0 B14R1.3 COc1ccc(cc1)NC(C)C(C)O AIFCHEM-94547068173 [0,0,0,0,0,0|2,0,1]=3 1 B14R1.3 COc1ccc(cc1)NC(C)C(F)F AIFCHEM-94577703255 [0,0,0,0,0,0|3,0,1]=4 2 B14R1.3 CSc1ccc(cc1)NC(C)C(C)O AIFCHEM-94547061949 [0,0,0,0,0,0|2,1,1]=4 3 B13R1.5 CCc1ccc(cc1)NC(C)CO AIFCHEM-5786194468 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.5 COc1ccc(cc1)NC(C)CO AIFCHEM-94577699851 [1,0,0,0,0,0|1,0,1]=3 5 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O AIFCHEM-5781434716 [1,0,0,0,0,0|3,0,0]=4 6 B15R1.16 CCOc1ccc(cc1)NC(C)C(C)O AIFCHEM-94547074151 [0,1,0,0,0,0|2,0,1]=4 7 B15R1.16 COCc1ccc(cc1)NC(C)C(C)O AIFCHEM-94547075863 [0,1,0,0,0,0|2,0,1]=4 8 B15R1.208 CCN(Cc1ccc(cc1)OC)C(=O)C AIFCHEM-99353249670 [0,1,0,0,0,0|3,0,0]=4 9 B15R1.219 COc1ccc(cc1)NC(C)C(C)(C)O AIFCHEM-94577699822 [0,1,0,0,0,0|2,0,1]=4 10 B15R1.1855 COc1ccc(c(c1)C)NC(C)C(C)O AIFCHEM-94547061698 [0,1,0,0,0,0|2,0,1]=4 11 B15R1.3777 COc1ccc(cc1Br)NC(C)C(C)O AIFCHEM-94547067715 [0,1,0,0,0,0|2,0,1]=4 12 B15R1.3777 COc1ccc(cc1C)NC(C)C(C)O AIFCHEM-94547065057 [0,1,0,0,0,0|2,0,1]=4 13 B15R1.3777 COc1ccc(cc1Cl)NC(C)C(C)O AIFCHEM-94547072809 [0,1,0,0,0,0|2,0,1]=4 14 B15R1.3777 COc1ccc(cc1F)NC(C)C(C)O AIFCHEM-94547071052 [0,1,0,0,0,0|2,0,1]=4 15 B15R1.3777 COc1ccc(cc1I)NC(C)C(C)O AIFCHEM-94547075289 [0,1,0,0,0,0|2,0,1]=4 16 B15R2.4834 COc1ccc2c(c1)CN(C2)C(=O)C AIFCHEM-5766170582 [0,0,0,1,0,0|3,0,0]=4 17 B13R1.36 COc1ccc(cc1)N(C)C(=O)C AIFCHEM-94605337723 [0,0,0,0,1,0|2,0,0]=3 18 B15R1.204 COc1ccc(nc1)CN(C)CC(=O)O AIFCHEM-5659274474 [0,0,0,0,0,1|3,0,0]=4 19 B15R1.204 CSc1ccc(cc1)CN(C)CC(=O)O AIFCHEM-5620958283 [0,0,0,0,0,1|2,1,0]=4 20 B15R1.205 COc1ccc(cc1)CNC(C)C(=O)N AIFCHEM-94533815969 [0,0,0,0,0,1|2,0,0]=3 21 B15R1.205 COc1ccc(cc1)CNC(C)C(C)O AIFCHEM-94547069239 [0,0,0,0,0,1|2,0,1]=4 22 B15R1.205 COc1ccc(cc1)CN[C@@H](C)C(=O)N AIFCHEM-94530165867 [0,0,0,0,0,1|2,0,0]=3 23 B15R1.205 COc1ccc(cc1)CN[C@@H](C)C(=O)O AIFCHEM-94576649568 [0,0,0,0,0,1|1,0,0]=2 24 B15R1.205 COc1ccc(cc1)CN[C@H](C)C(=O)N AIFCHEM-94551549891 [0,0,0,0,0,1|2,0,0]=3 25 B15R1.205 COc1ccc(cc1)CN[C@H](C)C(=O)O AIFCHEM-5951689113 [0,0,0,0,0,1|1,0,0]=2 26 B15R1.205 COc1ccc(nc1)CNC(C)C(=O)N AIFCHEM-94533817747 [0,0,0,0,0,1|3,0,0]=4 27 B15R1.205 COc1ccc(nc1)CNC(C)C(=O)O AIFCHEM-5926828508 [0,0,0,0,0,1|2,0,0]=3 28 B15R1.205 COc1ccc(nc1)CN[C@@H](C)C(=O)N AIFCHEM-94608801681 [0,0,0,0,0,1|3,0,0]=4 29 B15R1.205 COc1ccc(nc1)CN[C@@H](C)C(=O)O AIFCHEM-5760470466 [0,0,0,0,0,1|2,0,0]=3 30 B15R1.205 COc1ccc(nc1)CN[C@H](C)C(=O)N AIFCHEM-5929226590 [0,0,0,0,0,1|3,0,0]=4 31 B15R1.205 COc1ccc(nc1)CN[C@H](C)C(=O)O AIFCHEM-5978447816 [0,0,0,0,0,1|2,0,0]=3 32 B15R1.205 CSc1ccc(cc1)CNC(O)C(=O)O AIFCHEM-5632731933 [0,0,0,0,0,1|2,1,0]=4 33 B14R1.142 CC=Cc1ccc(cc1)CCC(=O)O AIFCHEM-6384002118 [1,1,0,0,0,0|2,0,0]=4 34 B14R1.142 CC=Cc1ccc(cc1)NCC(=O)O AIFCHEM-6187796965 [1,1,0,0,0,0|2,0,0]=4 35 B14R1.142 CCNc1ccc(cc1)OCC(=O)O AIFCHEM-94537418814 [1,1,0,0,0,0|1,0,0]=3 36 B14R1.6 COc1ccc(cc1)NC(CO)CO AIFCHEM-94577705902 [1,1,0,0,0,0|1,0,1]=4 37 B14R1.24 COCc1ccc(cc1)NC(C)CO AIFCHEM-5833842315 [1,1,0,0,0,0|1,0,1]=4 38 B14R1.3276 COc1ccc(cc1Cl)NC(C)CO AIFCHEM-94602534987 [1,1,0,0,0,0|1,0,1]=4 39 B14R1.3714 COc1ccc(c(c1)O)NC(C)CO AIFCHEM-5796901443 [1,1,0,0,0,0|1,0,1]=4 40 B14R1.8 CCN(C(=O)C)c1ccc(cc1)OC AIFCHEM-98288965083 [0,1,0,0,1,0|2,0,0]=4 41 B16R1.201 CNC(=O)CC(C)Nc1ccc(cc1)OC AIFCHEM-94577701671 [0,1,0,0,0,1|2,0,0]=4 42 B16R1.201 COC(=O)CC(C)Nc1ccc(cc1)OC AIFCHEM-94577699516 [0,1,0,0,0,1|1,0,0]=3 43 B16R1.4286 COc1ccc(cc1F)CN(C)CC(=O)O AIFCHEM-94554259138 [0,1,0,0,0,1|2,0,0]=4 44 B16R1.4286 COc1ccc(cc1I)CN(C)CC(=O)O AIFCHEM-94554258342 [0,1,0,0,0,1|2,0,0]=4 45 B16R1.20164 COc1ccc(c(c1)Br)CN(C)CC(=O)O AIFCHEM-5598071175 [0,1,0,0,0,1|2,0,0]=4 46 B16R1.20164 COc1ccc(c(c1)Cl)CN(C)CC(=O)O AIFCHEM-94554260125 [0,1,0,0,0,1|2,0,0]=4 47 B16R1.20164 COc1ccc(c(c1)F)CN(C)CC(=O)O AIFCHEM-94554258995 [0,1,0,0,0,1|2,0,0]=4 48 B16R1.197 COC(=O)C(C)NCc1ccc(cc1)OC AIFCHEM-5798142954 [0,1,0,0,0,1|1,0,0]=3 49 B16R1.197 COC(=O)[C@@H](C)NCc1ccc(cc1)OC AIFCHEM-5721825255 [0,1,0,0,0,1|1,0,0]=3 50 B16R1.197 COC(=O)[C@H](C)NCc1ccc(cc1)OC AIFCHEM-5729590889 [0,1,0,0,0,1|1,0,0]=3 51 B16R1.204 COc1ccc(cc1)CN[C@@H](CO)C(=O)N AIFCHEM-6475786252 [0,1,0,0,0,1|2,0,0]=4 52 B16R1.204 COc1ccc(cc1)CN[C@H](CO)C(=O)N AIFCHEM-6473598545 [0,1,0,0,0,1|2,0,0]=4 53 B16R1.204 COc1ccc(cn1)CNC(CO)C(=O)O AIFCHEM-6439022430 [0,1,0,0,0,1|2,0,0]=4 54 B16R1.204 COc1ccc(cn1)CN[C@@H](CO)C(=O)O AIFCHEM-94551094598 [0,1,0,0,0,1|2,0,0]=4 55 B16R1.204 COc1ccc(cn1)CN[C@H](CO)C(=O)O AIFCHEM-6487441834 [0,1,0,0,0,1|2,0,0]=4 56 B16R1.213 COc1ccc(cc1)C(=O)NC(C)C(=O)N AIFCHEM-94533821797 [0,1,0,0,0,1|2,0,0]=4 57 B16R1.213 COc1ccc(cc1)C(=O)N[C@@H](C)C(=O)N AIFCHEM-5744796667 [0,1,0,0,0,1|2,0,0]=4 58 B16R1.213 COc1ccc(cc1)C(=O)N[C@H](C)C(=O)N AIFCHEM-94551555719 [0,1,0,0,0,1|2,0,0]=4 59 B16R1.4287 COc1ccc(cc1Br)CNC(C)C(=O)O AIFCHEM-5957801640 [0,1,0,0,0,1|1,0,0]=3 60 B16R1.4287 COc1ccc(cc1Br)CN[C@@H](C)C(=O)O AIFCHEM-5736384797 [0,1,0,0,0,1|1,0,0]=3 61 B16R1.4287 COc1ccc(cc1Br)CN[C@H](C)C(=O)O AIFCHEM-5951837837 [0,1,0,0,0,1|1,0,0]=3 62 B16R1.4287 COc1ccc(cc1C)CNC(C)C(=O)N AIFCHEM-94533818459 [0,1,0,0,0,1|2,0,0]=4 63 B16R1.4287 COc1ccc(cc1C)CN[C@@H](C)C(=O)N AIFCHEM-5735086291 [0,1,0,0,0,1|2,0,0]=4 64 B16R1.4287 COc1ccc(cc1C)CN[C@@H](C)C(=O)O AIFCHEM-94576652058 [0,1,0,0,0,1|1,0,0]=3 65 B16R1.4287 COc1ccc(cc1C)CN[C@H](C)C(=O)N AIFCHEM-94551552381 [0,1,0,0,0,1|2,0,0]=4 66 B16R1.4287 COc1ccc(cc1Cl)CNC(C)C(=O)N AIFCHEM-6280076797 [0,1,0,0,0,1|2,0,0]=4 67 B16R1.4287 COc1ccc(cc1Cl)CN[C@@H](C)C(=O)N AIFCHEM-94530173507 [0,1,0,0,0,1|2,0,0]=4 68 B16R1.4287 COc1ccc(cc1Cl)CN[C@H](C)C(=O)N AIFCHEM-5898989182 [0,1,0,0,0,1|2,0,0]=4 69 B16R1.4287 COc1ccc(cc1F)CNC(O)C(=O)O AIFCHEM-5675285078 [0,1,0,0,0,1|2,0,0]=4 70 B16R1.4287 COc1ccc(cc1I)CNC(C)C(=O)O AIFCHEM-5926870413 [0,1,0,0,0,1|1,0,0]=3 71 B16R1.4287 COc1ccc(cc1I)CN[C@@H](C)C(=O)O AIFCHEM-94576651434 [0,1,0,0,0,1|1,0,0]=3 72 B16R1.4287 COc1ncc(cc1F)CNC(C)C(=O)O AIFCHEM-5927009519 [0,1,0,0,0,1|2,0,0]=4 73 B16R1.4287 COc1ncc(cc1F)CN[C@@H](C)C(=O)O AIFCHEM-94576654863 [0,1,0,0,0,1|2,0,0]=4 74 B16R1.5639 COc1ccc(c(c1)Cl)CNC(O)C(=O)O AIFCHEM-5675104115 [0,1,0,0,0,1|2,0,0]=4 75 B16R1.5639 COc1ccc(c(c1)F)CNC(C)C(=O)N AIFCHEM-94533818488 [0,1,0,0,0,1|2,0,0]=4 76 B16R1.5639 COc1ccc(c(c1)F)CN[C@@H](C)C(=O)N AIFCHEM-94608802422 [0,1,0,0,0,1|2,0,0]=4 77 B16R1.5639 COc1ccc(c(c1)F)CN[C@H](C)C(=O)N AIFCHEM-94551552410 [0,1,0,0,0,1|2,0,0]=4 78 B16R1.5639 COc1ccc(c(c1)O)CNC(C)C(=O)N AIFCHEM-94533820366 [0,1,0,0,0,1|2,0,0]=4 79 B16R1.5639 COc1ccc(c(c1)O)CNC(O)C(=O)O AIFCHEM-5676184116 [0,1,0,0,0,1|2,0,0]=4 80 B16R1.5639 COc1ccc(c(c1)O)CN[C@@H](C)C(=O)N AIFCHEM-94530175644 [0,1,0,0,0,1|2,0,0]=4 81 B16R1.5639 COc1ccc(c(c1)O)CN[C@@H](C)C(=O)O AIFCHEM-94576653965 [0,1,0,0,0,1|1,0,0]=3 82 B16R1.5639 COc1ccc(c(c1)O)CN[C@H](C)C(=O)N AIFCHEM-94551554288 [0,1,0,0,0,1|2,0,0]=4 83 B16R1.7117 CCOc1ccc(cc1)CNC(O)C(=O)O AIFCHEM-5593613080 [0,1,0,0,0,1|2,0,0]=4 84 B16R1.7117 CCOc1ccc(cn1)CNC(C)C(=O)O AIFCHEM-5957510583 [0,1,0,0,0,1|2,0,0]=4 85 B16R1.7117 CCOc1ccc(cn1)CN[C@@H](C)C(=O)O AIFCHEM-94576655350 [0,1,0,0,0,1|2,0,0]=4 86 B16R1.7117 CCOc1ccc(cn1)CN[C@H](C)C(=O)O AIFCHEM-5953452857 [0,1,0,0,0,1|2,0,0]=4 87 B16R1.12326 CC(C)c1ccc(cc1)CN[C@@H](C)C(=O)O AIFCHEM-5760796402 [0,1,0,0,0,1|2,0,0]=4 88 B16R1.12326 CC(C)c1ccc(cc1)CN[C@H](C)C(=O)O AIFCHEM-5934985515 [0,1,0,0,0,1|2,0,0]=4 89 B16R1.12326 CC(NCc1ccc(cc1)C(C)C)C(=O)O AIFCHEM-5957868206 [0,1,0,0,0,1|2,0,0]=4 90 B16R1.219 CCN(Cc1ccc(cc1)OC)C(=O)CO AIFCHEM-97890910486 [0,2,0,0,0,0|2,0,0]=4 91 B16R1.3885 CCNc1ccc(cc1)OC(C)(C)C(=O)O AIFCHEM-94537412681 [0,2,0,0,0,0|1,0,0]=3 92 B14R2.331 COc1ccc(cc1)NC2COC2 AIFCHEM-6141845488 [1,0,0,1,0,0|1,0,1]=4 93 B16R2.40 COc1ccc(cc1)NC2CNC(=O)C2 AIFCHEM-94577702946 [0,0,0,1,0,1|2,0,0]=4 94 B16R2.40 COc1ccc(cc1)NC2COC(=O)C2 AIFCHEM-94577703463 [0,0,0,1,0,1|1,0,0]=3 95 B14R1.679 CC(NCc1ccc(cc1)Cl)C(=O)O AIFCHEM-5977398856 [1,0,0,0,0,1|2,0,0]=4 96 B14R1.679 CC(NCc1ccc(cc1)O)C(=O)O AIFCHEM-5926915502 [1,0,0,0,0,1|1,0,0]=3 97 B14R1.679 C[C@@H](NCc1ccc(cc1)Cl)C(=O)O AIFCHEM-5951915489 [1,0,0,0,0,1|2,0,0]=4 98 B14R1.679 C[C@@H](NCc1ccc(cc1)O)C(=O)O AIFCHEM-5941501132 [1,0,0,0,0,1|1,0,0]=3 99 B14R1.679 C[C@H](NCc1ccc(cc1)Cl)C(=O)O AIFCHEM-5706835222 [1,0,0,0,0,1|2,0,0]=4 100 B14R1.679 C[C@H](NCc1ccc(cc1)O)C(=O)O AIFCHEM-5779135966 [1,0,0,0,0,1|1,0,0]=3 101 B16R1.4 COc1ccc(cc1)NC(C)CCC(=O)O AIFCHEM-94577700143 [0,0,0,0,0,2|1,0,0]=3 102 B16R1.4 COc1ccc(cc1)NC(C)CNC(=O)C AIFCHEM-94577704961 [0,0,0,0,0,2|2,0,0]=4 103 B16R1.4 COc1ccc(cc1)NC(C)COC(=O)C AIFCHEM-94577704089 [0,0,0,0,0,2|2,0,0]=4 104 B16R1.5 CCc1ccc(cc1)CNCC(C)C(=O)O AIFCHEM-5921110166 [0,0,0,0,0,2|2,0,0]=4 105 B16R1.5 CCc1ccc(cc1)CNC[C@@H](C)C(=O)O AIFCHEM-94558217321 [0,0,0,0,0,2|2,0,0]=4 106 B16R1.5 CCc1ccc(cc1)CNC[C@H](C)C(=O)O AIFCHEM-5765637067 [0,0,0,0,0,2|2,0,0]=4 107 B16R1.5 COc1ccc(cc1)CCNC(C)C(=O)N AIFCHEM-94533819774 [0,0,0,0,0,2|2,0,0]=4 108 B16R1.5 COc1ccc(cc1)CCNC(C)C(=O)O AIFCHEM-5957728048 [0,0,0,0,0,2|1,0,0]=3 109 B16R1.5 COc1ccc(cc1)CCNC(O)C(=O)O AIFCHEM-5632953857 [0,0,0,0,0,2|2,0,0]=4 110 B16R1.5 COc1ccc(cc1)CCN[C@@H](C)C(=O)N AIFCHEM-5744050054 [0,0,0,0,0,2|2,0,0]=4 111 B16R1.5 COc1ccc(cc1)CCN[C@@H](C)C(=O)O AIFCHEM-94576653373 [0,0,0,0,0,2|1,0,0]=3 112 B16R1.5 COc1ccc(cc1)CCN[C@H](C)C(=O)N AIFCHEM-94551553696 [0,0,0,0,0,2|2,0,0]=4 113 B16R1.5 COc1ccc(cc1)CCN[C@H](C)C(=O)O AIFCHEM-5953617476 [0,0,0,0,0,2|1,0,0]=3