0 B18R1.33185 CC[C@H](C)[C@H](NC(=O)c1ccccc1C)C(=O)N AIFCHEM-5822086009 [0,0,1,0,0,0|1,0,0]=2 1 B18R1.33185 CC[C@H](C)[C@H](NC(=O)c1ccncc1Br)C(=O)N AIFCHEM-5879443934 [0,0,1,0,0,0|3,0,0]=4 2 B18R1.33185 CC[C@H](C)[C@H](NC(=O)c1ccncc1F)C(=O)N AIFCHEM-5859674150 [0,0,1,0,0,0|3,0,0]=4 3 B18R1.34464 CC[C@H](C)[C@@H](C(=O)O)N(CC)Cc1ccccc1 AIFCHEM-94537417321 [0,0,1,0,0,0|1,0,1]=3 4 B18R1.271097 CCC(C)C(NCc1ccccc1OC)C(=O)O AIFCHEM-5730007530 [0,0,1,0,0,0|2,0,0]=3 5 B18R1.271097 CCC(C)[C@H](NCc1ccccc1OC)C(=O)O AIFCHEM-5755159055 [0,0,1,0,0,0|2,0,0]=3 6 B18R1.271097 CC[C@@H](C)[C@@H](NCc1ccccc1OC)C(=O)O AIFCHEM-5750396757 [0,0,1,0,0,0|2,0,0]=3 7 B18R1.271097 CC[C@@H](C)[C@H](NCc1ccccc1OC)C(=O)O AIFCHEM-5693875985 [0,0,1,0,0,0|2,0,0]=3 8 B18R1.271097 CC[C@H](C)[C@@H](NCc1ccccc1OC)C(=O)O AIFCHEM-5906813971 [0,0,1,0,0,0|2,0,0]=3 9 B18R1.271097 CCc1ccccc1CNC(C(=O)O)C(C)CC AIFCHEM-5734484813 [0,0,1,0,0,0|1,0,1]=3 10 B18R1.271097 CCc1ccccc1CN[C@@H](C(=O)O)[C@H](C)CC AIFCHEM-5722357987 [0,0,1,0,0,0|1,0,1]=3 11 B18R1.271097 CCc1ccccc1CN[C@H](C(=O)N)[C@@H](C)CC AIFCHEM-5839171490 [0,0,1,0,0,0|2,0,1]=4 12 B18R1.271097 CCc1ccccc1CN[C@H](C(=O)O)C(C)CC AIFCHEM-5708644411 [0,0,1,0,0,0|1,0,1]=3 13 B18R1.271097 CCc1ccccc1CN[C@H](C(=O)O)[C@H](C)CC AIFCHEM-5713841598 [0,0,1,0,0,0|1,0,1]=3 14 B17R1.4457 CCC[C@H](NC(=O)c1ccccc1Cl)C(=O)N AIFCHEM-94562147126 [1,0,1,0,0,0|2,0,0]=4 15 B17R1.4457 CCC[C@H](NC(=O)c1ccccc1O)C(=O)N AIFCHEM-94527352290 [1,0,1,0,0,0|2,0,0]=4 16 B17R1.7988 CCC(C)C(NCc1ccccc1F)C(=O)O AIFCHEM-94542687122 [1,0,1,0,0,0|1,0,0]=3 17 B17R1.7988 CCC(C)C(NCc1ccccc1O)C(=O)O AIFCHEM-94532462308 [1,0,1,0,0,0|0,0,1]=3 18 B17R1.7988 CCC(C)C(NCc1cccnc1O)C(=O)O AIFCHEM-94542686451 [1,0,1,0,0,0|1,0,1]=4 19 B17R1.7988 CCC(C)C(NCc1ccncc1O)C(=O)O AIFCHEM-5765686398 [1,0,1,0,0,0|1,0,1]=4 20 B17R1.7988 CCC(C)C(NCc1cnccc1Br)C(=O)O AIFCHEM-5765898579 [1,0,1,0,0,0|2,0,0]=4 21 B17R1.7988 CCC(C)C(NCc1ncccc1C)C(=O)O AIFCHEM-5734781291 [1,0,1,0,0,0|1,0,1]=4 22 B17R1.7988 CCC(C)C(NCc1ncccc1F)C(=O)O AIFCHEM-94542686360 [1,0,1,0,0,0|2,0,0]=4 23 B17R1.7988 CCC(C)[C@H](NCc1ccccc1F)C(=O)O AIFCHEM-5695462602 [1,0,1,0,0,0|1,0,0]=3 24 B17R1.7988 CCC(C)[C@H](NCc1ccncc1O)C(=O)O AIFCHEM-5762074770 [1,0,1,0,0,0|1,0,1]=4 25 B17R1.7988 CCC(C)[C@H](NCc1cnccc1Br)C(=O)O AIFCHEM-5786708630 [1,0,1,0,0,0|2,0,0]=4 26 B17R1.7988 CCC(C)[C@H](NCc1ncccc1C)C(=O)O AIFCHEM-5695592386 [1,0,1,0,0,0|1,0,1]=4 27 B17R1.7988 CCC(C)[C@H](NCc1ncccc1F)C(=O)O AIFCHEM-5755267147 [1,0,1,0,0,0|2,0,0]=4 28 B17R1.7988 CC[C@@H](C)[C@@H](NCc1ccccc1F)C(=O)O AIFCHEM-5767098706 [1,0,1,0,0,0|1,0,0]=3 29 B17R1.7988 CC[C@@H](C)[C@@H](NCc1ccccc1O)C(=O)O AIFCHEM-94532464270 [1,0,1,0,0,0|0,0,1]=3 30 B17R1.7988 CC[C@@H](C)[C@@H](NCc1cccnc1O)C(=O)O AIFCHEM-5722401544 [1,0,1,0,0,0|1,0,1]=4 31 B17R1.7988 CC[C@@H](C)[C@@H](NCc1cnccc1Br)C(=O)O AIFCHEM-5785337445 [1,0,1,0,0,0|2,0,0]=4 32 B17R1.7988 CC[C@@H](C)[C@@H](NCc1ncccc1C)C(=O)O AIFCHEM-5767050048 [1,0,1,0,0,0|1,0,1]=4 33 B17R1.7988 CC[C@@H](C)[C@@H](NCc1ncccc1F)C(=O)O AIFCHEM-5774705717 [1,0,1,0,0,0|2,0,0]=4 34 B17R1.7988 CC[C@@H](C)[C@H](NCc1ccccc1F)C(=O)O AIFCHEM-5783634574 [1,0,1,0,0,0|1,0,0]=3 35 B17R1.7988 CC[C@@H](C)[C@H](NCc1ccccc1O)C(=O)O AIFCHEM-94532459979 [1,0,1,0,0,0|0,0,1]=3 36 B17R1.7988 CC[C@@H](C)[C@H](NCc1cccnc1O)C(=O)O AIFCHEM-5693754375 [1,0,1,0,0,0|1,0,1]=4 37 B17R1.7988 CC[C@@H](C)[C@H](NCc1ccncc1O)C(=O)O AIFCHEM-5744144424 [1,0,1,0,0,0|1,0,1]=4 38 B17R1.7988 CC[C@@H](C)[C@H](NCc1cnccc1Br)C(=O)O AIFCHEM-5771600174 [1,0,1,0,0,0|2,0,0]=4 39 B17R1.7988 CC[C@@H](C)[C@H](NCc1ncccc1C)C(=O)O AIFCHEM-5783692683 [1,0,1,0,0,0|1,0,1]=4 40 B17R1.7988 CC[C@@H](C)[C@H](NCc1ncccc1F)C(=O)O AIFCHEM-5693934255 [1,0,1,0,0,0|2,0,0]=4 41 B17R1.7988 CC[C@H](C)[C@@H](NCc1ccccc1F)C(=O)O AIFCHEM-5973285282 [1,0,1,0,0,0|1,0,0]=3 42 B17R1.7988 CC[C@H](C)[C@@H](NCc1ccccc1O)C(=O)O AIFCHEM-94532459980 [1,0,1,0,0,0|0,0,1]=3 43 B17R1.7988 CC[C@H](C)[C@@H](NCc1cccnc1O)C(=O)O AIFCHEM-94541097853 [1,0,1,0,0,0|1,0,1]=4 44 B17R1.7988 CC[C@H](C)[C@@H](NCc1cnccc1Br)C(=O)O AIFCHEM-5907155534 [1,0,1,0,0,0|2,0,0]=4 45 B17R1.7988 CC[C@H](C)[C@@H](NCc1ncccc1C)C(=O)O AIFCHEM-5906815337 [1,0,1,0,0,0|1,0,1]=4 46 B17R1.7988 CC[C@H](C)[C@@H](NCc1ncccc1F)C(=O)O AIFCHEM-5905226718 [1,0,1,0,0,0|2,0,0]=4 47 B17R1.7988 CC[C@H](C)[C@H](NCc1ccccc1O)C(=O)N AIFCHEM-94532455871 [1,0,1,0,0,0|1,0,1]=4 48 B17R1.7988 CC[C@H](C)[C@H](NCc1ccccc1O)C(=O)O AIFCHEM-94532465829 [1,0,1,0,0,0|0,0,1]=3 49 B17R1.7988 CC[C@H](C)[C@H](NCc1cccnc1O)C(=O)O AIFCHEM-94541103702 [1,0,1,0,0,0|1,0,1]=4 50 B17R1.7988 CO[C@@H](C)[C@@H](NCc1ccccc1O)C(=O)O AIFCHEM-94532466727 [1,0,1,0,0,0|1,0,1]=4 51 B17R1.7988 CO[C@H](C)[C@H](NCc1ccccc1O)C(=O)O AIFCHEM-94532465562 [1,0,1,0,0,0|1,0,1]=4 52 B17R1.23973 CC[C@H](C)[C@H](NC(=O)c1cccnc1)C(=O)N AIFCHEM-5801835651 [1,0,1,0,0,0|2,0,0]=4 53 B17R1.65738 Cc1ccncc1C(=O)N[C@@H](C(=O)N)C(C)C AIFCHEM-94550908043 [1,0,1,0,0,0|2,0,0]=4 54 B17R1.65738 Cc1ccncc1C(=O)N[C@H](C(=O)N)C(C)C AIFCHEM-94601603785 [1,0,1,0,0,0|2,0,0]=4 55 B17R1.24747 CCC(C)C(C(=O)O)N(C)Cc1ccccn1 AIFCHEM-5679696540 [1,0,1,0,0,0|1,0,1]=4 56 B17R1.24747 CCC(C)C(C(=O)O)N(C)Cc1cccnc1 AIFCHEM-5640637446 [1,0,1,0,0,0|1,0,1]=4 57 B17R1.24747 CC[C@H](C)[C@@H](C(=O)O)N(C)Cc1ccccn1 AIFCHEM-6065883372 [1,0,1,0,0,0|1,0,1]=4 58 B17R1.24747 CC[C@H](C)[C@@H](C(=O)O)N(C)Cc1cccnc1 AIFCHEM-6066101999 [1,0,1,0,0,0|1,0,1]=4 59 B17R1.27011 CSc1ccccc1CNC(C(=O)O)C(C)C AIFCHEM-5916067873 [1,0,1,0,0,0|2,0,0]=4 60 B17R1.27011 CSc1ccccc1CN[C@@H](C(=O)O)C(C)C AIFCHEM-5950414598 [1,0,1,0,0,0|2,0,0]=4 61 B19R1.43875 CC[C@H](C)[C@H](NC(=O)c1cc(ccc1C)Br)C(=O)N AIFCHEM-5879562895 [0,1,1,0,0,0|1,0,0]=3 62 B19R1.43875 CC[C@H](C)[C@H](NC(=O)c1cc(ccc1F)Cl)C(=O)N AIFCHEM-5879477789 [0,1,1,0,0,0|2,0,0]=4 63 B19R1.43875 CC[C@H](C)[C@H](NC(=O)c1cc(ccc1I)C)C(=O)N AIFCHEM-5870317887 [0,1,1,0,0,0|2,0,0]=4 64 B19R1.43875 CC[C@H](C)[C@H](NC(=O)c1cc(ccc1O)O)C(=O)N AIFCHEM-94559582659 [0,1,1,0,0,0|2,0,0]=4 65 B19R1.43896 CC[C@H](C)[C@H](NC(=O)c1cccc(c1C)F)C(=O)N AIFCHEM-5859749490 [0,1,1,0,0,0|1,0,0]=3 66 B19R1.43896 CC[C@H](C)[C@H](NC(=O)c1cccc(c1C)O)C(=O)N AIFCHEM-5859625935 [0,1,1,0,0,0|1,0,0]=3 67 B19R1.43896 CC[C@H](C)[C@H](NC(=O)c1cccc(c1F)Cl)C(=O)N AIFCHEM-5839354907 [0,1,1,0,0,0|2,0,0]=4 68 B19R1.43896 CC[C@H](C)[C@H](NC(=O)c1cccc(c1F)F)C(=O)N AIFCHEM-5822170825 [0,1,1,0,0,0|2,0,0]=4 69 B19R1.111008 CC[C@H](C)[C@H](NC(=O)c1ccccc1C#N)C(=O)N AIFCHEM-5870262762 [0,1,1,0,0,0|1,0,1]=4 70 B19R1.111008 CC[C@H](C)[C@H](NC(=O)c1ccccc1I=O)C(=O)N AIFCHEM-94522456532 [0,1,1,0,0,0|2,0,0]=4 71 B19R1.398628 CC[C@H](C)[C@H](NC(=O)c1ccncc1C)C(=O)OC AIFCHEM-94527544402 [0,1,1,0,0,0|1,0,0]=3 72 B19R1.398628 CC[C@H](C)[C@H](NC(=O)c1ncccc1Cl)C(=O)OC AIFCHEM-94527545547 [0,1,1,0,0,0|2,0,0]=4 73 B19R1.398742 CC[C@H](C)[C@H](NC(=O)c1ccc(cc1Br)Br)C(=O)N AIFCHEM-5822423641 [0,1,1,0,0,0|2,0,0]=4 74 B19R1.398742 CC[C@H](C)[C@H](NC(=O)c1ccc(cc1Cl)I)C(=O)N AIFCHEM-5839270260 [0,1,1,0,0,0|2,0,0]=4 75 B19R1.398742 CC[C@H](C)[C@H](NC(=O)c1ccc(cc1Cl)O)C(=O)N AIFCHEM-94571242179 [0,1,1,0,0,0|2,0,0]=4 76 B19R1.398742 CC[C@H](C)[C@H](NC(=O)c1ccc(cc1F)O)C(=O)N AIFCHEM-5879601980 [0,1,1,0,0,0|2,0,0]=4 77 B19R1.398742 CC[C@H](C)[C@H](NC(=O)c1ccc(nc1C)C)C(=O)N AIFCHEM-5822062369 [0,1,1,0,0,0|2,0,0]=4 78 B19R1.9118 CC[C@H](C)[C@H](NCc1ccccc1C(=O)O)C(=O)N AIFCHEM-5801204652 [0,1,1,0,0,0|1,0,0]=3 79 B19R1.119817 CCC(C)C(NCc1cccc(c1OC)Cl)C(=O)O AIFCHEM-94542685757 [0,1,1,0,0,0|2,0,0]=4 80 B19R1.119817 CCC(C)C(NCc1cccc(c1OC)F)C(=O)O AIFCHEM-94542688680 [0,1,1,0,0,0|2,0,0]=4 81 B19R1.119817 CCC(C)[C@H](NCc1cccc(c1OC)Cl)C(=O)O AIFCHEM-5726624218 [0,1,1,0,0,0|2,0,0]=4 82 B19R1.119817 CCC(C)[C@H](NCc1cccc(c1OC)F)C(=O)O AIFCHEM-5762022035 [0,1,1,0,0,0|2,0,0]=4 83 B19R1.119817 CC[C@@H](C)[C@@H](NCc1cccc(c1OC)Cl)C(=O)O AIFCHEM-5767116966 [0,1,1,0,0,0|2,0,0]=4 84 B19R1.119817 CC[C@@H](C)[C@@H](NCc1cccc(c1OC)F)C(=O)O AIFCHEM-5722443019 [0,1,1,0,0,0|2,0,0]=4 85 B19R1.119817 CC[C@@H](C)[C@H](NCc1cccc(c1OC)Cl)C(=O)O AIFCHEM-5744492764 [0,1,1,0,0,0|2,0,0]=4 86 B19R1.119817 CC[C@@H](C)[C@H](NCc1cccc(c1OC)F)C(=O)O AIFCHEM-5713655510 [0,1,1,0,0,0|2,0,0]=4 87 B19R1.119817 CC[C@H](C)[C@@H](NCc1cccc(c1OC)F)C(=O)O AIFCHEM-5927720290 [0,1,1,0,0,0|2,0,0]=4 88 B19R1.461824 CCC(C)C(NCc1cc(ccc1C#N)Br)C(=O)O AIFCHEM-94542688568 [0,1,1,0,0,0|1,0,1]=4 89 B19R1.461824 CCC(C)C(NCc1cc(ccc1OC)C)C(=O)O AIFCHEM-5718290477 [0,1,1,0,0,0|2,0,0]=4 90 B19R1.461824 CCC(C)[C@H](NCc1cc(ccc1C#N)Br)C(=O)O AIFCHEM-5777230638 [0,1,1,0,0,0|1,0,1]=4 91 B19R1.461824 CCC(C)[C@H](NCc1cc(ccc1OC)C)C(=O)O AIFCHEM-5722478034 [0,1,1,0,0,0|2,0,0]=4 92 B19R1.461824 CC[C@@H](C)[C@@H](NCc1cc(ccc1C#N)Br)C(=O)O AIFCHEM-5774553081 [0,1,1,0,0,0|1,0,1]=4 93 B19R1.461824 CC[C@@H](C)[C@@H](NCc1cc(ccc1OC)C)C(=O)O AIFCHEM-5785280284 [0,1,1,0,0,0|2,0,0]=4 94 B19R1.461824 CC[C@@H](C)[C@H](NCc1cc(ccc1OC)C)C(=O)O AIFCHEM-5771573056 [0,1,1,0,0,0|2,0,0]=4 95 B19R1.461824 CC[C@H](C)[C@@H](NCc1cc(ccc1C#N)Br)C(=O)O AIFCHEM-5906337349 [0,1,1,0,0,0|1,0,1]=4 96 B19R1.461824 CC[C@H](C)[C@@H](NCc1cc(ccc1OC)C)C(=O)O AIFCHEM-5906508109 [0,1,1,0,0,0|2,0,0]=4 97 B19R1.469022 CCC(C)C(NCc1ccc(cc1C#N)F)C(=O)O AIFCHEM-94542688796 [0,1,1,0,0,0|1,0,1]=4 98 B19R1.469022 CCC(C)C(NCc1ccc(cc1OC)F)C(=O)O AIFCHEM-94542687134 [0,1,1,0,0,0|2,0,0]=4 99 B19R1.469022 CCC(C)[C@H](NCc1ccc(cc1C#N)F)C(=O)O AIFCHEM-5708606813 [0,1,1,0,0,0|1,0,1]=4 100 B19R1.469022 CCC(C)[C@H](NCc1ccc(cc1OC)F)C(=O)O AIFCHEM-5779650330 [0,1,1,0,0,0|2,0,0]=4 101 B19R1.469022 CC[C@@H](C)[C@@H](NCc1ccc(cc1C#N)F)C(=O)O AIFCHEM-5785335707 [0,1,1,0,0,0|1,0,1]=4 102 B19R1.469022 CC[C@@H](C)[C@@H](NCc1ccc(cc1OC)F)C(=O)O AIFCHEM-5785378600 [0,1,1,0,0,0|2,0,0]=4 103 B19R1.469022 CC[C@@H](C)[C@H](NCc1ccc(cc1C#N)F)C(=O)O AIFCHEM-5762472373 [0,1,1,0,0,0|1,0,1]=4 104 B19R1.469022 CC[C@@H](C)[C@H](NCc1ccc(cc1OC)F)C(=O)O AIFCHEM-5771514535 [0,1,1,0,0,0|2,0,0]=4 105 B19R1.469022 CC[C@H](C)[C@@H](NCc1ccc(cc1C#N)F)C(=O)O AIFCHEM-5927919370 [0,1,1,0,0,0|1,0,1]=4 106 B19R1.478737 CCC(C)C(NCc1c(cccc1OC)C)C(=O)O AIFCHEM-5765528079 [0,1,1,0,0,0|2,0,0]=4 107 B19R1.478737 CCC(C)C(NCc1c(cccc1OC)O)C(=O)O AIFCHEM-5781432642 [0,1,1,0,0,0|2,0,0]=4 108 B19R1.478737 CCC(C)[C@H](NCc1c(cccc1OC)O)C(=O)O AIFCHEM-5722470542 [0,1,1,0,0,0|2,0,0]=4 109 B19R1.478737 CC[C@@H](C)[C@@H](NCc1c(cccc1OC)O)C(=O)O AIFCHEM-5774682480 [0,1,1,0,0,0|2,0,0]=4 110 B19R1.478737 CC[C@@H](C)[C@H](NCc1c(cccc1OC)C)C(=O)O AIFCHEM-5783642912 [0,1,1,0,0,0|2,0,0]=4 111 B19R1.478737 CC[C@@H](C)[C@H](NCc1c(cccc1OC)O)C(=O)O AIFCHEM-5762493999 [0,1,1,0,0,0|2,0,0]=4 112 B19R1.478737 CC[C@H](C)[C@@H](NCc1c(cccc1OC)C)C(=O)O AIFCHEM-5981858504 [0,1,1,0,0,0|2,0,0]=4 113 B19R1.478737 CC[C@H](C)[C@@H](NCc1c(cccc1OC)O)C(=O)O AIFCHEM-5981865529 [0,1,1,0,0,0|2,0,0]=4 114 B19R2.1566788 N#Cc1ccccc1CN[C@@H](C(=O)O)C2CCC2 AIFCHEM-5921443236 [0,0,1,1,0,0|1,0,1]=4 115 B17R1.23976 CC[C@H](C)[C@H](NC(=O)c1cc[nH]c1C)C(=O)N AIFCHEM-5802053459 [0,0,1,0,1,0|2,0,0]=4 116 B17R1.23976 CC[C@H](C)[C@H](NC(=O)c1ccsc1C)C(=O)N AIFCHEM-5839684531 [0,0,1,0,1,0|2,0,0]=4 117 B17R1.23976 CC[C@H](C)[C@H](NC(=O)c1cscc1C)C(=O)N AIFCHEM-5879606593 [0,0,1,0,1,0|2,0,0]=4 118 B19R1.395190 CC[C@H](C)[C@H](NC(=O)Cc1ccccc1F)C(=O)N AIFCHEM-5821762944 [0,0,1,0,0,1|2,0,0]=4 119 B19R1.395190 CC[C@H](C)[C@H](NC(=O)Cc1ccccc1I)C(=O)N AIFCHEM-5879529116 [0,0,1,0,0,1|2,0,0]=4 120 B19R1.110638 CCC(C)C(NCCc1ccccc1OC)C(=O)O AIFCHEM-5718219707 [0,0,1,0,0,1|2,0,0]=4 121 B19R1.110638 CCC(C)[C@H](NCCc1ccccc1OC)C(=O)O AIFCHEM-5726591450 [0,0,1,0,0,1|2,0,0]=4 122 B19R1.110638 CC[C@@H](C)[C@@H](NCCc1ccccc1OC)C(=O)O AIFCHEM-5750493540 [0,0,1,0,0,1|2,0,0]=4 123 B19R1.110638 CC[C@@H](C)[C@H](NCCc1ccccc1OC)C(=O)O AIFCHEM-5783749126 [0,0,1,0,0,1|2,0,0]=4 124 B19R1.110638 CC[C@H](C)[C@@H](NCCc1ccccc1OC)C(=O)O AIFCHEM-5928398272 [0,0,1,0,0,1|2,0,0]=4