHEM-5867804155 [0,0,0,0,0,1|2,0,1]=4 111 B16R1.608 CC(C)CCNC(=O)C#Cc1ccccn1 AIFCHEM-94557228049 [0,0,0,0,0,1|2,0,1]=4 112 B16R1.608 CC(C)CCNC(=O)CCc1ccccn1 AIFCHEM-6098877906 [0,0,0,0,0,1|2,0,0]=3 113 B16R1.608 CC(C)CCNC(=O)CCc1cccnc1 AIFCHEM-6184262660 [0,0,0,0,0,1|2,0,0]=3 114 B16R1.608 CC(C)CCNC(=O)CCc1ccncc1 AIFCHEM-6098597245 [0,0,0,0,0,1|2,0,0]=3 115 B16R1.608 CC(C)CCNC(=O)CSc1ncccn1 AIFCHEM-94568045053 [0,0,0,0,0,1|3,0,0]=4 116 B16R1.608 CC(C)COCC(=O)NCc1ccccn1 AIFCHEM-5686871956 [0,0,0,0,0,1|3,0,0]=4 117 B16R1.608 CN(C)CCCC(=O)NCc1ccccn1 AIFCHEM-94526560859 [0,0,0,0,0,1|3,0,0]=4 118 B16R1.608 CN(C)CCCC(=O)NCc1ccncc1 AIFCHEM-94526560861 [0,0,0,0,0,1|3,0,0]=4 119 B16R1.610 CC(C)CCCNC(=O)Cc1ncccn1 AIFCHEM-5695449409 [0,0,0,0,0,1|3,0,0]=4 120 B16R1.610 CC(C)OCCNC(=O)Cc1ccccn1 AIFCHEM-94576238662 [0,0,0,0,0,1|2,0,0]=3 121 B16R1.610 CC(C)OCCNC(=O)Cc1ccncc1 AIFCHEM-94603109815 [0,0,0,0,0,1|2,0,0]=3 122 B16R1.610 CC(C)OCCNC(=O)Cc1cncnc1 AIFCHEM-6255313044 [0,0,0,0,0,1|3,0,0]=4 123 B13R1.44 CCCCC(=O)Nc1ccccn1 AIFCHEM-94586363259 [2,0,0,0,0,0|2,0,0]=4 124 B13R1.44 CCCCC(=O)Nc1ccncc1 AIFCHEM-94534099520 [2,0,0,0,0,0|2,0,0]=4 125 B13R1.44 CCCCN(C)Cc1ccccc1 AIFCHEM-94536079434 [2,0,0,0,0,0|2,0,0]=4 126 B15R1.83 CCCCCCC(=O)Nc1ccccc1 AIFCHEM-94521989168 [1,1,0,0,0,0|2,0,0]=4 127 B15R1.83 CCCCCNC(=O)Cc1ccccn1 AIFCHEM-94576227661 [1,1,0,0,0,0|2,0,0]=4 128 B15R1.83 CCCCOCC(=O)Nc1cccnc1 AIFCHEM-94531012402 [1,1,0,0,0,0|2,0,0]=4 129 B15R1.83 COCCCNC(=O)Cc1ccncc1 AIFCHEM-94603103139 [1,1,0,0,0,0|2,0,0]=4 130 B15R1.83 CSCCCNC(=O)Cc1ccncc1 AIFCHEM-94603106411 [1,1,0,0,0,0|2,0,0]=4 131 B15R1.93 CCCCNC(=O)C(C)c1ccccc1 AIFCHEM-5736745249 [1,1,0,0,0,0|1,0,0]=3 132 B15R1.93 CCCCNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-5726305228 [1,1,0,0,0,0|1,0,0]=3 133 B15R1.93 CCCCNC(=O)[C@H](C)c1ccccc1 AIFCHEM-94570984232 [1,1,0,0,0,0|1,0,0]=3 134 B15R1.93 COCCNC(=O)C(C)c1ccccc1 AIFCHEM-5990319028 [1,1,0,0,0,0|2,0,0]=4 135 B15R1.93 COCCNC(=O)[C@@H](C)c1ccccc1 AIFCHEM-6017398507 [1,1,0,0,0,0|2,0,0]=4 136 B15R1.93 COCCNC(=O)[C@H](C)c1ccccc1 AIFCHEM-6058387642 [1,1,0,0,0,0|2,0,0]=4 137 B15R1.128 CCCCCC(=O)Nc1ccc(cc1)Cl AIFCHEM-94586014354 [1,1,0,0,0,0|2,0,0]=4 138 B15R1.128 CCCCNC(=O)Cc1ccc(cc1)Br AIFCHEM-5695578276 [1,1,0,0,0,0|1,0,0]=3 139 B15R1.128 COCCNC(=O)Cc1ccc(cc1)I AIFCHEM-6048939083 [1,1,0,0,0,0|2,0,0]=4 140 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)Cl AIFCHEM-94598928395 [1,1,0,0,0,0|2,0,0]=4 141 B15R1.128 CSCCNC(=O)Cc1ccc(cc1)O AIFCHEM-94598927594 [1,1,0,0,0,0|2,0,0]=4 142 B15R1.129 CCCCCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523495878 [1,1,0,0,0,0|2,0,0]=4 143 B15R1.129 CCCCNC(=O)Cc1cccc(n1)Br AIFCHEM-5745850448 [1,1,0,0,0,0|2,0,0]=4 144 B15R1.129 CCCCNC(=O)Cc1cccc(n1)F AIFCHEM-5745500767 [1,1,0,0,0,0|2,0,0]=4 145 B15R1.129 COCCNC(=O)Cc1cccc(c1)C AIFCHEM-6058443810 [1,1,0,0,0,0|2,0,0]=4 146 B15R1.809 CCCC(C)NC(=O)Cc1ccccn1 AIFCHEM-94560478938 [1,1,0,0,0,0|2,0,0]=4 147 B15R1.809 CCCC(C)NC(=O)Cc1ccncc1 AIFCHEM-94560483872 [1,1,0,0,0,0|2,0,0]=4 148 B15R1.809 CCC[C@@H](C)NC(=O)Cc1ccccn1 AIFCHEM-94576227043 [1,1,0,0,0,0|2,0,0]=4 149 B15R1.809 CCC[C@@H](C)NC(=O)Cc1ccncc1 AIFCHEM-94603098196 [1,1,0,0,0,0|2,0,0]=4 150 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccccn1 AIFCHEM-94576232866 [1,1,0,0,0,0|2,0,0]=4 151 B15R1.809 CCC[C@H](C)NC(=O)Cc1ccncc1 AIFCHEM-94603104019 [1,1,0,0,0,0|2,0,0]=4 152 B15R1.964 CCC(C)CNC(=O)Cc1ccncc1 AIFCHEM-94534481126 [1,1,0,0,0,0|2,0,0]=4 153 B15R1.1409 COCCNC(=O)Cc1ccccc1Br AIFCHEM-5990953145 [1,1,0,0,0,0|2,0,0]=4 154 B15R1.1409 CSCCNC(=O)Cc1ccccc1O AIFCHEM-5882653495 [1,1,0,0,0,0|2,0,0]=4 155 B15R1.119 CC(C)CCCNCc1cccc(c1)F AIFCHEM-5746290313 [1,1,0,0,0,0|2,0,0]=4 156 B15R1.119 CC(C)CCCNCc1cccc(c1)I AIFCHEM-5746439372 [1,1,0,0,0,0|2,0,0]=4 157 B15R1.119 Cc1cccc(c1)CCNCCC(C)C AIFCHEM-94590814497 [1,1,0,0,0,0|1,0,1]=4 158 B15R1.131 CC(C)CCCNCc1ccccc1O AIFCHEM-94532456724 [1,1,0,0,0,0|2,0,0]=4 159 B15R1.871 CC(C)CCCNCc1ccc(cc1)O AIFCHEM-5694736228 [1,1,0,0,0,0|2,0,0]=4 160 B15R1.882 CC(C)CCNC(=O)c1ccc(=O)[nH]c1 AIFCHEM-6094385537 [0,1,0,0,1,0|2,0,0]=4 161 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)F AIFCHEM-6121758712 [0,1,0,0,1,0|1,0,0]=3 162 B15R1.882 CC(C)CCNC(=O)c1ccc(cc1)O AIFCHEM-6135108853 [0,1,0,0,1,0|1,0,0]=3 163 B15R1.882 CC(C)CCNC(=O)c1ccc(cn1)Br AIFCHEM-6184105988 [0,1,0,0,1,0|2,0,0]=4 164 B15R1.882 Cc1ccc(cc1)C(=O)NCCC(C)C AIFCHEM-6094426812 [0,1,0,0,1,0|1,0,0]=3 165 B15R1.1078 CC(C)CCN(C)C(=O)c1ccccc1 AIFCHEM-94565579174 [0,1,0,0,1,0|1,0,0]=3 166 B15R1.8019 CC(C)CCNC(=O)c1ccc[nH]c1=O AIFCHEM-6094919265 [0,1,0,0,1,0|2,0,0]=4 167 B15R1.8019 CC(C)CCNC(=O)c1ccccc1I AIFCHEM-6121509978 [0,1,0,0,1,0|1,0,0]=3 168 B15R1.8019 CN(C)CCNC(=O)c1ccccc1Cl AIFCHEM-94562149122 [0,1,0,0,1,0|2,0,0]=4 169 B15R1.8019 CN(C)CCNC(=O)c1ccccc1F AIFCHEM-94537684595 [0,1,0,0,1,0|2,0,0]=4 170 B15R1.8019 Cc1cccnc1C(=O)NCCC(C)C AIFCHEM-94596772617 [0,1,0,0,1,0|2,0,0]=4 171 B15R1.8019 Cc1cnccc1C(=O)NCCC(C)C AIFCHEM-6122130833 [0,1,0,0,1,0|2,0,0]=4 172 B15R1.8273 CC(C)CCNC(=O)c1cccc(c1)F AIFCHEM-6135763476 [0,1,0,0,1,0|1,0,0]=3 173 B15R1.8273 CC(C)CCNC(=O)c1cncc(c1)I AIFCHEM-6135965956 [0,1,0,0,1,0|2,0,0]=4 174 B15R1.8273 CN(C)CCNC(=O)c1cccc(c1)O AIFCHEM-5895758155 [0,1,0,0,1,0|2,0,0]=4 175 B15R1.8273 Cc1cccc(n1)C(=O)NCCC(C)C AIFCHEM-6095041268 [0,1,0,0,1,0|2,0,0]=4 176 B15R1.9094 CC(C)(C)CCNC(=O)c1cccnc1 AIFCHEM-6193596324 [0,1,0,0,1,0|2,0,0]=4 177 B15R1.111 CC(C)CCC(=O)Nc1ccc(=O)[nH]c1 AIFCHEM-5999825884 [0,1,0,0,1,0|2,0,0]=4 178 B15R1.111 CC(C)CNC(=O)Cc1ccc(cc1)Cl AIFCHEM-94563728617 [0,1,0,0,1,0|1,0,0]=3 179 B15R1.111 CC(C)CNC(=O)Cc1ccc(cn1)O AIFCHEM-6123065252 [0,1,0,0,1,0|2,0,0]=4 180 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)F AIFCHEM-94540072368 [0,1,0,0,1,0|2,0,0]=4 181 B15R1.111 CC(C)OCC(=O)Nc1ccc(cc1)I AIFCHEM-6111723582 [0,1,0,0,1,0|2,0,0]=4 182 B15R1.111 CC(C)SCC(=O)Nc1ccc(cc1)O AIFCHEM-94574887434 [0,1,0,0,1,0|2,0,0]=4 183 B15R1.111 CN(C)CCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608727788 [0,1,0,0,1,0|2,0,0]=4 184 B15R1.111 Cc1ccc(cc1)NC(=O)CCC(C)C AIFCHEM-94584238624 [0,1,0,0,1,0|1,0,0]=3 185 B15R1.111 Cc1ccc(cc1)NC(=O)COC(C)C AIFCHEM-94584236414 [0,1,0,0,1,0|2,0,0]=4 186 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Br AIFCHEM-94552712941 [0,1,0,0,1,0|1,0,0]=3 187 B15R1.120 CC(C)CCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523501308 [0,1,0,0,1,0|1,0,0]=3 188 B15R1.120 CC(C)CCN(C)Cc1cccc(c1)Br AIFCHEM-6096442749 [0,1,0,0,1,0|2,0,0]=4 189 B15R1.120 CC(C)CNC(=O)Cc1cccc(c1)O AIFCHEM-6179570320 [0,1,0,0,1,0|1,0,0]=3 190 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)F AIFCHEM-94563725326 [0,1,0,0,1,0|2,0,0]=4 191 B15R1.120 CC(C)CNC(=O)Cc1cccc(n1)O AIFCHEM-94563734646 [0,1,0,0,1,0|2,0,0]=4 192 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Br AIFCHEM-6179745985 [0,1,0,0,1,0|2,0,0]=4 193 B15R1.120 CC(C)CNC(=O)Cc1ccnc(c1)Cl AIFCHEM-94563734232 [0,1,0,0,1,0|2,0,0]=4 194 B15R1.120 Cc1cccc(c1)NC(=O)COC(C)C AIFCHEM-94565754804 [0,1,0,0,1,0|2,0,0]=4 195 B15R1.120 Cc1ccnc(c1)NC(=O)CCC(C)C AIFCHEM-5859978047 [0,1,0,0,1,0|2,0,0]=4 196 B15R1.256 CC(C)CCN(C)Cc1ccccc1F AIFCHEM-6149216723 [0,1,0,0,1,0|2,0,0]=4 197 B15R1.256 CC(C)CCN(C)Cc1ccccc1O AIFCHEM-94532463159 [0,1,0,0,1,0|2,0,0]=4 198 B15R1.256 CC(C)OCC(=O)Nc1ccccc1F AIFCHEM-94582112189 [0,1,0,0,1,0|2,0,0]=4 199 B15R1.256 CC(C)SCC(=O)Nc1ccccc1Cl AIFCHEM-94556557408 [0,1,0,0,1,0|2,0,0]=4 200 B15R1.256 CC(C)SCC(=O)Nc1ccccc1I AIFCHEM-5921758989 [0,1,0,0,1,0|2,0,0]=4 201 B15R1.256 Cc1ccccc1CN(C)CCC(C)C AIFCHEM-6180032051 [0,1,0,0,1,0|2,0,0]=4 202 B15R1.256 Cc1ccccc1NC(=O)CSC(C)C AIFCHEM-5921307341 [0,1,0,0,1,0|2,0,0]=4 203 B15R1.496 CC(C)CN(C)C(=O)Cc1ccccn1 AIFCHEM-5782349429 [0,1,0,0,1,0|2,0,0]=4 204 B15R1.3675 CC(C)C(C)NC(=O)Cc1ccncc1 AIFCHEM-6191050616 [0,1,0,0,1,0|2,0,0]=4 205 B15R1.3675 CC(C)[C@@H](C)NC(=O)Cc1ccncc1 AIFCHEM-94576831407 [0,1,0,0,1,0|2,0,0]=4 206 B15R1.9108 CC(C)(F)CNC(=O)Cc1cccnc1 AIFCHEM-5770919436 [0,1,0,0,1,0|2,0,0]=4 207 B15R1.5468 CC(C)CCNC(=O)Cc1cc(cs1)Br AIFCHEM-6094707393 [0,1,0,0,1,0|2,0,0]=4 208 B17R1.675 CC(C)CCCC(=O)NC(C)c1cccnc1 AIFCHEM-5605568237 [0,1,0,0,0,1|2,0,0]=4 209 B17R1.675 CC(C)CCCC(=O)N[C@@H](C)c1cccnc1 AIFCHEM-94593294666 [0,1,0,0,0,1|2,0,0]=4 210 B17R1.675 CC(C)CCCC(=O)N[C@H](C)c1cccnc1 AIFCHEM-94529458251 [0,1,0,0,0,1|2,0,0]=4 211 B17R1.675 CC(C)CCNC(=O)CC(C)c1ccccc1 AIFCHEM-6094682594 [0,1,0,0,0,1|1,0,0]=3 212 B17R1.675 CC(C)CCNC(=O)CC(C)c1cccnc1 AIFCHEM-94589259391 [0,1,0,0,0,1|2,0,0]=4 213 B17R1.675 CC(C)CCNC(=O)CN(C)c1ccccc1 AIFCHEM-6184237076 [0,1,0,0,0,1|1,0,0]=3 214 B17R1.675 CC(C)CCNC(=O)C[C@H](C)c1ccccc1 AIFCHEM-94574433901 [0,1,0,0,0,1|1,0,0]=3 215 B17R1.1079 CC(C)CCCC(=O)NCc1ccc(cc1)Cl AIFCHEM-6020837251 [0,1,0,0,0,1|1,0,0]=3 216 B17R1.1079 CC(C)CCCC(=O)NCc1ccc(cn1)Br AIFCHEM-94531456429 [0,1,0,0,0,1|2,0,0]=4 217 B17R1.1079 CC(C)CCNC(=O)COc1ccc(cc1)I AIFCHEM-94602444985 [0,1,0,0,0,1|1,0,0]=3 218 B17R1.1079 CC(C)CCNC(=O)COc1ccc(nc1)Cl AIFCHEM-6121807045 [0,1,0,0,0,1|2,0,0]=4 219 B17R1.1079 CC(C)COCC(=O)NCc1ccc(cc1)I AIFCHEM-94549226814 [0,1,0,0,0,1|2,0,0]=4 220 B17R1.1079 Cc1ccc(cc1)OCC(=O)NCCC(C)C AIFCHEM-6133136241 [0,1,0,0,0,1|1,0,0]=3 221 B17R1.1218 CCN(C)CCCC(=O)NCc1ccccc1 AIFCHEM-98724556194 [0,1,0,0,0,1|2,0,0]=4 222 B17R1.5010 CC(C)CCN(C)C(=O)COc1cccnc1 AIFCHEM-6150573197 [0,1,0,0,0,1|2,0,0]=4 223 B17R1.9015 CC(C)CCCC(=O)NCc1ccccc1Br AIFCHEM-5834333728 [0,1,0,0,0,1|1,0,0]=3 224 B17R1.9015 CC(C)CCCC(=O)NCc1ccccc1O AIFCHEM-94592073464 [0,1,0,0,0,1|1,0,0]=3 225 B17R1.9015 CC(C)CCCC(=O)NCc1ncccc1Br AIFCHEM-6191249816 [0,1,0,0,0,1|2,0,0]=4 226 B17R1.9015 CC(C)CCCC(=O)NCc1ncccc1Cl AIFCHEM-5809354506 [0,1,0,0,0,1|2,0,0]=4 227 B17R1.9015 CC(C)CCNC(=O)COc1ccccc1Cl AIFCHEM-6132698167 [0,1,0,0,0,1|1,0,0]=3 228 B17R1.9015 CC(C)COCC(=O)NCc1ccccc1I AIFCHEM-6099606017 [0,1,0,0,0,1|2,0,0]=4 229 B17R1.9015 CC(C)COCC(=O)NCc1ccccc1O AIFCHEM-94592070476 [0,1,0,0,0,1|2,0,0]=4 230 B17R1.9015 CN(C)CCCC(=O)NCc1ccccc1O AIFCHEM-94526554581 [0,1,0,0,0,1|2,0,0]=4 231 B17R1.9289 CC(C)CCCC(=O)N(C)Cc1ccccc1 AIFCHEM-94536107611 [0,1,0,0,0,1|1,0,0]=3 232 B17R1.9289 CC(C)CCCC(=O)N(C)Cc1ccccn1 AIFCHEM-6112308334 [0,1,0,0,0,1|2,0,0]=4 233 B17R1.9289 CC(C)CCCC(=O)N(C)Cc1ccncc1 AIFCHEM-94531382083 [0,1,0,0,0,1|2,0,0]=4 234 B17R1.9289 CC(C)CCNC(=O)C(C)Cc1ccccc1 AIFCHEM-6094306034 [0,1,0,0,0,1|1,0,0]=3 235 B17R1.9289 CC(C)CCNC(=O)C(O)Cc1ccccc1 AIFCHEM-94573435135 [0,1,0,0,0,1|1,0,0]=3 236 B17R1.9289 CC(C)CCNC(=O)[C@@H](O)Cc1ccccc1 AIFCHEM-6135836356 [0,1,0,0,0,1|1,0,0]=3 237 B17R1.9289 CC(C)CCNC(=O)[C@H](O)Cc1ccccc1 AIFCHEM-6121510047 [0,1,0,0,0,1|1,0,0]=3 238 B17R1.9289 CC(C)COCC(=O)N(C)Cc1ccccc1 AIFCHEM-6227477643 [0,1,0,0,0,1|2,0,0]=4 239 B17R1.14359 CC(C)CCCC(=O)NCc1cc(ccn1)Cl AIFCHEM-5754471904 [0,1,0,0,0,1|2,0,0]=4 240 B17R1.14359 CC(C)CCCC(=O)NCc1cccc(c1)Cl AIFCHEM-6230785593 [0,1,0,0,0,1|1,0,0]=3 241 B17R1.14359 CC(C)CCCC(=O)NCc1cncc(c1)F AIFCHEM-5910260882 [0,1,0,0,0,1|2,0,0]=4 242 B17R1.14359 CC(C)COCC(=O)NCc1cccc(c1)Cl AIFCHEM-6230396819 [0,1,0,0,0,1|2,0,0]=4 243 B17R1.14359 Cc1cccc(c1)OCC(=O)NCCN(C)C AIFCHEM-5962237853 [0,1,0,0,0,1|2,0,0]=4 244 B17R1.14359 Cc1cncc(c1)CNC(=O)CCCC(C)C AIFCHEM-5636941263 [0,1,0,0,0,1|2,0,0]=4 245 B17R1.16524 CC(C)CN(C)CC(=O)OCc1ccccc1 AIFCHEM-94572980635 [0,1,0,0,0,1|2,0,0]=4 246 B17R1.16524 CC(CN(C)C)NC(=O)CCc1ccccc1 AIFCHEM-6080649354 [0,1,0,0,0,1|2,0,0]=4 247 B17R1.16633 CC(C)C(C)NCC(=O)NCc1ccccc1 AIFCHEM-94522506418 [0,1,0,0,0,1|2,0,0]=4 248 B17R1.40529 CC(C)(C)CCNC(=O)COc1cccnc1 AIFCHEM-6266535221 [0,1,0,0,0,1|2,0,0]=4 249 B17R1.40529 CC(C)(C)CCNC(=O)CSc1ccccc1 AIFCHEM-6194044427 [0,1,0,0,0,1|1,0,0]=3 250 B17R1.40529 CC(C)(C)CCNC(=O)CSc1ccncc1 AIFCHEM-94591220190 [0,1,0,0,0,1|2,0,0]=4 251 B17R1.1120 CC(C)CCCCC(=O)Nc1ccc(cc1)Br AIFCHEM-94608729684 [0,1,0,0,0,1|2,0,0]=4 252 B17R1.1120 CC(C)CCCCC(=O)Nc1ccc(cc1)I AIFCHEM-6152692147 [0,1,0,0,0,1|2,0,0]=4 253 B17R1.1120 CC(C)CCCCC(=O)Nc1ccc(cc1)O AIFCHEM-94574892499 [0,1,0,0,0,1|2,0,0]=4 254 B17R1.1120 CC(C)OCCNC(=O)Cc1ccc(cc1)F AIFCHEM-6254536173 [0,1,0,0,0,1|1,0,0]=3 255 B17R1.1120 CC(C)OCCNC(=O)Cc1ccc(cn1)Cl AIFCHEM-6282514408 [0,1,0,0,0,1|2,0,0]=4 256 B17R1.1120 CC(C)OCCNC(=O)Cc1ccc(cn1)F AIFCHEM-6282644066 [0,1,0,0,0,1|2,0,0]=4 257 B17R1.1120 CC(C)OCCNC(=O)Cc1ccc(nc1)Cl AIFCHEM-6271101031 [0,1,0,0,0,1|2,0,0]=4 258 B17R1.1120 Cc1ccc(cc1)NC(=O)CCCCC(C)C AIFCHEM-94547767680 [0,1,0,0,0,1|2,0,0]=4 259 B17R1.1329 CN(C)CCCNC(=O)C(O)c1ccccc1 AIFCHEM-5702672665 [0,1,0,0,0,1|2,0,0]=4 260 B17R1.1329 CN(C)CCCNC(=O)[C@@H](O)c1ccccc1 AIFCHEM-94584129253 [0,1,0,0,0,1|2,0,0]=4 261 B17R1.1329 CN(C)CCCNC(=O)[C@H](O)c1ccccc1 AIFCHEM-94584133580 [0,1,0,0,0,1|2,0,0]=4 262 B17R1.8308 CC(C)CC(=O)NCC(=O)Cc1ccccc1 AIFCHEM-6183806378 [0,1,0,0,0,1|1,0,1]=4 263 B17R1.8993 CC(C)CCCCC(=O)Nc1ccccc1Br AIFCHEM-94569949759 [0,1,0,0,0,1|2,0,0]=4 264 B17R1.8993 CC(C)CCCCC(=O)Nc1ccccc1I AIFCHEM-5899177405 [0,1,0,0,0,1|2,0,0]=4 265 B17R1.8993 CC(C)CCCNC(=O)Cc1ccccc1Br AIFCHEM-5753241794 [0,1,0,0,0,1|1,0,0]=3 266 B17R1.8993 CC(C)CCCNC(=O)Cc1ccccc1Cl AIFCHEM-5700388784 [0,1,0,0,0,1|1,0,0]=3 267 B17R1.8993 CC(C)CCCNC(=O)Cc1cccnc1Cl AIFCHEM-5738574104 [0,1,0,0,0,1|2,0,0]=4 268 B17R1.8993 CC(C)CCCNC(=O)Cn1ccccc1=O AIFCHEM-5728090278 [0,1,0,0,0,1|2,0,0]=4 269 B17R1.8993 CC(C)OCCNC(=O)Cc1ccccc1Cl AIFCHEM-6259320359 [0,1,0,0,0,1|1,0,0]=3 270 B17R1.8993 CC(C)OCCNC(=O)Cc1ncccc1Br AIFCHEM-6259631930 [0,1,0,0,0,1|2,0,0]=4 271 B17R1.8993 CN(C)CCCNC(=O)Cc1ccccc1I AIFCHEM-5785107950 [0,1,0,0,0,1|2,0,0]=4 272 B17R1.8993 Cc1ccccc1CC(=O)NCCCN(C)C AIFCHEM-94584133824 [0,1,0,0,0,1|2,0,0]=4 273 B17R1.14406 CC(C)CCCCC(=O)Nc1cccc(c1)Cl AIFCHEM-94523503086 [0,1,0,0,0,1|2,0,0]=4 274 B17R1.14406 CC(C)CCCCC(=O)Nc1cccc(c1)O AIFCHEM-94542292937 [0,1,0,0,0,1|2,0,0]=4 275 B17R1.14406 CC(C)CCCNC(=O)Cc1ccnc(c1)Br AIFCHEM-5702081426 [0,1,0,0,0,1|2,0,0]=4 276 B17R1.14406 CC(C)OCCNC(=O)Cc1cccc(c1)Br AIFCHEM-6259742727 [0,1,0,0,0,1|1,0,0]=3 277 B17R1.14406 CC(C)OCCNC(=O)Cc1cncc(c1)Br AIFCHEM-6271478750 [0,1,0,0,0,1|2,0,0]=4 278 B17R1.14406 CN(C)CCCNC(=O)Cc1cccc(c1)F AIFCHEM-5785172128 [0,1,0,0,0,1|2,0,0]=4 279 B17R1.14406 CN(C)CCCNC(=O)Cc1cccc(c1)O AIFCHEM-94584133661 [0,1,0,0,0,1|2,0,0]=4 280 B17R1.16640 CC(C)(C)CCNCC(=O)Nc1ccccc1 AIFCHEM-94527746794 [0,1,0,0,0,1|2,0,0]=4 281 B17R1.16640 CC(C)(C)OCCNC(=O)Cc1cccnc1 AIFCHEM-94532278869 [0,1,0,0,0,1|2,0,0]=4 282 B17R1.16640 CC(C)(C)OCCNC(=O)Cc1ccncc1 AIFCHEM-6098416815 [0,1,0,0,0,1|2,0,0]=4 283 B17R1.1069 CC(C)CCNC(=O)C(C)c1ccc(cc1)Cl AIFCHEM-6184165279 [0,2,0,0,0,0|1,0,0]=3 284 B17R1.1069 CC(C)CCNC(=O)C(C)c1ccc(cc1)F AIFCHEM-6132400349 [0,2,0,0,0,0|1,0,0]=3 285 B17R1.1069 CC(C)CCNC(=O)C(O)c1ccc(cc1)Cl AIFCHEM-6184250224 [0,2,0,0,0,0|1,0,0]=3 286 B17R1.1069 CC(C)CCNC(=O)[C@@H](O)c1ccc(cc1)Cl AIFCHEM-6094970062 [0,2,0,0,0,0|1,0,0]=3 287 B17R1.1069 CC(C)CCNC(=O)[C@H](O)c1ccc(cc1)Cl AIFCHEM-6132874807 [0,2,0,0,0,0|1,0,0]=3 288 B17R1.3106 CC[C@@H](C(=O)NCCC(C)C)c1ccccc1 AIFCHEM-6098430921 [0,2,0,0,0,0|1,0,0]=3 289 B17R1.4002 CC(C)(C)CCNC(=O)C(O)c1ccccc1 AIFCHEM-6266188658 [0,2,0,0,0,0|1,0,0]=3 290 B17R1.9010 CC(C)CCNC(=O)C(O)c1ccccc1Cl AIFCHEM-6132211943 [0,2,0,0,0,0|1,0,0]=3 291 B17R1.9010 CC(C)CCNC(=O)[C@H](O)c1ccccc1Cl AIFCHEM-6131934837 [0,2,0,0,0,0|1,0,0]=3 292 B17R1.9010 CN(C)CCNC(=O)C(O)c1ccccc1F AIFCHEM-94537684246 [0,2,0,0,0,0|2,0,0]=4 293 B17R1.9010 CN(C)CCNC(=O)[C@H](O)c1ccccc1F AIFCHEM-94537683691 [0,2,0,0,0,0|2,0,0]=4 294 B17R1.9010 Cc1ccccc1C(C)C(=O)NCCC(C)C AIFCHEM-94601536959 [0,2,0,0,0,0|1,0,0]=3 295 B17R1.9293 CC(C(=O)N(C)CCN(C)C)c1ccccc1 AIFCHEM-94528267996 [0,2,0,0,0,0|2,0,0]=4 296 B17R1.9293 C[C@@H](C(=O)N(C)CCN(C)C)c1ccccc1 AIFCHEM-94528269940 [0,2,0,0,0,0|2,0,0]=4 297 B17R1.9293 C[C@H](C(=O)N(C)CCN(C)C)c1ccccc1 AIFCHEM-94528269939 [0,2,0,0,0,0|2,0,0]=4 298 B17R1.14349 CC(C(=O)NCCN(C)C)c1cccc(c1)F AIFCHEM-94537686093 [0,2,0,0,0,0|2,0,0]=4 299 B17R1.14349 CC(C)CCCC(=O)N(C)c1cccc(c1)Cl AIFCHEM-6088415524 [0,2,0,0,0,0|2,0,0]=4 300 B17R1.16608 CC(C)CCNC(=O)C(C)(C)c1cccnc1 AIFCHEM-6133218255 [0,2,0,0,0,0|2,0,0]=4 301 B17R1.196 CC(C)CCCC(=O)Nc1ccc(cc1)C#N AIFCHEM-5682302140 [0,2,0,0,0,0|2,0,0]=4 302 B17R1.196 CC(C)CCNC(=O)Cc1ccc(cc1)CO AIFCHEM-6132217062 [0,2,0,0,0,0|1,0,0]=3 303 B17R1.196 COc1ccc(cc1)NC(=O)CCCC(C)C AIFCHEM-94577713319 [0,2,0,0,0,0|2,0,0]=4 304 B17R1.196 CSc1ccc(cc1)CC(=O)NCCC(C)C AIFCHEM-6121891703 [0,2,0,0,0,0|1,0,0]=3 305 B17R1.1066 CC(C)CCCC(=O)Nc1ccc(c(c1)F)Cl AIFCHEM-6186741058 [0,2,0,0,0,0|2,0,0]=4 306 B17R1.1066 CC(C)CCCC(=O)Nc1ccc(c(c1)F)O AIFCHEM-94559746401 [0,2,0,0,0,0|2,0,0]=4 307 B17R1.1066 CC(C)CCCC(=O)Nc1ccc(c(c1)I)Cl AIFCHEM-5996020350 [0,2,0,0,0,0|2,0,0]=4 308 B17R1.1066 CC(C)CCNC(=O)Cc1ccc(c(c1)Br)Cl AIFCHEM-6135258605 [0,2,0,0,0,0|1,0,0]=3 309 B17R1.1066 CC(C)CCNC(=O)Cc1ccc(c(c1)Br)F AIFCHEM-6094263145 [0,2,0,0,0,0|1,0,0]=3 310 B17R1.1066 CN(C)CCNC(=O)Cc1ccc(c(c1)Br)F AIFCHEM-94537681994 [0,2,0,0,0,0|2,0,0]=4 311 B17R1.1066 CN(C)CCNC(=O)Cc1ccc(c(c1)Cl)Br AIFCHEM-94537679952 [0,2,0,0,0,0|2,0,0]=4 312 B17R1.1066 CN(C)CCNC(=O)Cc1ccc(c(c1)F)Cl AIFCHEM-94537687352 [0,2,0,0,0,0|2,0,0]=4 313 B17R1.1066 CN(C)CCNC(=O)Cc1ccc(c(c1)F)O AIFCHEM-5962075791 [0,2,0,0,0,0|2,0,0]=4 314 B17R1.1066 CN(C)CCNC(=O)Cc1ccc(c(c1)O)O AIFCHEM-94537678699 [0,2,0,0,0,0|2,0,0]=4 315 B17R1.1119 CC(C)(C)CCNC(=O)Cc1ccc(cc1)I AIFCHEM-6266549999 [0,2,0,0,0,0|1,0,0]=3 316 B17R1.1119 CC(C)(C)CCNC(=O)Cc1ccc(cc1)O AIFCHEM-6266331326 [0,2,0,0,0,0|1,0,0]=3 317 B17R1.1119 CC(C)(C)CCNC(=O)Cc1ccc(cn1)Br AIFCHEM-6202440021 [0,2,0,0,0,0|2,0,0]=4 318 B17R1.1119 CC(C)(C)CCNC(=O)Cc1ccc(cn1)F AIFCHEM-6266176826 [0,2,0,0,0,0|2,0,0]=4 319 B17R1.1121 CC(C)CCN(C)C(=O)Cc1ccc(cn1)F AIFCHEM-6150327855 [0,2,0,0,0,0|2,0,0]=4 320 B17R1.1121 CN(C)CCN(C)C(=O)Cc1ccc(cc1)Br AIFCHEM-94528265030 [0,2,0,0,0,0|2,0,0]=4 321 B17R1.1121 Cc1ccc(cn1)CC(=O)N(C)CCC(C)C AIFCHEM-6150283035 [0,2,0,0,0,0|2,0,0]=4 322 B17R1.14626 CC(C)CCCC(=O)Nc1ccc(cc1Br)F AIFCHEM-5650480976 [0,2,0,0,0,0|2,0,0]=4 323 B17R1.14626 CC(C)CCNC(=O)Cc1ccc(cc1F)Br AIFCHEM-6135725968 [0,2,0,0,0,0|1,0,0]=3 324 B17R1.14626 CC(C)CCNC(=O)Cc1ccc(cc1F)Cl AIFCHEM-6184072421 [0,2,0,0,0,0|1,0,0]=3 325 B17R1.14626 CC(C)CCNC(=O)Cc1ncc(cc1F)Br AIFCHEM-6098566251 [0,2,0,0,0,0|2,0,0]=4 326 B17R1.14626 CN(C)CCNC(=O)Cc1ccc(cc1Cl)F AIFCHEM-94537681582 [0,2,0,0,0,0|2,0,0]=4 327 B17R1.14626 CN(C)CCNC(=O)Cc1ccc(cc1F)Cl AIFCHEM-94537682000 [0,2,0,0,0,0|2,0,0]=4 328 B17R1.14626 Cc1cc(ccc1CC(=O)NCCN(C)C)Br AIFCHEM-94537687101 [0,2,0,0,0,0|2,0,0]=4 329 B17R1.14626 Cc1cc(ccc1NC(=O)CCCC(C)C)Br AIFCHEM-5656156155 [0,2,0,0,0,0|2,0,0]=4 330 B17R1.14626 Cc1ccc(c(c1)C)CC(=O)NCCN(C)C AIFCHEM-5975436782 [0,2,0,0,0,0|2,0,0]=4 331 B17R1.14626 Cc1ccc(c(c1)F)CC(=O)NCCN(C)C AIFCHEM-5915350764 [0,2,0,0,0,0|2,0,0]=4 332 B17R1.14626 Cc1ccn(c(=O)c1)CC(=O)NCCC(C)C AIFCHEM-6136057643 [0,2,0,0,0,0|2,0,0]=4 333 B17R1.23544 CC(CN(C)C)NC(=O)Cc1ccc(cc1)Cl AIFCHEM-6085046082 [0,2,0,0,0,0|2,0,0]=4 334 B17R1.2529 CCN(CCC(C)C)C(=O)Cc1ccccn1 AIFCHEM-95432351978 [0,2,0,0,0,0|2,0,0]=4 335 B17R1.2529 CCN(CCC(C)C)C(=O)Cc1cccnc1 AIFCHEM-94895870272 [0,2,0,0,0,0|2,0,0]=4 336 B17R1.2529 CCN(CCC(C)C)C(=O)Cc1ccncc1 AIFCHEM-95979545272 [0,2,0,0,0,0|2,0,0]=4 337 B17R1.8994 CC(C)CCN(C)C(=O)Cc1ccccc1F AIFCHEM-6096763602 [0,2,0,0,0,0|1,0,0]=3 338 B17R1.8994 CC(C)CCN(C)C(=O)Cc1ccccc1O AIFCHEM-6097460884 [0,2,0,0,0,0|1,0,0]=3 339 B17R1.8994 CC(C)CCN(C)C(=O)Cc1cccnc1Cl AIFCHEM-6149680401 [0,2,0,0,0,0|2,0,0]=4 340 B17R1.14407 CC(C)CCN(C)C(=O)Cc1cccc(c1)Cl AIFCHEM-6149696709 [0,2,0,0,0,0|1,0,0]=3 341 B17R1.14407 CC(C)CCN(C)C(=O)Cc1cccc(n1)F AIFCHEM-6159934419 [0,2,0,0,0,0|2,0,0]=4 342 B17R1.14407 CC(C)CCN(C)C(=O)Cc1cccc(n1)O AIFCHEM-6150148146 [0,2,0,0,0,0|2,0,0]=4 343 B17R1.14407 CC(C)CCN(C)C(=O)Cc1ccnc(c1)Br AIFCHEM-6097831628 [0,2,0,0,0,0|2,0,0]=4 344 B17R1.14407 CC(C)CCN(C)C(=O)Cc1cncc(c1)Br AIFCHEM-6160408010 [0,2,0,0,0,0|2,0,0]=4 345 B17R1.14407 Cc1cccc(c1)CC(=O)N(C)CCC(C)C AIFCHEM-6096772202 [0,2,0,0,0,0|1,0,0]=3 346 B17R1.14407 Cc1cccc(c1)CC(=O)N(C)CCN(C)C AIFCHEM-94528269039 [0,2,0,0,0,0|2,0,0]=4 347 B17R1.8845 CC(CN(C)C)NC(=O)Cc1cccc(c1)Br AIFCHEM-6025658328 [0,2,0,0,0,0|2,0,0]=4 348 B17R1.9017 CC(CN(C)C)NC(=O)Cc1ccccc1F AIFCHEM-6004455124 [0,2,0,0,0,0|2,0,0]=4 349 B17R1.9017 CC(CN(C)C)NC(=O)Cc1ccccc1I AIFCHEM-6080589298 [0,2,0,0,0,0|2,0,0]=4 350 B17R1.16674 C[C@@H](CC(C)(C)C)NC(=O)Cc1cccnc1 AIFCHEM-6052176435 [0,2,0,0,0,0|2,0,0]=4 351 B17R1.6551 COc1ccccc1CC(=O)NCCC(C)C AIFCHEM-6098697355 [0,2,0,0,0,0|1,0,0]=3 352 B17R1.6551 COc1ccccc1CC(=O)NCCN(C)C AIFCHEM-5975505986 [0,2,0,0,0,0|2,0,0]=4 353 B17R1.8992 CC(C)(C)CCNC(=O)Cc1ccccc1Br AIFCHEM-6242019026 [0,2,0,0,0,0|1,0,0]=3 354 B17R1.8992 CC(C)(C)CCNC(=O)Cc1ccccc1I AIFCHEM-6283923471 [0,2,0,0,0,0|1,0,0]=3 355 B17R1.8992 CC(C)(C)CCNC(=O)Cc1ncccc1Cl AIFCHEM-6266226280 [0,2,0,0,0,0|2,0,0]=4 356 B17R1.14346 CN(C)CCNC(=O)Cc1cccc(c1Br)Cl AIFCHEM-94537679960 [0,2,0,0,0,0|2,0,0]=4 357 B17R1.14346 CN(C)CCNC(=O)Cc1cccc(c1F)Br AIFCHEM-5896375080 [0,2,0,0,0,0|2,0,0]=4 358 B17R1.14346 CN(C)CCNC(=O)Cc1cccc(c1F)Cl AIFCHEM-5915775626 [0,2,0,0,0,0|2,0,0]=4 359 B17R1.14346 Cc1c(cccc1CC(=O)NCCN(C)C)Br AIFCHEM-94537679951 [0,2,0,0,0,0|2,0,0]=4 360 B17R1.76681 CC(C)CCCC(=O)Nc1c(cccc1Br)F AIFCHEM-5895449440 [0,2,0,0,0,0|2,0,0]=4 361 B17R1.76681 CC(C)CCNC(=O)Cc1c(cccc1Br)Cl AIFCHEM-6135919125 [0,2,0,0,0,0|1,0,0]=3 362 B17R1.76681 CC(C)CCNC(=O)Cc1c(cccc1Cl)Cl AIFCHEM-6135563524 [0,2,0,0,0,0|1,0,0]=3 363 B17R1.76681 Cc1cccc(c1CC(=O)NCCN(C)C)C AIFCHEM-94537687879 [0,2,0,0,0,0|2,0,0]=4 364 B17R1.76681 Cc1cccc(c1NC(=O)CCCC(C)C)C AIFCHEM-94581236709 [0,2,0,0,0,0|2,0,0]=4 365 B17R1.96784 CC(C)CCCC(=O)Nc1cc(ccc1Br)I AIFCHEM-5753635244 [0,2,0,0,0,0|2,0,0]=4 366 B17R1.96784 CC(C)CCCC(=O)Nc1cc(ccc1F)Br AIFCHEM-6181871095 [0,2,0,0,0,0|2,0,0]=4 367 B17R1.96784 Cc1ccc(c(c1)CC(=O)NCCC(C)C)C AIFCHEM-6184133852 [0,2,0,0,0,0|1,0,0]=3 368 B17R1.96784 Cc1ccc(c(c1)CC(=O)NCCN(C)C)Br AIFCHEM-94537682233 [0,2,0,0,0,0|2,0,0]=4 369 B17R1.14405 CC(C)(C)CCNC(=O)Cc1cccc(c1)F AIFCHEM-6284047901 [0,2,0,0,0,0|1,0,0]=3 370 B17R1.14405 CC(C)(C)CCNC(=O)Cc1cccc(n1)Cl AIFCHEM-6202353822 [0,2,0,0,0,0|2,0,0]=4 371 B17R1.14405 CC(C)(C)CCNC(=O)Cc1cccc(n1)F AIFCHEM-6193555068 [0,2,0,0,0,0|2,0,0]=4 372 B17R1.28470 CC(C)CCCC(=O)Nc1cccc(c1)C#N AIFCHEM-94571682238 [0,2,0,0,0,0|2,0,0]=4 373 B17R1.28470 CCc1cccc(c1)NC(=O)CCCC(C)C AIFCHEM-5766553472 [0,2,0,0,0,0|2,0,0]=4 374 B17R1.28470 COc1cccc(c1)CC(=O)NCCN(C)C AIFCHEM-5916138313 [0,2,0,0,0,0|2,0,0]=4 375 B17R1.61671 CC(C)CCCC(=O)Nc1cc(cc(c1)Br)Cl AIFCHEM-5763117100 [0,2,0,0,0,0|2,0,0]=4 376 B17R1.61671 CC(C)CCCC(=O)Nc1cc(cc(c1)I)F AIFCHEM-6063345705 [0,2,0,0,0,0|2,0,0]=4 377 B17R1.61671 CC(C)CCCC(=O)Nc1cc(cc(c1)I)I AIFCHEM-5905787170 [0,2,0,0,0,0|2,0,0]=4 378 B17R1.61671 CC(C)CCNC(=O)Cc1cc(cc(c1)Br)Br AIFCHEM-6184210828 [0,2,0,0,0,0|1,0,0]=3 379 B17R1.61671 Cc1cc(cc(c1)CC(=O)NCCN(C)C)C AIFCHEM-5916272411 [0,2,0,0,0,0|2,0,0]=4 380 B15R2.491 C[C@@H]1C[C@H]1NC(=O)Cc2ccncc2 AIFCHEM-94559019544 [1,0,0,1,0,0|2,0,0]=4 381 B15R2.16446 O=C(Cc1ccccn1)NC2CCC2 AIFCHEM-94537771429 [1,0,0,1,0,0|2,0,0]=4 382 B15R2.16446 O=C(Cc1cccnc1)NC2CCC2 AIFCHEM-5738952893 [1,0,0,1,0,0|2,0,0]=4 383 B15R2.297 CC1CCN(C1)C(=O)c2ccccc2 AIFCHEM-94565574429 [0,0,0,1,1,0|1,0,0]=3 384 B15R2.297 CC1CCN(C1)C(=O)c2cccnc2 AIFCHEM-5613914641 [0,0,0,1,1,0|2,0,0]=4 385 B15R2.297 C[C@@H]1CCN(C1)C(=O)c2ccccc2 AIFCHEM-94565579062 [0,0,0,1,1,0|1,0,0]=3 386 B15R2.297 C[C@@H]1CCN(C1)C(=O)c2cccnc2 AIFCHEM-5819872197 [0,0,0,1,1,0|2,0,0]=4 387 B15R2.297 C[C@H]1CCN(C1)C(=O)c2ccccc2 AIFCHEM-94565577816 [0,0,0,1,1,0|1,0,0]=3 388 B15R2.297 C[C@H]1CCN(C1)C(=O)c2cccnc2 AIFCHEM-5632489306 [0,0,0,1,1,0|2,0,0]=4 389 B15R2.297 O=C(c1ccccc1)N2CC[C@@H](C2)F AIFCHEM-94565575744 [0,0,0,1,1,0|2,0,0]=4 390 B15R2.297 O=C(c1ccccc1)N2CC[C@H](C2)F AIFCHEM-94601067208 [0,0,0,1,1,0|2,0,0]=4 391 B15R2.612 CN1CC(C1)NC(=O)c2ccccc2 AIFCHEM-94565586151 [0,0,0,1,1,0|2,0,0]=4 392 B15R2.596 CC1CC(C1)C(=O)Nc2ccccn2 AIFCHEM-5968895832 [0,0,0,1,1,0|2,0,0]=4 393 B15R2.596 O=C(Nc1ccccc1)C2CC(C2)O AIFCHEM-94552041848 [0,0,0,1,1,0|2,0,0]=4 394 B15R2.596 O=C(Nc1ccccc1)[C@H]2C[C@@H](C2)O AIFCHEM-94577030103 [0,0,0,1,1,0|2,0,0]=4 395 B15R2.596 O=C(Nc1ccccc1)[C@H]2C[C@H](C2)O AIFCHEM-94552045208 [0,0,0,1,1,0|2,0,0]=4 396 B15R2.16443 O=C(Cn1cccc1)NCCC2CC2 AIFCHEM-5763957677 [0,0,0,1,1,0|2,0,0]=4 397 B17R2.3231 CC1CCN(C1)C(=O)COc2ccccc2 AIFCHEM-5628910853 [0,0,0,1,0,1|1,0,0]=3 398 B17R2.3231 CC1CCN(C1)C(=O)CSc2ccccc2 AIFCHEM-5652920112 [0,0,0,1,0,1|1,0,0]=3 399 B17R2.3231 C[C@@H]1CCN(C1)C(=O)COc2ccccc2 AIFCHEM-5868256988 [0,0,0,1,0,1|1,0,0]=3 400 B17R2.3231 C[C@@H]1CCN(C1)C(=O)CSc2ccccc2 AIFCHEM-5792279065 [0,0,0,1,0,1|1,0,0]=3 401 B17R2.3231 C[C@H]1CCN(C1)C(=O)COc2ccccc2 AIFCHEM-5610235942 [0,0,0,1,0,1|1,0,0]=3 402 B17R2.3231 C[C@H]1CCN(C1)C(=O)CSc2ccccc2 AIFCHEM-5633123763 [0,0,0,1,0,1|1,0,0]=3 403 B17R2.3919 C[C@@H]1C[C@H]1CNC(=O)CCc2ccccc2 AIFCHEM-94599426389 [0,0,0,1,0,1|1,0,0]=3 404 B17R2.3919 C[C@@H]1C[C@H]1CNC(=O)COc2ccccc2 AIFCHEM-94599421167 [0,0,0,1,0,1|1,0,0]=3 405 B17R2.3919 C[C@@H]1C[C@H]1CNC(=O)CSc2ccncc2 AIFCHEM-94591218280 [0,0,0,1,0,1|2,0,0]=4 406 B17R2.5233 CC1CC(C1)NC(=O)CCc2ccncc2 AIFCHEM-6177627098 [0,0,0,1,0,1|2,0,0]=4 407 B17R2.5233 CC1CC(C1)NC(=O)COc2ccccc2 AIFCHEM-6142113643 [0,0,0,1,0,1|1,0,0]=3 408 B17R2.5233 CN1CC(C1)NC(=O)COc2ccccc2 AIFCHEM-6101397171 [0,0,0,1,0,1|2,0,0]=4 409 B17R2.5233 O=C(CCc1ccccc1)N[C@H]2C[C@@H](C2)F AIFCHEM-5891657033 [0,0,0,1,0,1|2,0,0]=4 410 B17R2.5233 O=C(CCc1ccccc1)N[C@H]2C[C@H](C2)F AIFCHEM-5941036757 [0,0,0,1,0,1|2,0,0]=4 411 B17R2.45566 O=C(CNCC1CC1)NCc2ccccc2 AIFCHEM-5803028450 [0,0,0,1,0,1|2,0,0]=4 412 B17R2.5025 CC(C)CNCC1C(=O)Nc2c1cccc2 AIFCHEM-94563724351 [0,0,0,1,0,1|2,0,0]=4 413 B17R2.5273 CC1CN(CCS1)C(=O)Cc2ccncc2 AIFCHEM-94534782896 [0,0,0,1,0,1|2,0,0]=4 414 B17R2.5273 CN1CCOC(C1)C(=O)Nc2ccccc2 AIFCHEM-94577037102 [0,0,0,1,0,1|2,0,0]=4 415 B17R2.5717 CC1(SCCN1C(=O)Cc2ccccn2)C AIFCHEM-94576232174 [0,0,0,1,0,1|2,0,0]=4 416 B17R2.5221 CC(C(=O)N[C@H]1C[C@@H](C1)F)c2ccccc2 AIFCHEM-5891285864 [0,1,0,1,0,0|2,0,0]=4 417 B17R2.5221 CC(C(=O)N[C@H]1C[C@H](C1)F)c2ccccc2 AIFCHEM-5960423681 [0,1,0,1,0,0|2,0,0]=4 418 B17R2.5221 C[C@@H](C(=O)NC1CC(C1)F)c2ccccc2 AIFCHEM-6175884189 [0,1,0,1,0,0|2,0,0]=4 419 B17R2.5221 C[C@@H](C(=O)N[C@H]1C[C@@H](C1)F)c2ccccc2 AIFCHEM-5979204126 [0,1,0,1,0,0|2,0,0]=4 420 B17R2.5221 C[C@H](C(=O)NC1CC(C1)F)c2ccccc2 AIFCHEM-6108538354 [0,1,0,1,0,0|2,0,0]=4 421 B17R2.5221 C[C@H](C(=O)N[C@H]1C[C@@H](C1)F)c2ccccc2 AIFCHEM-5913505636 [0,1,0,1,0,0|2,0,0]=4 422 B17R2.5221 C[C@H](C(=O)N[C@H]1C[C@H](C1)F)c2ccccc2 AIFCHEM-5941068378 [0,1,0,1,0,0|2,0,0]=4 423 B17R2.8654 CC(C(=O)N1CCC(C1)F)c2ccccc2 AIFCHEM-6166781205 [0,1,0,1,0,0|2,0,0]=4 424 B17R2.8654 CC(C(=O)N1CC[C@@H](C1)F)c2ccccc2 AIFCHEM-5634364296 [0,1,0,1,0,0|2,0,0]=4 425 B17R2.8654 CC(C(=O)N1CC[C@H](C1)F)c2ccccc2 AIFCHEM-5680141547 [0,1,0,1,0,0|2,0,0]=4 426 B17R2.8654 C[C@@H](C(=O)N1CCC(C1)F)c2ccccc2 AIFCHEM-6160862251 [0,1,0,1,0,0|2,0,0]=4 427 B17R2.8654 C[C@@H](C(=O)N1CC[C@@H](C1)F)c2ccccc2 AIFCHEM-5625298679 [0,1,0,1,0,0|2,0,0]=4 428 B17R2.8654 C[C@@H](C(=O)N1CC[C@H](C1)F)c2ccccc2 AIFCHEM-94601067913 [0,1,0,1,0,0|2,0,0]=4 429 B17R2.8654 C[C@H](C(=O)N1CCC(C1)F)c2ccccc2 AIFCHEM-6151571659 [0,1,0,1,0,0|2,0,0]=4 430 B17R2.8654 C[C@H](C(=O)N1CC[C@@H](C1)F)c2ccccc2 AIFCHEM-5682442511 [0,1,0,1,0,0|2,0,0]=4 431 B17R2.8654 C[C@H](C(=O)N1CC[C@H](C1)F)c2ccccc2 AIFCHEM-5657224627 [0,1,0,1,0,0|2,0,0]=4 432 B17R2.8654 O=C(C(O)c1ccccc1)N2CC[C@H](C2)F AIFCHEM-94601068736 [0,1,0,1,0,0|2,0,0]=4 433 B17R2.8654 O=C([C@@H](O)c1ccccc1)N2CC[C@H](C2)F AIFCHEM-94601062605 [0,1,0,1,0,0|2,0,0]=4 434 B17R2.8654 O=C([C@H](O)c1ccccc1)N2CC[C@H](C2)F AIFCHEM-94601066932 [0,1,0,1,0,0|2,0,0]=4 435 B17R2.210 CC1CCN(C1)C(=O)Cc2ccc(cc2)Br AIFCHEM-5638573515 [0,1,0,1,0,0|1,0,0]=3 436 B17R2.210 C[C@@H]1CCN(C1)C(=O)Cc2ccc(cc2)Br AIFCHEM-5791607482 [0,1,0,1,0,0|1,0,0]=3 437 B17R2.210 C[C@H]1CCN(C1)C(=O)Cc2ccc(cc2)Br AIFCHEM-5671722398 [0,1,0,1,0,0|1,0,0]=3 438 B17R2.210 O=C(Cc1ccc(cc1)Br)N2CCC(C2)F AIFCHEM-6176620917 [0,1,0,1,0,0|2,0,0]=4 439 B17R2.210 O=C(Cc1ccc(cc1)Br)N2CC[C@@H](C2)F AIFCHEM-5635020865 [0,1,0,1,0,0|2,0,0]=4 440 B17R2.210 O=C(Cc1ccc(cc1)Br)N2CC[C@H](C2)F AIFCHEM-94601063003 [0,1,0,1,0,0|2,0,0]=4 441 B17R2.210 O=C(Cc1ccc(cc1)O)N2CCC(C2)F AIFCHEM-6137565604 [0,1,0,1,0,0|2,0,0]=4 442 B17R2.210 O=C(Cc1ccc(cc1)O)N2CC[C@@H](C2)F AIFCHEM-5635571027 [0,1,0,1,0,0|2,0,0]=4 443 B17R2.210 O=C(Cc1ccc(cc1)O)N2CC[C@H](C2)F AIFCHEM-5680580676 [0,1,0,1,0,0|2,0,0]=4 444 B17R2.483 C[C@@H]1C[C@H]1CNC(=O)Cc2ccc(cc2)O AIFCHEM-94599422532 [0,1,0,1,0,0|1,0,0]=3 445 B17R2.56437 CC1CC(C1)NC(=O)Cc2ccc(cc2)Cl AIFCHEM-6140860719 [0,1,0,1,0,0|1,0,0]=3 446 B17R2.56437 CC1CC(C1)NC(=O)Cc2ccc(cn2)Cl AIFCHEM-6154081985 [0,1,0,1,0,0|2,0,0]=4 447 B17R2.56437 CN1CC(C1)NC(=O)Cc2ccc(cc2)O AIFCHEM-94583231176 [0,1,0,1,0,0|2,0,0]=4 448 B17R2.56437 O=C(Cc1ccc(cc1)Br)N[C@H]2C[C@@H](C2)F AIFCHEM-5979136731 [0,1,0,1,0,0|2,0,0]=4 449 B17R2.57022 Cc1ccc(nc1)CC(=O)NCCC2CC2 AIFCHEM-5764299689 [0,1,0,1,0,0|2,0,0]=4 450 B17R2.57022 O=C(Cc1ccc(cn1)Br)NCCC2CC2 AIFCHEM-5746405115 [0,1,0,1,0,0|2,0,0]=4 451 B17R2.57022 O=C(Cn1ccc(=O)cc1)NCCC2CC2 AIFCHEM-5784268928 [0,1,0,1,0,0|2,0,0]=4 452 B17R2.192 C[C@H]1CC[C@@H](CC1)C(=O)Nc2ccccc2 AIFCHEM-94552039956 [0,1,0,1,0,0|2,0,0]=4 453 B17R2.295439 CC1(CCN(C1)C(=O)Cc2ccccn2)F AIFCHEM-94576230399 [0,1,0,1,0,0|2,0,0]=4 454 B17R2.18667 CC1CCC(C1)C(=O)Nc2ccccc2Cl AIFCHEM-94556557559 [0,1,0,1,0,0|2,0,0]=4 455 B17R2.18667 CC1CCC(C1)C(=O)Nc2ccccc2F AIFCHEM-94582111263 [0,1,0,1,0,0|2,0,0]=4 456 B17R2.18667 CC1CCC(C1)C(=O)Nc2ccccc2I AIFCHEM-5980796819 [0,1,0,1,0,0|2,0,0]=4 457 B17R2.18667 CC1CCN(C1)C(=O)Cc2ncccc2Cl AIFCHEM-5628811073 [0,1,0,1,0,0|2,0,0]=4 458 B17R2.18667 CC1CCN(C1)C(=O)Cn2ccccc2=O AIFCHEM-5686562128 [0,1,0,1,0,0|2,0,0]=4 459 B17R2.18667 C[C@@H]1CCN(C1)C(=O)Cc2ncccc2Cl AIFCHEM-5868535828 [0,1,0,1,0,0|2,0,0]=4 460 B17R2.18667 C[C@H]1CCN(C1)C(=O)Cc2ncccc2Cl AIFCHEM-5666658134 [0,1,0,1,0,0|2,0,0]=4 461 B17R2.18667 C[C@H]1CCN(C1)C(=O)Cn2ccccc2=O AIFCHEM-5610233081 [0,1,0,1,0,0|2,0,0]=4 462 B17R2.18667 Cc1ccccc1NC(=O)C2CCC(C2)C AIFCHEM-94578152650 [0,1,0,1,0,0|2,0,0]=4 463 B17R2.20609 CC1CC(C1)NC(=O)Cc2ncccc2Br AIFCHEM-6177803066 [0,1,0,1,0,0|2,0,0]=4 464 B17R2.40308 C[C@@H]1C[C@H]1CNC(=O)Cn2ccccc2=O AIFCHEM-94599426930 [0,1,0,1,0,0|2,0,0]=4 465 B17R2.181376 O=C(Cc1ccccc1Cl)NCCC2CC2 AIFCHEM-5764245035 [0,1,0,1,0,0|1,0,0]=3 466 B17R2.181376 O=C(Cc1cccnc1Cl)NCCC2CC2 AIFCHEM-5697698405 [0,1,0,1,0,0|2,0,0]=4 467 B17R2.5294 CC1CCC(C1)C(=O)Nc2cccc(c2)Br AIFCHEM-94552707485 [0,1,0,1,0,0|2,0,0]=4 468 B17R2.5294 CC1CCC(C1)C(=O)Nc2cccc(c2)I AIFCHEM-5634638493 [0,1,0,1,0,0|2,0,0]=4 469 B17R2.5294 CC1CCN(C1)C(=O)Cc2cccc(c2)Br AIFCHEM-5637888021 [0,1,0,1,0,0|1,0,0]=3 470 B17R2.5294 CC1CCN(C1)C(=O)Cc2cccc(n2)F AIFCHEM-5613981000 [0,1,0,1,0,0|2,0,0]=4 471 B17R2.5294 CC1CCN(C1)C(=O)Cc2cccc(n2)O AIFCHEM-5686612317 [0,1,0,1,0,0|2,0,0]=4 472 B17R2.5294 CC1CCN(C1)C(=O)Cc2ccnc(c2)Br AIFCHEM-5686712959 [0,1,0,1,0,0|2,0,0]=4 473 B17R2.5294 C[C@@H]1CCN(C1)C(=O)Cc2cccc(c2)Br AIFCHEM-5843072901 [0,1,0,1,0,0|1,0,0]=3 474 B17R2.5294 C[C@@H]1CCN(C1)C(=O)Cc2cccc(n2)O AIFCHEM-5791939985 [0,1,0,1,0,0|2,0,0]=4 475 B17R2.5294 C[C@@H]1CCN(C1)C(=O)Cc2ccnc(c2)Br AIFCHEM-5868596437 [0,1,0,1,0,0|2,0,0]=4 476 B17R2.5294 C[C@H]1CCN(C1)C(=O)Cc2cccc(c2)Br AIFCHEM-5632815302 [0,1,0,1,0,0|1,0,0]=3 477 B17R2.5294 C[C@H]1CCN(C1)C(=O)Cc2cccc(n2)F AIFCHEM-5666414190 [0,1,0,1,0,0|2,0,0]=4 478 B17R2.5294 C[C@H]1CCN(C1)C(=O)Cc2cccc(n2)O AIFCHEM-5672083339 [0,1,0,1,0,0|2,0,0]=4 479 B17R2.5294 C[C@H]1CCN(C1)C(=O)Cc2ccnc(c2)Br AIFCHEM-5633002870 [0,1,0,1,0,0|2,0,0]=4 480 B17R2.5294 Cc1cccc(c1)CC(=O)N2CC[C@@H](C2)F AIFCHEM-5610460615 [0,1,0,1,0,0|2,0,0]=4 481 B17R2.5294 Cc1cccc(c1)CC(=O)N2CC[C@H](C2)F AIFCHEM-94601067012 [0,1,0,1,0,0|2,0,0]=4 482 B17R2.5294 Cc1cccc(c1)NC(=O)C2CCC(C2)C AIFCHEM-6101371291 [0,1,0,1,0,0|2,0,0]=4 483 B17R2.5294 O=C(Cc1cccc(c1)F)N2CC[C@@H](C2)F AIFCHEM-5610625773 [0,1,0,1,0,0|2,0,0]=4 484 B17R2.5294 O=C(Cc1cccc(c1)F)N2CC[C@H](C2)F AIFCHEM-5679384204 [0,1,0,1,0,0|2,0,0]=4 485 B17R2.19610 CC1CC(C1)NC(=O)Cc2cncc(c2)Br AIFCHEM-6142273760 [0,1,0,1,0,0|2,0,0]=4 486 B17R2.19610 CN1CC(C1)NC(=O)Cc2cccc(c2)I AIFCHEM-94583231980 [0,1,0,1,0,0|2,0,0]=4 487 B17R2.41873 C[C@@H]1C[C@H]1CNC(=O)Cc2cccc(n2)O AIFCHEM-94599429362 [0,1,0,1,0,0|2,0,0]=4 488 B17R2.41873 Cc1cccc(c1)CC(=O)NC[C@@H]2C[C@H]2C AIFCHEM-94599427344 [0,1,0,1,0,0|1,0,0]=3 489 B17R2.150383 Cc1cccc(c1)CC(=O)NCCC2CC2 AIFCHEM-5784303347 [0,1,0,1,0,0|1,0,0]=3 490 B17R2.150383 O=C(Cc1cccc(c1)O)NCCC2CC2 AIFCHEM-5697697235 [0,1,0,1,0,0|1,0,0]=3 491 B17R2.150383 O=C(Cc1cccc(n1)F)NCCC2CC2 AIFCHEM-5772778468 [0,1,0,1,0,0|2,0,0]=4 492 B17R2.150383 O=C(Cc1cccc(n1)O)NCCC2CC2 AIFCHEM-5717023674 [0,1,0,1,0,0|2,0,0]=4 493 B17R2.150383 O=C(Cc1ccnc(c1)Cl)NCCC2CC2 AIFCHEM-5746389397 [0,1,0,1,0,0|2,0,0]=4 494 B17R2.150383 O=C(Cc1cncc(c1)F)NCCC2CC2 AIFCHEM-5772719695 [0,1,0,1,0,0|2,0,0]=4 495 B17R3.67247 O=C(Cc1ccccn1)N2CC3CC2C3 AIFCHEM-5740583687 [0,0,0,2,0,0|2,0,0]=4 496 B17R3.67247 O=C(Cc1cccnc1)N2CC3CC2C3 AIFCHEM-94529329236 [0,0,0,2,0,0|2,0,0]=4 497 B13R1.337 CC(C)NCCCc1ccccc1 AIFCHEM-94520536453 [1,0,0,0,1,0|1,0,1]=4 498 B13R1.45 CC(C)CNC(=O)c1cccnc1 AIFCHEM-6179646778 [0,0,0,0,2,0|2,0,0]=4 499 B13R1.344 CC(C)CNC(=O)Cc1ccc[nH]1 AIFCHEM-94563733602 [0,0,0,0,2,0|2,0,0]=4 500 B13R1.348 CC(C)CC(=O)Nc1ccccn1 AIFCHEM-5962320555 [0,0,0,0,2,0|2,0,0]=4 501 B15R1.78 CCCNCC(=O)OCc1ccccc1 AIFCHEM-94569013856 [1,0,0,0,0,1|2,0,0]=4 502 B15R1.78 CCCOCC(=O)NCc1ccccc1 AIFCHEM-5876740065 [1,0,0,0,0,1|2,0,0]=4 503 B15R1.78 COCCNC(=O)COc1ccccc1 AIFCHEM-6017076951 [1,0,0,0,0,1|2,0,0]=4 504 B15R1.78 CSCCNC(=O)CCc1ccccc1 AIFCHEM-94598931451 [1,0,0,0,0,1|2,0,0]=4 505 B15R1.78 CSCCNC(=O)COc1ccccc1 AIFCHEM-5882541722 [1,0,0,0,0,1|2,0,0]=4 506 B15R1.78 CSCCNC(=O)CSc1ccccc1 AIFCHEM-94598925315 [1,0,0,0,0,1|2,0,0]=4 507 B15R1.504 CC(C)CNCCCCc1ccccc1 AIFCHEM-94572972500 [1,0,0,0,0,1|1,0,1]=4 508 B15R1.504 CC(C)CNCCSCc1ccccc1 AIFCHEM-94572978086 [1,0,0,0,0,1|2,0,0]=4 509 B17R1.1324 CC(C)CCCCC(=O)NCc1ccccc1 AIFCHEM-5855381323 [0,0,0,0,0,2|1,0,0]=3 510 B17R1.1324 CC(C)CCCNC(=O)COc1ccncc1 AIFCHEM-5728046602 [0,0,0,0,0,2|2,0,0]=4 511 B17R1.1324 CC(C)OCCNC(=O)CSc1ccccc1 AIFCHEM-6255430357 [0,0,0,0,0,2|1,0,0]=3 512 B17R1.1324 CN(C)CCCNC(=O)CSc1ccccc1 AIFCHEM-94584126569 [0,0,0,0,0,2|2,0,0]=4 513 B17R1.16611 CC(C)CCNC(=O)C/C=C/c1cccnc1 AIFCHEM-94572200334 [0,0,0,0,0,2|2,0,0]=4 514 B17R1.16611 CN(C)CCNC(=O)CCCc1ccccc1 AIFCHEM-5962157747 [0,0,0,0,0,2|2,0,0]=4 515 B17R1.16611 CN(C)CCNC(=O)CCOc1ccccc1 AIFCHEM-94537686411 [0,0,0,0,0,2|2,0,0]=4 516 B17R1.16611 CN(C)CCNC(=O)CCSc1ccccc1 AIFCHEM-5962265112 [0,0,0,0,0,2|2,0,0]=4