0 B17R2.1942 CCc1cc(c(cc1C2=CC(=O)CC2)F)O 271570a_100010737933_100011156610 [0,0,1,0,0,0|2,0,1]=4 1 B17R2.23923 CC1SCCN1CCc2ccc(c(c2)O)O 269982a_200011216479_200010393615 [0,0,1,0,0,0|2,0,1]=4 2 B17R2.23923 C[C@@H]1CCCN1CCc2ccc(c(c2)O)O 269982a_100015189458_200010393615 [0,0,1,0,0,0|1,0,1]=3 3 B17R2.23923 C[C@H]1CCCN1CCc2ccc(c(c2)O)O 269982a_100020605311_200010393615 [0,0,1,0,0,0|1,0,1]=3 4 B17R2.23923 Cc1cc(ccc1Br)SCN2CCCC2=O 62a_100000026320_100009813585 [0,0,1,0,0,0|3,0,0]=4 5 B17R2.23923 Cc1cc(ccc1Br)SCN2CCCC2=O 62a_100009813585_100000026320 [0,0,1,0,0,0|3,0,0]=4 6 B17R2.23923 Cc1cc(ccc1Cl)SCN2CCCC2=O 62a_100000026320_100000049509 [0,0,1,0,0,0|3,0,0]=4 7 B17R2.23923 Cc1cc(ccc1Cl)SCN2CCCC2=O 62a_100000049509_100000026320 [0,0,1,0,0,0|3,0,0]=4 8 B17R2.23923 Cc1cc(ccc1F)SCN2CCCC2=O 62a_100000026320_100011218330 [0,0,1,0,0,0|3,0,0]=4 9 B17R2.23923 Cc1cc(ccc1F)SCN2CCCC2=O 62a_100011218330_100000026320 [0,0,1,0,0,0|3,0,0]=4 10 B17R2.23923 Cc1cc(ccc1N)SCN2CCCC2=O 62a_100000026320_100000211769 [0,0,1,0,0,0|3,0,0]=4 11 B17R2.23923 Cc1cc(ccc1N)SCN2CCCC2=O 62a_100000211769_100000026320 [0,0,1,0,0,0|3,0,0]=4 12 B17R2.23923 Cc1cc(ccc1O)SCN2CCCC2=O 62a_100000026320_100000186361 [0,0,1,0,0,0|2,0,0]=3 13 B17R2.23923 Cc1cc(cnc1O)SCN2CCCC2=O 62a_100000026320_100000685391 [0,0,1,0,0,0|3,0,0]=4 14 B17R2.23923 Cc1cc(cnc1O)SCN2CCCC2=O 62a_100000685391_100000026320 [0,0,1,0,0,0|3,0,0]=4 15 B17R2.23923 Cc1cc(ncc1O)SCN2CCCC2=O 62a_100000026320_100000692680 [0,0,1,0,0,0|3,0,0]=4 16 B17R2.23923 Cc1ccc(cc1Br)SCN2CCCC2=O 62a_100000026320_100011847877 [0,0,1,0,0,0|3,0,0]=4 17 B17R2.23923 Cc1ccc(cc1Br)SCN2CCCC2=O 62a_100011847877_100000026320 [0,0,1,0,0,0|3,0,0]=4 18 B17R2.23923 Cc1ccc(cc1C)SCN2CCCC2=O 62a_100000026320_100011215607 [0,0,1,0,0,0|3,0,0]=4 19 B17R2.23923 Cc1ccc(cc1C)SCN2CCCC2=O 62a_100011215607_100000026320 [0,0,1,0,0,0|3,0,0]=4 20 B17R2.23923 Cc1ccc(cc1Cl)SCN2CCCC2=O 62a_100000026320_100011216363 [0,0,1,0,0,0|3,0,0]=4 21 B17R2.23923 Cc1ccc(cc1Cl)SCN2CCCC2=O 62a_100011216363_100000026320 [0,0,1,0,0,0|3,0,0]=4 22 B17R2.23923 Cc1ccc(cc1F)SCN2CCCC2=O 62a_100000026320_100000720648 [0,0,1,0,0,0|3,0,0]=4 23 B17R2.23923 Cc1ccc(cc1F)SCN2CCCC2=O 62a_100000720648_100000026320 [0,0,1,0,0,0|3,0,0]=4 24 B17R2.23923 Cc1ccc(cc1N)SCN2CCCC2=O 62a_100000026320_100000761890 [0,0,1,0,0,0|3,0,0]=4 25 B17R2.23923 Cc1ccc(cc1N)SCN2CCCC2=O 62a_100000761890_100000026320 [0,0,1,0,0,0|3,0,0]=4 26 B17R2.23923 Cc1ccc(cc1O)SCN2CCCC2=O 62a_100000026320_100000685420 [0,0,1,0,0,0|2,0,0]=3 27 B17R2.23923 Cc1ccc(cc1O)SCN2CCCC2=O 62a_100000685420_100000026320 [0,0,1,0,0,0|2,0,0]=3 28 B17R2.23923 Cc1cnc(cc1O)SCN2CCCC2=O 62a_100000026320_100000704368 [0,0,1,0,0,0|3,0,0]=4 29 B17R2.23923 Cc1cnc(cc1O)SCN2CCCC2=O 62a_100000704368_100000026320 [0,0,1,0,0,0|3,0,0]=4 30 B17R2.23923 Cc1nc(ccc1O)SCN2CCCC2=O 62a_100000026320_100010233687 [0,0,1,0,0,0|3,0,0]=4 31 B17R2.23923 Cc1nc(ccc1O)SCN2CCCC2=O 62a_100010233687_100000026320 [0,0,1,0,0,0|3,0,0]=4 32 B17R2.23923 Cc1ncc(cc1O)SCN2CCCC2=O 62a_100000026320_100009864810 [0,0,1,0,0,0|3,0,0]=4 33 B17R2.23923 Cc1ncc(cc1O)SCN2CCCC2=O 62a_100009864810_100000026320 [0,0,1,0,0,0|3,0,0]=4 34 B17R2.23923 Nc1cc(ccc1Br)SCN2CCCC2=O 62a_100000026320_100000750456 [0,0,1,0,0,0|3,0,0]=4 35 B17R2.23923 Nc1cc(ccc1Br)SCN2CCCC2=O 62a_100000750456_100000026320 [0,0,1,0,0,0|3,0,0]=4 36 B17R2.23923 Nc1cc(ccc1Cl)SCN2CCCC2=O 62a_100000026320_200000761891 [0,0,1,0,0,0|3,0,0]=4 37 B17R2.23923 Nc1cc(ccc1Cl)SCN2CCCC2=O 62a_200000761891_100000026320 [0,0,1,0,0,0|3,0,0]=4 38 B17R2.23923 Nc1cc(ccc1F)SCN2CCCC2=O 62a_100000026320_100000740924 [0,0,1,0,0,0|3,0,0]=4 39 B17R2.23923 Nc1cc(ccc1F)SCN2CCCC2=O 62a_100000740924_100000026320 [0,0,1,0,0,0|3,0,0]=4 40 B17R2.23923 Nc1cc(ccc1O)SCN2CCCC2=O 62a_100000026320_100000752626 [0,0,1,0,0,0|2,0,0]=3 41 B17R2.23923 Nc1cc(ccc1O)SCN2CCCC2=O 62a_100000752626_100000026320 [0,0,1,0,0,0|2,0,0]=3 42 B17R2.23923 Nc1cc(cnc1O)SCN2CCCC2=O 62a_100000026320_100000743729 [0,0,1,0,0,0|3,0,0]=4 43 B17R2.23923 Nc1cc(cnc1O)SCN2CCCC2=O 62a_100000743729_100000026320 [0,0,1,0,0,0|3,0,0]=4 44 B17R2.23923 Nc1cc(ncc1O)SCN2CCCC2=O 62a_100000026320_100009819941 [0,0,1,0,0,0|3,0,0]=4 45 B17R2.23923 Nc1cc(ncc1O)SCN2CCCC2=O 62a_100009819941_100000026320 [0,0,1,0,0,0|3,0,0]=4 46 B17R2.23923 Nc1ccc(cc1Br)SCN2CCCC2=O 62a_100000026320_100000750455 [0,0,1,0,0,0|3,0,0]=4 47 B17R2.23923 Nc1ccc(cc1Br)SCN2CCCC2=O 62a_100000750455_100000026320 [0,0,1,0,0,0|3,0,0]=4 48 B17R2.23923 Nc1ccc(cc1Cl)SCN2CCCC2=O 62a_100000026320_100011218065 [0,0,1,0,0,0|3,0,0]=4 49 B17R2.23923 Nc1ccc(cc1Cl)SCN2CCCC2=O 62a_100011218065_100000026320 [0,0,1,0,0,0|3,0,0]=4 50 B17R2.23923 Nc1ccc(cc1F)SCN2CCCC2=O 62a_100000026320_100011215594 [0,0,1,0,0,0|3,0,0]=4 51 B17R2.23923 Nc1ccc(cc1F)SCN2CCCC2=O 62a_100011215594_100000026320 [0,0,1,0,0,0|3,0,0]=4 52 B17R2.23923 Nc1ccc(cc1N)SCN2CCCC2=O 62a_100000026320_100011534411 [0,0,1,0,0,0|3,0,0]=4 53 B17R2.23923 Nc1ccc(cc1N)SCN2CCCC2=O 62a_100000741789_100000026320 [0,0,1,0,0,0|3,0,0]=4 54 B17R2.23923 Nc1ccc(cc1O)SCN2CCCC2=O 62a_100000026320_100000739049 [0,0,1,0,0,0|2,0,0]=3 55 B17R2.23923 Nc1ccc(cc1O)SCN2CCCC2=O 62a_100000739049_100000026320 [0,0,1,0,0,0|2,0,0]=3 56 B17R2.23923 Nc1ccc(nc1O)SCN2CCCC2=O 62a_100000718904_100000026320 [0,0,1,0,0,0|3,0,0]=4 57 B17R2.23923 Nc1nc(ccc1O)SCN2CCCC2=O 62a_100000026320_100000685527 [0,0,1,0,0,0|3,0,0]=4 58 B17R2.23923 Nc1nc(ccc1O)SCN2CCCC2=O 62a_100000685527_100000026320 [0,0,1,0,0,0|3,0,0]=4 59 B17R2.23923 Nc1ncc(cc1O)SCN2CCCC2=O 62a_100000026320_100009819042 [0,0,1,0,0,0|3,0,0]=4 60 B17R2.23923 Nc1ncc(cc1O)SCN2CCCC2=O 62a_100009819042_100000026320 [0,0,1,0,0,0|3,0,0]=4 61 B17R2.23923 O=C1CCCC1NCc2ccc(c(c2)F)O 34a_100000758358_100000709159 [0,0,1,0,0,0|3,0,0]=4 62 B17R2.23923 O=C1CCCC1NCc2ccc(c(c2)O)Cl 34a_100020636435_100000709159 [0,0,1,0,0,0|3,0,0]=4 63 B17R2.23923 O=C1CCCC1NCc2ccc(c(c2)O)F 34a_100160469508_100000709159 [0,0,1,0,0,0|3,0,0]=4 64 B17R2.23923 O=C1CCCC1NCc2ccc(c(c2)O)O 34a_100000010075_100000709159 [0,0,1,0,0,0|2,0,0]=3 65 B17R2.23923 O=C1CCCN1CSc2c[nH]c(=O)c(c2)O 62a_100000026320_100009814561 [0,0,1,0,0,0|2,0,1]=4 66 B17R2.23923 O=C1CCCN1CSc2cc(c(cn2)F)O 62a_100000026320_100009854642 [0,0,1,0,0,0|3,0,0]=4 67 B17R2.23923 O=C1CCCN1CSc2cc(c(cn2)F)O 62a_100009854642_100000026320 [0,0,1,0,0,0|3,0,0]=4 68 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)Br 62a_100000026320_100012356285 [0,0,1,0,0,0|3,0,0]=4 69 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)Br 62a_100012356285_100000026320 [0,0,1,0,0,0|3,0,0]=4 70 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)Cl 62a_100000026320_100012353702 [0,0,1,0,0,0|3,0,0]=4 71 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)Cl 62a_100012353702_100000026320 [0,0,1,0,0,0|3,0,0]=4 72 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)F 62a_100000026320_100012047266 [0,0,1,0,0,0|3,0,0]=4 73 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)F 62a_100012047266_100000026320 [0,0,1,0,0,0|3,0,0]=4 74 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)O 62a_100000026320_100012361655 [0,0,1,0,0,0|2,0,0]=3 75 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Br)O 62a_100012361655_100000026320 [0,0,1,0,0,0|2,0,0]=3 76 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)Br 62a_100000026320_100012047281 [0,0,1,0,0,0|3,0,0]=4 77 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)Br 62a_100012047281_100000026320 [0,0,1,0,0,0|3,0,0]=4 78 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)Cl 62a_100000026320_100011214914 [0,0,1,0,0,0|3,0,0]=4 79 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)Cl 62a_100011214914_100000026320 [0,0,1,0,0,0|3,0,0]=4 80 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)F 62a_100000026320_100011215976 [0,0,1,0,0,0|3,0,0]=4 81 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)F 62a_100011215976_100000026320 [0,0,1,0,0,0|3,0,0]=4 82 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)O 62a_100000026320_100012360047 [0,0,1,0,0,0|2,0,0]=3 83 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)Cl)O 62a_100012360047_100000026320 [0,0,1,0,0,0|2,0,0]=3 84 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)Br 62a_100000026320_100000685389 [0,0,1,0,0,0|3,0,0]=4 85 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)Br 62a_100000685389_100000026320 [0,0,1,0,0,0|3,0,0]=4 86 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)Cl 62a_100000026320_100011216805 [0,0,1,0,0,0|3,0,0]=4 87 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)Cl 62a_100011216805_100000026320 [0,0,1,0,0,0|3,0,0]=4 88 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)F 62a_100000026320_100000703953 [0,0,1,0,0,0|3,0,0]=4 89 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)F 62a_100000703953_100000026320 [0,0,1,0,0,0|3,0,0]=4 90 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)O 62a_100000026320_100000185481 [0,0,1,0,0,0|2,0,0]=3 91 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)F)O 62a_100000185481_100000026320 [0,0,1,0,0,0|2,0,0]=3 92 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)O)Br 62a_100000026320_100012356990 [0,0,1,0,0,0|2,0,0]=3 93 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)O)Br 62a_100012356990_100000026320 [0,0,1,0,0,0|2,0,0]=3 94 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)O)Cl 62a_100000026320_100011356854 [0,0,1,0,0,0|2,0,0]=3 95 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)O)Cl 62a_100011356854_100000026320 [0,0,1,0,0,0|2,0,0]=3 96 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)O)F 62a_100000026320_100000686035 [0,0,1,0,0,0|2,0,0]=3 97 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)O)F 62a_100000686035_100000026320 [0,0,1,0,0,0|2,0,0]=3 98 B17R2.23923 O=C1CCCN1CSc2ccc(c(c2)O)O 62a_100000026320_100009813601 [0,0,1,0,0,0|1,0,0]=2 99 B17R2.23923 O=C1CCCN1CSc2ccc(c(n2)Br)O 62a_100000026320_100000725334 [0,0,1,0,0,0|3,0,0]=4 100 B17R2.23923 O=C1CCCN1CSc2ccc(c(n2)Br)O 62a_100000725334_100000026320 [0,0,1,0,0,0|3,0,0]=4 101 B17R2.23923 O=C1CCCN1CSc2ccc(c(n2)Cl)O 62a_100000026320_100000721234 [0,0,1,0,0,0|3,0,0]=4 102 B17R2.23923 O=C1CCCN1CSc2ccc(c(n2)F)O 62a_100000026320_100009819667 [0,0,1,0,0,0|3,0,0]=4 103 B17R2.23923 O=C1CCCN1CSc2ccc(c(n2)F)O 62a_100009819667_100000026320 [0,0,1,0,0,0|3,0,0]=4 104 B17R2.23923 O=C1CCCN1CSc2ccc(c(n2)O)F 62a_100000026320_100010729010 [0,0,1,0,0,0|3,0,0]=4 105 B17R2.23923 O=C1CCCN1CSc2cnc(c(c2)Cl)O 62a_100000026320_100010238531 [0,0,1,0,0,0|3,0,0]=4 106 B17R2.23923 O=C1CCCN1CSc2cnc(c(c2)Cl)O 62a_100010238531_100000026320 [0,0,1,0,0,0|3,0,0]=4 107 B17R2.23923 O=C1CCCN1CSc2cnc(c(c2)O)F 62a_100000026320_100009819871 [0,0,1,0,0,0|3,0,0]=4 108 B17R2.23923 O=C1CCCN1CSc2cnc(c(c2)O)F 62a_100009819871_100000026320 [0,0,1,0,0,0|3,0,0]=4 109 B17R2.23923 O=C1OCCC1NCc2ccc(c(c2)O)O 34a_100000010075_100000211211 [0,0,1,0,0,0|3,0,0]=4 110 B17R2.39955 CC(=O)N1CCc2cc(c(cc2C1C)O)O 527a_100000735813_100103153847 [0,0,1,0,0,0|0,0,0]=1 111 B17R2.39955 CC(C)N1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000210206 [0,0,1,0,0,0|1,0,1]=3 112 B17R2.357666 C=CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_200121576911 [0,0,1,0,0,0|0,0,2]=3 113 B17R2.357666 CC(CO)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100012180447 [0,0,1,0,0,0|2,0,1]=4 114 B17R2.357666 CCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210414 [0,0,1,0,0,0|0,0,0]=1 115 B17R2.357666 CCC(C)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100011215416 [0,0,1,0,0,0|1,0,1]=3 116 B17R2.357666 CNC(=O)N1CCc2cc(c(cc2C1)O)O 273464a_100102657272_200015384465 [0,0,1,0,0,0|1,0,0]=2 117 B17R2.357666 O=C(CO)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210174 [0,0,1,0,0,0|1,0,0]=2 118 B16R2.1063 Oc1ccc(cc1O)CCN2CCCC2 269982a_100000188435_200010393615 [1,0,1,0,0,0|0,0,1]=3 119 B16R2.1063 Oc1ccc(cc1O)CCN2CCSC2 269982a_100011215254_200010393615 [1,0,1,0,0,0|1,0,1]=4 120 B16R2.1067 C[C@@H]1CCCN1CCc2ccc(cc2)O 2230a_100015189458_100009816426 [1,0,1,0,0,0|1,0,1]=4 121 B16R2.1067 C[C@@H]1CCCN1CCc2ccc(cc2)O 269982a_100015189458_100009816426 [1,0,1,0,0,0|1,0,1]=4 122 B16R2.1067 C[C@H]1CCCN1CCc2ccc(cc2)O 2230a_100020605311_100009816426 [1,0,1,0,0,0|1,0,1]=4 123 B16R2.1067 C[C@H]1CCCN1CCc2ccc(cc2)O 269982a_100020605311_100009816426 [1,0,1,0,0,0|1,0,1]=4 124 B16R2.1067 Cc1ccc(cc1)SCN2CCCC2=O 62a_100000026320_100000186775 [1,0,1,0,0,0|2,0,0]=4 125 B16R2.1067 Cc1ccc(cc1)SCN2CCCC2=O 62a_100000186775_100000026320 [1,0,1,0,0,0|2,0,0]=4 126 B16R2.1067 Nc1ccc(cc1)SCN2CCCC2=O 62a_100000026320_100000185761 [1,0,1,0,0,0|2,0,0]=4 127 B16R2.1067 Nc1ccc(cc1)SCN2CCCC2=O 62a_100000185761_100000026320 [1,0,1,0,0,0|2,0,0]=4 128 B16R2.1067 O=C1CCCC1NCc2ccc(cc2)O 34a_100000185549_100000709159 [1,0,1,0,0,0|2,0,0]=4 129 B16R2.1067 O=C1CCCN1CSc2ccc(cc2)Br 62a_100000026320_100000752885 [1,0,1,0,0,0|2,0,0]=4 130 B16R2.1067 O=C1CCCN1CSc2ccc(cc2)Br 62a_100000752885_100000026320 [1,0,1,0,0,0|2,0,0]=4 131 B16R2.1067 O=C1CCCN1CSc2ccc(cc2)Cl 62a_100000026320_100000755918 [1,0,1,0,0,0|2,0,0]=4 132 B16R2.1067 O=C1CCCN1CSc2ccc(cc2)Cl 62a_100000755918_100000026320 [1,0,1,0,0,0|2,0,0]=4 133 B16R2.1067 O=C1CCCN1CSc2ccc(cc2)F 62a_100000026320_100000211213 [1,0,1,0,0,0|2,0,0]=4 134 B16R2.1067 O=C1CCCN1CSc2ccc(cc2)F 62a_100000211213_100000026320 [1,0,1,0,0,0|2,0,0]=4 135 B16R2.1067 O=C1CCCN1CSc2ccc(cc2)O 62a_100000026320_100000185759 [1,0,1,0,0,0|1,0,0]=3 136 B16R2.1067 O=C1CCCN1CSc2ccc(cn2)O 62a_100000026320_100000744096 [1,0,1,0,0,0|2,0,0]=4 137 B16R2.1067 O=C1CCCN1CSc2ccc(cn2)O 62a_100000685995_100000026320 [1,0,1,0,0,0|2,0,0]=4 138 B16R2.2910 Cc1cccc(c1)SCN2CCCC2=O 62a_100000026320_100011215228 [1,0,1,0,0,0|2,0,0]=4 139 B16R2.2910 Cc1cccc(c1)SCN2CCCC2=O 62a_100011215228_100000026320 [1,0,1,0,0,0|2,0,0]=4 140 B16R2.2910 Nc1cccc(c1)SCN2CCCC2=O 62a_100000026320_100000210019 [1,0,1,0,0,0|2,0,0]=4 141 B16R2.2910 Nc1cccc(c1)SCN2CCCC2=O 62a_100000210019_100000026320 [1,0,1,0,0,0|2,0,0]=4 142 B16R2.2910 O=C1CCCC1NCc2cccc(c2)O 2230a_100000743036_100000211823 [1,0,1,0,0,0|2,0,0]=4 143 B16R2.2910 O=C1CCCC1NCc2cccc(c2)O 34a_100000743036_100000709159 [1,0,1,0,0,0|2,0,0]=4 144 B16R2.2910 O=C1CCCC1OCc2cccc(c2)O 34a_200000719330_100011660834 [1,0,1,0,0,0|2,0,0]=4 145 B16R2.2910 O=C1CCCC1SCc2cccc(c2)O 62a_100000211823_100011660834 [1,0,1,0,0,0|2,0,0]=4 146 B16R2.2910 O=C1CCCC1SCc2cccc(c2)O 62a_100011660834_100000211823 [1,0,1,0,0,0|2,0,0]=4 147 B16R2.2910 O=C1CCCN1CSc2cc(ccn2)O 62a_100000026320_100000762945 [1,0,1,0,0,0|2,0,0]=4 148 B16R2.2910 O=C1CCCN1CSc2cccc(c2)Br 62a_100000026320_100000691529 [1,0,1,0,0,0|2,0,0]=4 149 B16R2.2910 O=C1CCCN1CSc2cccc(c2)Br 62a_100000691529_100000026320 [1,0,1,0,0,0|2,0,0]=4 150 B16R2.2910 O=C1CCCN1CSc2cccc(c2)Cl 62a_100000026320_100000699651 [1,0,1,0,0,0|2,0,0]=4 151 B16R2.2910 O=C1CCCN1CSc2cccc(c2)Cl 62a_100000699651_100000026320 [1,0,1,0,0,0|2,0,0]=4 152 B16R2.2910 O=C1CCCN1CSc2cccc(c2)F 62a_100000026320_100000685547 [1,0,1,0,0,0|2,0,0]=4 153 B16R2.2910 O=C1CCCN1CSc2cccc(c2)F 62a_100000685547_100000026320 [1,0,1,0,0,0|2,0,0]=4 154 B16R2.2910 O=C1CCCN1CSc2cccc(c2)O 62a_100000026320_100000211634 [1,0,1,0,0,0|1,0,0]=3 155 B16R2.2910 O=C1CCCN1CSc2cccc(c2)[S] 62a_100000026320_114929384022 [1,0,1,0,0,0|1,1,0]=4 156 B16R2.2910 O=C1CCCN1CSc2cccc(c2)[S] 62a_114929384022_100000026320 [1,0,1,0,0,0|1,1,0]=4 157 B16R2.2910 O=C1CCCN1CSc2cncc(c2)O 62a_100000026320_100000754920 [1,0,1,0,0,0|2,0,0]=4 158 B16R2.2910 O=C1CCCN1CSc2cncc(c2)O 62a_100000754920_100000026320 [1,0,1,0,0,0|2,0,0]=4 159 B16R2.3885 CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100015343762 [1,0,1,0,0,0|0,0,0]=2 160 B16R2.3885 CC(C)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000210206 [1,0,1,0,0,0|1,0,1]=4 161 B16R2.37659 CCN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000210202 [1,0,1,0,0,0|0,0,1]=3 162 B16R2.1205 C=CC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_200121576911 [1,0,1,0,0,0|0,0,2]=4 163 B16R2.1205 CCC(=O)C1CCc2ccc(cc2C1)O 1458a_100000087082_100000210202 [1,0,1,0,0,0|1,0,0]=3 164 B16R2.1205 CCC(=O)C1CCc2ccc(cc2O1)O 1458a_100000099368_100000210202 [1,0,1,0,0,0|2,0,0]=4 165 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Br 11a_100015189961_100000210414 [1,0,1,0,0,0|1,0,0]=3 166 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_100000210414 [1,0,1,0,0,0|1,0,0]=3 167 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000210414 [1,0,1,0,0,0|1,0,0]=3 168 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Br 527a_100015189961_100000210414 [1,0,1,0,0,0|1,0,0]=3 169 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)C 11a_100011255368_100000210414 [1,0,1,0,0,0|1,0,0]=3 170 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)C 1626a_100011255368_100000210414 [1,0,1,0,0,0|1,0,0]=3 171 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)C 240690a_100011255368_100000210414 [1,0,1,0,0,0|1,0,0]=3 172 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)C 527a_100011255368_100000210414 [1,0,1,0,0,0|1,0,0]=3 173 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Cl 11a_100000690163_100000210414 [1,0,1,0,0,0|1,0,0]=3 174 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_100000210414 [1,0,1,0,0,0|1,0,0]=3 175 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000210414 [1,0,1,0,0,0|1,0,0]=3 176 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100000210414 [1,0,1,0,0,0|1,0,0]=3 177 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)F 11a_100000755980_100000210414 [1,0,1,0,0,0|1,0,0]=3 178 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_100000210414 [1,0,1,0,0,0|1,0,0]=3 179 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000210414 [1,0,1,0,0,0|1,0,0]=3 180 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)F 527a_100000755980_100000210414 [1,0,1,0,0,0|1,0,0]=3 181 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000210414 [1,0,1,0,0,0|0,0,0]=2 182 B16R2.1205 CCC(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100000210414 [1,0,1,0,0,0|0,0,0]=2 183 B16R2.1205 CCC(=O)N1CCc2ncc(cc2C1)Cl 11a_100016987718_100000210414 [1,0,1,0,0,0|2,0,0]=4 184 B16R2.1205 CCC(=O)N1CCc2ncc(cc2C1)Cl 1626a_100016987718_100000210414 [1,0,1,0,0,0|2,0,0]=4 185 B16R2.1205 CCC(=O)N1CCc2ncc(cc2C1)Cl 240690a_100016987718_100000210414 [1,0,1,0,0,0|2,0,0]=4 186 B16R2.1205 CCC(=O)N1CCc2ncc(cc2C1)Cl 527a_100016987718_100000210414 [1,0,1,0,0,0|2,0,0]=4 187 B16R2.1205 CCC(C)N1CCc2ccc(cc2C1)O 2230a_100015185785_100000758301 [1,0,1,0,0,0|1,0,1]=4 188 B16R2.1205 CCC(C)N1CCc2ccc(cc2C1)O 269982a_100015185785_100000758301 [1,0,1,0,0,0|1,0,1]=4 189 B16R2.1205 CCC(C)N1CCc2ccc(cc2C1)O 34a_100015185785_100011215416 [1,0,1,0,0,0|1,0,1]=4 190 B16R2.1205 CNC(=O)C1CCc2ccc(cc2C1)O 240690a_100102657272_100000087082 [1,0,1,0,0,0|2,0,0]=4 191 B16R2.1205 CNC(=O)C1CCc2ccc(cc2C1)O 527a_100102657272_100000087082 [1,0,1,0,0,0|2,0,0]=4 192 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)Br 2708a_100102657272_100015189961 [1,0,1,0,0,0|2,0,0]=4 193 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)Br 273464a_100102657272_100015189961 [1,0,1,0,0,0|2,0,0]=4 194 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)C 2708a_100102657272_100011255368 [1,0,1,0,0,0|2,0,0]=4 195 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)C 273464a_100102657272_100011255368 [1,0,1,0,0,0|2,0,0]=4 196 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)Cl 2708a_100102657272_100000690163 [1,0,1,0,0,0|2,0,0]=4 197 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)Cl 273464a_100102657272_100000690163 [1,0,1,0,0,0|2,0,0]=4 198 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)F 2708a_100102657272_100000755980 [1,0,1,0,0,0|2,0,0]=4 199 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)F 273464a_100102657272_100000755980 [1,0,1,0,0,0|2,0,0]=4 200 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)O 2708a_100102657272_100015185785 [1,0,1,0,0,0|1,0,0]=3 201 B16R2.1205 CNC(=O)N1CCc2ccc(cc2C1)O 273464a_100102657272_100015185785 [1,0,1,0,0,0|1,0,0]=3 202 B16R2.1205 Cc1ccc2c(c1)CN(CC2)C(=O)CO 240690a_100011255368_100000210174 [1,0,1,0,0,0|2,0,0]=4 203 B16R2.1205 Cc1ccc2c(c1)CN(CC2)C(=O)CO 527a_100011255368_100000210174 [1,0,1,0,0,0|2,0,0]=4 204 B16R2.1205 O=C(CF)C1CCc2ccc(cc2C1)O 1458a_100000087082_100015361967 [1,0,1,0,0,0|2,0,0]=4 205 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000210174 [1,0,1,0,0,0|2,0,0]=4 206 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)Br 527a_100015189961_100000210174 [1,0,1,0,0,0|2,0,0]=4 207 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000210174 [1,0,1,0,0,0|2,0,0]=4 208 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100000210174 [1,0,1,0,0,0|2,0,0]=4 209 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000210174 [1,0,1,0,0,0|2,0,0]=4 210 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)F 527a_100000755980_100000210174 [1,0,1,0,0,0|2,0,0]=4 211 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000210174 [1,0,1,0,0,0|1,0,0]=3 212 B16R2.1205 O=C(CO)N1CCc2ccc(cc2C1)O 527a_100015185785_100000210174 [1,0,1,0,0,0|1,0,0]=3 213 B16R2.33799 C=CC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_200121576911 [1,0,1,0,0,0|0,0,2]=4 214 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Br 11a_100000686056_100000210414 [1,0,1,0,0,0|1,0,0]=3 215 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_100000210414 [1,0,1,0,0,0|1,0,0]=3 216 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000210414 [1,0,1,0,0,0|1,0,0]=3 217 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Br 527a_100000686056_100000210414 [1,0,1,0,0,0|1,0,0]=3 218 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)C 11a_100000718575_100000210414 [1,0,1,0,0,0|1,0,0]=3 219 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)C 1626a_100000718575_100000210414 [1,0,1,0,0,0|1,0,0]=3 220 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)C 240690a_100000718575_100000210414 [1,0,1,0,0,0|1,0,0]=3 221 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)C 527a_100000718575_100000210414 [1,0,1,0,0,0|1,0,0]=3 222 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Cl 11a_100011273784_100000210414 [1,0,1,0,0,0|1,0,0]=3 223 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_100000210414 [1,0,1,0,0,0|1,0,0]=3 224 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000210414 [1,0,1,0,0,0|1,0,0]=3 225 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100000210414 [1,0,1,0,0,0|1,0,0]=3 226 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)F 11a_100011273785_100000210414 [1,0,1,0,0,0|1,0,0]=3 227 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_100000210414 [1,0,1,0,0,0|1,0,0]=3 228 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000210414 [1,0,1,0,0,0|1,0,0]=3 229 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)F 527a_100011273785_100000210414 [1,0,1,0,0,0|1,0,0]=3 230 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000210414 [1,0,1,0,0,0|0,0,0]=2 231 B16R2.33799 CCC(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100000210414 [1,0,1,0,0,0|0,0,0]=2 232 B16R2.33799 CCC(=O)N1CCc2nc(ccc2C1)Cl 11a_100015190003_100000210414 [1,0,1,0,0,0|2,0,0]=4 233 B16R2.33799 CCC(=O)N1CCc2nc(ccc2C1)Cl 1626a_100015190003_100000210414 [1,0,1,0,0,0|2,0,0]=4 234 B16R2.33799 CCC(=O)N1CCc2nc(ccc2C1)Cl 240690a_100015190003_100000210414 [1,0,1,0,0,0|2,0,0]=4 235 B16R2.33799 CCC(=O)N1CCc2nc(ccc2C1)Cl 527a_100015190003_100000210414 [1,0,1,0,0,0|2,0,0]=4 236 B16R2.33799 CCC(=O)N1CCc2nc(ncc2C1)O 11a_200025716142_100000210414 [1,0,1,0,0,0|2,0,0]=4 237 B16R2.33799 CCC(=O)N1CCc2nc(ncc2C1)O 240690a_200025716142_100000210414 [1,0,1,0,0,0|2,0,0]=4 238 B16R2.33799 CCC(=O)N1CCc2nc(ncc2C1)O 527a_200025716142_100000210414 [1,0,1,0,0,0|2,0,0]=4 239 B16R2.33799 CCC(C)N1CCc2cc(ccc2C1)O 2230a_100000077532_100000758301 [1,0,1,0,0,0|1,0,1]=4 240 B16R2.33799 CCC(C)N1CCc2cc(ccc2C1)O 269982a_100000077532_100000758301 [1,0,1,0,0,0|1,0,1]=4 241 B16R2.33799 CCC(C)N1CCc2cc(ccc2C1)O 34a_100000077532_100011215416 [1,0,1,0,0,0|1,0,1]=4 242 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)Br 2708a_100102657272_100000686056 [1,0,1,0,0,0|2,0,0]=4 243 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)Br 273464a_100102657272_100000686056 [1,0,1,0,0,0|2,0,0]=4 244 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)C 2708a_100102657272_100000718575 [1,0,1,0,0,0|2,0,0]=4 245 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)C 273464a_100102657272_100000718575 [1,0,1,0,0,0|2,0,0]=4 246 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)Cl 2708a_100102657272_100011273784 [1,0,1,0,0,0|2,0,0]=4 247 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)Cl 273464a_100102657272_100011273784 [1,0,1,0,0,0|2,0,0]=4 248 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)F 2708a_100102657272_100011273785 [1,0,1,0,0,0|2,0,0]=4 249 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)F 273464a_100102657272_100011273785 [1,0,1,0,0,0|2,0,0]=4 250 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)O 2708a_100102657272_100000077532 [1,0,1,0,0,0|1,0,0]=3 251 B16R2.33799 CNC(=O)N1CCc2cc(ccc2C1)O 273464a_100102657272_100000077532 [1,0,1,0,0,0|1,0,0]=3 252 B16R2.33799 Cc1ccc2c(c1)CCN(C2)C(=O)CO 240690a_100000718575_100000210174 [1,0,1,0,0,0|2,0,0]=4 253 B16R2.33799 Cc1ccc2c(c1)CCN(C2)C(=O)CO 527a_100000718575_100000210174 [1,0,1,0,0,0|2,0,0]=4 254 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000210174 [1,0,1,0,0,0|2,0,0]=4 255 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)Br 527a_100000686056_100000210174 [1,0,1,0,0,0|2,0,0]=4 256 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000210174 [1,0,1,0,0,0|2,0,0]=4 257 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100000210174 [1,0,1,0,0,0|2,0,0]=4 258 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000210174 [1,0,1,0,0,0|2,0,0]=4 259 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)F 527a_100011273785_100000210174 [1,0,1,0,0,0|2,0,0]=4 260 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000210174 [1,0,1,0,0,0|1,0,0]=3 261 B16R2.33799 O=C(CO)N1CCc2cc(ccc2C1)O 527a_100000077532_100000210174 [1,0,1,0,0,0|1,0,0]=3 262 B16R2.50969 CCCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000210303 [1,0,1,0,0,0|0,0,1]=3 263 B16R2.50969 CSCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100011218213 [1,0,1,0,0,0|1,0,1]=4 264 B16R2.50969 OCCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000211926 [1,0,1,0,0,0|1,0,1]=4 265 B16R2.50969 Oc1cc2c(cc1O)CN(CC2)CCF 34a_200015384465_100011217306 [1,0,1,0,0,0|1,0,1]=4 266 B18R2.13532 COc1ccc(cc1Br)SCN2CCCC2=O 62a_100000026320_100011249507 [0,1,1,0,0,0|2,0,0]=4 267 B18R2.13532 COc1ccc(cc1Br)SCN2CCCC2=O 62a_100011249507_100000026320 [0,1,1,0,0,0|2,0,0]=4 268 B18R2.13532 COc1ccc(cc1C)SCN2CCCC2=O 62a_100000026320_100011219705 [0,1,1,0,0,0|2,0,0]=4 269 B18R2.13532 COc1ccc(cc1C)SCN2CCCC2=O 62a_100011219705_100000026320 [0,1,1,0,0,0|2,0,0]=4 270 B18R2.13532 COc1ccc(cc1Cl)SCN2CCCC2=O 62a_100000026320_100012355395 [0,1,1,0,0,0|2,0,0]=4 271 B18R2.13532 COc1ccc(cc1Cl)SCN2CCCC2=O 62a_100012355395_100000026320 [0,1,1,0,0,0|2,0,0]=4 272 B18R2.13532 COc1ccc(cc1F)SCN2CCCC2=O 62a_100000026320_100000171752 [0,1,1,0,0,0|2,0,0]=4 273 B18R2.13532 COc1ccc(cc1F)SCN2CCCC2=O 62a_100000171752_100000026320 [0,1,1,0,0,0|2,0,0]=4 274 B18R2.13532 COc1ccc(cc1N)SCN2CCCC2=O 62a_100000026320_100011249504 [0,1,1,0,0,0|2,0,0]=4 275 B18R2.13532 COc1ccc(cc1N)SCN2CCCC2=O 62a_100011249504_100000026320 [0,1,1,0,0,0|2,0,0]=4 276 B18R2.13532 COc1ccc(cc1O)CNC2CCCC2=O 34a_100000740000_100000709159 [0,1,1,0,0,0|2,0,0]=4 277 B18R2.13532 COc1ccc(cc1O)SCN2CCCC2=O 62a_100000026320_100009816560 [0,1,1,0,0,0|1,0,0]=3 278 B18R2.13532 COc1cnc(cc1O)SCN2CCCC2=O 62a_100000026320_100010264082 [0,1,1,0,0,0|2,0,0]=4 279 B18R2.13532 COc1ncc(cc1O)SCN2CCCC2=O 62a_100000026320_100010135713 [0,1,1,0,0,0|2,0,0]=4 280 B18R2.13532 Cc1cc(ccc1CO)SCN2CCCC2=O 62a_100000026320_100000748258 [0,1,1,0,0,0|2,0,0]=4 281 B18R2.13532 Cc1cc(ccc1CO)SCN2CCCC2=O 62a_100000748258_100000026320 [0,1,1,0,0,0|2,0,0]=4 282 B18R2.13532 N#Cc1ccc(cc1O)SCN2CCCC2=O 62a_100000026320_100011934713 [0,1,1,0,0,0|2,0,0]=4 283 B18R2.13532 Nc1cc(ccc1CO)SCN2CCCC2=O 62a_100000026320_100000718831 [0,1,1,0,0,0|2,0,0]=4 284 B18R2.13532 Nc1cc(ccc1CO)SCN2CCCC2=O 62a_100000718831_100000026320 [0,1,1,0,0,0|2,0,0]=4 285 B18R2.13532 O=C1CCCN1CSc2ccc(c(c2)Br)CO 62a_100000026320_100010240206 [0,1,1,0,0,0|2,0,0]=4 286 B18R2.13532 O=C1CCCN1CSc2ccc(c(c2)Br)CO 62a_100010240206_100000026320 [0,1,1,0,0,0|2,0,0]=4 287 B18R2.13532 O=C1CCCN1CSc2ccc(c(c2)F)CO 62a_100000026320_100011191541 [0,1,1,0,0,0|2,0,0]=4 288 B18R2.13532 O=C1CCCN1CSc2ccc(c(c2)F)CO 62a_100011191541_100000026320 [0,1,1,0,0,0|2,0,0]=4 289 B18R2.13532 O=C1CCCN1CSc2ccc(c(c2)O)CO 62a_100000026320_100000071718 [0,1,1,0,0,0|1,0,0]=3 290 B18R2.13532 O=C1CCCN1CSc2ccc(c(c2)O)CO 62a_100000071718_100000026320 [0,1,1,0,0,0|1,0,0]=3 291 B18R2.13532 O=Cc1ccc(cc1O)SCN2CCCC2=O 62a_100000026320_100011277552 [0,1,1,0,0,0|1,0,1]=4 292 B18R2.13532 O=Cc1ccc(cc1O)SCN2CCCC2=O 62a_100011277552_100000026320 [0,1,1,0,0,0|1,0,1]=4 293 B18R2.15252 CCc1cc(ccc1O)SCN2CCCC2=O 62a_100000026320_100012338938 [0,1,1,0,0,0|2,0,0]=4 294 B18R2.15252 COc1cc(ccc1Br)SCN2CCCC2=O 62a_100000026320_100012353699 [0,1,1,0,0,0|2,0,0]=4 295 B18R2.15252 COc1cc(ccc1Br)SCN2CCCC2=O 62a_100012353699_100000026320 [0,1,1,0,0,0|2,0,0]=4 296 B18R2.15252 COc1cc(ccc1C)SCN2CCCC2=O 62a_100000026320_100011830276 [0,1,1,0,0,0|2,0,0]=4 297 B18R2.15252 COc1cc(ccc1C)SCN2CCCC2=O 62a_100011830276_100000026320 [0,1,1,0,0,0|2,0,0]=4 298 B18R2.15252 COc1cc(ccc1Cl)SCN2CCCC2=O 62a_100000026320_100011356853 [0,1,1,0,0,0|2,0,0]=4 299 B18R2.15252 COc1cc(ccc1Cl)SCN2CCCC2=O 62a_100011356853_100000026320 [0,1,1,0,0,0|2,0,0]=4 300 B18R2.15252 COc1cc(ccc1F)SCN2CCCC2=O 62a_100000026320_100011934186 [0,1,1,0,0,0|2,0,0]=4 301 B18R2.15252 COc1cc(ccc1F)SCN2CCCC2=O 62a_100011934186_100000026320 [0,1,1,0,0,0|2,0,0]=4 302 B18R2.15252 COc1cc(ccc1N)SCN2CCCC2=O 62a_100000026320_100015196925 [0,1,1,0,0,0|2,0,0]=4 303 B18R2.15252 COc1cc(ccc1N)SCN2CCCC2=O 62a_100011279103_100000026320 [0,1,1,0,0,0|2,0,0]=4 304 B18R2.15252 COc1cc(ccc1O)CCN2CCC[C@@H]2C 2230a_100020605311_100010741665 [0,1,1,0,0,0|1,0,1]=4 305 B18R2.15252 COc1cc(ccc1O)CCN2CCC[C@@H]2C 269982a_100020605311_100010741665 [0,1,1,0,0,0|1,0,1]=4 306 B18R2.15252 COc1cc(ccc1O)CCN2CCC[C@H]2C 2230a_100015189458_100010741665 [0,1,1,0,0,0|1,0,1]=4 307 B18R2.15252 COc1cc(ccc1O)CCN2CCC[C@H]2C 269982a_100015189458_100010741665 [0,1,1,0,0,0|1,0,1]=4 308 B18R2.15252 COc1cc(ccc1O)CNC2CCCC2=O 34a_100000185554_100000709159 [0,1,1,0,0,0|2,0,0]=4 309 B18R2.15252 COc1cc(ccc1O)SCN2CCCC2=O 62a_100000026320_100000694246 [0,1,1,0,0,0|1,0,0]=3 310 B18R2.15252 COc1nc(ccc1O)SCN2CCCC2=O 62a_100000026320_100010893133 [0,1,1,0,0,0|2,0,0]=4 311 B18R2.15252 Cc1ccc(cc1CO)SCN2CCCC2=O 62a_100000026320_100000700630 [0,1,1,0,0,0|2,0,0]=4 312 B18R2.15252 Cc1ccc(cc1CO)SCN2CCCC2=O 62a_100000700630_100000026320 [0,1,1,0,0,0|2,0,0]=4 313 B18R2.15252 N#Cc1cc(ccc1O)SCN2CCCC2=O 62a_100000026320_100000687585 [0,1,1,0,0,0|2,0,0]=4 314 B18R2.15252 NCc1cc(ccc1O)SCN2CCCC2=O 62a_100000026320_100000730032 [0,1,1,0,0,0|2,0,0]=4 315 B18R2.15252 NCc1cc(ccc1O)SCN2CCCC2=O 62a_100000730032_100000026320 [0,1,1,0,0,0|2,0,0]=4 316 B18R2.15252 Nc1ccc(cc1CO)SCN2CCCC2=O 62a_100000026320_100012353972 [0,1,1,0,0,0|2,0,0]=4 317 B18R2.15252 Nc1ccc(cc1CO)SCN2CCCC2=O 62a_100012353972_100000026320 [0,1,1,0,0,0|2,0,0]=4 318 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)Br 62a_100000026320_100012359683 [0,1,1,0,0,0|2,0,0]=4 319 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)Br 62a_100012359683_100000026320 [0,1,1,0,0,0|2,0,0]=4 320 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)Cl 62a_100000026320_100010128486 [0,1,1,0,0,0|2,0,0]=4 321 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)Cl 62a_100010128486_100000026320 [0,1,1,0,0,0|2,0,0]=4 322 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)F 62a_100000026320_100000246282 [0,1,1,0,0,0|2,0,0]=4 323 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)F 62a_100000246282_100000026320 [0,1,1,0,0,0|2,0,0]=4 324 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)O 62a_100000026320_100000184703 [0,1,1,0,0,0|1,0,0]=3 325 B18R2.15252 O=C1CCCN1CSc2ccc(c(c2)CO)O 62a_100000184703_100000026320 [0,1,1,0,0,0|1,0,0]=3 326 B18R2.15252 O=C1CCCN1CSc2cnc(c(c2)CO)O 62a_100000026320_100010065268 [0,1,1,0,0,0|2,0,0]=4 327 B18R2.15252 O=C1CCCN1CSc2cnc(c(c2)CO)O 62a_100010065268_100000026320 [0,1,1,0,0,0|2,0,0]=4 328 B18R2.15252 O=Cc1cc(ccc1O)SCN2CCCC2=O 62a_100000026320_100000186750 [0,1,1,0,0,0|1,0,1]=4 329 B18R2.33781 O=C1CCCC1C(=O)Cc2ccc(c(c2)O)O 1458a_100000031429_100000211823 [0,1,1,0,0,0|1,0,1]=4 330 B18R2.38903 Cc1c(ccc(c1C)SCN2CCCC2=O)O 62a_100000026320_100012353674 [0,1,1,0,0,0|2,0,0]=4 331 B18R2.38903 Cc1c(ccc(c1C)SCN2CCCC2=O)O 62a_100012353674_100000026320 [0,1,1,0,0,0|2,0,0]=4 332 B18R2.38903 Cc1c(ccc(c1F)SCN2CCCC2=O)O 62a_100000026320_100010390934 [0,1,1,0,0,0|2,0,0]=4 333 B18R2.38903 Cc1c(ccc(c1F)SCN2CCCC2=O)O 62a_100010390934_100000026320 [0,1,1,0,0,0|2,0,0]=4 334 B18R2.38903 Cc1c(ccc(c1N)O)SCN2CCCC2=O 62a_100000026320_100013039247 [0,1,1,0,0,0|2,0,0]=4 335 B18R2.38903 Cc1c(ccc(c1N)O)SCN2CCCC2=O 62a_100013039247_100000026320 [0,1,1,0,0,0|2,0,0]=4 336 B18R2.38903 Nc1c(ccc(c1O)Br)SCN2CCCC2=O 62a_100020748643_100000026320 [0,1,1,0,0,0|2,0,0]=4 337 B18R2.38903 O=C1CCCN1CSc2ccc(c(c2F)F)O 62a_100000026320_100011830415 [0,1,1,0,0,0|2,0,0]=4 338 B18R2.38903 O=C1CCCN1CSc2ccc(c(c2F)F)O 62a_100011830415_100000026320 [0,1,1,0,0,0|2,0,0]=4 339 B18R2.38903 O=C1CCCN1CSc2ccc(c(c2F)O)Br 62a_100000026320_200010782288 [0,1,1,0,0,0|2,0,0]=4 340 B18R2.38903 O=C1CCCN1CSc2ccc(c(c2F)O)Br 62a_200010782288_100000026320 [0,1,1,0,0,0|2,0,0]=4 341 B18R2.38903 O=C1CCCN1CSc2ccc(c(c2F)O)F 62a_100000026320_100010167067 [0,1,1,0,0,0|2,0,0]=4 342 B18R2.38903 O=C1CCCN1CSc2ccc(c(c2F)O)F 62a_100010167067_100000026320 [0,1,1,0,0,0|2,0,0]=4 343 B18R2.60986 Cc1cc(c(cc1O)C)SCN2CCCC2=O 62a_100000026320_100000698207 [0,1,1,0,0,0|2,0,0]=4 344 B18R2.60986 Cc1cc(c(cc1O)C)SCN2CCCC2=O 62a_100000698207_100000026320 [0,1,1,0,0,0|2,0,0]=4 345 B18R2.60986 Cc1cc(c(cc1O)SCN2CCCC2=O)F 62a_100000026320_100014242602 [0,1,1,0,0,0|2,0,0]=4 346 B18R2.60986 Cc1cc(c(cc1O)SCN2CCCC2=O)F 62a_100014242602_100000026320 [0,1,1,0,0,0|2,0,0]=4 347 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)F)O 62a_100000026320_100012355673 [0,1,1,0,0,0|2,0,0]=4 348 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)F)O 62a_100012355673_100000026320 [0,1,1,0,0,0|2,0,0]=4 349 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)N)O 62a_100000026320_200010235796 [0,1,1,0,0,0|2,0,0]=4 350 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)N)O 62a_200010235796_100000026320 [0,1,1,0,0,0|2,0,0]=4 351 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)O)F 62a_100000026320_100010068922 [0,1,1,0,0,0|2,0,0]=4 352 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)O)F 62a_100010068922_100000026320 [0,1,1,0,0,0|2,0,0]=4 353 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)O)N 62a_100000026320_200010107346 [0,1,1,0,0,0|2,0,0]=4 354 B18R2.60986 Cc1cc(c(cc1SCN2CCCC2=O)O)N 62a_200010107346_100000026320 [0,1,1,0,0,0|2,0,0]=4 355 B18R2.60986 Nc1cc(c(cc1O)Cl)SCN2CCCC2=O 62a_100000026320_100011011175 [0,1,1,0,0,0|2,0,0]=4 356 B18R2.60986 Nc1cc(c(cc1O)Cl)SCN2CCCC2=O 62a_100011011175_100000026320 [0,1,1,0,0,0|2,0,0]=4 357 B18R2.60986 Nc1cc(c(cc1O)F)SCN2CCCC2=O 62a_100000026320_100012359894 [0,1,1,0,0,0|2,0,0]=4 358 B18R2.60986 Nc1cc(c(cc1O)F)SCN2CCCC2=O 62a_100012359894_100000026320 [0,1,1,0,0,0|2,0,0]=4 359 B18R2.60986 Nc1cc(c(cc1O)SCN2CCCC2=O)F 62a_100000026320_100013038943 [0,1,1,0,0,0|2,0,0]=4 360 B18R2.60986 Nc1cc(c(cc1O)SCN2CCCC2=O)F 62a_100013038943_100000026320 [0,1,1,0,0,0|2,0,0]=4 361 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2Br)Cl)O 62a_100000026320_100021297947 [0,1,1,0,0,0|2,0,0]=4 362 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2Br)Cl)O 62a_100021297947_100000026320 [0,1,1,0,0,0|2,0,0]=4 363 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2F)Cl)O 62a_100000026320_100010735246 [0,1,1,0,0,0|2,0,0]=4 364 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2F)Cl)O 62a_100010735246_100000026320 [0,1,1,0,0,0|2,0,0]=4 365 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2F)F)O 62a_100000026320_100012457948 [0,1,1,0,0,0|2,0,0]=4 366 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2F)F)O 62a_100012457948_100000026320 [0,1,1,0,0,0|2,0,0]=4 367 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2F)O)F 62a_100000026320_100011830439 [0,1,1,0,0,0|2,0,0]=4 368 B18R2.60986 O=C1CCCN1CSc2cc(c(cc2F)O)F 62a_100011830439_100000026320 [0,1,1,0,0,0|2,0,0]=4 369 B18R2.92827 CC1(CCCN1CCc2ccc(c(c2)O)O)C 269982a_100000761399_200010393615 [0,1,1,0,0,0|1,0,1]=4 370 B18R2.93340 CC1CCC(N1CCc2ccc(c(c2)O)O)C 269982a_100000687148_200010393615 [0,1,1,0,0,0|1,0,1]=4 371 B18R2.106088 CCC1CCCN1CCc2ccc(c(c2)O)O 269982a_100000754278_200010393615 [0,1,1,0,0,0|1,0,1]=4 372 B18R2.106088 N#C[C@H]1CCCN1CCc2ccc(c(c2)O)O 269982a_106645074975_200010393615 [0,1,1,0,0,0|1,0,1]=4 373 B18R2.106088 OC[C@H]1CCCN1CCc2ccc(c(c2)O)O 269982a_100000745186_200010393615 [0,1,1,0,0,0|0,0,2]=4 374 B18R2.289156 Cc1cc(cc(c1N)O)SCN2CCCC2=O 62a_100000026320_100010371313 [0,1,1,0,0,0|2,0,0]=4 375 B18R2.289156 Cc1cc(cc(c1N)O)SCN2CCCC2=O 62a_100010371313_100000026320 [0,1,1,0,0,0|2,0,0]=4 376 B18R2.289156 Cc1cc(cc(c1O)Br)SCN2CCCC2=O 62a_100000026320_100010982682 [0,1,1,0,0,0|2,0,0]=4 377 B18R2.289156 Cc1cc(cc(c1O)Br)SCN2CCCC2=O 62a_100010982682_100000026320 [0,1,1,0,0,0|2,0,0]=4 378 B18R2.289156 Cc1cc(cc(c1O)C)SCN2CCCC2=O 62a_100000026320_100011216129 [0,1,1,0,0,0|2,0,0]=4 379 B18R2.289156 Cc1cc(cc(c1O)C)SCN2CCCC2=O 62a_100011216129_100000026320 [0,1,1,0,0,0|2,0,0]=4 380 B18R2.289156 Cc1cc(cc(c1O)Cl)SCN2CCCC2=O 62a_100000026320_200015900153 [0,1,1,0,0,0|2,0,0]=4 381 B18R2.289156 Cc1cc(cc(c1O)Cl)SCN2CCCC2=O 62a_200015900153_100000026320 [0,1,1,0,0,0|2,0,0]=4 382 B18R2.289156 Cc1cc(cc(c1O)N)SCN2CCCC2=O 62a_100000026320_100011825904 [0,1,1,0,0,0|2,0,0]=4 383 B18R2.289156 Cc1cc(cc(c1O)N)SCN2CCCC2=O 62a_100011825904_100000026320 [0,1,1,0,0,0|2,0,0]=4 384 B18R2.289156 Nc1c(cc(cc1F)SCN2CCCC2=O)O 62a_100000026320_100015475841 [0,1,1,0,0,0|2,0,0]=4 385 B18R2.289156 Nc1c(cc(cc1F)SCN2CCCC2=O)O 62a_100015475841_100000026320 [0,1,1,0,0,0|2,0,0]=4 386 B18R2.289156 Nc1cc(cc(c1O)F)SCN2CCCC2=O 62a_100000026320_100011217383 [0,1,1,0,0,0|2,0,0]=4 387 B18R2.289156 Nc1cc(cc(c1O)F)SCN2CCCC2=O 62a_100011217383_100000026320 [0,1,1,0,0,0|2,0,0]=4 388 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)Cl)O)Cl 62a_100000026320_100012339652 [0,1,1,0,0,0|2,0,0]=4 389 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)Cl)O)Cl 62a_100012339652_100000026320 [0,1,1,0,0,0|2,0,0]=4 390 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)F)F)O 62a_100000026320_100000709865 [0,1,1,0,0,0|2,0,0]=4 391 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)F)F)O 62a_100000709865_100000026320 [0,1,1,0,0,0|2,0,0]=4 392 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)F)O)F 62a_100000026320_100011216917 [0,1,1,0,0,0|2,0,0]=4 393 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)F)O)F 62a_100011216917_100000026320 [0,1,1,0,0,0|2,0,0]=4 394 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)F)O)O 62a_100000026320_100010114375 [0,1,1,0,0,0|1,0,0]=3 395 B18R2.289156 O=C1CCCN1CSc2cc(c(c(c2)O)O)O 62a_100000026320_100010658518 [0,1,1,0,0,0|1,0,0]=3 396 B18R2.706238 CC(C#N)N1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000184139 [0,1,1,0,0,0|1,0,1]=4 397 B18R2.706238 CC(CO)N1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100012180447 [0,1,1,0,0,0|0,0,2]=4 398 B18R2.706238 CC1c2cc(c(cc2CCN1C(=O)CO)O)O 527a_100000735813_100000210174 [0,1,1,0,0,0|0,0,0]=2 399 B18R2.706238 CCC(=O)N1CCc2cc(c(cc2C1C)O)O 527a_100000735813_100000210414 [0,1,1,0,0,0|0,0,0]=2 400 B18R2.706238 CCC(C)N1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000758301 [0,1,1,0,0,0|1,0,1]=4 401 B18R2.706238 CNC(=O)N1CCc2cc(c(cc2C1C)O)O 273464a_100102657272_100000735813 [0,1,1,0,0,0|0,0,0]=2 402 B18R2.59003 CC(C)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210198 [0,1,1,0,0,0|0,0,0]=2 403 B18R2.59003 CC(F)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000062450 [0,1,1,0,0,0|0,0,0]=2 404 B18R2.59003 C[C@@H](O)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000717761 [0,1,1,0,0,0|0,0,0]=2 405 B18R2.59003 C[C@H](O)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_217856618621 [0,1,1,0,0,0|0,0,0]=2 406 B18R2.59003 NC(=O)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100011215815 [0,1,1,0,0,0|1,0,1]=4 407 B18R2.59003 O=C(C(F)F)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210393 [0,1,1,0,0,0|1,0,0]=3 408 B18R2.59003 O=C(C(O)O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000233687 [0,1,1,0,0,0|1,0,0]=3 409 B18R2.467126 CCS(=O)(=O)N1CCc2cc(c(cc2C1)O)O 270084a_200015384465_100000211323 [0,1,1,0,0,0|1,0,0]=3 410 B18R2.467126 CCS(=O)(=O)N1CCc2cc(c(cc2C1)O)O 274078a_200015384465_100000211323 [0,1,1,0,0,0|1,0,0]=3 411 B18R2.467126 O=S(=O)(CCl)N1CCc2cc(c(cc2C1)O)O 270084a_200015384465_100000031410 [0,1,1,0,0,0|2,0,0]=4 412 B18R2.467126 O=S(=O)(CCl)N1CCc2cc(c(cc2C1)O)O 274078a_200015384465_100000031410 [0,1,1,0,0,0|2,0,0]=4 413 B18R2.630088 C=CCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210193 [0,1,1,0,0,0|0,0,1]=3 414 B18R2.630088 CC(CCO)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100009893172 [0,1,1,0,0,0|1,0,1]=4 415 B18R2.630088 CC=CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210699 [0,1,1,0,0,0|0,0,1]=3 416 B18R2.630088 CCCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000211992 [0,1,1,0,0,0|0,0,0]=2 417 B18R2.630088 CCCC(C)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000766640 [0,1,1,0,0,0|1,0,1]=4 418 B18R2.630088 CCNC(=O)N1CCc2cc(c(cc2C1)O)O 273464a_100015525214_200015384465 [0,1,1,0,0,0|0,0,0]=2 419 B18R2.630088 COCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210968 [0,1,1,0,0,0|0,0,0]=2 420 B18R2.630088 COCC(C)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000765312 [0,1,1,0,0,0|1,0,1]=4 421 B18R2.630088 CSCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000184570 [0,1,1,0,0,0|0,0,0]=2 422 B18R2.630088 N#CCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100051588842 [0,1,1,0,0,0|0,0,1]=3 423 B18R2.630088 O=C(C=CBr)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100016273825 [0,1,1,0,0,0|0,0,2]=4 424 B18R2.630088 O=C(C=CCl)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_200016279998 [0,1,1,0,0,0|0,0,2]=4 425 B18R2.630088 O=C(CCO)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100011216618 [0,1,1,0,0,0|0,0,0]=2 426 B16R1.20101 CCc1cc(c(cc1SCCC(=O)N)F)O 62a_100000744528_100011156610 [0,0,2,0,0,0|2,0,0]=4 427 B16R1.20101 CCc1cc(c(cc1SCCC(=O)N)F)O 62a_100011156610_100000744528 [0,0,2,0,0,0|2,0,0]=4 428 B16R1.3336 CCC(=O)N(CC)Cc1ccc(c(c1)C)C 11a_100000201273_100000210414 [0,0,2,0,0,0|2,0,0]=4 429 B16R1.3336 CCC(=O)N(CC)Cc1ccc(c(c1)C)C 1626a_100000201273_100000210414 [0,0,2,0,0,0|2,0,0]=4 430 B16R1.3336 CCC(=O)N(CC)Cc1ccc(c(c1)C)C 240690a_100000201273_100000210414 [0,0,2,0,0,0|2,0,0]=4 431 B16R1.3336 CCC(=O)N(CC)Cc1ccc(c(c1)C)C 527a_100000201273_100000210414 [0,0,2,0,0,0|2,0,0]=4 432 B16R1.15312 C#CCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100011220946 [0,0,2,0,0,0|0,0,2]=4 433 B16R1.15312 C=CCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000210193 [0,0,2,0,0,0|0,0,2]=4 434 B16R1.15312 C=CCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000210193 [0,0,2,0,0,0|0,0,2]=4 435 B16R1.15312 CC=CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000210699 [0,0,2,0,0,0|0,0,2]=4 436 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)C)C 11a_100020591374_100000211992 [0,0,2,0,0,0|2,0,0]=4 437 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)C)C 1626a_100020591374_100000211992 [0,0,2,0,0,0|2,0,0]=4 438 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)C)C 240690a_100020591374_100000211992 [0,0,2,0,0,0|2,0,0]=4 439 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)C)C 527a_100020591374_100000211992 [0,0,2,0,0,0|2,0,0]=4 440 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)Cl 11a_100011207230_100000211992 [0,0,2,0,0,0|2,0,0]=4 441 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)Cl 1626a_100011207230_100000211992 [0,0,2,0,0,0|2,0,0]=4 442 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)Cl 240690a_100011207230_100000211992 [0,0,2,0,0,0|2,0,0]=4 443 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)Cl 527a_100011207230_100000211992 [0,0,2,0,0,0|2,0,0]=4 444 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)F 11a_200011997520_100000211992 [0,0,2,0,0,0|2,0,0]=4 445 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)F 1626a_200011997520_100000211992 [0,0,2,0,0,0|2,0,0]=4 446 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)F 240690a_200011997520_100000211992 [0,0,2,0,0,0|2,0,0]=4 447 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)Cl)F 527a_200011997520_100000211992 [0,0,2,0,0,0|2,0,0]=4 448 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)F)F 11a_200000706328_100000211992 [0,0,2,0,0,0|2,0,0]=4 449 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)F)F 1626a_200000706328_100000211992 [0,0,2,0,0,0|2,0,0]=4 450 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)F)F 240690a_200000706328_100000211992 [0,0,2,0,0,0|2,0,0]=4 451 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)F)F 527a_200000706328_100000211992 [0,0,2,0,0,0|2,0,0]=4 452 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000211992 [0,0,2,0,0,0|0,0,0]=2 453 B16R1.15312 CCCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000211992 [0,0,2,0,0,0|0,0,0]=2 454 B16R1.15312 CCCC(=O)NN=Cc1ccc(c(c1)O)O 4a_100000189770_100000184535 [0,0,2,0,0,0|1,0,1]=4 455 B16R1.15312 CCCC(=O)OCNc1ccc(c(c1)O)O 34a_100102946323_100000034017 [0,0,2,0,0,0|2,0,0]=4 456 B16R1.15312 CCCC(C)NCCc1ccc(c(c1)O)O 34a_100000210387_100000766640 [0,0,2,0,0,0|1,0,1]=4 457 B16R1.15312 CCNC(=O)CCCc1ccc(c(c1)C)F 11a_100015525214_100011998530 [0,0,2,0,0,0|2,0,0]=4 458 B16R1.15312 CCNC(=O)CCCc1ccc(c(c1)C)F 240690a_100015525214_100011998530 [0,0,2,0,0,0|2,0,0]=4 459 B16R1.15312 CCNC(=O)CCCc1ccc(c(c1)C)F 527a_100015525214_100011998530 [0,0,2,0,0,0|2,0,0]=4 460 B16R1.15312 CCNC(=O)CCNc1ccc(c(c1)C)O 7a_100011218179_100000737597 [0,0,2,0,0,0|2,0,0]=4 461 B16R1.15312 CCNC(=O)CCNc1ccc(c(c1)F)O 7a_100011220035_100000737597 [0,0,2,0,0,0|2,0,0]=4 462 B16R1.15312 CCNC(=O)CCNc1ccc(c(c1)O)C 7a_100000759471_100000737597 [0,0,2,0,0,0|2,0,0]=4 463 B16R1.15312 CCNC(=O)CCNc1ccc(c(c1)O)F 7a_100012017398_100000737597 [0,0,2,0,0,0|2,0,0]=4 464 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)Br)O 62a_100000737597_100012361655 [0,0,2,0,0,0|2,0,0]=4 465 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)Br)O 62a_100012361655_100000737597 [0,0,2,0,0,0|2,0,0]=4 466 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)C)O 62a_100000737597_100000186361 [0,0,2,0,0,0|2,0,0]=4 467 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)Cl)O 62a_100000737597_100012360047 [0,0,2,0,0,0|2,0,0]=4 468 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000737597 [0,0,2,0,0,0|2,0,0]=4 469 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)F)O 62a_100000185481_100000737597 [0,0,2,0,0,0|2,0,0]=4 470 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)F)O 62a_100000737597_100000185481 [0,0,2,0,0,0|2,0,0]=4 471 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)N)O 62a_100000737597_100000752626 [0,0,2,0,0,0|2,0,0]=4 472 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)N)O 62a_100000752626_100000737597 [0,0,2,0,0,0|2,0,0]=4 473 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)Br 62a_100000737597_100012356990 [0,0,2,0,0,0|2,0,0]=4 474 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)Br 62a_100012356990_100000737597 [0,0,2,0,0,0|2,0,0]=4 475 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)C 62a_100000685420_100000737597 [0,0,2,0,0,0|2,0,0]=4 476 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)C 62a_100000737597_100000685420 [0,0,2,0,0,0|2,0,0]=4 477 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)Cl 62a_100000737597_100011356854 [0,0,2,0,0,0|2,0,0]=4 478 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000737597 [0,0,2,0,0,0|2,0,0]=4 479 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)F 62a_100000686035_100000737597 [0,0,2,0,0,0|2,0,0]=4 480 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)F 62a_100000737597_100000686035 [0,0,2,0,0,0|2,0,0]=4 481 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)N 62a_100000737597_100000739049 [0,0,2,0,0,0|2,0,0]=4 482 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)N 62a_100000739049_100000737597 [0,0,2,0,0,0|2,0,0]=4 483 B16R1.15312 CCNC(=O)CCSc1ccc(c(c1)O)O 62a_100000737597_100009813601 [0,0,2,0,0,0|1,0,0]=3 484 B16R1.15312 CCNC(=O)CNCc1ccc(c(c1)F)O 34a_100000758358_100000183381 [0,0,2,0,0,0|2,0,0]=4 485 B16R1.15312 CCNC(=O)CNCc1ccc(c(c1)O)Cl 34a_100020636435_100000183381 [0,0,2,0,0,0|2,0,0]=4 486 B16R1.15312 CCNC(=O)CNCc1ccc(c(c1)O)F 34a_100160469508_100000183381 [0,0,2,0,0,0|2,0,0]=4 487 B16R1.15312 CCNC(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000183381 [0,0,2,0,0,0|1,0,0]=3 488 B16R1.15312 CCNC(=O)NCCc1ccc(c(c1)O)O 2708a_100000210387_100015525214 [0,0,2,0,0,0|1,0,0]=3 489 B16R1.15312 CCNC(=O)NCCc1ccc(c(c1)O)O 273464a_100000210387_100015525214 [0,0,2,0,0,0|1,0,0]=3 490 B16R1.15312 CCNC(=O)NCCc1ccc(c(c1)O)O 273464a_100015525214_100000210387 [0,0,2,0,0,0|1,0,0]=3 491 B16R1.15312 CCNC(=O)NCCc1ccc(c(c1)O)O 512a_100015525214_100000210387 [0,0,2,0,0,0|1,0,0]=3 492 B16R1.15312 CCOC(=O)CCNc1ccc(c(c1)O)O 34a_100102946323_100000765890 [0,0,2,0,0,0|2,0,0]=4 493 B16R1.15312 CCOC(=O)CCSc1ccc(c(c1)O)O 62a_100000765890_100009813601 [0,0,2,0,0,0|2,0,0]=4 494 B16R1.15312 CCOC(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000188475 [0,0,2,0,0,0|2,0,0]=4 495 B16R1.15312 CNNC(=O)NCCc1ccc(c(c1)O)O 273464a_100000210387_100016993582 [0,0,2,0,0,0|2,0,0]=4 496 B16R1.15312 CNNC(=O)NCCc1ccc(c(c1)O)O 512a_100016993582_100000210387 [0,0,2,0,0,0|2,0,0]=4 497 B16R1.15312 COCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000210968 [0,0,2,0,0,0|1,0,0]=3 498 B16R1.15312 COCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000210968 [0,0,2,0,0,0|1,0,0]=3 499 B16R1.15312 CSCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000184570 [0,0,2,0,0,0|1,0,0]=3 500 B16R1.15312 CSCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000184570 [0,0,2,0,0,0|1,0,0]=3 501 B16R1.15312 N#CCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100051588842 [0,0,2,0,0,0|1,0,1]=4 502 B16R1.15312 O=C(CCO)NCCc1ccc(c(c1)O)O 240690a_100000210387_100011216618 [0,0,2,0,0,0|1,0,0]=3 503 B16R1.15312 O=C(CNCc1ccc(c(c1)O)O)NCO 34a_100000010075_100000185155 [0,0,2,0,0,0|2,0,0]=4 504 B16R1.2640 CCC(C)N(C)CCc1ccc(c(c1)O)O 269982a_100000741768_200010393615 [0,0,2,0,0,0|1,0,1]=4 505 B16R1.6630 CCN(CCc1ccc(c(c1)O)O)C(C)C 269982a_100000223864_200010393615 [0,0,2,0,0,0|1,0,1]=4 506 B16R1.7995 CCCN(CC)CCc1ccc(c(c1)O)O 269982a_100000226822_200010393615 [0,0,2,0,0,0|1,0,1]=4 507 B16R1.20497 C#CCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000695029 [0,0,2,0,0,0|1,0,1]=4 508 B16R1.20497 C=CCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000757094 [0,0,2,0,0,0|1,0,0]=3 509 B16R1.20497 C=CCCCOCCc1ccc(c(c1)O)O 7a_100000758997_200010393615 [0,0,2,0,0,0|2,0,0]=4 510 B16R1.20497 C=CCCCSCCc1ccc(c(c1)O)O 62a_100011713584_200010393615 [0,0,2,0,0,0|2,0,0]=4 511 B16R1.20497 C=COCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000039644 [0,0,2,0,0,0|2,0,0]=4 512 B16R1.20497 CCCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000718602 [0,0,2,0,0,0|1,0,1]=4 513 B16R1.20497 COCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000740836 [0,0,2,0,0,0|2,0,0]=4 514 B16R1.20497 Cc1ccc(cc1C)CCNCCCC=O 2230a_100020591374_200011292268 [0,0,2,0,0,0|2,0,0]=4 515 B16R1.20497 O=CCCCCCSc1ccc(c(c1)O)O 62a_100000139337_100009813601 [0,0,2,0,0,0|2,0,0]=4 516 B16R1.20497 O=CCCCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200011292268 [0,0,2,0,0,0|2,0,0]=4 517 B16R1.20497 O=CCCCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_200011292268 [0,0,2,0,0,0|2,0,0]=4 518 B16R1.20497 O=CCCCNCCc1ccc(c(c1)F)F 2230a_200000706328_200011292268 [0,0,2,0,0,0|2,0,0]=4 519 B16R1.20497 O=CCCCSCCc1ccc(c(c1)O)O 62a_200011292268_200010393615 [0,0,2,0,0,0|1,0,0]=3 520 B16R1.20497 OCCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100011216708 [0,0,2,0,0,0|0,0,2]=4 521 B16R1.20497 Oc1ccc(cc1O)CCNCCCCF 34a_100000210387_100000729493 [0,0,2,0,0,0|1,0,1]=4 522 B16R1.17101 CCC(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000210414 [0,0,2,0,0,0|1,0,0]=3 523 B16R1.17101 CCC(=O)NCCc1cc(c(cc1O)O)O 527a_200000106461_100000210414 [0,0,2,0,0,0|1,0,0]=3 524 B16R1.17101 CNC(=O)CCCc1cc(c(cc1C)Br)C 11a_106832991635_200012024217 [0,0,2,0,0,0|2,0,0]=4 525 B16R1.17101 CNC(=O)CCCc1cc(c(cc1C)Br)C 1626a_100102657272_200012024217 [0,0,2,0,0,0|2,0,0]=4 526 B16R1.17101 CNC(=O)CCCc1cc(c(cc1C)Br)C 240690a_100102657272_200012024217 [0,0,2,0,0,0|2,0,0]=4 527 B16R1.17101 CNC(=O)CCCc1cc(c(cc1C)Br)C 527a_100102657272_200012024217 [0,0,2,0,0,0|2,0,0]=4 528 B16R1.17101 CNC(=O)CCNc1cc(c(cc1C)Cl)O 34a_100009961766_100012179268 [0,0,2,0,0,0|2,0,0]=4 529 B16R1.17101 CNC(=O)CCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000737683 [0,0,2,0,0,0|2,0,0]=4 530 B16R1.17101 CNC(=O)CCNc1cc(c(cc1C)O)C 34a_100000720036_100012179268 [0,0,2,0,0,0|2,0,0]=4 531 B16R1.17101 CNC(=O)CCNc1cc(c(cc1C)O)C 7a_100000720036_100000737683 [0,0,2,0,0,0|2,0,0]=4 532 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)F)O 62a_100000737683_100010068922 [0,0,2,0,0,0|2,0,0]=4 533 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)F)O 62a_100010068922_100000737683 [0,0,2,0,0,0|2,0,0]=4 534 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)N)O 62a_100000737683_200010107346 [0,0,2,0,0,0|2,0,0]=4 535 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)N)O 62a_200010107346_100000737683 [0,0,2,0,0,0|2,0,0]=4 536 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)O)C 62a_100000698207_100000737683 [0,0,2,0,0,0|2,0,0]=4 537 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)O)C 62a_100000737683_100000698207 [0,0,2,0,0,0|2,0,0]=4 538 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)O)F 62a_100000737683_100012355673 [0,0,2,0,0,0|2,0,0]=4 539 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)O)F 62a_100012355673_100000737683 [0,0,2,0,0,0|2,0,0]=4 540 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)O)N 62a_100000737683_200010235796 [0,0,2,0,0,0|2,0,0]=4 541 B16R1.17101 CNC(=O)CCSc1cc(c(cc1C)O)N 62a_200010235796_100000737683 [0,0,2,0,0,0|2,0,0]=4 542 B16R1.17101 CNC(=O)NCCc1cc(c(cc1O)O)O 273464a_100102657272_200000106461 [0,0,2,0,0,0|2,0,0]=4 543 B16R1.17101 CNC(=O)NCCc1cc(c(cc1O)O)O 273464a_200000106461_100102657272 [0,0,2,0,0,0|2,0,0]=4 544 B16R1.17101 O=C(CO)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000210174 [0,0,2,0,0,0|2,0,0]=4 545 B16R1.17101 O=C(CO)NCCc1cc(c(cc1O)O)O 527a_200000106461_100000210174 [0,0,2,0,0,0|2,0,0]=4 546 B18R3.87866 Oc1cc2c(cc1O)CN(CC2)C3CCC3 34a_200015384465_100000749161 [0,0,1,1,0,0|1,0,1]=4 547 B16R2.1089 CC1CCN1CCc2ccc(c(c2)O)O 269982a_100000755817_200010393615 [0,0,1,0,1,0|1,0,1]=4 548 B16R2.1089 O=C1CCC1NCc2ccc(c(c2)O)O 34a_100000010075_100009892977 [0,0,1,0,1,0|2,0,0]=4 549 B16R2.4011 O=C1CCCC1Nc2ccc(c(c2)O)O 34a_100102946323_100000709159 [0,0,1,0,1,0|2,0,0]=4 550 B16R2.4011 O=C1CCCC1Sc2ccc(c(c2)O)O 62a_100000211823_100009813601 [0,0,1,0,1,0|2,0,0]=4 551 B18R2.33595 Cc1cc(ccc1Br)CSCN2CCCC2=O 62a_100000026320_100000727479 [0,0,1,0,0,1|2,0,0]=4 552 B18R2.33595 Cc1cc(ccc1Br)CSCN2CCCC2=O 62a_100000727479_100000026320 [0,0,1,0,0,1|2,0,0]=4 553 B18R2.33595 Cc1cc(ccc1Br)NCCN2CCCC2=O 2230a_100000210723_100000739059 [0,0,1,0,0,1|2,0,0]=4 554 B18R2.33595 Cc1cc(ccc1Br)NCCN2CCCC2=O 34a_100000210723_100000739059 [0,0,1,0,0,1|2,0,0]=4 555 B18R2.33595 Cc1cc(ccc1Br)NCCN2CCCC2=O 7a_100000210723_100000739059 [0,0,1,0,0,1|2,0,0]=4 556 B18R2.33595 Cc1cc(ccc1Br)OCCN2CCCC2=O 34a_100000690111_100000739059 [0,0,1,0,0,1|2,0,0]=4 557 B18R2.33595 Cc1cc(ccc1Br)OCCN2CCCC2=O 7a_100000690111_100000739059 [0,0,1,0,0,1|2,0,0]=4 558 B18R2.33595 Cc1cc(ccc1Br)SCCN2CCCC2=O 62a_100000739059_100009813585 [0,0,1,0,0,1|2,0,0]=4 559 B18R2.33595 Cc1cc(ccc1Br)SCCN2CCCC2=O 62a_100009813585_100000739059 [0,0,1,0,0,1|2,0,0]=4 560 B18R2.33595 Cc1cc(ccc1Cl)CSCN2CCCC2=O 62a_100000026320_100012184735 [0,0,1,0,0,1|2,0,0]=4 561 B18R2.33595 Cc1cc(ccc1Cl)CSCN2CCCC2=O 62a_100012184735_100000026320 [0,0,1,0,0,1|2,0,0]=4 562 B18R2.33595 Cc1cc(ccc1Cl)NCCN2CCCC2=O 2230a_100000187808_100000739059 [0,0,1,0,0,1|2,0,0]=4 563 B18R2.33595 Cc1cc(ccc1Cl)NCCN2CCCC2=O 34a_100000187808_100000739059 [0,0,1,0,0,1|2,0,0]=4 564 B18R2.33595 Cc1cc(ccc1Cl)NCCN2CCCC2=O 7a_100000187808_100000739059 [0,0,1,0,0,1|2,0,0]=4 565 B18R2.33595 Cc1cc(ccc1Cl)OCCN2CCCC2=O 34a_100000211092_100000739059 [0,0,1,0,0,1|2,0,0]=4 566 B18R2.33595 Cc1cc(ccc1Cl)OCCN2CCCC2=O 7a_100000211092_100000739059 [0,0,1,0,0,1|2,0,0]=4 567 B18R2.33595 Cc1cc(ccc1Cl)SCCN2CCCC2=O 62a_100000049509_100000739059 [0,0,1,0,0,1|2,0,0]=4 568 B18R2.33595 Cc1cc(ccc1Cl)SCCN2CCCC2=O 62a_100000739059_100000049509 [0,0,1,0,0,1|2,0,0]=4 569 B18R2.33595 Cc1cc(ccc1F)CSCN2CCCC2=O 62a_100000026320_100011216667 [0,0,1,0,0,1|2,0,0]=4 570 B18R2.33595 Cc1cc(ccc1F)CSCN2CCCC2=O 62a_100011216667_100000026320 [0,0,1,0,0,1|2,0,0]=4 571 B18R2.33595 Cc1cc(ccc1F)NCCN2CCCC2=O 2230a_100000750164_100000739059 [0,0,1,0,0,1|2,0,0]=4 572 B18R2.33595 Cc1cc(ccc1F)NCCN2CCCC2=O 34a_100000750164_100000739059 [0,0,1,0,0,1|2,0,0]=4 573 B18R2.33595 Cc1cc(ccc1F)NCCN2CCCC2=O 7a_100000750164_100000739059 [0,0,1,0,0,1|2,0,0]=4 574 B18R2.33595 Cc1cc(ccc1F)OCCN2CCCC2=O 34a_100000751312_100000739059 [0,0,1,0,0,1|2,0,0]=4 575 B18R2.33595 Cc1cc(ccc1F)OCCN2CCCC2=O 7a_100000751312_100000739059 [0,0,1,0,0,1|2,0,0]=4 576 B18R2.33595 Cc1cc(ccc1F)SCCN2CCCC2=O 62a_100000739059_100011218330 [0,0,1,0,0,1|2,0,0]=4 577 B18R2.33595 Cc1cc(ccc1F)SCCN2CCCC2=O 62a_100011218330_100000739059 [0,0,1,0,0,1|2,0,0]=4 578 B18R2.33595 Cc1cc(ccc1I)NCCN2CCCC2=O 34a_100000198070_100000739059 [0,0,1,0,0,1|2,0,0]=4 579 B18R2.33595 Cc1cc(ccc1I)NCCN2CCCC2=O 7a_100000198070_100000739059 [0,0,1,0,0,1|2,0,0]=4 580 B18R2.33595 Cc1cc(ccc1I)OCCN2CCCC2=O 34a_100000729255_100000739059 [0,0,1,0,0,1|2,0,0]=4 581 B18R2.33595 Cc1cc(ccc1I)OCCN2CCCC2=O 7a_100000729255_100000739059 [0,0,1,0,0,1|2,0,0]=4 582 B18R2.33595 Cc1cc(ccc1N)OCCN2CCCC2=O 34a_100000756630_100000739059 [0,0,1,0,0,1|2,0,0]=4 583 B18R2.33595 Cc1cc(ccc1N)OCCN2CCCC2=O 7a_100000756630_100000739059 [0,0,1,0,0,1|2,0,0]=4 584 B18R2.33595 Cc1cc(ccc1N)SCCN2CCCC2=O 62a_100000211769_100000739059 [0,0,1,0,0,1|2,0,0]=4 585 B18R2.33595 Cc1cc(ccc1N)SCCN2CCCC2=O 62a_100000739059_100000211769 [0,0,1,0,0,1|2,0,0]=4 586 B18R2.33595 Cc1cc(ccc1O)NCCN2CCCC2=O 34a_100011218179_100000739059 [0,0,1,0,0,1|1,0,0]=3 587 B18R2.33595 Cc1cc(ccc1O)NCCN2CCCC2=O 7a_100011218179_100000739059 [0,0,1,0,0,1|1,0,0]=3 588 B18R2.33595 Cc1cc(ccc1O)NCCN2CCNC2=O 7a_100011218179_100000090651 [0,0,1,0,0,1|2,0,0]=4 589 B18R2.33595 Cc1cc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100000186361 [0,0,1,0,0,1|1,0,0]=3 590 B18R2.33595 Cc1cc(ccc1O)SCCN2CCNC2=O 62a_100000090651_100000186361 [0,0,1,0,0,1|2,0,0]=4 591 B18R2.33595 Cc1cc(cnc1O)SCCN2CCCC2=O 62a_100000685391_100000739059 [0,0,1,0,0,1|2,0,0]=4 592 B18R2.33595 Cc1cc(cnc1O)SCCN2CCCC2=O 62a_100000739059_100000685391 [0,0,1,0,0,1|2,0,0]=4 593 B18R2.33595 Cc1cc(ncc1O)SCCN2CCCC2=O 62a_100000739059_100000692680 [0,0,1,0,0,1|2,0,0]=4 594 B18R2.33595 Cc1ccc(cc1Br)CSCN2CCCC2=O 62a_100000026320_100012232412 [0,0,1,0,0,1|2,0,0]=4 595 B18R2.33595 Cc1ccc(cc1Br)CSCN2CCCC2=O 62a_100012232412_100000026320 [0,0,1,0,0,1|2,0,0]=4 596 B18R2.33595 Cc1ccc(cc1Br)NCCN2CCCC2=O 2230a_100000736455_100000739059 [0,0,1,0,0,1|2,0,0]=4 597 B18R2.33595 Cc1ccc(cc1Br)NCCN2CCCC2=O 34a_100000736455_100000739059 [0,0,1,0,0,1|2,0,0]=4 598 B18R2.33595 Cc1ccc(cc1Br)NCCN2CCCC2=O 7a_100000736455_100000739059 [0,0,1,0,0,1|2,0,0]=4 599 B18R2.33595 Cc1ccc(cc1Br)OCCN2CCCC2=O 34a_100011380479_100000739059 [0,0,1,0,0,1|2,0,0]=4 600 B18R2.33595 Cc1ccc(cc1Br)OCCN2CCCC2=O 7a_100011380479_100000739059 [0,0,1,0,0,1|2,0,0]=4 601 B18R2.33595 Cc1ccc(cc1Br)SCCN2CCCC2=O 62a_100000739059_100011847877 [0,0,1,0,0,1|2,0,0]=4 602 B18R2.33595 Cc1ccc(cc1Br)SCCN2CCCC2=O 62a_100011847877_100000739059 [0,0,1,0,0,1|2,0,0]=4 603 B18R2.33595 Cc1ccc(cc1C)CSCN2CCCC2=O 62a_100000026320_100000742320 [0,0,1,0,0,1|2,0,0]=4 604 B18R2.33595 Cc1ccc(cc1C)CSCN2CCCC2=O 62a_100000742320_100000026320 [0,0,1,0,0,1|2,0,0]=4 605 B18R2.33595 Cc1ccc(cc1C)NCCN2CCCC2=O 2230a_100000724040_100000739059 [0,0,1,0,0,1|2,0,0]=4 606 B18R2.33595 Cc1ccc(cc1C)NCCN2CCCC2=O 34a_100000724040_100000739059 [0,0,1,0,0,1|2,0,0]=4 607 B18R2.33595 Cc1ccc(cc1C)NCCN2CCCC2=O 7a_100000724040_100000739059 [0,0,1,0,0,1|2,0,0]=4 608 B18R2.33595 Cc1ccc(cc1C)OCCN2CCCC2=O 34a_100000210932_100000739059 [0,0,1,0,0,1|2,0,0]=4 609 B18R2.33595 Cc1ccc(cc1C)OCCN2CCCC2=O 7a_100000210932_100000739059 [0,0,1,0,0,1|2,0,0]=4 610 B18R2.33595 Cc1ccc(cc1C)SCCN2CCCC2=O 62a_100000739059_100011215607 [0,0,1,0,0,1|2,0,0]=4 611 B18R2.33595 Cc1ccc(cc1C)SCCN2CCCC2=O 62a_100011215607_100000739059 [0,0,1,0,0,1|2,0,0]=4 612 B18R2.33595 Cc1ccc(cc1Cl)CSCN2CCCC2=O 62a_100000026320_100011823929 [0,0,1,0,0,1|2,0,0]=4 613 B18R2.33595 Cc1ccc(cc1Cl)CSCN2CCCC2=O 62a_100011823929_100000026320 [0,0,1,0,0,1|2,0,0]=4 614 B18R2.33595 Cc1ccc(cc1Cl)NCCN2CCCC2=O 2230a_100000188892_100000739059 [0,0,1,0,0,1|2,0,0]=4 615 B18R2.33595 Cc1ccc(cc1Cl)NCCN2CCCC2=O 34a_100000188892_100000739059 [0,0,1,0,0,1|2,0,0]=4 616 B18R2.33595 Cc1ccc(cc1Cl)NCCN2CCCC2=O 7a_100000188892_100000739059 [0,0,1,0,0,1|2,0,0]=4 617 B18R2.33595 Cc1ccc(cc1Cl)OCCN2CCCC2=O 34a_100011265682_100000739059 [0,0,1,0,0,1|2,0,0]=4 618 B18R2.33595 Cc1ccc(cc1Cl)OCCN2CCCC2=O 7a_100011265682_100000739059 [0,0,1,0,0,1|2,0,0]=4 619 B18R2.33595 Cc1ccc(cc1Cl)SCCN2CCCC2=O 62a_100000739059_100011216363 [0,0,1,0,0,1|2,0,0]=4 620 B18R2.33595 Cc1ccc(cc1Cl)SCCN2CCCC2=O 62a_100011216363_100000739059 [0,0,1,0,0,1|2,0,0]=4 621 B18R2.33595 Cc1ccc(cc1F)CSCN2CCCC2=O 62a_100000026320_100011217369 [0,0,1,0,0,1|2,0,0]=4 622 B18R2.33595 Cc1ccc(cc1F)CSCN2CCCC2=O 62a_100011217369_100000026320 [0,0,1,0,0,1|2,0,0]=4 623 B18R2.33595 Cc1ccc(cc1F)NCCN2CCCC2=O 2230a_100000210958_100000739059 [0,0,1,0,0,1|2,0,0]=4 624 B18R2.33595 Cc1ccc(cc1F)NCCN2CCCC2=O 34a_100000210958_100000739059 [0,0,1,0,0,1|2,0,0]=4 625 B18R2.33595 Cc1ccc(cc1F)NCCN2CCCC2=O 7a_100000210958_100000739059 [0,0,1,0,0,1|2,0,0]=4 626 B18R2.33595 Cc1ccc(cc1F)OCCN2CCCC2=O 34a_100000722560_100000739059 [0,0,1,0,0,1|2,0,0]=4 627 B18R2.33595 Cc1ccc(cc1F)OCCN2CCCC2=O 7a_100000722560_100000739059 [0,0,1,0,0,1|2,0,0]=4 628 B18R2.33595 Cc1ccc(cc1F)SCCN2CCCC2=O 62a_100000720648_100000739059 [0,0,1,0,0,1|2,0,0]=4 629 B18R2.33595 Cc1ccc(cc1F)SCCN2CCCC2=O 62a_100000739059_100000720648 [0,0,1,0,0,1|2,0,0]=4 630 B18R2.33595 Cc1ccc(cc1I)CSCN2CCCC2=O 62a_100000026320_100010206137 [0,0,1,0,0,1|2,0,0]=4 631 B18R2.33595 Cc1ccc(cc1I)CSCN2CCCC2=O 62a_100010206137_100000026320 [0,0,1,0,0,1|2,0,0]=4 632 B18R2.33595 Cc1ccc(cc1I)NCCN2CCCC2=O 34a_100000184131_100000739059 [0,0,1,0,0,1|2,0,0]=4 633 B18R2.33595 Cc1ccc(cc1I)NCCN2CCCC2=O 7a_100000184131_100000739059 [0,0,1,0,0,1|2,0,0]=4 634 B18R2.33595 Cc1ccc(cc1N)OCCN2CCCC2=O 34a_100011216113_100000739059 [0,0,1,0,0,1|2,0,0]=4 635 B18R2.33595 Cc1ccc(cc1N)OCCN2CCCC2=O 7a_100011216113_100000739059 [0,0,1,0,0,1|2,0,0]=4 636 B18R2.33595 Cc1ccc(cc1N)SCCN2CCCC2=O 62a_100000739059_100000761890 [0,0,1,0,0,1|2,0,0]=4 637 B18R2.33595 Cc1ccc(cc1N)SCCN2CCCC2=O 62a_100000761890_100000739059 [0,0,1,0,0,1|2,0,0]=4 638 B18R2.33595 Cc1ccc(cc1O)NCCN2CCCC2=O 34a_100000759471_100000739059 [0,0,1,0,0,1|1,0,0]=3 639 B18R2.33595 Cc1ccc(cc1O)NCCN2CCCC2=O 7a_100000759471_100000739059 [0,0,1,0,0,1|1,0,0]=3 640 B18R2.33595 Cc1ccc(cc1O)NCCN2CCNC2=O 7a_100000759471_100000090651 [0,0,1,0,0,1|2,0,0]=4 641 B18R2.33595 Cc1ccc(cc1O)SCCN2CCCC2=O 62a_100000685420_100000739059 [0,0,1,0,0,1|1,0,0]=3 642 B18R2.33595 Cc1ccc(cc1O)SCCN2CCCC2=O 62a_100000739059_100000685420 [0,0,1,0,0,1|1,0,0]=3 643 B18R2.33595 Cc1ccc(cc1O)SCCN2CCNC2=O 62a_100000090651_100000685420 [0,0,1,0,0,1|2,0,0]=4 644 B18R2.33595 Cc1ccc(cc1O)SCCN2CCNC2=O 62a_100000685420_100000090651 [0,0,1,0,0,1|2,0,0]=4 645 B18R2.33595 Cc1cnc(cc1O)SCCN2CCCC2=O 62a_100000704368_100000739059 [0,0,1,0,0,1|2,0,0]=4 646 B18R2.33595 Cc1cnc(cc1O)SCCN2CCCC2=O 62a_100000739059_100000704368 [0,0,1,0,0,1|2,0,0]=4 647 B18R2.33595 Cc1nc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100010233687 [0,0,1,0,0,1|2,0,0]=4 648 B18R2.33595 Cc1nc(ccc1O)SCCN2CCCC2=O 62a_100010233687_100000739059 [0,0,1,0,0,1|2,0,0]=4 649 B18R2.33595 Cc1ncc(cc1O)SCCN2CCCC2=O 62a_100000739059_100009864810 [0,0,1,0,0,1|2,0,0]=4 650 B18R2.33595 Cc1ncc(cc1O)SCCN2CCCC2=O 62a_100009864810_100000739059 [0,0,1,0,0,1|2,0,0]=4 651 B18R2.33595 Nc1cc(ccc1Br)OCCN2CCCC2=O 34a_100011999798_100000739059 [0,0,1,0,0,1|2,0,0]=4 652 B18R2.33595 Nc1cc(ccc1Br)OCCN2CCCC2=O 7a_100011999798_100000739059 [0,0,1,0,0,1|2,0,0]=4 653 B18R2.33595 Nc1cc(ccc1Br)SCCN2CCCC2=O 62a_100000739059_100000750456 [0,0,1,0,0,1|2,0,0]=4 654 B18R2.33595 Nc1cc(ccc1Br)SCCN2CCCC2=O 62a_100000750456_100000739059 [0,0,1,0,0,1|2,0,0]=4 655 B18R2.33595 Nc1cc(ccc1Cl)OCCN2CCCC2=O 34a_100011934297_100000739059 [0,0,1,0,0,1|2,0,0]=4 656 B18R2.33595 Nc1cc(ccc1Cl)SCCN2CCCC2=O 62a_100000739059_200000761891 [0,0,1,0,0,1|2,0,0]=4 657 B18R2.33595 Nc1cc(ccc1Cl)SCCN2CCCC2=O 62a_200000761891_100000739059 [0,0,1,0,0,1|2,0,0]=4 658 B18R2.33595 Nc1cc(ccc1F)OCCN2CCCC2=O 34a_100012017239_100000739059 [0,0,1,0,0,1|2,0,0]=4 659 B18R2.33595 Nc1cc(ccc1F)OCCN2CCCC2=O 7a_100012017239_100000739059 [0,0,1,0,0,1|2,0,0]=4 660 B18R2.33595 Nc1cc(ccc1F)SCCN2CCCC2=O 62a_100000739059_100000740924 [0,0,1,0,0,1|2,0,0]=4 661 B18R2.33595 Nc1cc(ccc1F)SCCN2CCCC2=O 62a_100000740924_100000739059 [0,0,1,0,0,1|2,0,0]=4 662 B18R2.33595 Nc1cc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100000752626 [0,0,1,0,0,1|1,0,0]=3 663 B18R2.33595 Nc1cc(ccc1O)SCCN2CCCC2=O 62a_100000752626_100000739059 [0,0,1,0,0,1|1,0,0]=3 664 B18R2.33595 Nc1cc(ccc1O)SCCN2CCNC2=O 62a_100000090651_100000752626 [0,0,1,0,0,1|2,0,0]=4 665 B18R2.33595 Nc1cc(ccc1O)SCCN2CCNC2=O 62a_100000752626_100000090651 [0,0,1,0,0,1|2,0,0]=4 666 B18R2.33595 Nc1cc(cnc1O)SCCN2CCCC2=O 62a_100000739059_100000743729 [0,0,1,0,0,1|2,0,0]=4 667 B18R2.33595 Nc1cc(cnc1O)SCCN2CCCC2=O 62a_100000743729_100000739059 [0,0,1,0,0,1|2,0,0]=4 668 B18R2.33595 Nc1cc(ncc1O)SCCN2CCCC2=O 62a_100000739059_100009819941 [0,0,1,0,0,1|2,0,0]=4 669 B18R2.33595 Nc1cc(ncc1O)SCCN2CCCC2=O 62a_100009819941_100000739059 [0,0,1,0,0,1|2,0,0]=4 670 B18R2.33595 Nc1ccc(cc1Br)OCCN2CCCC2=O 34a_100012001276_100000739059 [0,0,1,0,0,1|2,0,0]=4 671 B18R2.33595 Nc1ccc(cc1Br)OCCN2CCCC2=O 7a_100012001276_100000739059 [0,0,1,0,0,1|2,0,0]=4 672 B18R2.33595 Nc1ccc(cc1Br)SCCN2CCCC2=O 62a_100000739059_100000750455 [0,0,1,0,0,1|2,0,0]=4 673 B18R2.33595 Nc1ccc(cc1Br)SCCN2CCCC2=O 62a_100000750455_100000739059 [0,0,1,0,0,1|2,0,0]=4 674 B18R2.33595 Nc1ccc(cc1Cl)OCCN2CCCC2=O 34a_100011215599_100000739059 [0,0,1,0,0,1|2,0,0]=4 675 B18R2.33595 Nc1ccc(cc1Cl)OCCN2CCCC2=O 7a_100011215599_100000739059 [0,0,1,0,0,1|2,0,0]=4 676 B18R2.33595 Nc1ccc(cc1Cl)SCCN2CCCC2=O 62a_100000739059_100011218065 [0,0,1,0,0,1|2,0,0]=4 677 B18R2.33595 Nc1ccc(cc1Cl)SCCN2CCCC2=O 62a_100011218065_100000739059 [0,0,1,0,0,1|2,0,0]=4 678 B18R2.33595 Nc1ccc(cc1F)OCCN2CCCC2=O 34a_100000759473_100000739059 [0,0,1,0,0,1|2,0,0]=4 679 B18R2.33595 Nc1ccc(cc1F)OCCN2CCCC2=O 7a_100000759473_100000739059 [0,0,1,0,0,1|2,0,0]=4 680 B18R2.33595 Nc1ccc(cc1F)SCCN2CCCC2=O 62a_100000739059_100011215594 [0,0,1,0,0,1|2,0,0]=4 681 B18R2.33595 Nc1ccc(cc1F)SCCN2CCCC2=O 62a_100011215594_100000739059 [0,0,1,0,0,1|2,0,0]=4 682 B18R2.33595 Nc1ccc(cc1I)OCCN2CCCC2=O 34a_100010084370_100000739059 [0,0,1,0,0,1|2,0,0]=4 683 B18R2.33595 Nc1ccc(cc1I)OCCN2CCCC2=O 7a_100010084370_100000739059 [0,0,1,0,0,1|2,0,0]=4 684 B18R2.33595 Nc1ccc(cc1N)OCCN2CCCC2=O 34a_100025771000_100000739059 [0,0,1,0,0,1|2,0,0]=4 685 B18R2.33595 Nc1ccc(cc1N)SCCN2CCCC2=O 62a_100000739059_100011534411 [0,0,1,0,0,1|2,0,0]=4 686 B18R2.33595 Nc1ccc(cc1N)SCCN2CCCC2=O 62a_100000741789_100000739059 [0,0,1,0,0,1|2,0,0]=4 687 B18R2.33595 Nc1ccc(cc1O)SCCN2CCCC2=O 62a_100000739049_100000739059 [0,0,1,0,0,1|1,0,0]=3 688 B18R2.33595 Nc1ccc(cc1O)SCCN2CCCC2=O 62a_100000739059_100000739049 [0,0,1,0,0,1|1,0,0]=3 689 B18R2.33595 Nc1ccc(cc1O)SCCN2CCNC2=O 62a_100000090651_100000739049 [0,0,1,0,0,1|2,0,0]=4 690 B18R2.33595 Nc1ccc(cc1O)SCCN2CCNC2=O 62a_100000739049_100000090651 [0,0,1,0,0,1|2,0,0]=4 691 B18R2.33595 Nc1ccc(nc1O)SCCN2CCCC2=O 62a_100000718904_100000739059 [0,0,1,0,0,1|2,0,0]=4 692 B18R2.33595 Nc1nc(ccc1O)SCCN2CCCC2=O 62a_100000685527_100000739059 [0,0,1,0,0,1|2,0,0]=4 693 B18R2.33595 Nc1nc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100000685527 [0,0,1,0,0,1|2,0,0]=4 694 B18R2.33595 Nc1ncc(cc1O)SCCN2CCCC2=O 62a_100000739059_100009819042 [0,0,1,0,0,1|2,0,0]=4 695 B18R2.33595 Nc1ncc(cc1O)SCCN2CCCC2=O 62a_100009819042_100000739059 [0,0,1,0,0,1|2,0,0]=4 696 B18R2.33595 O=C1CCCC1NCCc2ccc(c(c2)O)O 34a_100000210387_100000709159 [0,0,1,0,0,1|1,0,0]=3 697 B18R2.33595 O=C1CCCC1SCCc2ccc(c(c2)O)O 62a_100000211823_200010393615 [0,0,1,0,0,1|1,0,0]=3 698 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)Br 2230a_100011306057_100000739059 [0,0,1,0,0,1|2,0,0]=4 699 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)Br 34a_100011306057_100000739059 [0,0,1,0,0,1|2,0,0]=4 700 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)Br 7a_100011306057_100000739059 [0,0,1,0,0,1|2,0,0]=4 701 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)Cl 2230a_100000686031_100000739059 [0,0,1,0,0,1|2,0,0]=4 702 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)Cl 34a_100000686031_100000739059 [0,0,1,0,0,1|2,0,0]=4 703 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)F 2230a_100000760356_100000739059 [0,0,1,0,0,1|2,0,0]=4 704 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)F 34a_100000760356_100000739059 [0,0,1,0,0,1|2,0,0]=4 705 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)F 7a_100000760356_100000739059 [0,0,1,0,0,1|2,0,0]=4 706 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)I 34a_100000750458_100000739059 [0,0,1,0,0,1|2,0,0]=4 707 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Br)O 34a_100011534360_100000739059 [0,0,1,0,0,1|1,0,0]=3 708 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)Br 2230a_100000687081_100000739059 [0,0,1,0,0,1|2,0,0]=4 709 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)Br 34a_100000687081_100000739059 [0,0,1,0,0,1|2,0,0]=4 710 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)Br 7a_100000687081_100000739059 [0,0,1,0,0,1|2,0,0]=4 711 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)Cl 2230a_100000184108_100000739059 [0,0,1,0,0,1|2,0,0]=4 712 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)Cl 34a_100000184108_100000739059 [0,0,1,0,0,1|2,0,0]=4 713 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)F 2230a_100000211060_100000739059 [0,0,1,0,0,1|2,0,0]=4 714 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)F 34a_100000211060_100000739059 [0,0,1,0,0,1|2,0,0]=4 715 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)F 7a_100000211060_100000739059 [0,0,1,0,0,1|2,0,0]=4 716 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)I 34a_100000761885_100000739059 [0,0,1,0,0,1|2,0,0]=4 717 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)Cl)O 34a_100000744943_100000739059 [0,0,1,0,0,1|1,0,0]=3 718 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)Br 2230a_100000759894_100000739059 [0,0,1,0,0,1|2,0,0]=4 719 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)Br 34a_100000759894_100000739059 [0,0,1,0,0,1|2,0,0]=4 720 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)Br 7a_100000759894_100000739059 [0,0,1,0,0,1|2,0,0]=4 721 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)Cl 2230a_100000739366_100000739059 [0,0,1,0,0,1|2,0,0]=4 722 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)Cl 34a_100000739366_100000739059 [0,0,1,0,0,1|2,0,0]=4 723 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)Cl 7a_100000739366_100000739059 [0,0,1,0,0,1|2,0,0]=4 724 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)F 2230a_100000210724_100000739059 [0,0,1,0,0,1|2,0,0]=4 725 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)F 34a_100000210724_100000739059 [0,0,1,0,0,1|2,0,0]=4 726 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)F 7a_100000210724_100000739059 [0,0,1,0,0,1|2,0,0]=4 727 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)I 34a_100011356925_100000739059 [0,0,1,0,0,1|2,0,0]=4 728 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)I 7a_100011356925_100000739059 [0,0,1,0,0,1|2,0,0]=4 729 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)O 34a_100011220035_100000739059 [0,0,1,0,0,1|1,0,0]=3 730 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)F)O 7a_100011220035_100000739059 [0,0,1,0,0,1|1,0,0]=3 731 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)I)Br 34a_100000750459_100000739059 [0,0,1,0,0,1|2,0,0]=4 732 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)I)Cl 34a_100012360549_100000739059 [0,0,1,0,0,1|2,0,0]=4 733 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)I)F 34a_114828291077_100000739059 [0,0,1,0,0,1|2,0,0]=4 734 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)I)F 7a_114828291077_100000739059 [0,0,1,0,0,1|2,0,0]=4 735 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)O)Cl 34a_100011934209_100000739059 [0,0,1,0,0,1|1,0,0]=3 736 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)O)F 34a_100012017398_100000739059 [0,0,1,0,0,1|1,0,0]=3 737 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)O)F 7a_100012017398_100000739059 [0,0,1,0,0,1|1,0,0]=3 738 B18R2.33595 O=C1CCCN1CCNc2ccc(c(c2)O)O 34a_100102946323_100000739059 [0,0,1,0,0,1|0,0,0]=2 739 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Br)Cl 34a_100011933957_100000739059 [0,0,1,0,0,1|2,0,0]=4 740 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Br)Cl 7a_100011933957_100000739059 [0,0,1,0,0,1|2,0,0]=4 741 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Br)F 34a_100000693481_100000739059 [0,0,1,0,0,1|2,0,0]=4 742 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Br)F 7a_100000693481_100000739059 [0,0,1,0,0,1|2,0,0]=4 743 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Br)I 34a_100000701344_100000739059 [0,0,1,0,0,1|2,0,0]=4 744 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Br)I 7a_100000701344_100000739059 [0,0,1,0,0,1|2,0,0]=4 745 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)Br 34a_100011215161_100000739059 [0,0,1,0,0,1|2,0,0]=4 746 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)Br 7a_100011215161_100000739059 [0,0,1,0,0,1|2,0,0]=4 747 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)Cl 34a_100000211054_100000739059 [0,0,1,0,0,1|2,0,0]=4 748 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)Cl 7a_100000211054_100000739059 [0,0,1,0,0,1|2,0,0]=4 749 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)F 34a_100000211030_100000739059 [0,0,1,0,0,1|2,0,0]=4 750 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)F 7a_100000211030_100000739059 [0,0,1,0,0,1|2,0,0]=4 751 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)I 34a_100000047559_100000739059 [0,0,1,0,0,1|2,0,0]=4 752 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)Cl)I 7a_100000047559_100000739059 [0,0,1,0,0,1|2,0,0]=4 753 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)Br 34a_100000755031_100000739059 [0,0,1,0,0,1|2,0,0]=4 754 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)Br 7a_100000755031_100000739059 [0,0,1,0,0,1|2,0,0]=4 755 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)Cl 34a_100000691581_100000739059 [0,0,1,0,0,1|2,0,0]=4 756 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)Cl 7a_100000691581_100000739059 [0,0,1,0,0,1|2,0,0]=4 757 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)F 34a_100000181275_100000739059 [0,0,1,0,0,1|2,0,0]=4 758 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)F 7a_100000181275_100000739059 [0,0,1,0,0,1|2,0,0]=4 759 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)I 34a_100009990212_100000739059 [0,0,1,0,0,1|2,0,0]=4 760 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)F)I 7a_100009990212_100000739059 [0,0,1,0,0,1|2,0,0]=4 761 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)I)Br 34a_100012339312_100000739059 [0,0,1,0,0,1|2,0,0]=4 762 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)I)Br 7a_100012339312_100000739059 [0,0,1,0,0,1|2,0,0]=4 763 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)I)Cl 34a_100000049588_100000739059 [0,0,1,0,0,1|2,0,0]=4 764 B18R2.33595 O=C1CCCN1CCOc2ccc(c(c2)I)Cl 7a_100000049588_100000739059 [0,0,1,0,0,1|2,0,0]=4 765 B18R2.33595 O=C1CCCN1CCSc2c[nH]c(=O)c(c2)O 62a_100000739059_100009814561 [0,0,1,0,0,1|1,0,1]=4 766 B18R2.33595 O=C1CCCN1CCSc2cc(c(cn2)F)O 62a_100000739059_100009854642 [0,0,1,0,0,1|2,0,0]=4 767 B18R2.33595 O=C1CCCN1CCSc2cc(c(cn2)F)O 62a_100009854642_100000739059 [0,0,1,0,0,1|2,0,0]=4 768 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)Br 62a_100000739059_100012356285 [0,0,1,0,0,1|2,0,0]=4 769 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)Br 62a_100012356285_100000739059 [0,0,1,0,0,1|2,0,0]=4 770 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)Cl 62a_100000739059_100012353702 [0,0,1,0,0,1|2,0,0]=4 771 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)Cl 62a_100012353702_100000739059 [0,0,1,0,0,1|2,0,0]=4 772 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)F 62a_100000739059_100012047266 [0,0,1,0,0,1|2,0,0]=4 773 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)F 62a_100012047266_100000739059 [0,0,1,0,0,1|2,0,0]=4 774 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)O 62a_100000739059_100012361655 [0,0,1,0,0,1|1,0,0]=3 775 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Br)O 62a_100012361655_100000739059 [0,0,1,0,0,1|1,0,0]=3 776 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)Br 62a_100000739059_100012047281 [0,0,1,0,0,1|2,0,0]=4 777 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)Br 62a_100012047281_100000739059 [0,0,1,0,0,1|2,0,0]=4 778 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)Cl 62a_100000739059_100011214914 [0,0,1,0,0,1|2,0,0]=4 779 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)Cl 62a_100011214914_100000739059 [0,0,1,0,0,1|2,0,0]=4 780 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)F 62a_100000739059_100011215976 [0,0,1,0,0,1|2,0,0]=4 781 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)F 62a_100011215976_100000739059 [0,0,1,0,0,1|2,0,0]=4 782 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)O 62a_100000739059_100012360047 [0,0,1,0,0,1|1,0,0]=3 783 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)Cl)O 62a_100012360047_100000739059 [0,0,1,0,0,1|1,0,0]=3 784 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)Br 62a_100000685389_100000739059 [0,0,1,0,0,1|2,0,0]=4 785 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)Br 62a_100000739059_100000685389 [0,0,1,0,0,1|2,0,0]=4 786 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)Cl 62a_100000739059_100011216805 [0,0,1,0,0,1|2,0,0]=4 787 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)Cl 62a_100011216805_100000739059 [0,0,1,0,0,1|2,0,0]=4 788 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)F 62a_100000703953_100000739059 [0,0,1,0,0,1|2,0,0]=4 789 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)F 62a_100000739059_100000703953 [0,0,1,0,0,1|2,0,0]=4 790 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)O 62a_100000185481_100000739059 [0,0,1,0,0,1|1,0,0]=3 791 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)F)O 62a_100000739059_100000185481 [0,0,1,0,0,1|1,0,0]=3 792 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)O)Br 62a_100000739059_100012356990 [0,0,1,0,0,1|1,0,0]=3 793 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)O)Br 62a_100012356990_100000739059 [0,0,1,0,0,1|1,0,0]=3 794 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)O)Cl 62a_100000739059_100011356854 [0,0,1,0,0,1|1,0,0]=3 795 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)O)Cl 62a_100011356854_100000739059 [0,0,1,0,0,1|1,0,0]=3 796 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)O)F 62a_100000686035_100000739059 [0,0,1,0,0,1|1,0,0]=3 797 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)O)F 62a_100000739059_100000686035 [0,0,1,0,0,1|1,0,0]=3 798 B18R2.33595 O=C1CCCN1CCSc2ccc(c(c2)O)O 62a_100000739059_100009813601 [0,0,1,0,0,1|0,0,0]=2 799 B18R2.33595 O=C1CCCN1CCSc2ccc(c(n2)Br)O 62a_100000725334_100000739059 [0,0,1,0,0,1|2,0,0]=4 800 B18R2.33595 O=C1CCCN1CCSc2ccc(c(n2)Br)O 62a_100000739059_100000725334 [0,0,1,0,0,1|2,0,0]=4 801 B18R2.33595 O=C1CCCN1CCSc2ccc(c(n2)Cl)O 62a_100000739059_100000721234 [0,0,1,0,0,1|2,0,0]=4 802 B18R2.33595 O=C1CCCN1CCSc2ccc(c(n2)F)O 62a_100000739059_100009819667 [0,0,1,0,0,1|2,0,0]=4 803 B18R2.33595 O=C1CCCN1CCSc2ccc(c(n2)F)O 62a_100009819667_100000739059 [0,0,1,0,0,1|2,0,0]=4 804 B18R2.33595 O=C1CCCN1CCSc2ccc(c(n2)O)F 62a_100000739059_100010729010 [0,0,1,0,0,1|2,0,0]=4 805 B18R2.33595 O=C1CCCN1CCSc2cnc(c(c2)Cl)O 62a_100000739059_100010238531 [0,0,1,0,0,1|2,0,0]=4 806 B18R2.33595 O=C1CCCN1CCSc2cnc(c(c2)Cl)O 62a_100010238531_100000739059 [0,0,1,0,0,1|2,0,0]=4 807 B18R2.33595 O=C1CCCN1CCSc2cnc(c(c2)O)F 62a_100000739059_100009819871 [0,0,1,0,0,1|2,0,0]=4 808 B18R2.33595 O=C1CCCN1CCSc2cnc(c(c2)O)F 62a_100009819871_100000739059 [0,0,1,0,0,1|2,0,0]=4 809 B18R2.33595 O=C1CCCN1CSCc2cc(=O)c(co2)O 62a_100000026320_100000010605 [0,0,1,0,0,1|1,0,1]=4 810 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Br)Br 62a_100000026320_100012353900 [0,0,1,0,0,1|2,0,0]=4 811 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Br)Br 62a_100012353900_100000026320 [0,0,1,0,0,1|2,0,0]=4 812 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Br)Cl 62a_100000026320_100012353894 [0,0,1,0,0,1|2,0,0]=4 813 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Br)Cl 62a_100012353894_100000026320 [0,0,1,0,0,1|2,0,0]=4 814 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Br)F 62a_100000026320_100011206884 [0,0,1,0,0,1|2,0,0]=4 815 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Br)F 62a_100011206884_100000026320 [0,0,1,0,0,1|2,0,0]=4 816 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)Br 62a_100000026320_100012353895 [0,0,1,0,0,1|2,0,0]=4 817 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)Br 62a_100012353895_100000026320 [0,0,1,0,0,1|2,0,0]=4 818 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)Cl 62a_100000026320_100000184707 [0,0,1,0,0,1|2,0,0]=4 819 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)Cl 62a_100000184707_100000026320 [0,0,1,0,0,1|2,0,0]=4 820 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)F 62a_100000026320_100011934319 [0,0,1,0,0,1|2,0,0]=4 821 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)F 62a_100000717365_100000026320 [0,0,1,0,0,1|2,0,0]=4 822 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)I 62a_100000026320_100012349665 [0,0,1,0,0,1|2,0,0]=4 823 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)Cl)I 62a_100012349665_100000026320 [0,0,1,0,0,1|2,0,0]=4 824 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)Br 62a_100000026320_100000767054 [0,0,1,0,0,1|2,0,0]=4 825 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)Br 62a_100000767054_100000026320 [0,0,1,0,0,1|2,0,0]=4 826 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)Cl 62a_100000026320_100000716492 [0,0,1,0,0,1|2,0,0]=4 827 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)Cl 62a_100000716492_100000026320 [0,0,1,0,0,1|2,0,0]=4 828 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)F 62a_100000026320_100000757363 [0,0,1,0,0,1|2,0,0]=4 829 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)F 62a_100000757363_100000026320 [0,0,1,0,0,1|2,0,0]=4 830 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)I 62a_100000026320_100010149604 [0,0,1,0,0,1|2,0,0]=4 831 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)F)I 62a_100010149604_100000026320 [0,0,1,0,0,1|2,0,0]=4 832 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)I)Br 62a_100000026320_100010146616 [0,0,1,0,0,1|2,0,0]=4 833 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)I)Br 62a_100010146616_100000026320 [0,0,1,0,0,1|2,0,0]=4 834 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)I)F 62a_100000026320_100010188208 [0,0,1,0,0,1|2,0,0]=4 835 B18R2.33595 O=C1CCCN1CSCc2ccc(c(c2)I)F 62a_100010188208_100000026320 [0,0,1,0,0,1|2,0,0]=4 836 B18R2.33595 O=C1NCCN1CCNc2ccc(c(c2)F)O 7a_100011220035_100000090651 [0,0,1,0,0,1|2,0,0]=4 837 B18R2.33595 O=C1NCCN1CCNc2ccc(c(c2)O)F 7a_100012017398_100000090651 [0,0,1,0,0,1|2,0,0]=4 838 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)Br)O 62a_100000090651_100012361655 [0,0,1,0,0,1|2,0,0]=4 839 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)Br)O 62a_100012361655_100000090651 [0,0,1,0,0,1|2,0,0]=4 840 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)Cl)O 62a_100000090651_100012360047 [0,0,1,0,0,1|2,0,0]=4 841 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)Cl)O 62a_100012360047_100000090651 [0,0,1,0,0,1|2,0,0]=4 842 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)F)O 62a_100000090651_100000185481 [0,0,1,0,0,1|2,0,0]=4 843 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)F)O 62a_100000185481_100000090651 [0,0,1,0,0,1|2,0,0]=4 844 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)O)Br 62a_100000090651_100012356990 [0,0,1,0,0,1|2,0,0]=4 845 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)O)Br 62a_100012356990_100000090651 [0,0,1,0,0,1|2,0,0]=4 846 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)O)Cl 62a_100000090651_100011356854 [0,0,1,0,0,1|2,0,0]=4 847 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)O)Cl 62a_100011356854_100000090651 [0,0,1,0,0,1|2,0,0]=4 848 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)O)F 62a_100000090651_100000686035 [0,0,1,0,0,1|2,0,0]=4 849 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)O)F 62a_100000686035_100000090651 [0,0,1,0,0,1|2,0,0]=4 850 B18R2.33595 O=C1NCCN1CCSc2ccc(c(c2)O)O 62a_100000090651_100009813601 [0,0,1,0,0,1|1,0,0]=3 851 B18R2.33595 O=C1OCCC1NCCc2ccc(c(c2)O)O 34a_100000210387_100000211211 [0,0,1,0,0,1|2,0,0]=4 852 B18R2.33595 O=C1OCCC1SCCc2ccc(c(c2)O)O 62a_100000211211_200010393615 [0,0,1,0,0,1|2,0,0]=4 853 B18R2.39765 CC1CCCCN1CCc2ccc(c(c2)O)O 269982a_100000211376_200010393615 [0,0,1,0,0,1|1,0,1]=4 854 B18R2.39765 C[C@H]1COCCN1CCc2ccc(c(c2)O)O 269982a_100009815349_200010393615 [0,0,1,0,0,1|1,0,1]=4 855 B18R2.39765 O=C1CCCCC1NCc2ccc(c(c2)O)O 34a_100000010075_100000754470 [0,0,1,0,0,1|2,0,0]=4 856 B18R2.39765 O=C1CCOCC1NCc2ccc(c(c2)O)O 34a_100000010075_100012180262 [0,0,1,0,0,1|2,0,0]=4 857 B18R2.39765 O=C1NCCCC1NCc2ccc(c(c2)O)O 34a_100000010075_100000687798 [0,0,1,0,0,1|2,0,0]=4 858 B18R2.65908 CC1=CCCN(C1)CCc2ccc(c(c2)O)O 269982a_100000725631_200010393615 [0,0,1,0,0,1|1,0,1]=4 859 B18R2.65908 C[C@H]1CCCN(C1)CCc2ccc(c(c2)O)O 269982a_100000717927_200010393615 [0,0,1,0,0,1|1,0,1]=4 860 B18R2.65908 Oc1ccc(cc1O)CCN2CCCC(C2)F 269982a_100000697950_200010393615 [0,0,1,0,0,1|1,0,1]=4 861 B18R2.65908 Oc1ccc(cc1O)CCN2CCCC(C2)O 269982a_100000211013_200010393615 [0,0,1,0,0,1|0,0,2]=4 862 B18R2.62777 C=C(C)CN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000748629 [0,0,1,0,0,1|1,0,0]=3 863 B18R2.62777 C=C(F)CN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100009893438 [0,0,1,0,0,1|1,0,1]=4 864 B18R2.62777 CC(C)CN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000210760 [0,0,1,0,0,1|1,0,1]=4 865 B18R2.62777 CC(O)CN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100011218427 [0,0,1,0,0,1|0,0,2]=4 866 B18R2.62777 CC1c2cc(c(cc2CCN1CC(=O)N)O)O 2230a_100000735813_100000747473 [0,0,1,0,0,1|1,0,0]=3 867 B18R2.62777 CC1c2cc(c(cc2CCN1C[C@@H](C)O)O)O 2230a_100000735813_100009817552 [0,0,1,0,0,1|0,0,2]=4 868 B18R2.2243323 CCC(C)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000748023 [0,0,1,0,0,1|1,0,1]=4 869 B18R2.2243323 CCC(O)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100011218378 [0,0,1,0,0,1|0,0,2]=4 870 B18R2.2243323 CC[C@H](C)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100009816398 [0,0,1,0,0,1|1,0,1]=4 871 B18R2.2243323 CNC(=O)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000183359 [0,0,1,0,0,1|1,0,0]=3 872 B18R2.2243323 COC(=O)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000747449 [0,0,1,0,0,1|1,0,0]=3 873 B15R1.8398 CC(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100015343762 [1,0,2,0,0,0|1,0,0]=4 874 B15R1.8398 CC(=O)NCCc1cc(c(cc1O)O)O 527a_200000106461_100103153847 [1,0,2,0,0,0|1,0,0]=4 875 B15R1.1358 CCN(C(=O)C)C(C)c1ccc(cc1)F 11a_100000222793_100015343762 [1,0,2,0,0,0|1,0,0]=4 876 B15R1.1358 CCN(C(=O)C)C(C)c1ccc(cc1)F 1626a_100000222793_100015343762 [1,0,2,0,0,0|1,0,0]=4 877 B15R1.1358 CCN(C(=O)C)C(C)c1ccc(cc1)F 240690a_100000222793_100015343762 [1,0,2,0,0,0|1,0,0]=4 878 B15R1.1358 CCN(C(=O)C)C(C)c1ccc(cc1)F 527a_100000222793_100103153847 [1,0,2,0,0,0|1,0,0]=4 879 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Br 11a_100000187385_100000210414 [1,0,2,0,0,0|1,0,0]=4 880 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Br 1626a_100000187385_100000210414 [1,0,2,0,0,0|1,0,0]=4 881 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Br 240690a_100000187385_100000210414 [1,0,2,0,0,0|1,0,0]=4 882 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Br 527a_100000187385_100000210414 [1,0,2,0,0,0|1,0,0]=4 883 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)C 11a_100000180869_100000210414 [1,0,2,0,0,0|1,0,0]=4 884 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)C 1626a_100000180869_100000210414 [1,0,2,0,0,0|1,0,0]=4 885 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)C 240690a_100000180869_100000210414 [1,0,2,0,0,0|1,0,0]=4 886 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)C 527a_100000180869_100000210414 [1,0,2,0,0,0|1,0,0]=4 887 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Cl 11a_100000180830_100000210414 [1,0,2,0,0,0|1,0,0]=4 888 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Cl 1626a_100000180830_100000210414 [1,0,2,0,0,0|1,0,0]=4 889 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Cl 240690a_100000180830_100000210414 [1,0,2,0,0,0|1,0,0]=4 890 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)Cl 527a_100000180830_100000210414 [1,0,2,0,0,0|1,0,0]=4 891 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)F 11a_100015183324_100000210414 [1,0,2,0,0,0|1,0,0]=4 892 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)F 1626a_100015183324_100000210414 [1,0,2,0,0,0|1,0,0]=4 893 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)F 240690a_100015183324_100000210414 [1,0,2,0,0,0|1,0,0]=4 894 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)F 527a_100015183324_100000210414 [1,0,2,0,0,0|1,0,0]=4 895 B15R1.1373 CCC(=O)N(CC)Cc1ccc(cc1)O 240690a_100000748449_100000210414 [1,0,2,0,0,0|0,0,0]=3 896 B15R1.1373 CCN(Cc1ccc(cc1)O)C(=O)CO 240690a_100000748449_100000210174 [1,0,2,0,0,0|1,0,0]=4 897 B15R1.1373 CCN(Cc1ccc(cc1)O)C(=O)NC 2708a_100102657272_100000748449 [1,0,2,0,0,0|1,0,0]=4 898 B15R1.1373 CCN(Cc1ccc(cc1)O)C(=O)NC 273464a_100102657272_100000748449 [1,0,2,0,0,0|1,0,0]=4 899 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 11a_100000187426_100000210414 [1,0,2,0,0,0|1,0,0]=4 900 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 1626a_100000187426_100000210414 [1,0,2,0,0,0|1,0,0]=4 901 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 240690a_100000187426_100000210414 [1,0,2,0,0,0|1,0,0]=4 902 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Br 527a_100000187426_100000210414 [1,0,2,0,0,0|1,0,0]=4 903 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 11a_102516607250_100000210414 [1,0,2,0,0,0|1,0,0]=4 904 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 1626a_102516607250_100000210414 [1,0,2,0,0,0|1,0,0]=4 905 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 240690a_102516607250_100000210414 [1,0,2,0,0,0|1,0,0]=4 906 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)C 527a_102516607250_100000210414 [1,0,2,0,0,0|1,0,0]=4 907 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 11a_100000201194_100000210414 [1,0,2,0,0,0|1,0,0]=4 908 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 1626a_100000201194_100000210414 [1,0,2,0,0,0|1,0,0]=4 909 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 240690a_100000201194_100000210414 [1,0,2,0,0,0|1,0,0]=4 910 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)Cl 527a_100000201194_100000210414 [1,0,2,0,0,0|1,0,0]=4 911 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 11a_100000195558_100000210414 [1,0,2,0,0,0|1,0,0]=4 912 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 1626a_100000195558_100000210414 [1,0,2,0,0,0|1,0,0]=4 913 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 240690a_100000195558_100000210414 [1,0,2,0,0,0|1,0,0]=4 914 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)F 527a_100000195558_100000210414 [1,0,2,0,0,0|1,0,0]=4 915 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)O 1626a_100000201218_100000210414 [1,0,2,0,0,0|0,0,0]=3 916 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)O 240690a_100000201218_100000210414 [1,0,2,0,0,0|0,0,0]=3 917 B15R1.1374 CCC(=O)N(CC)Cc1cccc(c1)O 527a_100000201218_100000210414 [1,0,2,0,0,0|0,0,0]=3 918 B15R1.1374 CCN(Cc1cccc(c1)O)C(=O)CO 240690a_100000201218_100000210174 [1,0,2,0,0,0|1,0,0]=4 919 B15R1.1374 CCN(Cc1cccc(c1)O)C(=O)CO 527a_100000201218_100000210174 [1,0,2,0,0,0|1,0,0]=4 920 B15R1.1374 CCN(Cc1cccc(c1)O)C(=O)NC 2708a_100102657272_100000201218 [1,0,2,0,0,0|1,0,0]=4 921 B15R1.1374 CCN(Cc1cccc(c1)O)C(=O)NC 273464a_100102657272_100000201218 [1,0,2,0,0,0|1,0,0]=4 922 B15R1.5521 CCC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100000210414 [1,0,2,0,0,0|0,0,0]=3 923 B15R1.5521 CN(Cc1ccc(c(c1)O)O)C(=O)CO 240690a_100020587154_100000210174 [1,0,2,0,0,0|1,0,0]=4 924 B15R1.5521 CNC(=O)N(C)Cc1ccc(c(c1)O)O 273464a_100102657272_100020587154 [1,0,2,0,0,0|1,0,0]=4 925 B15R1.11 CCCC(=O)CCCc1ccc(cc1)O 1458a_100000116853_100000210303 [1,0,2,0,0,0|1,0,0]=4 926 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Br 11a_100000755846_100000211992 [1,0,2,0,0,0|1,0,0]=4 927 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Br 1626a_100000755846_100000211992 [1,0,2,0,0,0|1,0,0]=4 928 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Br 240690a_100000755846_100000211992 [1,0,2,0,0,0|1,0,0]=4 929 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Br 527a_100000755846_100000211992 [1,0,2,0,0,0|1,0,0]=4 930 B15R1.11 CCCC(=O)NCCc1ccc(cc1)C 11a_100000705350_100000211992 [1,0,2,0,0,0|1,0,0]=4 931 B15R1.11 CCCC(=O)NCCc1ccc(cc1)C 1626a_100000705350_100000211992 [1,0,2,0,0,0|1,0,0]=4 932 B15R1.11 CCCC(=O)NCCc1ccc(cc1)C 240690a_100000705350_100000211992 [1,0,2,0,0,0|1,0,0]=4 933 B15R1.11 CCCC(=O)NCCc1ccc(cc1)C 527a_100000705350_100000211992 [1,0,2,0,0,0|1,0,0]=4 934 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Cl 11a_100000185265_100000211992 [1,0,2,0,0,0|1,0,0]=4 935 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Cl 1626a_100000185265_100000211992 [1,0,2,0,0,0|1,0,0]=4 936 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Cl 240690a_100000185265_100000211992 [1,0,2,0,0,0|1,0,0]=4 937 B15R1.11 CCCC(=O)NCCc1ccc(cc1)Cl 527a_100000185265_100000211992 [1,0,2,0,0,0|1,0,0]=4 938 B15R1.11 CCCC(=O)NCCc1ccc(cc1)F 11a_100000199005_100000211992 [1,0,2,0,0,0|1,0,0]=4 939 B15R1.11 CCCC(=O)NCCc1ccc(cc1)F 1626a_100000199005_100000211992 [1,0,2,0,0,0|1,0,0]=4 940 B15R1.11 CCCC(=O)NCCc1ccc(cc1)F 240690a_100000199005_100000211992 [1,0,2,0,0,0|1,0,0]=4 941 B15R1.11 CCCC(=O)NCCc1ccc(cc1)F 527a_100000199005_100000211992 [1,0,2,0,0,0|1,0,0]=4 942 B15R1.11 CCCC(=O)NCCc1ccc(cc1)O 240690a_100000743037_100000211992 [1,0,2,0,0,0|0,0,0]=3 943 B15R1.11 CCCC(=O)NCCc1ccc(cc1)O 527a_100000743037_100000211992 [1,0,2,0,0,0|0,0,0]=3 944 B15R1.11 CCNC(=O)CCCc1ccc(cc1)Br 11a_100015525214_100011236545 [1,0,2,0,0,0|1,0,0]=4 945 B15R1.11 CCNC(=O)CCCc1ccc(cc1)Br 240690a_100015525214_100011236545 [1,0,2,0,0,0|1,0,0]=4 946 B15R1.11 CCNC(=O)CCCc1ccc(cc1)Br 527a_100015525214_100011236545 [1,0,2,0,0,0|1,0,0]=4 947 B15R1.11 CCNC(=O)CCCc1ccc(cc1)C 11a_100015525214_100000741418 [1,0,2,0,0,0|1,0,0]=4 948 B15R1.11 CCNC(=O)CCCc1ccc(cc1)C 240690a_100015525214_100000741418 [1,0,2,0,0,0|1,0,0]=4 949 B15R1.11 CCNC(=O)CCCc1ccc(cc1)C 527a_100015525214_100000741418 [1,0,2,0,0,0|1,0,0]=4 950 B15R1.11 CCNC(=O)CCCc1ccc(cc1)Cl 11a_100015525214_100000741339 [1,0,2,0,0,0|1,0,0]=4 951 B15R1.11 CCNC(=O)CCCc1ccc(cc1)Cl 240690a_100015525214_100000741339 [1,0,2,0,0,0|1,0,0]=4 952 B15R1.11 CCNC(=O)CCCc1ccc(cc1)Cl 527a_100015525214_100000741339 [1,0,2,0,0,0|1,0,0]=4 953 B15R1.11 CCNC(=O)CCCc1ccc(cc1)F 11a_100015525214_100011219804 [1,0,2,0,0,0|1,0,0]=4 954 B15R1.11 CCNC(=O)CCCc1ccc(cc1)F 240690a_100015525214_100011219804 [1,0,2,0,0,0|1,0,0]=4 955 B15R1.11 CCNC(=O)CCCc1ccc(cc1)F 527a_100015525214_100011219804 [1,0,2,0,0,0|1,0,0]=4 956 B15R1.11 CCNC(=O)CCCc1ccc(cc1)I 11a_100015525214_100011236544 [1,0,2,0,0,0|1,0,0]=4 957 B15R1.11 CCNC(=O)CCCc1ccc(cc1)I 240690a_100015525214_100011236544 [1,0,2,0,0,0|1,0,0]=4 958 B15R1.11 CCNC(=O)CCCc1ccc(cc1)I 527a_100015525214_100011236544 [1,0,2,0,0,0|1,0,0]=4 959 B15R1.11 CCNC(=O)CCCc1ccc(cc1)O 240690a_100015525214_100000116853 [1,0,2,0,0,0|0,0,0]=3 960 B15R1.11 CCNC(=O)CCCc1ccc(cc1)O 527a_100015525214_100000116853 [1,0,2,0,0,0|0,0,0]=3 961 B15R1.11 CCNC(=O)CCSc1ccc(cc1)O 62a_100000737597_100000185759 [1,0,2,0,0,0|1,0,0]=4 962 B15R1.11 CCNC(=O)CNCc1ccc(cc1)O 34a_100000185549_100000183381 [1,0,2,0,0,0|1,0,0]=4 963 B15R1.11 CCNC(=O)NCCc1ccc(cc1)O 2708a_100000743037_100015525214 [1,0,2,0,0,0|1,0,0]=4 964 B15R1.11 CCNC(=O)NCCc1ccc(cc1)O 2708a_100015525214_100000743037 [1,0,2,0,0,0|1,0,0]=4 965 B15R1.11 CCNC(=O)NCCc1ccc(cc1)O 273464a_100000743037_100015525214 [1,0,2,0,0,0|1,0,0]=4 966 B15R1.11 CCNC(=O)NCCc1ccc(cc1)O 273464a_100015525214_100000743037 [1,0,2,0,0,0|1,0,0]=4 967 B15R1.11 CCNC(=O)NCCc1ccc(cc1)O 512a_100015525214_100000743037 [1,0,2,0,0,0|1,0,0]=4 968 B15R1.11 CCOC(=O)CCCc1ccc(cc1)O 271570a_203496583355_100010203577 [1,0,2,0,0,0|1,0,0]=4 969 B15R1.11 CNNC(=O)CCCc1ccc(cc1)O 22a_100016993582_100000116853 [1,0,2,0,0,0|1,0,0]=4 970 B15R1.11 COCC(=O)NCCc1ccc(cc1)O 240690a_100000743037_100000210968 [1,0,2,0,0,0|1,0,0]=4 971 B15R1.11 COCC(=O)NCCc1ccc(cc1)O 527a_100000743037_100000210968 [1,0,2,0,0,0|1,0,0]=4 972 B15R1.11 CSCC(=O)NCCc1ccc(cc1)O 240690a_100000743037_100000184570 [1,0,2,0,0,0|1,0,0]=4 973 B15R1.11 CSCC(=O)NCCc1ccc(cc1)O 527a_100000743037_100000184570 [1,0,2,0,0,0|1,0,0]=4 974 B15R1.11 O=C(CCO)NCCc1ccc(cc1)O 240690a_100000743037_100011216618 [1,0,2,0,0,0|1,0,0]=4 975 B15R1.633 CCCC(=O)NCCc1cccc(c1)Br 11a_100011207229_100000211992 [1,0,2,0,0,0|1,0,0]=4 976 B15R1.633 CCCC(=O)NCCc1cccc(c1)Br 1626a_100011207229_100000211992 [1,0,2,0,0,0|1,0,0]=4 977 B15R1.633 CCCC(=O)NCCc1cccc(c1)Br 240690a_100011207229_100000211992 [1,0,2,0,0,0|1,0,0]=4 978 B15R1.633 CCCC(=O)NCCc1cccc(c1)Br 527a_100011207229_100000211992 [1,0,2,0,0,0|1,0,0]=4 979 B15R1.633 CCCC(=O)NCCc1cccc(c1)C 11a_100000749837_100000211992 [1,0,2,0,0,0|1,0,0]=4 980 B15R1.633 CCCC(=O)NCCc1cccc(c1)C 1626a_100000749837_100000211992 [1,0,2,0,0,0|1,0,0]=4 981 B15R1.633 CCCC(=O)NCCc1cccc(c1)C 240690a_100000749837_100000211992 [1,0,2,0,0,0|1,0,0]=4 982 B15R1.633 CCCC(=O)NCCc1cccc(c1)C 527a_100000749837_100000211992 [1,0,2,0,0,0|1,0,0]=4 983 B15R1.633 CCCC(=O)NCCc1cccc(c1)Cl 11a_100000185263_100000211992 [1,0,2,0,0,0|1,0,0]=4 984 B15R1.633 CCCC(=O)NCCc1cccc(c1)Cl 1626a_100000185263_100000211992 [1,0,2,0,0,0|1,0,0]=4 985 B15R1.633 CCCC(=O)NCCc1cccc(c1)Cl 240690a_100000185263_100000211992 [1,0,2,0,0,0|1,0,0]=4 986 B15R1.633 CCCC(=O)NCCc1cccc(c1)Cl 527a_100000185263_100000211992 [1,0,2,0,0,0|1,0,0]=4 987 B15R1.633 CCCC(=O)NCCc1cccc(c1)F 11a_100000205154_100000211992 [1,0,2,0,0,0|1,0,0]=4 988 B15R1.633 CCCC(=O)NCCc1cccc(c1)F 1626a_100000205154_100000211992 [1,0,2,0,0,0|1,0,0]=4 989 B15R1.633 CCCC(=O)NCCc1cccc(c1)F 240690a_100000205154_100000211992 [1,0,2,0,0,0|1,0,0]=4 990 B15R1.633 CCCC(=O)NCCc1cccc(c1)F 527a_100000205154_100000211992 [1,0,2,0,0,0|1,0,0]=4 991 B15R1.633 CCCC(=O)NCCc1cccc(c1)O 240690a_100000747277_100000211992 [1,0,2,0,0,0|0,0,0]=3 992 B15R1.633 CCCC(=O)NCCc1cccc(c1)O 527a_100000747277_100000211992 [1,0,2,0,0,0|0,0,0]=3 993 B15R1.633 CCCC(=O)NNCc1cccc(c1)O 22a_100000008902_100000211992 [1,0,2,0,0,0|1,0,0]=4 994 B15R1.633 CCNC(=O)CCCc1cccc(c1)Br 11a_100015525214_100000685939 [1,0,2,0,0,0|1,0,0]=4 995 B15R1.633 CCNC(=O)CCCc1cccc(c1)Br 240690a_100015525214_100000685939 [1,0,2,0,0,0|1,0,0]=4 996 B15R1.633 CCNC(=O)CCCc1cccc(c1)Br 527a_100015525214_100000685939 [1,0,2,0,0,0|1,0,0]=4 997 B15R1.633 CCNC(=O)CCSc1cccc(c1)O 62a_100000737597_100000211634 [1,0,2,0,0,0|1,0,0]=4 998 B15R1.633 CCNC(=O)CNCc1cccc(c1)O 2230a_100000743036_100000183381 [1,0,2,0,0,0|1,0,0]=4 999 B15R1.633 CCNC(=O)CNCc1cccc(c1)O 2230a_100016988866_100011660834 [1,0,2,0,0,0|1,0,0]=4 1000 B15R1.633 CCNC(=O)CNCc1cccc(c1)O 270004a_100016988866_100000188321 [1,0,2,0,0,0|1,0,0]=4 1001 B15R1.633 CCNC(=O)CNCc1cccc(c1)O 34a_100000743036_100000183381 [1,0,2,0,0,0|1,0,0]=4 1002 B15R1.633 CCNC(=O)CSCc1cccc(c1)O 62a_100000183381_100011660834 [1,0,2,0,0,0|1,0,0]=4 1003 B15R1.633 CCNC(=O)CSCc1cccc(c1)O 62a_100011660834_100000183381 [1,0,2,0,0,0|1,0,0]=4 1004 B15R1.633 CCNC(=O)NCCc1cccc(c1)O 2708a_100000747277_100015525214 [1,0,2,0,0,0|1,0,0]=4 1005 B15R1.633 CCNC(=O)NCCc1cccc(c1)O 2708a_100015525214_100000747277 [1,0,2,0,0,0|1,0,0]=4 1006 B15R1.633 CCNC(=O)NCCc1cccc(c1)O 273464a_100000747277_100015525214 [1,0,2,0,0,0|1,0,0]=4 1007 B15R1.633 CCNC(=O)NCCc1cccc(c1)O 273464a_100015525214_100000747277 [1,0,2,0,0,0|1,0,0]=4 1008 B15R1.633 CCNC(=O)NCCc1cccc(c1)O 512a_100000747277_100015525214 [1,0,2,0,0,0|1,0,0]=4 1009 B15R1.633 CCNC(=O)NCCc1cccc(c1)O 512a_100015525214_100000747277 [1,0,2,0,0,0|1,0,0]=4 1010 B15R1.633 COCC(=O)NCCc1cccc(c1)O 240690a_100000747277_100000210968 [1,0,2,0,0,0|1,0,0]=4 1011 B15R1.633 COCC(=O)NCCc1cccc(c1)O 527a_100000747277_100000210968 [1,0,2,0,0,0|1,0,0]=4 1012 B15R1.633 CSCC(=O)NCCc1cccc(c1)O 240690a_100000747277_100000184570 [1,0,2,0,0,0|1,0,0]=4 1013 B15R1.633 CSCC(=O)NCCc1cccc(c1)O 527a_100000747277_100000184570 [1,0,2,0,0,0|1,0,0]=4 1014 B15R1.633 O=C(CCO)NCCc1cccc(c1)O 240690a_100000747277_100011216618 [1,0,2,0,0,0|1,0,0]=4 1015 B15R1.11630 CCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000210414 [1,0,2,0,0,0|0,0,0]=3 1016 B15R1.11630 CCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000210414 [1,0,2,0,0,0|0,0,0]=3 1017 B15R1.11630 CNC(=O)CCNc1ccc(c(c1)O)O 34a_100102946323_100012179268 [1,0,2,0,0,0|1,0,0]=4 1018 B15R1.11630 CNC(=O)CCSc1ccc(c(c1)O)O 62a_100000737683_100009813601 [1,0,2,0,0,0|1,0,0]=4 1019 B15R1.11630 CNC(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000183359 [1,0,2,0,0,0|1,0,0]=4 1020 B15R1.11630 CNC(=O)NCCc1ccc(c(c1)O)O 2708a_100000210387_106832991635 [1,0,2,0,0,0|1,0,0]=4 1021 B15R1.11630 CNC(=O)NCCc1ccc(c(c1)O)O 273464a_100000210387_100102657272 [1,0,2,0,0,0|1,0,0]=4 1022 B15R1.11630 CNC(=O)NCCc1ccc(c(c1)O)O 273464a_100102657272_100000210387 [1,0,2,0,0,0|1,0,0]=4 1023 B15R1.11630 CNC(=O)NCCc1ccc(c(c1)O)O 512a_106832991638_100000210387 [1,0,2,0,0,0|1,0,0]=4 1024 B15R1.11630 O=C(CO)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000210174 [1,0,2,0,0,0|1,0,0]=4 1025 B15R1.11630 O=C(CO)NCCc1ccc(c(c1)O)O 527a_100000210387_100000210174 [1,0,2,0,0,0|1,0,0]=4 1026 B15R1.12032 C=CCCCNCc1ccc(c(c1)O)O 34a_100000010075_100000757094 [1,0,2,0,0,0|1,0,0]=4 1027 B15R1.12032 C=CCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000754431 [1,0,2,0,0,0|0,0,1]=4 1028 B15R1.12032 CCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000210210 [1,0,2,0,0,0|0,0,1]=4 1029 B15R1.12032 CCCCNCCc1ccc(c(c1)O)O 7a_106832991798_200010393615 [1,0,2,0,0,0|0,0,1]=4 1030 B15R1.12032 O=CCCCCSc1ccc(c(c1)O)O 62a_100000139335_100009813601 [1,0,2,0,0,0|1,0,0]=4 1031 B15R1.12032 OCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000230001 [1,0,2,0,0,0|0,0,1]=4 1032 B15R1.12032 Oc1ccc(cc1O)CCNCCCF 34a_100000210387_100011934791 [1,0,2,0,0,0|1,0,0]=4 1033 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Br 11a_100000752880_100000210414 [1,0,2,0,0,0|1,0,0]=4 1034 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Br 1626a_100000752880_100000210414 [1,0,2,0,0,0|1,0,0]=4 1035 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Br 240690a_100000752880_100000210414 [1,0,2,0,0,0|1,0,0]=4 1036 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Br 527a_100000752880_100000210414 [1,0,2,0,0,0|1,0,0]=4 1037 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Cl 11a_100000698262_100000210414 [1,0,2,0,0,0|1,0,0]=4 1038 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Cl 1626a_100000698262_100000210414 [1,0,2,0,0,0|1,0,0]=4 1039 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Cl 240690a_100000698262_100000210414 [1,0,2,0,0,0|1,0,0]=4 1040 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)Cl 527a_100000698262_100000210414 [1,0,2,0,0,0|1,0,0]=4 1041 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)F 11a_100102946585_100000210414 [1,0,2,0,0,0|1,0,0]=4 1042 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)F 1626a_100102946585_100000210414 [1,0,2,0,0,0|1,0,0]=4 1043 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)F 240690a_100102946585_100000210414 [1,0,2,0,0,0|1,0,0]=4 1044 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)F 527a_100102946585_100000210414 [1,0,2,0,0,0|1,0,0]=4 1045 B15R1.1001 CCC(=O)N(C)CCc1ccc(cc1)O 240690a_100016989440_100000210414 [1,0,2,0,0,0|0,0,0]=3 1046 B15R1.1001 CN(CCc1ccc(cc1)O)C(=O)CO 240690a_100016989440_100000210174 [1,0,2,0,0,0|1,0,0]=4 1047 B15R1.1001 CNC(=O)N(C)CCc1ccc(cc1)O 2708a_100102657272_100016989440 [1,0,2,0,0,0|1,0,0]=4 1048 B15R1.1001 CNC(=O)N(C)CCc1ccc(cc1)O 273464a_100102657272_100016989440 [1,0,2,0,0,0|1,0,0]=4 1049 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)C 11a_114849113767_100000210414 [1,0,2,0,0,0|1,0,0]=4 1050 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)C 1626a_114849113767_100000210414 [1,0,2,0,0,0|1,0,0]=4 1051 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)C 240690a_114849113767_100000210414 [1,0,2,0,0,0|1,0,0]=4 1052 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)C 527a_114849113767_100000210414 [1,0,2,0,0,0|1,0,0]=4 1053 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)Cl 11a_106726388433_100000210414 [1,0,2,0,0,0|1,0,0]=4 1054 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)Cl 1626a_106726388433_100000210414 [1,0,2,0,0,0|1,0,0]=4 1055 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)Cl 240690a_106726388433_100000210414 [1,0,2,0,0,0|1,0,0]=4 1056 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)Cl 527a_106726388433_100000210414 [1,0,2,0,0,0|1,0,0]=4 1057 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)F 11a_106726388868_100000210414 [1,0,2,0,0,0|1,0,0]=4 1058 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)F 1626a_106726388868_100000210414 [1,0,2,0,0,0|1,0,0]=4 1059 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)F 240690a_106726388868_100000210414 [1,0,2,0,0,0|1,0,0]=4 1060 B15R1.1002 CCC(=O)N(C)CCc1cccc(c1)F 527a_106726388868_100000210414 [1,0,2,0,0,0|1,0,0]=4 1061 B15R1.10390 CCCC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_100000210303 [1,0,2,0,0,0|1,0,0]=4 1062 B15R1.10390 CCCC(=O)CCc1ccc(c(c1)O)O 1458a_100000211992_200010393615 [1,0,2,0,0,0|1,0,0]=4 1063 B15R1.10390 CCCN(C)CCc1ccc(c(c1)O)O 269982a_100000747261_200010393615 [1,0,2,0,0,0|0,0,1]=4 1064 B15R1.8626 CCN(CC)CCc1ccc(c(c1)O)O 269956a_100000042499_200010393615 [1,0,2,0,0,0|0,0,1]=4 1065 B15R1.8626 CCN(CC)CCc1ccc(c(c1)O)O 269982a_100000724800_200010393615 [1,0,2,0,0,0|0,0,1]=4 1066 B15R1.12 C=CCCCNCCc1ccc(cc1)O 2230a_100000700776_100009816426 [1,0,2,0,0,0|1,0,0]=4 1067 B15R1.12 C=CCCCNCCc1ccc(cc1)O 34a_100000743037_100000757094 [1,0,2,0,0,0|1,0,0]=4 1068 B15R1.12 Cc1ccc(cc1)CCNCCCC=O 2230a_100000705350_200011292268 [1,0,2,0,0,0|1,0,0]=4 1069 B15R1.12 O=CCCCNCCc1ccc(cc1)Br 2230a_100000755846_200011292268 [1,0,2,0,0,0|1,0,0]=4 1070 B15R1.12 O=CCCCNCCc1ccc(cc1)Cl 2230a_100000185265_200011292268 [1,0,2,0,0,0|1,0,0]=4 1071 B15R1.12 O=CCCCNCCc1ccc(cc1)F 2230a_100000199005_200011292268 [1,0,2,0,0,0|1,0,0]=4 1072 B15R1.12 O=CCCCSCCc1ccc(cc1)O 62a_100009816426_200011292268 [1,0,2,0,0,0|1,0,0]=4 1073 B15R1.12 O=CCCCSCCc1ccc(cc1)O 62a_200011292268_100009816426 [1,0,2,0,0,0|1,0,0]=4 1074 B15R1.106 C=CCCCNCCc1cccc(c1)O 2230a_100000747277_100011713584 [1,0,2,0,0,0|1,0,0]=4 1075 B15R1.106 C=CCCCNCCc1cccc(c1)O 34a_100000747277_100000757094 [1,0,2,0,0,0|1,0,0]=4 1076 B15R1.106 Cc1cccc(c1)CCNCCCC=O 2230a_100000749837_200011292268 [1,0,2,0,0,0|1,0,0]=4 1077 B15R1.106 O=CCCCNCCc1cccc(c1)Br 2230a_100011207229_200011292268 [1,0,2,0,0,0|1,0,0]=4 1078 B15R1.106 O=CCCCNCCc1cccc(c1)Cl 2230a_100000185263_200011292268 [1,0,2,0,0,0|1,0,0]=4 1079 B15R1.106 O=CCCCNCCc1cccc(c1)F 2230a_100000205154_200011292268 [1,0,2,0,0,0|1,0,0]=4 1080 B15R1.106 O=CCCCNCCc1cccc(c1)O 2230a_100000747277_200011292268 [1,0,2,0,0,0|0,0,0]=3 1081 B15R1.3175 CCC(=O)NCCc1cc(ccc1C)C 11a_200011485678_100000210414 [1,0,2,0,0,0|1,0,0]=4 1082 B15R1.3175 CCC(=O)NCCc1cc(ccc1C)C 1626a_200011485678_100000210414 [1,0,2,0,0,0|1,0,0]=4 1083 B15R1.3175 CCC(=O)NCCc1cc(ccc1C)C 240690a_200011485678_100000210414 [1,0,2,0,0,0|1,0,0]=4 1084 B15R1.3175 CCC(=O)NCCc1cc(ccc1C)C 527a_200011485678_100000210414 [1,0,2,0,0,0|1,0,0]=4 1085 B15R1.3175 CNC(=O)CCNc1cc(ccc1C)O 34a_100011216113_100012179268 [1,0,2,0,0,0|1,0,0]=4 1086 B15R1.3175 CNC(=O)CCSc1cc(ccc1C)O 62a_100000737683_100011380479 [1,0,2,0,0,0|1,0,0]=4 1087 B15R1.3175 CNC(=O)CCSc1cc(ccc1C)O 62a_100011380479_100000737683 [1,0,2,0,0,0|1,0,0]=4 1088 B15R1.3175 CNC(=O)CNCc1cc(ccc1C)O 34a_200009844824_100000183359 [1,0,2,0,0,0|1,0,0]=4 1089 B15R1.3836 CCC(=O)NCCc1ccc(cc1C)C 11a_100000745621_100000210414 [1,0,2,0,0,0|1,0,0]=4 1090 B15R1.3836 CCC(=O)NCCc1ccc(cc1C)C 1626a_100000745621_100000210414 [1,0,2,0,0,0|1,0,0]=4 1091 B15R1.3836 CCC(=O)NCCc1ccc(cc1C)C 240690a_100000745621_100000210414 [1,0,2,0,0,0|1,0,0]=4 1092 B15R1.3836 CCC(=O)NCCc1ccc(cc1C)C 527a_100000745621_100000210414 [1,0,2,0,0,0|1,0,0]=4 1093 B15R1.3836 CNC(=O)CCNc1ccc(cc1C)O 34a_100000756630_100012179268 [1,0,2,0,0,0|1,0,0]=4 1094 B15R1.3836 CNC(=O)CCSc1ccc(cc1C)O 62a_100000737683_100000690111 [1,0,2,0,0,0|1,0,0]=4 1095 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 11a_106744473289_100000210414 [1,0,2,0,0,0|1,0,0]=4 1096 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 1626a_106744473289_100000210414 [1,0,2,0,0,0|1,0,0]=4 1097 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 240690a_106744473289_100000210414 [1,0,2,0,0,0|1,0,0]=4 1098 B15R1.5513 CCC(=O)N(C)Cc1cc(ccc1C)Br 527a_106744473289_100000210414 [1,0,2,0,0,0|1,0,0]=4 1099 B15R1.14339 CCC(=O)N(C)Cc1ccc(cc1C)C 11a_100025771030_100000210414 [1,0,2,0,0,0|1,0,0]=4 1100 B15R1.14339 CCC(=O)N(C)Cc1ccc(cc1C)C 1626a_100025771030_100000210414 [1,0,2,0,0,0|1,0,0]=4 1101 B15R1.14339 CCC(=O)N(C)Cc1ccc(cc1C)C 240690a_100025771030_100000210414 [1,0,2,0,0,0|1,0,0]=4 1102 B15R1.14339 CCC(=O)N(C)Cc1ccc(cc1C)C 527a_100025771030_100000210414 [1,0,2,0,0,0|1,0,0]=4 1103 B15R2.100 Oc1ccc(cc1)CCN2CCCC2 2230a_100000188435_100009816426 [2,0,1,0,0,0|0,0,1]=4 1104 B15R2.100 Oc1ccc(cc1)CCN2CCCC2 269982a_100000188435_100009816426 [2,0,1,0,0,0|0,0,1]=4 1105 B15R2.55 O=C1CCCN1CSc2ccccc2 62a_100000026320_100000041952 [2,0,1,0,0,0|1,0,0]=4 1106 B15R2.55 O=C1CCCN1CSc2ccccc2 62a_100000719477_100000026320 [2,0,1,0,0,0|1,0,0]=4 1107 B15R2.7174 CC(=O)C1CCc2ccc(cc2C1)O 1458a_100000087082_200000210301 [2,0,1,0,0,0|1,0,0]=4 1108 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Br 11a_100015189961_100015343762 [2,0,1,0,0,0|1,0,0]=4 1109 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_100015343762 [2,0,1,0,0,0|1,0,0]=4 1110 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100015343762 [2,0,1,0,0,0|1,0,0]=4 1111 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Br 527a_100015189961_100103153847 [2,0,1,0,0,0|1,0,0]=4 1112 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)C 11a_100011255368_100015343762 [2,0,1,0,0,0|1,0,0]=4 1113 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)C 1626a_100011255368_100015343762 [2,0,1,0,0,0|1,0,0]=4 1114 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)C 240690a_100011255368_100015343762 [2,0,1,0,0,0|1,0,0]=4 1115 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)C 527a_100011255368_100103153847 [2,0,1,0,0,0|1,0,0]=4 1116 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Cl 11a_100000690163_100015343762 [2,0,1,0,0,0|1,0,0]=4 1117 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_100015343762 [2,0,1,0,0,0|1,0,0]=4 1118 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100015343762 [2,0,1,0,0,0|1,0,0]=4 1119 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100103153847 [2,0,1,0,0,0|1,0,0]=4 1120 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)F 11a_100000755980_100015343762 [2,0,1,0,0,0|1,0,0]=4 1121 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_100015343762 [2,0,1,0,0,0|1,0,0]=4 1122 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100015343762 [2,0,1,0,0,0|1,0,0]=4 1123 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)F 527a_100000755980_100103153847 [2,0,1,0,0,0|1,0,0]=4 1124 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100015343762 [2,0,1,0,0,0|0,0,0]=3 1125 B15R2.7174 CC(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100103153847 [2,0,1,0,0,0|0,0,0]=3 1126 B15R2.7174 [13CH3]C(=O)C1CCc2ccc(cc2C1)O 1458a_100000087082_200025704644 [2,0,1,0,0,0|1,0,0]=4 1127 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Br 11a_100000686056_100015343762 [2,0,1,0,0,0|1,0,0]=4 1128 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_100015343762 [2,0,1,0,0,0|1,0,0]=4 1129 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100015343762 [2,0,1,0,0,0|1,0,0]=4 1130 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Br 527a_100000686056_100103153847 [2,0,1,0,0,0|1,0,0]=4 1131 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)C 11a_100000718575_100015343762 [2,0,1,0,0,0|1,0,0]=4 1132 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)C 1626a_100000718575_100015343762 [2,0,1,0,0,0|1,0,0]=4 1133 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)C 240690a_100000718575_100015343762 [2,0,1,0,0,0|1,0,0]=4 1134 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)C 527a_100000718575_100103153847 [2,0,1,0,0,0|1,0,0]=4 1135 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Cl 11a_100011273784_100015343762 [2,0,1,0,0,0|1,0,0]=4 1136 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_100015343762 [2,0,1,0,0,0|1,0,0]=4 1137 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100015343762 [2,0,1,0,0,0|1,0,0]=4 1138 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100103153847 [2,0,1,0,0,0|1,0,0]=4 1139 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)F 11a_100011273785_100015343762 [2,0,1,0,0,0|1,0,0]=4 1140 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_100015343762 [2,0,1,0,0,0|1,0,0]=4 1141 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100015343762 [2,0,1,0,0,0|1,0,0]=4 1142 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)F 527a_100011273785_100103153847 [2,0,1,0,0,0|1,0,0]=4 1143 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100015343762 [2,0,1,0,0,0|0,0,0]=3 1144 B15R2.7180 CC(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100103153847 [2,0,1,0,0,0|0,0,0]=3 1145 B15R2.21336 CCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000210202 [2,0,1,0,0,0|0,0,0]=3 1146 B15R2.21336 Oc1cc2c(cc1O)CN(CC2)CF 34a_200015384465_100015361967 [2,0,1,0,0,0|1,0,0]=4 1147 B15R2.627 CC(=O)N1CCc2ccccc2C1C 11a_100011660714_100015343762 [2,0,1,0,0,0|0,0,0]=3 1148 B15R2.627 CC(=O)N1CCc2ccccc2C1C 1626a_100011660714_100015343762 [2,0,1,0,0,0|0,0,0]=3 1149 B15R2.627 CC(=O)N1CCc2ccccc2C1C 240690a_100011660714_100015343762 [2,0,1,0,0,0|0,0,0]=3 1150 B15R2.627 CC(=O)N1CCc2ccccc2C1C 527a_100011660714_100103153847 [2,0,1,0,0,0|0,0,0]=3 1151 B15R2.13981 CC1c2cc(c(cc2CCN1C)O)O 2230a_100000735813_200000210301 [2,0,1,0,0,0|0,0,0]=3 1152 B15R2.13981 CC1c2cc(c(cc2CCN1[13CH3])O)O 2230a_100000735813_200025704644 [2,0,1,0,0,0|0,0,0]=3 1153 B15R2.1282 CCCN1CCc2ccc(cc2C1)O 2230a_100015185785_100000210303 [2,0,1,0,0,0|0,0,1]=4 1154 B15R2.1282 CCCN1CCc2ccc(cc2C1)O 269982a_100015185785_100000210303 [2,0,1,0,0,0|0,0,1]=4 1155 B15R2.1282 CCCN1CCc2ccc(cc2C1)O 34a_100015185785_100000210303 [2,0,1,0,0,0|0,0,1]=4 1156 B15R2.1601 CCC(=O)C1CCc2ccccc2C1 1458a_100011217706_100000210202 [2,0,1,0,0,0|1,0,0]=4 1157 B15R2.1601 CCC(=O)N1CCc2ccccc2C1 11a_100000188457_100000210414 [2,0,1,0,0,0|0,0,0]=3 1158 B15R2.1601 CCC(=O)N1CCc2ccccc2C1 1626a_100000188457_100000210414 [2,0,1,0,0,0|0,0,0]=3 1159 B15R2.1601 CCC(=O)N1CCc2ccccc2C1 240690a_100000188457_100000210414 [2,0,1,0,0,0|0,0,0]=3 1160 B15R2.1601 CCC(=O)N1CCc2ccccc2C1 527a_100000188457_100000210414 [2,0,1,0,0,0|0,0,0]=3 1161 B15R2.1601 CCC(=O)N1CCc2cccnc2C1 11a_100015206102_100000210414 [2,0,1,0,0,0|1,0,0]=4 1162 B15R2.1601 CCC(=O)N1CCc2cccnc2C1 1626a_100015206102_100000210414 [2,0,1,0,0,0|1,0,0]=4 1163 B15R2.1601 CCC(=O)N1CCc2cccnc2C1 240690a_100015206102_100000210414 [2,0,1,0,0,0|1,0,0]=4 1164 B15R2.1601 CCC(=O)N1CCc2cccnc2C1 527a_100015206102_100000210414 [2,0,1,0,0,0|1,0,0]=4 1165 B15R2.1601 CCC(=O)N1CCc2ccncc2C1 11a_100015190008_100000210414 [2,0,1,0,0,0|1,0,0]=4 1166 B15R2.1601 CCC(=O)N1CCc2ccncc2C1 240690a_100015190008_100000210414 [2,0,1,0,0,0|1,0,0]=4 1167 B15R2.1601 CCC(=O)N1CCc2ccncc2C1 527a_100015190008_100000210414 [2,0,1,0,0,0|1,0,0]=4 1168 B15R2.1601 CCC(=O)N1CCc2cnccc2C1 11a_100020645890_100000210414 [2,0,1,0,0,0|1,0,0]=4 1169 B15R2.1601 CCC(=O)N1CCc2cnccc2C1 240690a_100020645890_100000210414 [2,0,1,0,0,0|1,0,0]=4 1170 B15R2.1601 CCC(=O)N1CCc2cnccc2C1 527a_100020645890_100000210414 [2,0,1,0,0,0|1,0,0]=4 1171 B15R2.1601 CCC(=O)N1CCc2ncccc2C1 11a_100000699647_100000210414 [2,0,1,0,0,0|1,0,0]=4 1172 B15R2.1601 CCC(=O)N1CCc2ncccc2C1 240690a_100000699647_100000210414 [2,0,1,0,0,0|1,0,0]=4 1173 B15R2.1601 CCC(=O)N1CCc2ncccc2C1 527a_100000699647_100000210414 [2,0,1,0,0,0|1,0,0]=4 1174 B15R2.1601 CNC(=O)N1CCc2ccccc2C1 2708a_100102657272_100000188457 [2,0,1,0,0,0|1,0,0]=4 1175 B15R2.1601 CNC(=O)N1CCc2ccccc2C1 273464a_100102657272_100000188457 [2,0,1,0,0,0|1,0,0]=4 1176 B15R2.1601 O=C(CO)N1CCc2ccccc2C1 240690a_100000188457_100000210174 [2,0,1,0,0,0|1,0,0]=4 1177 B15R2.1601 O=C(CO)N1CCc2ccccc2C1 527a_100000188457_100000210174 [2,0,1,0,0,0|1,0,0]=4 1178 B15R2.10252 CCCN1CCc2cc(ccc2C1)O 2230a_100000077532_100000210303 [2,0,1,0,0,0|0,0,1]=4 1179 B15R2.10252 CCCN1CCc2cc(ccc2C1)O 269982a_100000077532_100000210303 [2,0,1,0,0,0|0,0,1]=4 1180 B15R2.10252 CCCN1CCc2cc(ccc2C1)O 34a_100000077532_100000210303 [2,0,1,0,0,0|0,0,1]=4 1181 B17R1.954 CCNC(=O)CCSc1cc(c(c(c1)F)O)O 62a_100000737597_100010114375 [0,1,2,0,0,0|1,0,0]=4 1182 B17R1.954 CCNC(=O)CCSc1cc(c(c(c1)O)O)O 62a_100000737597_100010658518 [0,1,2,0,0,0|1,0,0]=4 1183 B17R1.1070 CC(C)CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000210554 [0,1,2,0,0,0|0,0,0]=3 1184 B17R1.1070 CC(C)CC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000210554 [0,1,2,0,0,0|0,0,0]=3 1185 B17R1.1070 CC(C)NC(=O)CCSc1ccc(c(c1)O)O 62a_100000737564_100009813601 [0,1,2,0,0,0|1,0,0]=4 1186 B17R1.1070 CC(C)NC(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000183996 [0,1,2,0,0,0|1,0,0]=4 1187 B17R1.1070 CC(C)NC(=O)NCCc1ccc(c(c1)O)O 2708a_100000210387_100138425928 [0,1,2,0,0,0|1,0,0]=4 1188 B17R1.1070 CC(C)NC(=O)NCCc1ccc(c(c1)O)O 273464a_100138425928_100000210387 [0,1,2,0,0,0|1,0,0]=4 1189 B17R1.1070 CC(C)NC(=O)NCCc1ccc(c(c1)O)O 512a_100138425928_100000210387 [0,1,2,0,0,0|1,0,0]=4 1190 B17R1.1070 CN(C)CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000750896 [0,1,2,0,0,0|1,0,0]=4 1191 B17R1.1070 CN(C)CC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000750896 [0,1,2,0,0,0|1,0,0]=4 1192 B17R1.1070 C[C@@H](O)CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100011933948 [0,1,2,0,0,0|0,0,0]=3 1193 B17R1.1070 C[S+](C)CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_200159257847 [0,1,2,0,0,0|1,0,0]=4 1194 B17R1.1070 C[S+](C)CC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_200159257847 [0,1,2,0,0,0|1,0,0]=4 1195 B17R1.2208 CCC(C)C(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100011192722 [0,1,2,0,0,0|0,0,0]=3 1196 B17R1.2208 CCC(C)C(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100011192722 [0,1,2,0,0,0|0,0,0]=3 1197 B17R1.2208 CCC(O)C(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100011196387 [0,1,2,0,0,0|0,0,0]=3 1198 B17R1.2208 CCN(C)C(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000738999 [0,1,2,0,0,0|1,0,0]=4 1199 B17R1.2208 CCN(C)C(=O)NCCc1ccc(c(c1)O)O 2708a_100000210387_100000225621 [0,1,2,0,0,0|1,0,0]=4 1200 B17R1.2208 CCN(C)C(=O)NCCc1ccc(c(c1)O)O 273464a_100000210387_100000225621 [0,1,2,0,0,0|1,0,0]=4 1201 B17R1.2208 COC(C)C(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000743197 [0,1,2,0,0,0|1,0,0]=4 1202 B17R1.2208 COC(C)C(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000743197 [0,1,2,0,0,0|1,0,0]=4 1203 B17R1.2208 CSC(C)C(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000149566 [0,1,2,0,0,0|1,0,0]=4 1204 B17R1.2208 CSC(C)C(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000149566 [0,1,2,0,0,0|1,0,0]=4 1205 B17R1.2208 O=C(NCCc1ccc(c(c1)O)O)C(O)CO 240690a_100000210387_100011215603 [0,1,2,0,0,0|1,0,0]=4 1206 B17R1.6636 CCCC(=O)NCC(O)c1ccc(c(c1)O)O 527a_100000106456_100000211992 [0,1,2,0,0,0|0,0,0]=3 1207 B17R1.6636 CCNC(=O)NCC(O)c1ccc(c(c1)O)O 273464a_100000106456_100015525214 [0,1,2,0,0,0|1,0,0]=4 1208 B17R1.6636 CCNC(=O)NCC(O)c1ccc(c(c1)O)O 273464a_100015525214_100000106456 [0,1,2,0,0,0|1,0,0]=4 1209 B17R1.6636 CCNC(=O)NCC(O)c1ccc(c(c1)O)O 512a_100015525214_100000106456 [0,1,2,0,0,0|1,0,0]=4 1210 B17R1.6636 COCC(=O)NCC(O)c1ccc(c(c1)O)O 527a_100000106456_100000210968 [0,1,2,0,0,0|1,0,0]=4 1211 B17R1.6636 CSCC(=O)NCC(O)c1ccc(c(c1)O)O 527a_100000106456_100000184570 [0,1,2,0,0,0|1,0,0]=4 1212 B17R1.21663 CCCC(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000211992 [0,1,2,0,0,0|0,0,0]=3 1213 B17R1.21663 CCCC(=O)NCCc1cc(c(cc1O)O)O 527a_200000106461_100000211992 [0,1,2,0,0,0|0,0,0]=3 1214 B17R1.21663 CCNC(=O)NCCc1cc(c(cc1O)O)O 273464a_100015525214_200000106461 [0,1,2,0,0,0|1,0,0]=4 1215 B17R1.21663 CCNC(=O)NCCc1cc(c(cc1O)O)O 273464a_200000106461_100015525214 [0,1,2,0,0,0|1,0,0]=4 1216 B17R1.21663 COCC(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000210968 [0,1,2,0,0,0|1,0,0]=4 1217 B17R1.21663 COCC(=O)NCCc1cc(c(cc1O)O)O 527a_200000106461_100000210968 [0,1,2,0,0,0|1,0,0]=4 1218 B17R1.21663 CSCC(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000184570 [0,1,2,0,0,0|1,0,0]=4 1219 B17R1.21663 CSCC(=O)NCCc1cc(c(cc1O)O)O 527a_200000106461_100000184570 [0,1,2,0,0,0|1,0,0]=4 1220 B17R1.21663 O=C(CCO)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100011216618 [0,1,2,0,0,0|1,0,0]=4 1221 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Br)OC 11a_103549771065_100000211992 [0,1,2,0,0,0|1,0,0]=4 1222 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Br)OC 1626a_103549771065_100000211992 [0,1,2,0,0,0|1,0,0]=4 1223 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Br)OC 240690a_103549771065_100000211992 [0,1,2,0,0,0|1,0,0]=4 1224 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Br)OC 527a_103549771065_100000211992 [0,1,2,0,0,0|1,0,0]=4 1225 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Cl)OC 11a_100025770840_100000211992 [0,1,2,0,0,0|1,0,0]=4 1226 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Cl)OC 1626a_100025770840_100000211992 [0,1,2,0,0,0|1,0,0]=4 1227 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Cl)OC 240690a_100025770840_100000211992 [0,1,2,0,0,0|1,0,0]=4 1228 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)Cl)OC 527a_100025770840_100000211992 [0,1,2,0,0,0|1,0,0]=4 1229 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)O)OC 240690a_100011207234_100000211992 [0,1,2,0,0,0|0,0,0]=3 1230 B17R1.21665 CCCC(=O)NCCc1ccc(c(c1)O)OC 527a_100011207234_100000211992 [0,1,2,0,0,0|0,0,0]=3 1231 B17R1.21665 CCNC(=O)CCSc1ccc(c(c1)O)CO 62a_100000071718_100000737597 [0,1,2,0,0,0|1,0,0]=4 1232 B17R1.21665 CCNC(=O)CCSc1ccc(c(c1)O)CO 62a_100000737597_100000071718 [0,1,2,0,0,0|1,0,0]=4 1233 B17R1.21665 CCNC(=O)CCSc1ccc(c(c1)O)OC 62a_100000737597_100009816560 [0,1,2,0,0,0|1,0,0]=4 1234 B17R1.21665 CCNC(=O)CNCc1ccc(c(c1)O)OC 34a_100000740000_100000183381 [0,1,2,0,0,0|1,0,0]=4 1235 B17R1.21665 CCNC(=O)NCCc1ccc(c(c1)O)OC 2708a_100011207234_100015525214 [0,1,2,0,0,0|1,0,0]=4 1236 B17R1.21665 CCNC(=O)NCCc1ccc(c(c1)O)OC 2708a_100015525214_100011207234 [0,1,2,0,0,0|1,0,0]=4 1237 B17R1.21665 CCNC(=O)NCCc1ccc(c(c1)O)OC 273464a_100011207234_100015525214 [0,1,2,0,0,0|1,0,0]=4 1238 B17R1.21665 CCNC(=O)NCCc1ccc(c(c1)O)OC 273464a_100015525214_100011207234 [0,1,2,0,0,0|1,0,0]=4 1239 B17R1.21665 CCNC(=O)NCCc1ccc(c(c1)O)OC 512a_100011207234_100015525214 [0,1,2,0,0,0|1,0,0]=4 1240 B17R1.21665 CCNC(=O)NCCc1ccc(c(c1)O)OC 512a_100015525214_100011207234 [0,1,2,0,0,0|1,0,0]=4 1241 B17R1.21665 COCC(=O)NCCc1ccc(c(c1)O)OC 240690a_100011207234_100000210968 [0,1,2,0,0,0|1,0,0]=4 1242 B17R1.21665 COCC(=O)NCCc1ccc(c(c1)O)OC 527a_100011207234_100000210968 [0,1,2,0,0,0|1,0,0]=4 1243 B17R1.21665 COc1ccc(cc1O)CCNC(=O)CCO 240690a_100011207234_100011216618 [0,1,2,0,0,0|1,0,0]=4 1244 B17R1.21665 COc1ccc(cc1O)CCNC(=O)CSC 240690a_100011207234_100000184570 [0,1,2,0,0,0|1,0,0]=4 1245 B17R1.21665 COc1ccc(cc1O)CCNC(=O)CSC 527a_100011207234_100000184570 [0,1,2,0,0,0|1,0,0]=4 1246 B17R1.21666 CCCC(=O)NCCc1ccc(c(c1)OC)O 240690a_100000756042_100000211992 [0,1,2,0,0,0|0,0,0]=3 1247 B17R1.21666 CCCC(=O)NCCc1ccc(c(c1)OC)O 527a_100000756042_100000211992 [0,1,2,0,0,0|0,0,0]=3 1248 B17R1.21666 CCNC(=O)CCSc1ccc(c(c1)CO)O 62a_100000184703_100000737597 [0,1,2,0,0,0|1,0,0]=4 1249 B17R1.21666 CCNC(=O)CCSc1ccc(c(c1)CO)O 62a_100000737597_100000184703 [0,1,2,0,0,0|1,0,0]=4 1250 B17R1.21666 CCNC(=O)CCSc1ccc(c(c1)OC)O 62a_100000737597_100000694246 [0,1,2,0,0,0|1,0,0]=4 1251 B17R1.21666 CCNC(=O)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000183381 [0,1,2,0,0,0|1,0,0]=4 1252 B17R1.21666 CCNC(=O)NCCc1ccc(c(c1)OC)O 2708a_100000756042_100015525214 [0,1,2,0,0,0|1,0,0]=4 1253 B17R1.21666 CCNC(=O)NCCc1ccc(c(c1)OC)O 2708a_100015525214_100000756042 [0,1,2,0,0,0|1,0,0]=4 1254 B17R1.21666 CCNC(=O)NCCc1ccc(c(c1)OC)O 273464a_100000756042_100015525214 [0,1,2,0,0,0|1,0,0]=4 1255 B17R1.21666 CCNC(=O)NCCc1ccc(c(c1)OC)O 273464a_100015525214_100000756042 [0,1,2,0,0,0|1,0,0]=4 1256 B17R1.21666 CCNC(=O)NCCc1ccc(c(c1)OC)O 512a_100000756042_100015525214 [0,1,2,0,0,0|1,0,0]=4 1257 B17R1.21666 CCNC(=O)NCCc1ccc(c(c1)OC)O 512a_100015525214_100000756042 [0,1,2,0,0,0|1,0,0]=4 1258 B17R1.21666 COCC(=O)NCCc1ccc(c(c1)OC)O 240690a_100000756042_100000210968 [0,1,2,0,0,0|1,0,0]=4 1259 B17R1.21666 COCC(=O)NCCc1ccc(c(c1)OC)O 527a_100000756042_100000210968 [0,1,2,0,0,0|1,0,0]=4 1260 B17R1.21666 COc1cc(ccc1O)CCNC(=O)CCO 240690a_100000756042_100011216618 [0,1,2,0,0,0|1,0,0]=4 1261 B17R1.21666 COc1cc(ccc1O)CCNC(=O)CSC 240690a_100000756042_100000184570 [0,1,2,0,0,0|1,0,0]=4 1262 B17R1.21666 COc1cc(ccc1O)CCNC(=O)CSC 527a_100000756042_100000184570 [0,1,2,0,0,0|1,0,0]=4 1263 B17R1.21827 CCNC(=O)CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000183381 [0,1,2,0,0,0|0,0,1]=4 1264 B17R1.22095 CCNC(=O)C(=O)CCc1ccc(c(c1)O)O 1458a_200011297158_200010393615 [0,1,2,0,0,0|0,0,1]=4 1265 B17R1.22095 CCNC(=O)C(C)NCc1ccc(c(c1)O)O 34a_100000010075_100000230173 [0,1,2,0,0,0|1,0,0]=4 1266 B17R1.30229 C#CCCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000692101 [0,1,2,0,0,0|0,0,1]=4 1267 B17R1.30229 C#CCCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000692101 [0,1,2,0,0,0|0,0,1]=4 1268 B17R1.30229 C=CCCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000749702 [0,1,2,0,0,0|0,0,1]=4 1269 B17R1.30229 C=CCCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000749702 [0,1,2,0,0,0|0,0,1]=4 1270 B17R1.30229 CC=CCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100121576822 [0,1,2,0,0,0|0,0,1]=4 1271 B17R1.30229 CC=CCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100121576822 [0,1,2,0,0,0|0,0,1]=4 1272 B17R1.30229 CCC=CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000212282 [0,1,2,0,0,0|0,0,1]=4 1273 B17R1.30229 CCCCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000210183 [0,1,2,0,0,0|0,0,0]=3 1274 B17R1.30229 CCCCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000210183 [0,1,2,0,0,0|0,0,0]=3 1275 B17R1.30229 CCCNC(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000183358 [0,1,2,0,0,0|1,0,0]=4 1276 B17R1.30229 CCCNC(=O)NCCc1ccc(c(c1)O)O 2708a_100000210387_100020643023 [0,1,2,0,0,0|0,0,0]=3 1277 B17R1.30229 CCCNC(=O)NCCc1ccc(c(c1)O)O 273464a_100000210387_100020643023 [0,1,2,0,0,0|0,0,0]=3 1278 B17R1.30229 CCCNC(=O)NCCc1ccc(c(c1)O)O 273464a_100020643023_100000210387 [0,1,2,0,0,0|0,0,0]=3 1279 B17R1.30229 CCCNC(=O)NCCc1ccc(c(c1)O)O 512a_100020643023_100000210387 [0,1,2,0,0,0|0,0,0]=3 1280 B17R1.30229 CCNNC(=O)NCCc1ccc(c(c1)O)O 273464a_100000210387_100000756455 [0,1,2,0,0,0|1,0,0]=4 1281 B17R1.30229 CCNNC(=O)NCCc1ccc(c(c1)O)O 512a_100000756455_100000210387 [0,1,2,0,0,0|1,0,0]=4 1282 B17R1.30229 CCOCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000211967 [0,1,2,0,0,0|0,0,0]=3 1283 B17R1.30229 CCOCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000211967 [0,1,2,0,0,0|0,0,0]=3 1284 B17R1.30229 CCSCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000230394 [0,1,2,0,0,0|0,0,0]=3 1285 B17R1.30229 CCSCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000230394 [0,1,2,0,0,0|0,0,0]=3 1286 B17R1.30229 COCCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000749529 [0,1,2,0,0,0|0,0,0]=3 1287 B17R1.30229 COCCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000749529 [0,1,2,0,0,0|0,0,0]=3 1288 B17R1.30229 CSCCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100000174002 [0,1,2,0,0,0|0,0,0]=3 1289 B17R1.30229 CSCCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100000174002 [0,1,2,0,0,0|0,0,0]=3 1290 B17R1.30229 N#CCCC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100011934036 [0,1,2,0,0,0|0,0,1]=4 1291 B17R1.30229 N#CCCC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100011934036 [0,1,2,0,0,0|0,0,1]=4 1292 B17R1.30229 O=C(NCCF)NCCc1ccc(c(c1)O)O 2708a_100000210387_100000724931 [0,1,2,0,0,0|1,0,0]=4 1293 B17R1.30229 O=C(NCCF)NCCc1ccc(c(c1)O)O 273464a_100000210387_100000724931 [0,1,2,0,0,0|1,0,0]=4 1294 B17R1.30229 O=C(NCCF)NCCc1ccc(c(c1)O)O 273464a_100000724931_100000210387 [0,1,2,0,0,0|1,0,0]=4 1295 B17R1.30229 O=C(NCCO)NCCc1ccc(c(c1)O)O 2708a_100000210387_100000210304 [0,1,2,0,0,0|1,0,0]=4 1296 B17R1.30229 O=C(NCCO)NCCc1ccc(c(c1)O)O 273464a_100000210304_100000210387 [0,1,2,0,0,0|1,0,0]=4 1297 B17R1.30229 O=C(NCCO)NCCc1ccc(c(c1)O)O 273464a_100000210387_100000210304 [0,1,2,0,0,0|1,0,0]=4 1298 B17R1.35662 CCCS(=O)(=O)NCCc1ccc(c(c1)O)O 270084a_100000210387_100000211391 [0,1,2,0,0,0|1,0,0]=4 1299 B17R1.35662 CCCS(=O)(=O)NCCc1ccc(c(c1)O)O 274078a_100000210387_100000211391 [0,1,2,0,0,0|1,0,0]=4 1300 B17R1.24206 CNC(=O)N(C)C[C@H](O)c1ccc(c(c1)O)O 273464a_100102657272_100000694638 [0,1,2,0,0,0|1,0,0]=4 1301 B17R1.1071 CC(=O)CCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000685027 [0,1,2,0,0,0|0,0,0]=3 1302 B17R1.1071 CC(=O)CCCOCCc1ccc(c(c1)O)O 7a_100000759063_200010393615 [0,1,2,0,0,0|1,0,0]=4 1303 B17R1.1071 CC(=O)CCCSCCc1ccc(c(c1)O)O 62a_100011215641_200010393615 [0,1,2,0,0,0|1,0,0]=4 1304 B17R1.1071 CC(=O)OCCNCCc1ccc(c(c1)O)O 34a_100000210387_100009814007 [0,1,2,0,0,0|1,0,0]=4 1305 B17R1.1071 NC(=O)CCCNCCc1ccc(c(c1)O)O 34a_100000210387_100102525003 [0,1,2,0,0,0|0,0,0]=3 1306 B17R1.1071 NC(=O)CCCSCCc1ccc(c(c1)O)O 62a_100102525003_200010393615 [0,1,2,0,0,0|1,0,0]=4 1307 B17R1.1071 NC(=O)OCCNCCc1ccc(c(c1)O)O 34a_100000210387_200011214921 [0,1,2,0,0,0|1,0,0]=4 1308 B17R1.9269 C=CCCCNCC(O)c1ccc(c(c1)O)O 34a_100000106456_100000757094 [0,1,2,0,0,0|1,0,0]=4 1309 B17R1.10852 C=CCCCCNCCc1ccc(c(c1)O)O 34a_100000210387_100011215482 [0,1,2,0,0,0|1,0,0]=4 1310 B17R1.10852 O=CCCCCSCCc1ccc(c(c1)O)O 62a_100000139335_200010393615 [0,1,2,0,0,0|1,0,0]=4 1311 B17R1.29497 C=CCCCNCCc1ccc(c(c1)O)OC 2230a_100011207234_100011713584 [0,1,2,0,0,0|1,0,0]=4 1312 B17R1.29497 C=CCCCNCCc1ccc(c(c1)O)OC 34a_100011207234_100000757094 [0,1,2,0,0,0|1,0,0]=4 1313 B17R1.29497 COc1ccc(cc1Br)CCNCCCC=O 2230a_103549771065_200011292268 [0,1,2,0,0,0|1,0,0]=4 1314 B17R1.29497 COc1ccc(cc1Cl)CCNCCCC=O 2230a_100025770840_200011292268 [0,1,2,0,0,0|1,0,0]=4 1315 B17R1.29497 COc1ccc(cc1O)CCNCCCC=O 2230a_100011207234_200011292268 [0,1,2,0,0,0|0,0,0]=3 1316 B17R1.29498 C=CCCCNCCc1ccc(c(c1)OC)O 2230a_100000700776_100010741665 [0,1,2,0,0,0|1,0,0]=4 1317 B17R1.29498 C=CCCCNCCc1ccc(c(c1)OC)O 34a_100000756042_100000757094 [0,1,2,0,0,0|1,0,0]=4 1318 B17R1.29498 COc1cc(ccc1O)CCSCCCC=O 62a_200011292268_100010741665 [0,1,2,0,0,0|1,0,0]=4 1319 B17R1.96174 CC(C)C(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000210198 [0,1,2,0,0,0|1,0,0]=4 1320 B17R1.96174 CC(C)C(=O)NCCc1cc(c(cc1O)O)O 527a_200000106461_100000210198 [0,1,2,0,0,0|1,0,0]=4 1321 B17R1.96174 CC(F)C(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000062450 [0,1,2,0,0,0|1,0,0]=4 1322 B17R1.96174 CC(F)C(=O)NCCc1cc(c(cc1O)O)O 527a_200000106461_100000062450 [0,1,2,0,0,0|1,0,0]=4 1323 B17R1.96174 C[C@@H](O)C(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_100000717761 [0,1,2,0,0,0|1,0,0]=4 1324 B17R1.96174 C[C@H](O)C(=O)NCCc1cc(c(cc1O)O)O 240690a_200000106461_217856618621 [0,1,2,0,0,0|1,0,0]=4 1325 B17R2.2502 COc1cc(ccc1O)CCN2CCCC2 2230a_100000188435_100010741665 [1,1,1,0,0,0|0,0,1]=4 1326 B17R2.2502 COc1cc(ccc1O)CCN2CCCC2 269982a_100000188435_100010741665 [1,1,1,0,0,0|0,0,1]=4 1327 B17R2.18661 C[C@@H]1CCN(C1)CCc2ccc(c(c2)O)O 269982a_100016987628_200010393615 [1,1,1,0,0,0|0,0,1]=4 1328 B17R2.18661 Oc1ccc(cc1O)CCN2CCC(C2)O 269982a_100011215560_200010393615 [1,1,1,0,0,0|0,0,1]=4 1329 B17R2.18661 Oc1ccc(cc1O)CCN2CC[C@@H](C2)F 269982a_100015203821_200010393615 [1,1,1,0,0,0|0,0,1]=4 1330 B17R2.54 COc1ccc(cc1)SCN2CCCC2=O 62a_100000026320_100000171711 [1,1,1,0,0,0|1,0,0]=4 1331 B17R2.54 O=C1CCCN1CSc2ccc(cc2)CO 62a_100000026320_100000690907 [1,1,1,0,0,0|1,0,0]=4 1332 B17R2.54 O=C1CCCN1CSc2ccc(cc2)CO 62a_100000690907_100000026320 [1,1,1,0,0,0|1,0,0]=4 1333 B17R2.384 CN(CN1CCCC1=O)c2ccc(cc2)O 269982a_100000182112_100000026320 [1,1,1,0,0,0|1,0,0]=4 1334 B17R2.20834 Cc1cc(ccc1SCN2CCCC2=O)O 62a_100000026320_100000690111 [1,1,1,0,0,0|1,0,0]=4 1335 B17R2.20834 Nc1cc(ccc1SCN2CCCC2=O)O 62a_100000026320_100011999798 [1,1,1,0,0,0|1,0,0]=4 1336 B17R2.20834 Nc1cc(ccc1SCN2CCCC2=O)O 62a_100011999798_100000026320 [1,1,1,0,0,0|1,0,0]=4 1337 B17R2.20834 O=C1CCCN1CSc2ccc(cc2Br)O 62a_100000026320_100000701344 [1,1,1,0,0,0|1,0,0]=4 1338 B17R2.20834 O=C1CCCN1CSc2ccc(cc2Br)O 62a_100000701344_100000026320 [1,1,1,0,0,0|1,0,0]=4 1339 B17R2.20834 O=C1CCCN1CSc2ccc(cc2Cl)O 62a_100000026320_100000047559 [1,1,1,0,0,0|1,0,0]=4 1340 B17R2.20834 O=C1CCCN1CSc2ccc(cc2Cl)O 62a_100000047559_100000026320 [1,1,1,0,0,0|1,0,0]=4 1341 B17R2.20834 O=C1CCCN1CSc2ccc(cc2F)O 62a_100000026320_100000755031 [1,1,1,0,0,0|1,0,0]=4 1342 B17R2.20834 O=C1CCCN1CSc2ccc(cc2F)O 62a_100000755031_100000026320 [1,1,1,0,0,0|1,0,0]=4 1343 B17R2.20834 O=C1CCCN1CSc2ccc(cc2O)O 62a_100000026320_100009813921 [1,1,1,0,0,0|1,0,0]=4 1344 B17R2.2659 COc1cccc(c1)SCN2CCCC2=O 62a_100000026320_100000170001 [1,1,1,0,0,0|1,0,0]=4 1345 B17R2.2659 O=C1CCCN1CSc2cccc(c2)CO 62a_100000026320_100000687537 [1,1,1,0,0,0|1,0,0]=4 1346 B17R2.2659 O=C1CCCN1CSc2cccc(c2)CO 62a_100000687537_100000026320 [1,1,1,0,0,0|1,0,0]=4 1347 B17R2.3382 Cc1c(cccc1SCN2CCCC2=O)O 62a_100000026320_100012002258 [1,1,1,0,0,0|1,0,0]=4 1348 B17R2.3382 Cc1c(cccc1SCN2CCCC2=O)O 62a_100012002258_100000026320 [1,1,1,0,0,0|1,0,0]=4 1349 B17R2.3382 Nc1c(cccc1SCN2CCCC2=O)O 62a_100000026320_100011934926 [1,1,1,0,0,0|1,0,0]=4 1350 B17R2.3382 O=C1CCCN1CSc2cccc(c2Br)O 62a_100000026320_100010187914 [1,1,1,0,0,0|1,0,0]=4 1351 B17R2.3382 O=C1CCCN1CSc2cccc(c2Br)O 62a_100010187914_100000026320 [1,1,1,0,0,0|1,0,0]=4 1352 B17R2.3382 O=C1CCCN1CSc2cccc(c2Cl)O 62a_100000026320_100000049636 [1,1,1,0,0,0|1,0,0]=4 1353 B17R2.3382 O=C1CCCN1CSc2cccc(c2F)O 62a_100000026320_100009817021 [1,1,1,0,0,0|1,0,0]=4 1354 B17R2.3382 O=C1CCCN1CSc2cccc(c2F)O 62a_100009817021_100000026320 [1,1,1,0,0,0|1,0,0]=4 1355 B17R2.3382 O=C1CCCN1CSc2cccc(c2O)O 62a_100000026320_100009815950 [1,1,1,0,0,0|1,0,0]=4 1356 B17R2.41755 CN(CN1CCCC1=O)c2cccc(c2)O 269982a_100000756613_100000026320 [1,1,1,0,0,0|1,0,0]=4 1357 B17R2.42606 Cc1ccc(cc1SCN2CCCC2=O)O 62a_100000026320_100011380479 [1,1,1,0,0,0|1,0,0]=4 1358 B17R2.42606 Cc1ccc(cc1SCN2CCCC2=O)O 62a_100011380479_100000026320 [1,1,1,0,0,0|1,0,0]=4 1359 B17R2.42606 Nc1ccc(cc1SCN2CCCC2=O)O 62a_100000026320_100012001276 [1,1,1,0,0,0|1,0,0]=4 1360 B17R2.42606 Nc1ccc(cc1SCN2CCCC2=O)O 62a_100012001276_100000026320 [1,1,1,0,0,0|1,0,0]=4 1361 B17R2.42606 O=C1CCCN1CSc2cc(ccc2Br)O 62a_100000026320_100012339312 [1,1,1,0,0,0|1,0,0]=4 1362 B17R2.42606 O=C1CCCN1CSc2cc(ccc2Br)O 62a_100012339312_100000026320 [1,1,1,0,0,0|1,0,0]=4 1363 B17R2.42606 O=C1CCCN1CSc2cc(ccc2Cl)O 62a_100000026320_100000049588 [1,1,1,0,0,0|1,0,0]=4 1364 B17R2.42606 O=C1CCCN1CSc2cc(ccc2Cl)O 62a_100000049588_100000026320 [1,1,1,0,0,0|1,0,0]=4 1365 B17R2.42606 O=C1CCCN1CSc2cc(ccc2F)O 62a_100000026320_100000693481 [1,1,1,0,0,0|1,0,0]=4 1366 B17R2.42606 O=C1CCCN1CSc2cc(ccc2F)O 62a_100000693481_100000026320 [1,1,1,0,0,0|1,0,0]=4 1367 B17R2.42606 O=C1CCCN1CSc2cc(ccc2O)O 62a_100000026320_100009813629 [1,1,1,0,0,0|1,0,0]=4 1368 B17R2.158960 Cc1cc(cc(c1)SCN2CCCC2=O)O 62a_100000026320_100011999630 [1,1,1,0,0,0|1,0,0]=4 1369 B17R2.158960 O=C1CCCN1CSc2cc(cc(c2)Br)O 62a_100000026320_100010068917 [1,1,1,0,0,0|1,0,0]=4 1370 B17R2.158960 O=C1CCCN1CSc2cc(cc(c2)Br)O 62a_100010068917_100000026320 [1,1,1,0,0,0|1,0,0]=4 1371 B17R2.158960 O=C1CCCN1CSc2cc(cc(c2)Cl)O 62a_100000026320_100010068924 [1,1,1,0,0,0|1,0,0]=4 1372 B17R2.158960 O=C1CCCN1CSc2cc(cc(c2)Cl)O 62a_100010068924_100000026320 [1,1,1,0,0,0|1,0,0]=4 1373 B17R2.158960 O=C1CCCN1CSc2cc(cc(c2)F)O 62a_100000026320_100000688818 [1,1,1,0,0,0|1,0,0]=4 1374 B17R2.158960 O=C1CCCN1CSc2cc(cc(c2)F)O 62a_100000688818_100000026320 [1,1,1,0,0,0|1,0,0]=4 1375 B17R2.158960 O=C1CCCN1CSc2cc(cc(c2)O)O 62a_100000026320_100009868816 [1,1,1,0,0,0|1,0,0]=4 1376 B17R2.88266 C=CCN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000210623 [1,1,1,0,0,0|0,0,1]=4 1377 B17R2.88266 CC1c2cc(c(cc2CCN1CC=O)O)O 2230a_100000735813_200015260668 [1,1,1,0,0,0|0,0,0]=3 1378 B17R2.88266 CC1c2cc(c(cc2CCN1CCF)O)O 2230a_100000735813_100011217306 [1,1,1,0,0,0|0,0,1]=4 1379 B17R2.88266 CC1c2cc(c(cc2CCN1CCO)O)O 2230a_100000735813_100000211926 [1,1,1,0,0,0|0,0,1]=4 1380 B17R2.88266 CCCN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000210303 [1,1,1,0,0,0|0,0,1]=4 1381 B17R2.88266 COCN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000766300 [1,1,1,0,0,0|0,0,1]=4 1382 B17R2.88266 CSCN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100011218213 [1,1,1,0,0,0|0,0,1]=4 1383 B17R2.4791 CCS(=O)(=O)N1CCc2ccc(cc2C1)O 270084a_100015185785_100000211323 [1,1,1,0,0,0|1,0,0]=4 1384 B17R2.4791 CCS(=O)(=O)N1CCc2ccc(cc2C1)O 274078a_100015185785_100000211323 [1,1,1,0,0,0|1,0,0]=4 1385 B17R2.6194 C#CCC(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100011220946 [1,1,1,0,0,0|0,0,1]=4 1386 B17R2.6194 C=CCC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000210193 [1,1,1,0,0,0|0,0,1]=4 1387 B17R2.6194 C=CCC(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100000210193 [1,1,1,0,0,0|0,0,1]=4 1388 B17R2.6194 CC=CC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000210699 [1,1,1,0,0,0|0,0,1]=4 1389 B17R2.6194 CCCC(=O)C1CCc2ccc(cc2C1)O 1458a_100000087082_100000210303 [1,1,1,0,0,0|1,0,0]=4 1390 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Br 11a_100015189961_100000211992 [1,1,1,0,0,0|1,0,0]=4 1391 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_100000211992 [1,1,1,0,0,0|1,0,0]=4 1392 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000211992 [1,1,1,0,0,0|1,0,0]=4 1393 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Br 527a_100015189961_100000211992 [1,1,1,0,0,0|1,0,0]=4 1394 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)C 11a_100011255368_100000211992 [1,1,1,0,0,0|1,0,0]=4 1395 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)C 1626a_100011255368_100000211992 [1,1,1,0,0,0|1,0,0]=4 1396 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)C 240690a_100011255368_100000211992 [1,1,1,0,0,0|1,0,0]=4 1397 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)C 527a_100011255368_100000211992 [1,1,1,0,0,0|1,0,0]=4 1398 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Cl 11a_100000690163_100000211992 [1,1,1,0,0,0|1,0,0]=4 1399 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_100000211992 [1,1,1,0,0,0|1,0,0]=4 1400 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000211992 [1,1,1,0,0,0|1,0,0]=4 1401 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100000211992 [1,1,1,0,0,0|1,0,0]=4 1402 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)F 11a_100000755980_100000211992 [1,1,1,0,0,0|1,0,0]=4 1403 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_100000211992 [1,1,1,0,0,0|1,0,0]=4 1404 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000211992 [1,1,1,0,0,0|1,0,0]=4 1405 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)F 527a_100000755980_100000211992 [1,1,1,0,0,0|1,0,0]=4 1406 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000211992 [1,1,1,0,0,0|0,0,0]=3 1407 B17R2.6194 CCCC(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100000211992 [1,1,1,0,0,0|0,0,0]=3 1408 B17R2.6194 CCNC(=O)C1CCc2ccc(cc2C1)O 240690a_100015525214_100000087082 [1,1,1,0,0,0|1,0,0]=4 1409 B17R2.6194 CCNC(=O)C1CCc2ccc(cc2C1)O 527a_100015525214_100000087082 [1,1,1,0,0,0|1,0,0]=4 1410 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)Br 2708a_100015525214_100015189961 [1,1,1,0,0,0|1,0,0]=4 1411 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)Br 273464a_100015525214_100015189961 [1,1,1,0,0,0|1,0,0]=4 1412 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)C 2708a_100015525214_100011255368 [1,1,1,0,0,0|1,0,0]=4 1413 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)C 273464a_100015525214_100011255368 [1,1,1,0,0,0|1,0,0]=4 1414 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)Cl 2708a_100015525214_100000690163 [1,1,1,0,0,0|1,0,0]=4 1415 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)Cl 273464a_100015525214_100000690163 [1,1,1,0,0,0|1,0,0]=4 1416 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)F 2708a_100015525214_100000755980 [1,1,1,0,0,0|1,0,0]=4 1417 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)F 273464a_100015525214_100000755980 [1,1,1,0,0,0|1,0,0]=4 1418 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)O 2708a_100015525214_100015185785 [1,1,1,0,0,0|0,0,0]=3 1419 B17R2.6194 CCNC(=O)N1CCc2ccc(cc2C1)O 273464a_100015525214_100015185785 [1,1,1,0,0,0|0,0,0]=3 1420 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Br 11a_100015189961_100000210968 [1,1,1,0,0,0|1,0,0]=4 1421 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_100000210968 [1,1,1,0,0,0|1,0,0]=4 1422 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000210968 [1,1,1,0,0,0|1,0,0]=4 1423 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Br 527a_100015189961_100000210968 [1,1,1,0,0,0|1,0,0]=4 1424 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)C 11a_100011255368_100000210968 [1,1,1,0,0,0|1,0,0]=4 1425 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)C 1626a_100011255368_100000210968 [1,1,1,0,0,0|1,0,0]=4 1426 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)C 240690a_100011255368_100000210968 [1,1,1,0,0,0|1,0,0]=4 1427 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)C 527a_100011255368_100000210968 [1,1,1,0,0,0|1,0,0]=4 1428 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Cl 11a_100000690163_100000210968 [1,1,1,0,0,0|1,0,0]=4 1429 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_100000210968 [1,1,1,0,0,0|1,0,0]=4 1430 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000210968 [1,1,1,0,0,0|1,0,0]=4 1431 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100000210968 [1,1,1,0,0,0|1,0,0]=4 1432 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)F 11a_100000755980_100000210968 [1,1,1,0,0,0|1,0,0]=4 1433 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_100000210968 [1,1,1,0,0,0|1,0,0]=4 1434 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000210968 [1,1,1,0,0,0|1,0,0]=4 1435 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)F 527a_100000755980_100000210968 [1,1,1,0,0,0|1,0,0]=4 1436 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000210968 [1,1,1,0,0,0|0,0,0]=3 1437 B17R2.6194 COCC(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100000210968 [1,1,1,0,0,0|0,0,0]=3 1438 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Br 11a_100015189961_100000184570 [1,1,1,0,0,0|1,0,0]=4 1439 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_100000184570 [1,1,1,0,0,0|1,0,0]=4 1440 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000184570 [1,1,1,0,0,0|1,0,0]=4 1441 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Br 527a_100015189961_100000184570 [1,1,1,0,0,0|1,0,0]=4 1442 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)C 11a_100011255368_100000184570 [1,1,1,0,0,0|1,0,0]=4 1443 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)C 1626a_100011255368_100000184570 [1,1,1,0,0,0|1,0,0]=4 1444 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)C 240690a_100011255368_100000184570 [1,1,1,0,0,0|1,0,0]=4 1445 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)C 527a_100011255368_100000184570 [1,1,1,0,0,0|1,0,0]=4 1446 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Cl 11a_100000690163_100000184570 [1,1,1,0,0,0|1,0,0]=4 1447 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_100000184570 [1,1,1,0,0,0|1,0,0]=4 1448 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000184570 [1,1,1,0,0,0|1,0,0]=4 1449 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100000184570 [1,1,1,0,0,0|1,0,0]=4 1450 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)F 11a_100000755980_100000184570 [1,1,1,0,0,0|1,0,0]=4 1451 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_100000184570 [1,1,1,0,0,0|1,0,0]=4 1452 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000184570 [1,1,1,0,0,0|1,0,0]=4 1453 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)F 527a_100000755980_100000184570 [1,1,1,0,0,0|1,0,0]=4 1454 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000184570 [1,1,1,0,0,0|0,0,0]=3 1455 B17R2.6194 CSCC(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100000184570 [1,1,1,0,0,0|0,0,0]=3 1456 B17R2.6194 Cc1ccc2c(c1)CN(CC2)C(=O)CCO 240690a_100011255368_100011216618 [1,1,1,0,0,0|1,0,0]=4 1457 B17R2.6194 N#CCC(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100051588842 [1,1,1,0,0,0|0,0,1]=4 1458 B17R2.6194 O=C(CCF)C1CCc2ccc(cc2C1)O 1458a_100000087082_100011217306 [1,1,1,0,0,0|1,0,0]=4 1459 B17R2.6194 O=C(CCO)C1CCc2ccc(cc2C1)O 1458a_100000087082_100000211926 [1,1,1,0,0,0|1,0,0]=4 1460 B17R2.6194 O=C(CCO)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100011216618 [1,1,1,0,0,0|1,0,0]=4 1461 B17R2.6194 O=C(CCO)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100011216618 [1,1,1,0,0,0|1,0,0]=4 1462 B17R2.6194 O=C(CCO)N1CCc2ccc(cc2C1)F 240690a_100000755980_100011216618 [1,1,1,0,0,0|1,0,0]=4 1463 B17R2.6194 O=C(CCO)N1CCc2ccc(cc2C1)O 240690a_100015185785_100011216618 [1,1,1,0,0,0|0,0,0]=3 1464 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)C#N 11a_100000067367_100000210414 [1,1,1,0,0,0|1,0,0]=4 1465 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)C#N 1626a_100000067367_100000210414 [1,1,1,0,0,0|1,0,0]=4 1466 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)C#N 240690a_100000067367_100000210414 [1,1,1,0,0,0|1,0,0]=4 1467 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)C#N 527a_100000067367_100000210414 [1,1,1,0,0,0|1,0,0]=4 1468 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)CO 240690a_100138411858_100000210414 [1,1,1,0,0,0|0,0,0]=3 1469 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)OC 11a_100015207042_100000210414 [1,1,1,0,0,0|0,0,0]=3 1470 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)OC 1626a_100015207042_100000210414 [1,1,1,0,0,0|0,0,0]=3 1471 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)OC 240690a_100015207042_100000210414 [1,1,1,0,0,0|0,0,0]=3 1472 B17R2.11709 CCC(=O)N1CCc2ccc(cc2C1)OC 527a_100015207042_100000210414 [1,1,1,0,0,0|0,0,0]=3 1473 B17R2.11709 CNC(=O)N1CCc2ccc(cc2C1)CO 2708a_100102657272_100138411858 [1,1,1,0,0,0|1,0,0]=4 1474 B17R2.11709 CNC(=O)N1CCc2ccc(cc2C1)CO 273464a_100102657272_100138411858 [1,1,1,0,0,0|1,0,0]=4 1475 B17R2.11709 CNC(=O)N1CCc2ccc(cc2C1)OC 2708a_100102657272_100015207042 [1,1,1,0,0,0|1,0,0]=4 1476 B17R2.11709 CNC(=O)N1CCc2ccc(cc2C1)OC 273464a_100102657272_100015207042 [1,1,1,0,0,0|1,0,0]=4 1477 B17R2.11709 COc1ccc2c(c1)CN(CC2)C(=O)CO 240690a_100015207042_100000210174 [1,1,1,0,0,0|1,0,0]=4 1478 B17R2.11709 COc1ccc2c(c1)CN(CC2)C(=O)CO 527a_100015207042_100000210174 [1,1,1,0,0,0|1,0,0]=4 1479 B17R2.11709 O=C(CO)N1CCc2ccc(cc2C1)CO 240690a_100138411858_100000210174 [1,1,1,0,0,0|1,0,0]=4 1480 B17R2.19728 CC(C)C(=O)C1CCc2ccc(cc2C1)O 1458a_100000087082_100000210206 [1,1,1,0,0,0|1,0,0]=4 1481 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Br 11a_100015189961_100000210198 [1,1,1,0,0,0|1,0,0]=4 1482 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_100000210198 [1,1,1,0,0,0|1,0,0]=4 1483 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000210198 [1,1,1,0,0,0|1,0,0]=4 1484 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Br 527a_100015189961_100000210198 [1,1,1,0,0,0|1,0,0]=4 1485 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Cl 11a_100000690163_100000210198 [1,1,1,0,0,0|1,0,0]=4 1486 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_100000210198 [1,1,1,0,0,0|1,0,0]=4 1487 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000210198 [1,1,1,0,0,0|1,0,0]=4 1488 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100000210198 [1,1,1,0,0,0|1,0,0]=4 1489 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)F 11a_100000755980_100000210198 [1,1,1,0,0,0|1,0,0]=4 1490 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_100000210198 [1,1,1,0,0,0|1,0,0]=4 1491 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000210198 [1,1,1,0,0,0|1,0,0]=4 1492 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)F 527a_100000755980_100000210198 [1,1,1,0,0,0|1,0,0]=4 1493 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000210198 [1,1,1,0,0,0|0,0,0]=3 1494 B17R2.19728 CC(C)C(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100000210198 [1,1,1,0,0,0|0,0,0]=3 1495 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Br 11a_100015189961_100000062450 [1,1,1,0,0,0|1,0,0]=4 1496 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_100000062450 [1,1,1,0,0,0|1,0,0]=4 1497 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000062450 [1,1,1,0,0,0|1,0,0]=4 1498 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Br 527a_100015189961_100000062450 [1,1,1,0,0,0|1,0,0]=4 1499 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Cl 11a_100000690163_100000062450 [1,1,1,0,0,0|1,0,0]=4 1500 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_100000062450 [1,1,1,0,0,0|1,0,0]=4 1501 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000062450 [1,1,1,0,0,0|1,0,0]=4 1502 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)Cl 527a_100000690163_100000062450 [1,1,1,0,0,0|1,0,0]=4 1503 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)F 11a_100000755980_100000062450 [1,1,1,0,0,0|1,0,0]=4 1504 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_100000062450 [1,1,1,0,0,0|1,0,0]=4 1505 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000062450 [1,1,1,0,0,0|1,0,0]=4 1506 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)F 527a_100000755980_100000062450 [1,1,1,0,0,0|1,0,0]=4 1507 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000062450 [1,1,1,0,0,0|0,0,0]=3 1508 B17R2.19728 CC(F)C(=O)N1CCc2ccc(cc2C1)O 527a_100015185785_100000062450 [1,1,1,0,0,0|0,0,0]=3 1509 B17R2.19728 C[C@@H](O)C(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_100000717761 [1,1,1,0,0,0|1,0,0]=4 1510 B17R2.19728 C[C@@H](O)C(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_100000717761 [1,1,1,0,0,0|1,0,0]=4 1511 B17R2.19728 C[C@@H](O)C(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_100000717761 [1,1,1,0,0,0|1,0,0]=4 1512 B17R2.19728 C[C@@H](O)C(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000717761 [1,1,1,0,0,0|0,0,0]=3 1513 B17R2.19728 C[C@H](O)C(=O)N1CCc2ccc(cc2C1)Br 1626a_100015189961_217856618621 [1,1,1,0,0,0|1,0,0]=4 1514 B17R2.19728 C[C@H](O)C(=O)N1CCc2ccc(cc2C1)Br 240690a_100015189961_217856618621 [1,1,1,0,0,0|1,0,0]=4 1515 B17R2.19728 C[C@H](O)C(=O)N1CCc2ccc(cc2C1)Cl 1626a_100000690163_217856618621 [1,1,1,0,0,0|1,0,0]=4 1516 B17R2.19728 C[C@H](O)C(=O)N1CCc2ccc(cc2C1)Cl 240690a_100000690163_217856618621 [1,1,1,0,0,0|1,0,0]=4 1517 B17R2.19728 C[C@H](O)C(=O)N1CCc2ccc(cc2C1)F 1626a_100000755980_217856618621 [1,1,1,0,0,0|1,0,0]=4 1518 B17R2.19728 C[C@H](O)C(=O)N1CCc2ccc(cc2C1)F 240690a_100000755980_217856618621 [1,1,1,0,0,0|1,0,0]=4 1519 B17R2.19728 C[C@H](O)C(=O)N1CCc2ccc(cc2C1)O 240690a_100015185785_217856618621 [1,1,1,0,0,0|0,0,0]=3 1520 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)C 11a_100011255368_100000210198 [1,1,1,0,0,0|1,0,0]=4 1521 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)C 1626a_100011255368_100000210198 [1,1,1,0,0,0|1,0,0]=4 1522 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)C 240690a_100011255368_100000210198 [1,1,1,0,0,0|1,0,0]=4 1523 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)C 527a_100011255368_100000210198 [1,1,1,0,0,0|1,0,0]=4 1524 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)F 11a_100011255368_100000062450 [1,1,1,0,0,0|1,0,0]=4 1525 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)F 1626a_100011255368_100000062450 [1,1,1,0,0,0|1,0,0]=4 1526 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)F 240690a_100011255368_100000062450 [1,1,1,0,0,0|1,0,0]=4 1527 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)C(C)F 527a_100011255368_100000062450 [1,1,1,0,0,0|1,0,0]=4 1528 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)[C@@H](C)O 240690a_100011255368_100000717761 [1,1,1,0,0,0|1,0,0]=4 1529 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)[C@H](C)O 1626a_100011255368_217856618621 [1,1,1,0,0,0|1,0,0]=4 1530 B17R2.19728 Cc1ccc2c(c1)CN(CC2)C(=O)[C@H](C)O 240690a_100011255368_217856618621 [1,1,1,0,0,0|1,0,0]=4 1531 B17R2.19728 O=C(C(F)F)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000210393 [1,1,1,0,0,0|1,0,0]=4 1532 B17R2.19728 O=C(C(F)F)N1CCc2ccc(cc2C1)O 527a_100015185785_100000210393 [1,1,1,0,0,0|1,0,0]=4 1533 B17R2.19728 O=C(C(O)O)N1CCc2ccc(cc2C1)O 240690a_100015185785_100000233687 [1,1,1,0,0,0|1,0,0]=4 1534 B17R2.58255 CCC(=O)N1Cc2cc(ccc2CC1C)Br 11a_200000706634_100000210414 [1,1,1,0,0,0|1,0,0]=4 1535 B17R2.58255 CCC(=O)N1Cc2cc(ccc2CC1C)Br 1626a_200000706634_100000210414 [1,1,1,0,0,0|1,0,0]=4 1536 B17R2.58255 CCC(=O)N1Cc2cc(ccc2CC1C)Br 240690a_200000706634_100000210414 [1,1,1,0,0,0|1,0,0]=4 1537 B17R2.58255 CCC(=O)N1Cc2cc(ccc2CC1C)Br 527a_200000706634_100000210414 [1,1,1,0,0,0|1,0,0]=4 1538 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Br)C 11a_100016068755_100000210414 [1,1,1,0,0,0|1,0,0]=4 1539 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Br)C 1626a_100016068755_100000210414 [1,1,1,0,0,0|1,0,0]=4 1540 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Br)C 240690a_100016068755_100000210414 [1,1,1,0,0,0|1,0,0]=4 1541 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Br)C 527a_100016068755_100000210414 [1,1,1,0,0,0|1,0,0]=4 1542 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Br 11a_100012945082_100000210414 [1,1,1,0,0,0|1,0,0]=4 1543 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Br 1626a_100012945082_100000210414 [1,1,1,0,0,0|1,0,0]=4 1544 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Br 240690a_100012945082_100000210414 [1,1,1,0,0,0|1,0,0]=4 1545 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Br 527a_100012945082_100000210414 [1,1,1,0,0,0|1,0,0]=4 1546 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Cl 11a_100000689981_100000210414 [1,1,1,0,0,0|1,0,0]=4 1547 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Cl 1626a_100000689981_100000210414 [1,1,1,0,0,0|1,0,0]=4 1548 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Cl 240690a_100000689981_100000210414 [1,1,1,0,0,0|1,0,0]=4 1549 B17R2.355989 CCC(=O)N1CCc2c(cc(cc2C1)Cl)Cl 527a_100000689981_100000210414 [1,1,1,0,0,0|1,0,0]=4 1550 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)C#N 11a_100016988750_100000210414 [1,1,1,0,0,0|1,0,0]=4 1551 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)C#N 1626a_100016988750_100000210414 [1,1,1,0,0,0|1,0,0]=4 1552 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)C#N 240690a_100016988750_100000210414 [1,1,1,0,0,0|1,0,0]=4 1553 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)C#N 527a_100016988750_100000210414 [1,1,1,0,0,0|1,0,0]=4 1554 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)OC 11a_100015189960_100000210414 [1,1,1,0,0,0|0,0,0]=3 1555 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)OC 1626a_100015189960_100000210414 [1,1,1,0,0,0|0,0,0]=3 1556 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)OC 240690a_100015189960_100000210414 [1,1,1,0,0,0|0,0,0]=3 1557 B17R2.11734 CCC(=O)N1CCc2cc(ccc2C1)OC 527a_100015189960_100000210414 [1,1,1,0,0,0|0,0,0]=3 1558 B17R2.11734 CNC(=O)N1CCc2cc(ccc2C1)OC 2708a_100102657272_100015189960 [1,1,1,0,0,0|1,0,0]=4 1559 B17R2.11734 CNC(=O)N1CCc2cc(ccc2C1)OC 273464a_100102657272_100015189960 [1,1,1,0,0,0|1,0,0]=4 1560 B17R2.11734 COc1ccc2c(c1)CCN(C2)C(=O)CO 240690a_100015189960_100000210174 [1,1,1,0,0,0|1,0,0]=4 1561 B17R2.11734 COc1ccc2c(c1)CCN(C2)C(=O)CO 527a_100015189960_100000210174 [1,1,1,0,0,0|1,0,0]=4 1562 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Br 11a_100000686056_100000210198 [1,1,1,0,0,0|1,0,0]=4 1563 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_100000210198 [1,1,1,0,0,0|1,0,0]=4 1564 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000210198 [1,1,1,0,0,0|1,0,0]=4 1565 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Br 527a_100000686056_100000210198 [1,1,1,0,0,0|1,0,0]=4 1566 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Cl 11a_100011273784_100000210198 [1,1,1,0,0,0|1,0,0]=4 1567 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_100000210198 [1,1,1,0,0,0|1,0,0]=4 1568 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000210198 [1,1,1,0,0,0|1,0,0]=4 1569 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100000210198 [1,1,1,0,0,0|1,0,0]=4 1570 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)F 11a_100011273785_100000210198 [1,1,1,0,0,0|1,0,0]=4 1571 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_100000210198 [1,1,1,0,0,0|1,0,0]=4 1572 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000210198 [1,1,1,0,0,0|1,0,0]=4 1573 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)F 527a_100011273785_100000210198 [1,1,1,0,0,0|1,0,0]=4 1574 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000210198 [1,1,1,0,0,0|0,0,0]=3 1575 B17R2.19758 CC(C)C(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100000210198 [1,1,1,0,0,0|0,0,0]=3 1576 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Br 11a_100000686056_100000062450 [1,1,1,0,0,0|1,0,0]=4 1577 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_100000062450 [1,1,1,0,0,0|1,0,0]=4 1578 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000062450 [1,1,1,0,0,0|1,0,0]=4 1579 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Br 527a_100000686056_100000062450 [1,1,1,0,0,0|1,0,0]=4 1580 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Cl 11a_100011273784_100000062450 [1,1,1,0,0,0|1,0,0]=4 1581 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_100000062450 [1,1,1,0,0,0|1,0,0]=4 1582 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000062450 [1,1,1,0,0,0|1,0,0]=4 1583 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100000062450 [1,1,1,0,0,0|1,0,0]=4 1584 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)F 11a_100011273785_100000062450 [1,1,1,0,0,0|1,0,0]=4 1585 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_100000062450 [1,1,1,0,0,0|1,0,0]=4 1586 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000062450 [1,1,1,0,0,0|1,0,0]=4 1587 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)F 527a_100011273785_100000062450 [1,1,1,0,0,0|1,0,0]=4 1588 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000062450 [1,1,1,0,0,0|0,0,0]=3 1589 B17R2.19758 CC(F)C(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100000062450 [1,1,1,0,0,0|0,0,0]=3 1590 B17R2.19758 C[C@@H](O)C(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000717761 [1,1,1,0,0,0|1,0,0]=4 1591 B17R2.19758 C[C@@H](O)C(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000717761 [1,1,1,0,0,0|1,0,0]=4 1592 B17R2.19758 C[C@@H](O)C(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000717761 [1,1,1,0,0,0|1,0,0]=4 1593 B17R2.19758 C[C@@H](O)C(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000717761 [1,1,1,0,0,0|0,0,0]=3 1594 B17R2.19758 C[C@H](O)C(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_217856618621 [1,1,1,0,0,0|1,0,0]=4 1595 B17R2.19758 C[C@H](O)C(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_217856618621 [1,1,1,0,0,0|1,0,0]=4 1596 B17R2.19758 C[C@H](O)C(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_217856618621 [1,1,1,0,0,0|1,0,0]=4 1597 B17R2.19758 C[C@H](O)C(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_217856618621 [1,1,1,0,0,0|1,0,0]=4 1598 B17R2.19758 C[C@H](O)C(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_217856618621 [1,1,1,0,0,0|1,0,0]=4 1599 B17R2.19758 C[C@H](O)C(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_217856618621 [1,1,1,0,0,0|1,0,0]=4 1600 B17R2.19758 C[C@H](O)C(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_217856618621 [1,1,1,0,0,0|0,0,0]=3 1601 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)C 11a_100000718575_100000210198 [1,1,1,0,0,0|1,0,0]=4 1602 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)C 1626a_100000718575_100000210198 [1,1,1,0,0,0|1,0,0]=4 1603 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)C 240690a_100000718575_100000210198 [1,1,1,0,0,0|1,0,0]=4 1604 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)C 527a_100000718575_100000210198 [1,1,1,0,0,0|1,0,0]=4 1605 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)F 11a_100000718575_100000062450 [1,1,1,0,0,0|1,0,0]=4 1606 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)F 1626a_100000718575_100000062450 [1,1,1,0,0,0|1,0,0]=4 1607 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)F 240690a_100000718575_100000062450 [1,1,1,0,0,0|1,0,0]=4 1608 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)C(C)F 527a_100000718575_100000062450 [1,1,1,0,0,0|1,0,0]=4 1609 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)[C@@H](C)O 240690a_100000718575_100000717761 [1,1,1,0,0,0|1,0,0]=4 1610 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)[C@H](C)O 1626a_100000718575_217856618621 [1,1,1,0,0,0|1,0,0]=4 1611 B17R2.19758 Cc1ccc2c(c1)CCN(C2)C(=O)[C@H](C)O 240690a_100000718575_217856618621 [1,1,1,0,0,0|1,0,0]=4 1612 B17R2.19758 O=C(C(F)F)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000210393 [1,1,1,0,0,0|1,0,0]=4 1613 B17R2.19758 O=C(C(F)F)N1CCc2cc(ccc2C1)O 527a_100000077532_100000210393 [1,1,1,0,0,0|1,0,0]=4 1614 B17R2.19758 O=C(C(O)O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000233687 [1,1,1,0,0,0|1,0,0]=4 1615 B17R2.36170 CCS(=O)(=O)N1CCc2cc(ccc2C1)O 270084a_100000077532_100000211323 [1,1,1,0,0,0|1,0,0]=4 1616 B17R2.36170 CCS(=O)(=O)N1CCc2cc(ccc2C1)O 274078a_100000077532_100000211323 [1,1,1,0,0,0|1,0,0]=4 1617 B17R2.49831 C#CCC(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100011220946 [1,1,1,0,0,0|0,0,1]=4 1618 B17R2.49831 C=CCC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000210193 [1,1,1,0,0,0|0,0,1]=4 1619 B17R2.49831 C=CCC(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100000210193 [1,1,1,0,0,0|0,0,1]=4 1620 B17R2.49831 CC=CC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000210699 [1,1,1,0,0,0|0,0,1]=4 1621 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Br 11a_100000686056_100000211992 [1,1,1,0,0,0|1,0,0]=4 1622 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_100000211992 [1,1,1,0,0,0|1,0,0]=4 1623 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000211992 [1,1,1,0,0,0|1,0,0]=4 1624 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Br 527a_100000686056_100000211992 [1,1,1,0,0,0|1,0,0]=4 1625 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)C 11a_100000718575_100000211992 [1,1,1,0,0,0|1,0,0]=4 1626 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)C 1626a_100000718575_100000211992 [1,1,1,0,0,0|1,0,0]=4 1627 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)C 240690a_100000718575_100000211992 [1,1,1,0,0,0|1,0,0]=4 1628 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)C 527a_100000718575_100000211992 [1,1,1,0,0,0|1,0,0]=4 1629 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Cl 11a_100011273784_100000211992 [1,1,1,0,0,0|1,0,0]=4 1630 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_100000211992 [1,1,1,0,0,0|1,0,0]=4 1631 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000211992 [1,1,1,0,0,0|1,0,0]=4 1632 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100000211992 [1,1,1,0,0,0|1,0,0]=4 1633 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)F 11a_100011273785_100000211992 [1,1,1,0,0,0|1,0,0]=4 1634 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_100000211992 [1,1,1,0,0,0|1,0,0]=4 1635 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000211992 [1,1,1,0,0,0|1,0,0]=4 1636 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)F 527a_100011273785_100000211992 [1,1,1,0,0,0|1,0,0]=4 1637 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000211992 [1,1,1,0,0,0|0,0,0]=3 1638 B17R2.49831 CCCC(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100000211992 [1,1,1,0,0,0|0,0,0]=3 1639 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)Br 2708a_100015525214_100000686056 [1,1,1,0,0,0|1,0,0]=4 1640 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)Br 273464a_100015525214_100000686056 [1,1,1,0,0,0|1,0,0]=4 1641 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)C 2708a_100015525214_100000718575 [1,1,1,0,0,0|1,0,0]=4 1642 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)C 273464a_100015525214_100000718575 [1,1,1,0,0,0|1,0,0]=4 1643 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)Cl 2708a_100015525214_100011273784 [1,1,1,0,0,0|1,0,0]=4 1644 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)Cl 273464a_100015525214_100011273784 [1,1,1,0,0,0|1,0,0]=4 1645 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)F 2708a_100015525214_100011273785 [1,1,1,0,0,0|1,0,0]=4 1646 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)F 273464a_100015525214_100011273785 [1,1,1,0,0,0|1,0,0]=4 1647 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)O 2708a_100015525214_100000077532 [1,1,1,0,0,0|0,0,0]=3 1648 B17R2.49831 CCNC(=O)N1CCc2cc(ccc2C1)O 273464a_100015525214_100000077532 [1,1,1,0,0,0|0,0,0]=3 1649 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Br 11a_100000686056_100000210968 [1,1,1,0,0,0|1,0,0]=4 1650 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_100000210968 [1,1,1,0,0,0|1,0,0]=4 1651 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000210968 [1,1,1,0,0,0|1,0,0]=4 1652 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Br 527a_100000686056_100000210968 [1,1,1,0,0,0|1,0,0]=4 1653 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)C 11a_100000718575_100000210968 [1,1,1,0,0,0|1,0,0]=4 1654 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)C 1626a_100000718575_100000210968 [1,1,1,0,0,0|1,0,0]=4 1655 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)C 240690a_100000718575_100000210968 [1,1,1,0,0,0|1,0,0]=4 1656 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)C 527a_100000718575_100000210968 [1,1,1,0,0,0|1,0,0]=4 1657 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Cl 11a_100011273784_100000210968 [1,1,1,0,0,0|1,0,0]=4 1658 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_100000210968 [1,1,1,0,0,0|1,0,0]=4 1659 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000210968 [1,1,1,0,0,0|1,0,0]=4 1660 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100000210968 [1,1,1,0,0,0|1,0,0]=4 1661 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)F 11a_100011273785_100000210968 [1,1,1,0,0,0|1,0,0]=4 1662 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_100000210968 [1,1,1,0,0,0|1,0,0]=4 1663 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000210968 [1,1,1,0,0,0|1,0,0]=4 1664 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)F 527a_100011273785_100000210968 [1,1,1,0,0,0|1,0,0]=4 1665 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000210968 [1,1,1,0,0,0|0,0,0]=3 1666 B17R2.49831 COCC(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100000210968 [1,1,1,0,0,0|0,0,0]=3 1667 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Br 11a_100000686056_100000184570 [1,1,1,0,0,0|1,0,0]=4 1668 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Br 1626a_100000686056_100000184570 [1,1,1,0,0,0|1,0,0]=4 1669 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100000184570 [1,1,1,0,0,0|1,0,0]=4 1670 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Br 527a_100000686056_100000184570 [1,1,1,0,0,0|1,0,0]=4 1671 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)C 11a_100000718575_100000184570 [1,1,1,0,0,0|1,0,0]=4 1672 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)C 1626a_100000718575_100000184570 [1,1,1,0,0,0|1,0,0]=4 1673 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)C 240690a_100000718575_100000184570 [1,1,1,0,0,0|1,0,0]=4 1674 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)C 527a_100000718575_100000184570 [1,1,1,0,0,0|1,0,0]=4 1675 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Cl 11a_100011273784_100000184570 [1,1,1,0,0,0|1,0,0]=4 1676 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Cl 1626a_100011273784_100000184570 [1,1,1,0,0,0|1,0,0]=4 1677 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100000184570 [1,1,1,0,0,0|1,0,0]=4 1678 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)Cl 527a_100011273784_100000184570 [1,1,1,0,0,0|1,0,0]=4 1679 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)F 11a_100011273785_100000184570 [1,1,1,0,0,0|1,0,0]=4 1680 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)F 1626a_100011273785_100000184570 [1,1,1,0,0,0|1,0,0]=4 1681 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)F 240690a_100011273785_100000184570 [1,1,1,0,0,0|1,0,0]=4 1682 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)F 527a_100011273785_100000184570 [1,1,1,0,0,0|1,0,0]=4 1683 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100000184570 [1,1,1,0,0,0|0,0,0]=3 1684 B17R2.49831 CSCC(=O)N1CCc2cc(ccc2C1)O 527a_100000077532_100000184570 [1,1,1,0,0,0|0,0,0]=3 1685 B17R2.49831 Cc1ccc2c(c1)CCN(C2)C(=O)CCO 240690a_100000718575_100011216618 [1,1,1,0,0,0|1,0,0]=4 1686 B17R2.49831 N#CCC(=O)N1CCc2cc(ccc2C1)O 240690a_100000077532_100051588842 [1,1,1,0,0,0|0,0,1]=4 1687 B17R2.49831 O=C(CCO)N1CCc2cc(ccc2C1)Br 240690a_100000686056_100011216618 [1,1,1,0,0,0|1,0,0]=4 1688 B17R2.49831 O=C(CCO)N1CCc2cc(ccc2C1)Cl 240690a_100011273784_100011216618 [1,1,1,0,0,0|1,0,0]=4 1689 B17R2.49831 O=C(CCO)N1CCc2cc(ccc2C1)F 240690a_100011273785_100011216618 [1,1,1,0,0,0|1,0,0]=4 1690 B17R2.49831 O=C(CCO)N1CCc2cc(ccc2C1)O 240690a_100000077532_100011216618 [1,1,1,0,0,0|0,0,0]=3 1691 B17R2.359019 CCC(=O)N1Cc2ccc(cc2C(C1)C)Cl 11a_100009840616_100000210414 [1,1,1,0,0,0|1,0,0]=4 1692 B17R2.359019 CCC(=O)N1Cc2ccc(cc2C(C1)C)Cl 1626a_100009840616_100000210414 [1,1,1,0,0,0|1,0,0]=4 1693 B17R2.359019 CCC(=O)N1Cc2ccc(cc2C(C1)C)Cl 240690a_100009840616_100000210414 [1,1,1,0,0,0|1,0,0]=4 1694 B17R2.359019 CCC(=O)N1Cc2ccc(cc2C(C1)C)Cl 527a_100009840616_100000210414 [1,1,1,0,0,0|1,0,0]=4 1695 B17R2.1106351 CCC(=O)N1CCc2c(ccc(c2F)Br)C1 11a_100015699739_100000210414 [1,1,1,0,0,0|1,0,0]=4 1696 B17R2.1106351 CCC(=O)N1CCc2c(ccc(c2F)Br)C1 1626a_100015699739_100000210414 [1,1,1,0,0,0|1,0,0]=4 1697 B17R2.1106351 CCC(=O)N1CCc2c(ccc(c2F)Br)C1 240690a_100015699739_100000210414 [1,1,1,0,0,0|1,0,0]=4 1698 B17R2.1106351 CCC(=O)N1CCc2c(ccc(c2F)Br)C1 527a_100015699739_100000210414 [1,1,1,0,0,0|1,0,0]=4 1699 B17R2.4854 CC(C)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000210624 [1,1,1,0,0,0|0,0,1]=4 1700 B17R2.4854 CC(O)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100011218427 [1,1,1,0,0,0|0,0,1]=4 1701 B17R2.4854 C[C@@H](O)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100009817552 [1,1,1,0,0,0|0,0,1]=4 1702 B17R2.153043 C/C=C/CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100102629194 [1,1,1,0,0,0|0,0,1]=4 1703 B17R2.153043 CC=CCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000070051 [1,1,1,0,0,0|0,0,1]=4 1704 B17R2.153043 CCCCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000210210 [1,1,1,0,0,0|0,0,1]=4 1705 B17R2.153043 COCCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100011201679 [1,1,1,0,0,0|0,0,1]=4 1706 B17R2.153043 CSCCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000212216 [1,1,1,0,0,0|0,0,1]=4 1707 B17R2.153043 OCCCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000230001 [1,1,1,0,0,0|0,0,1]=4 1708 B17R2.153043 Oc1cc2c(cc1O)CN(CC2)CCCF 34a_200015384465_100011934791 [1,1,1,0,0,0|0,0,1]=4 1709 B19R2.19029 COc1ccc(cc1Br)CSCN2CCCC2=O 62a_100000026320_200011397701 [0,1,1,0,0,1|1,0,0]=4 1710 B19R2.19029 COc1ccc(cc1Br)CSCN2CCCC2=O 62a_200011397701_100000026320 [0,1,1,0,0,1|1,0,0]=4 1711 B19R2.19029 COc1ccc(cc1Br)NCCN2CCCC2=O 34a_100000187427_100000739059 [0,1,1,0,0,1|1,0,0]=4 1712 B19R2.19029 COc1ccc(cc1Br)OCCN2CCCC2=O 34a_100010234764_100000739059 [0,1,1,0,0,1|1,0,0]=4 1713 B19R2.19029 COc1ccc(cc1Br)OCCN2CCCC2=O 7a_100010234764_100000739059 [0,1,1,0,0,1|1,0,0]=4 1714 B19R2.19029 COc1ccc(cc1Br)SCCN2CCCC2=O 62a_100000739059_100011249507 [0,1,1,0,0,1|1,0,0]=4 1715 B19R2.19029 COc1ccc(cc1Br)SCCN2CCCC2=O 62a_100011249507_100000739059 [0,1,1,0,0,1|1,0,0]=4 1716 B19R2.19029 COc1ccc(cc1C)CSCN2CCCC2=O 62a_100000026320_200011290836 [0,1,1,0,0,1|1,0,0]=4 1717 B19R2.19029 COc1ccc(cc1C)CSCN2CCCC2=O 62a_200011290836_100000026320 [0,1,1,0,0,1|1,0,0]=4 1718 B19R2.19029 COc1ccc(cc1C)NCCN2CCCC2=O 2230a_100000743268_100000739059 [0,1,1,0,0,1|1,0,0]=4 1719 B19R2.19029 COc1ccc(cc1C)NCCN2CCCC2=O 34a_100000743268_100000739059 [0,1,1,0,0,1|1,0,0]=4 1720 B19R2.19029 COc1ccc(cc1C)NCCN2CCCC2=O 7a_100000743268_100000739059 [0,1,1,0,0,1|1,0,0]=4 1721 B19R2.19029 COc1ccc(cc1C)OCCN2CCCC2=O 34a_100000759738_100000739059 [0,1,1,0,0,1|1,0,0]=4 1722 B19R2.19029 COc1ccc(cc1C)OCCN2CCCC2=O 7a_100000759738_100000739059 [0,1,1,0,0,1|1,0,0]=4 1723 B19R2.19029 COc1ccc(cc1C)SCCN2CCCC2=O 62a_100000739059_100011219705 [0,1,1,0,0,1|1,0,0]=4 1724 B19R2.19029 COc1ccc(cc1C)SCCN2CCCC2=O 62a_100011219705_100000739059 [0,1,1,0,0,1|1,0,0]=4 1725 B19R2.19029 COc1ccc(cc1Cl)CSCN2CCCC2=O 62a_100000026320_100000693707 [0,1,1,0,0,1|1,0,0]=4 1726 B19R2.19029 COc1ccc(cc1Cl)CSCN2CCCC2=O 62a_100000693707_100000026320 [0,1,1,0,0,1|1,0,0]=4 1727 B19R2.19029 COc1ccc(cc1Cl)NCCN2CCCC2=O 2230a_100000211044_100000739059 [0,1,1,0,0,1|1,0,0]=4 1728 B19R2.19029 COc1ccc(cc1Cl)NCCN2CCCC2=O 34a_100000211044_100000739059 [0,1,1,0,0,1|1,0,0]=4 1729 B19R2.19029 COc1ccc(cc1Cl)OCCN2CCCC2=O 34a_200009861682_100000739059 [0,1,1,0,0,1|1,0,0]=4 1730 B19R2.19029 COc1ccc(cc1Cl)OCCN2CCCC2=O 7a_200009861682_100000739059 [0,1,1,0,0,1|1,0,0]=4 1731 B19R2.19029 COc1ccc(cc1Cl)SCCN2CCCC2=O 62a_100000739059_100012355395 [0,1,1,0,0,1|1,0,0]=4 1732 B19R2.19029 COc1ccc(cc1Cl)SCCN2CCCC2=O 62a_100012355395_100000739059 [0,1,1,0,0,1|1,0,0]=4 1733 B19R2.19029 COc1ccc(cc1F)CSCN2CCCC2=O 62a_100000026320_100000189595 [0,1,1,0,0,1|1,0,0]=4 1734 B19R2.19029 COc1ccc(cc1F)CSCN2CCCC2=O 62a_100000189595_100000026320 [0,1,1,0,0,1|1,0,0]=4 1735 B19R2.19029 COc1ccc(cc1F)NCCN2CCCC2=O 2230a_100000740183_100000739059 [0,1,1,0,0,1|1,0,0]=4 1736 B19R2.19029 COc1ccc(cc1F)NCCN2CCCC2=O 34a_100000740183_100000739059 [0,1,1,0,0,1|1,0,0]=4 1737 B19R2.19029 COc1ccc(cc1F)OCCN2CCCC2=O 34a_100000746305_100000739059 [0,1,1,0,0,1|1,0,0]=4 1738 B19R2.19029 COc1ccc(cc1F)OCCN2CCCC2=O 7a_100000746305_100000739059 [0,1,1,0,0,1|1,0,0]=4 1739 B19R2.19029 COc1ccc(cc1F)SCCN2CCCC2=O 62a_100000171752_100000739059 [0,1,1,0,0,1|1,0,0]=4 1740 B19R2.19029 COc1ccc(cc1F)SCCN2CCCC2=O 62a_100000739059_100000171752 [0,1,1,0,0,1|1,0,0]=4 1741 B19R2.19029 COc1ccc(cc1I)NCCN2CCCC2=O 34a_100011356947_100000739059 [0,1,1,0,0,1|1,0,0]=4 1742 B19R2.19029 COc1ccc(cc1I)OCCN2CCCC2=O 34a_100010084122_100000739059 [0,1,1,0,0,1|1,0,0]=4 1743 B19R2.19029 COc1ccc(cc1I)OCCN2CCCC2=O 7a_100010084122_100000739059 [0,1,1,0,0,1|1,0,0]=4 1744 B19R2.19029 COc1ccc(cc1N)SCCN2CCCC2=O 62a_100000739059_100011249504 [0,1,1,0,0,1|1,0,0]=4 1745 B19R2.19029 COc1ccc(cc1N)SCCN2CCCC2=O 62a_100011249504_100000739059 [0,1,1,0,0,1|1,0,0]=4 1746 B19R2.19029 COc1ccc(cc1O)CCNC2CCCC2=O 2230a_100011207234_100000211823 [0,1,1,0,0,1|1,0,0]=4 1747 B19R2.19029 COc1ccc(cc1O)CCNC2CCCC2=O 34a_100011207234_100000709159 [0,1,1,0,0,1|1,0,0]=4 1748 B19R2.19029 COc1ccc(cc1O)NCCN2CCCC2=O 34a_100000211920_100000739059 [0,1,1,0,0,1|0,0,0]=3 1749 B19R2.19029 COc1ccc(cc1O)SCCN2CCCC2=O 62a_100000739059_100009816560 [0,1,1,0,0,1|0,0,0]=3 1750 B19R2.19029 COc1ccc(cc1O)SCCN2CCNC2=O 62a_100000090651_100009816560 [0,1,1,0,0,1|1,0,0]=4 1751 B19R2.19029 COc1cnc(cc1O)SCCN2CCCC2=O 62a_100000739059_100010264082 [0,1,1,0,0,1|1,0,0]=4 1752 B19R2.19029 COc1ncc(cc1O)SCCN2CCCC2=O 62a_100000739059_100010135713 [0,1,1,0,0,1|1,0,0]=4 1753 B19R2.19029 Cc1cc(ccc1CO)NCCN2CCCC2=O 34a_100000102464_100000739059 [0,1,1,0,0,1|1,0,0]=4 1754 B19R2.19029 Cc1cc(ccc1CO)SCCN2CCCC2=O 62a_100000739059_100000748258 [0,1,1,0,0,1|1,0,0]=4 1755 B19R2.19029 Cc1cc(ccc1CO)SCCN2CCCC2=O 62a_100000748258_100000739059 [0,1,1,0,0,1|1,0,0]=4 1756 B19R2.19029 N#Cc1ccc(cc1O)NCCN2CCCC2=O 34a_100000094571_100000739059 [0,1,1,0,0,1|1,0,0]=4 1757 B19R2.19029 N#Cc1ccc(cc1O)NCCN2CCCC2=O 7a_100000094571_100000739059 [0,1,1,0,0,1|1,0,0]=4 1758 B19R2.19029 N#Cc1ccc(cc1O)SCCN2CCCC2=O 62a_100000739059_100011934713 [0,1,1,0,0,1|1,0,0]=4 1759 B19R2.19029 Nc1cc(ccc1CO)SCCN2CCCC2=O 62a_100000718831_100000739059 [0,1,1,0,0,1|1,0,0]=4 1760 B19R2.19029 Nc1cc(ccc1CO)SCCN2CCCC2=O 62a_100000739059_100000718831 [0,1,1,0,0,1|1,0,0]=4 1761 B19R2.19029 O=C1CCCN1CCNc2ccc(c(c2)Cl)CO 34a_100000689119_100000739059 [0,1,1,0,0,1|1,0,0]=4 1762 B19R2.19029 O=C1CCCN1CCOc2ccc(c(c2)Br)CO 34a_100010146404_100000739059 [0,1,1,0,0,1|1,0,0]=4 1763 B19R2.19029 O=C1CCCN1CCOc2ccc(c(c2)Br)CO 7a_100010146404_100000739059 [0,1,1,0,0,1|1,0,0]=4 1764 B19R2.19029 O=C1CCCN1CCOc2ccc(c(c2)Cl)CO 34a_200000075811_100000739059 [0,1,1,0,0,1|1,0,0]=4 1765 B19R2.19029 O=C1CCCN1CCOc2ccc(c(c2)Cl)CO 7a_200000075811_100000739059 [0,1,1,0,0,1|1,0,0]=4 1766 B19R2.19029 O=C1CCCN1CCOc2ccc(c(c2)F)CO 34a_100000084598_100000739059 [0,1,1,0,0,1|1,0,0]=4 1767 B19R2.19029 O=C1CCCN1CCOc2ccc(c(c2)F)CO 7a_100000084598_100000739059 [0,1,1,0,0,1|1,0,0]=4 1768 B19R2.19029 O=C1CCCN1CCSc2ccc(c(c2)Br)CO 62a_100000739059_100010240206 [0,1,1,0,0,1|1,0,0]=4 1769 B19R2.19029 O=C1CCCN1CCSc2ccc(c(c2)Br)CO 62a_100010240206_100000739059 [0,1,1,0,0,1|1,0,0]=4 1770 B19R2.19029 O=C1CCCN1CCSc2ccc(c(c2)F)CO 62a_100000739059_100011191541 [0,1,1,0,0,1|1,0,0]=4 1771 B19R2.19029 O=C1CCCN1CCSc2ccc(c(c2)F)CO 62a_100011191541_100000739059 [0,1,1,0,0,1|1,0,0]=4 1772 B19R2.19029 O=C1CCCN1CCSc2ccc(c(c2)O)CO 62a_100000071718_100000739059 [0,1,1,0,0,1|0,0,0]=3 1773 B19R2.19029 O=C1CCCN1CCSc2ccc(c(c2)O)CO 62a_100000739059_100000071718 [0,1,1,0,0,1|0,0,0]=3 1774 B19R2.19029 O=C1NCCN1CCSc2ccc(c(c2)O)CO 62a_100000071718_100000090651 [0,1,1,0,0,1|1,0,0]=4 1775 B19R2.19029 O=C1NCCN1CCSc2ccc(c(c2)O)CO 62a_100000090651_100000071718 [0,1,1,0,0,1|1,0,0]=4 1776 B19R2.19029 O=Cc1ccc(cc1O)SCCN2CCCC2=O 62a_100000739059_100011277552 [0,1,1,0,0,1|0,0,1]=4 1777 B19R2.19029 O=Cc1ccc(cc1O)SCCN2CCCC2=O 62a_100011277552_100000739059 [0,1,1,0,0,1|0,0,1]=4 1778 B19R2.21863 CCc1cc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100012338938 [0,1,1,0,0,1|1,0,0]=4 1779 B19R2.21863 COc1cc(ccc1Br)CSCN2CCCC2=O 62a_100000026320_100010110085 [0,1,1,0,0,1|1,0,0]=4 1780 B19R2.21863 COc1cc(ccc1Br)CSCN2CCCC2=O 62a_100010110085_100000026320 [0,1,1,0,0,1|1,0,0]=4 1781 B19R2.21863 COc1cc(ccc1Br)NCCN2CCCC2=O 2230a_100000765947_100000739059 [0,1,1,0,0,1|1,0,0]=4 1782 B19R2.21863 COc1cc(ccc1Br)NCCN2CCCC2=O 34a_100000765947_100000739059 [0,1,1,0,0,1|1,0,0]=4 1783 B19R2.21863 COc1cc(ccc1Br)OCCN2CCCC2=O 34a_100011827694_100000739059 [0,1,1,0,0,1|1,0,0]=4 1784 B19R2.21863 COc1cc(ccc1Br)OCCN2CCCC2=O 7a_100011827694_100000739059 [0,1,1,0,0,1|1,0,0]=4 1785 B19R2.21863 COc1cc(ccc1Br)SCCN2CCCC2=O 62a_100000739059_100012353699 [0,1,1,0,0,1|1,0,0]=4 1786 B19R2.21863 COc1cc(ccc1Br)SCCN2CCCC2=O 62a_100012353699_100000739059 [0,1,1,0,0,1|1,0,0]=4 1787 B19R2.21863 COc1cc(ccc1C)NCCN2CCCC2=O 2230a_100011279678_100000739059 [0,1,1,0,0,1|1,0,0]=4 1788 B19R2.21863 COc1cc(ccc1C)NCCN2CCCC2=O 34a_100011279678_100000739059 [0,1,1,0,0,1|1,0,0]=4 1789 B19R2.21863 COc1cc(ccc1C)OCCN2CCCC2=O 34a_100009865632_100000739059 [0,1,1,0,0,1|1,0,0]=4 1790 B19R2.21863 COc1cc(ccc1C)OCCN2CCCC2=O 7a_100009865632_100000739059 [0,1,1,0,0,1|1,0,0]=4 1791 B19R2.21863 COc1cc(ccc1C)SCCN2CCCC2=O 62a_100000739059_100011830276 [0,1,1,0,0,1|1,0,0]=4 1792 B19R2.21863 COc1cc(ccc1C)SCCN2CCCC2=O 62a_100011830276_100000739059 [0,1,1,0,0,1|1,0,0]=4 1793 B19R2.21863 COc1cc(ccc1Cl)CSCN2CCCC2=O 62a_100000026320_200010214485 [0,1,1,0,0,1|1,0,0]=4 1794 B19R2.21863 COc1cc(ccc1Cl)CSCN2CCCC2=O 62a_200010214485_100000026320 [0,1,1,0,0,1|1,0,0]=4 1795 B19R2.21863 COc1cc(ccc1Cl)NCCN2CCCC2=O 2230a_100000742311_100000739059 [0,1,1,0,0,1|1,0,0]=4 1796 B19R2.21863 COc1cc(ccc1Cl)NCCN2CCCC2=O 34a_100000742311_100000739059 [0,1,1,0,0,1|1,0,0]=4 1797 B19R2.21863 COc1cc(ccc1Cl)OCCN2CCCC2=O 34a_100012186310_100000739059 [0,1,1,0,0,1|1,0,0]=4 1798 B19R2.21863 COc1cc(ccc1Cl)OCCN2CCCC2=O 7a_100012186310_100000739059 [0,1,1,0,0,1|1,0,0]=4 1799 B19R2.21863 COc1cc(ccc1Cl)SCCN2CCCC2=O 62a_100000739059_100011356853 [0,1,1,0,0,1|1,0,0]=4 1800 B19R2.21863 COc1cc(ccc1Cl)SCCN2CCCC2=O 62a_100011356853_100000739059 [0,1,1,0,0,1|1,0,0]=4 1801 B19R2.21863 COc1cc(ccc1F)CSCN2CCCC2=O 62a_100000026320_100012349856 [0,1,1,0,0,1|1,0,0]=4 1802 B19R2.21863 COc1cc(ccc1F)CSCN2CCCC2=O 62a_100012349856_100000026320 [0,1,1,0,0,1|1,0,0]=4 1803 B19R2.21863 COc1cc(ccc1F)NCCN2CCCC2=O 2230a_100000701188_100000739059 [0,1,1,0,0,1|1,0,0]=4 1804 B19R2.21863 COc1cc(ccc1F)NCCN2CCCC2=O 34a_100000701188_100000739059 [0,1,1,0,0,1|1,0,0]=4 1805 B19R2.21863 COc1cc(ccc1F)OCCN2CCCC2=O 34a_100012001760_100000739059 [0,1,1,0,0,1|1,0,0]=4 1806 B19R2.21863 COc1cc(ccc1F)OCCN2CCCC2=O 7a_100012001760_100000739059 [0,1,1,0,0,1|1,0,0]=4 1807 B19R2.21863 COc1cc(ccc1F)SCCN2CCCC2=O 62a_100000739059_100011934186 [0,1,1,0,0,1|1,0,0]=4 1808 B19R2.21863 COc1cc(ccc1F)SCCN2CCCC2=O 62a_100011934186_100000739059 [0,1,1,0,0,1|1,0,0]=4 1809 B19R2.21863 COc1cc(ccc1I)NCCN2CCCC2=O 34a_100000746945_100000739059 [0,1,1,0,0,1|1,0,0]=4 1810 B19R2.21863 COc1cc(ccc1N)OCCN2CCCC2=O 34a_100015326901_100000739059 [0,1,1,0,0,1|1,0,0]=4 1811 B19R2.21863 COc1cc(ccc1N)OCCN2CCCC2=O 7a_100015326901_100000739059 [0,1,1,0,0,1|1,0,0]=4 1812 B19R2.21863 COc1cc(ccc1N)SCCN2CCCC2=O 62a_100000739059_100015196925 [0,1,1,0,0,1|1,0,0]=4 1813 B19R2.21863 COc1cc(ccc1N)SCCN2CCCC2=O 62a_100011279103_100000739059 [0,1,1,0,0,1|1,0,0]=4 1814 B19R2.21863 COc1cc(ccc1O)CCNC2CCCC2=O 34a_100000756042_100000709159 [0,1,1,0,0,1|1,0,0]=4 1815 B19R2.21863 COc1cc(ccc1O)CCSC2CCCC2=O 62a_100000211823_100010741665 [0,1,1,0,0,1|1,0,0]=4 1816 B19R2.21863 COc1cc(ccc1O)NCCN2CCCC2=O 34a_100000726020_100000739059 [0,1,1,0,0,1|0,0,0]=3 1817 B19R2.21863 COc1cc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100000694246 [0,1,1,0,0,1|0,0,0]=3 1818 B19R2.21863 COc1cc(ccc1O)SCCN2CCNC2=O 62a_100000090651_100000694246 [0,1,1,0,0,1|1,0,0]=4 1819 B19R2.21863 COc1nc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100010893133 [0,1,1,0,0,1|1,0,0]=4 1820 B19R2.21863 Cc1ccc(cc1CO)OCCN2CCCC2=O 34a_100009878257_100000739059 [0,1,1,0,0,1|1,0,0]=4 1821 B19R2.21863 Cc1ccc(cc1CO)OCCN2CCCC2=O 7a_100009878257_100000739059 [0,1,1,0,0,1|1,0,0]=4 1822 B19R2.21863 Cc1ccc(cc1CO)SCCN2CCCC2=O 62a_100000700630_100000739059 [0,1,1,0,0,1|1,0,0]=4 1823 B19R2.21863 Cc1ccc(cc1CO)SCCN2CCCC2=O 62a_100000739059_100000700630 [0,1,1,0,0,1|1,0,0]=4 1824 B19R2.21863 N#Cc1cc(ccc1O)NCCN2CCCC2=O 34a_100011249283_100000739059 [0,1,1,0,0,1|1,0,0]=4 1825 B19R2.21863 N#Cc1cc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100000687585 [0,1,1,0,0,1|1,0,0]=4 1826 B19R2.21863 NCc1cc(ccc1O)SCCN2CCCC2=O 62a_100000730032_100000739059 [0,1,1,0,0,1|1,0,0]=4 1827 B19R2.21863 NCc1cc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100000730032 [0,1,1,0,0,1|1,0,0]=4 1828 B19R2.21863 Nc1ccc(cc1CO)SCCN2CCCC2=O 62a_100000739059_100012353972 [0,1,1,0,0,1|1,0,0]=4 1829 B19R2.21863 Nc1ccc(cc1CO)SCCN2CCCC2=O 62a_100012353972_100000739059 [0,1,1,0,0,1|1,0,0]=4 1830 B19R2.21863 O=C1CCCN1CCNc2ccc(c(c2)CO)Br 2230a_100012347228_100000739059 [0,1,1,0,0,1|1,0,0]=4 1831 B19R2.21863 O=C1CCCN1CCNc2ccc(c(c2)CO)Br 34a_100012347228_100000739059 [0,1,1,0,0,1|1,0,0]=4 1832 B19R2.21863 O=C1CCCN1CCNc2ccc(c(c2)CO)Cl 2230a_100011273577_100000739059 [0,1,1,0,0,1|1,0,0]=4 1833 B19R2.21863 O=C1CCCN1CCNc2ccc(c(c2)CO)Cl 34a_100011273577_100000739059 [0,1,1,0,0,1|1,0,0]=4 1834 B19R2.21863 O=C1CCCN1CCNc2ccc(c(c2)CO)F 34a_100011218011_100000739059 [0,1,1,0,0,1|1,0,0]=4 1835 B19R2.21863 O=C1CCCN1CCOc2ccc(c(c2)CO)Br 34a_100012351483_100000739059 [0,1,1,0,0,1|1,0,0]=4 1836 B19R2.21863 O=C1CCCN1CCOc2ccc(c(c2)CO)Br 7a_100012351483_100000739059 [0,1,1,0,0,1|1,0,0]=4 1837 B19R2.21863 O=C1CCCN1CCOc2ccc(c(c2)CO)Cl 34a_100000091669_100000739059 [0,1,1,0,0,1|1,0,0]=4 1838 B19R2.21863 O=C1CCCN1CCOc2ccc(c(c2)CO)Cl 7a_100000091669_100000739059 [0,1,1,0,0,1|1,0,0]=4 1839 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)Br 62a_100000739059_100012359683 [0,1,1,0,0,1|1,0,0]=4 1840 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)Br 62a_100012359683_100000739059 [0,1,1,0,0,1|1,0,0]=4 1841 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)Cl 62a_100000739059_100010128486 [0,1,1,0,0,1|1,0,0]=4 1842 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)Cl 62a_100010128486_100000739059 [0,1,1,0,0,1|1,0,0]=4 1843 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)F 62a_100000246282_100000739059 [0,1,1,0,0,1|1,0,0]=4 1844 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)F 62a_100000739059_100000246282 [0,1,1,0,0,1|1,0,0]=4 1845 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)O 62a_100000184703_100000739059 [0,1,1,0,0,1|0,0,0]=3 1846 B19R2.21863 O=C1CCCN1CCSc2ccc(c(c2)CO)O 62a_100000739059_100000184703 [0,1,1,0,0,1|0,0,0]=3 1847 B19R2.21863 O=C1CCCN1CCSc2cnc(c(c2)CO)O 62a_100000739059_100010065268 [0,1,1,0,0,1|1,0,0]=4 1848 B19R2.21863 O=C1CCCN1CCSc2cnc(c(c2)CO)O 62a_100010065268_100000739059 [0,1,1,0,0,1|1,0,0]=4 1849 B19R2.21863 O=C1NCCN1CCSc2ccc(c(c2)CO)O 62a_100000090651_100000184703 [0,1,1,0,0,1|1,0,0]=4 1850 B19R2.21863 O=C1NCCN1CCSc2ccc(c(c2)CO)O 62a_100000184703_100000090651 [0,1,1,0,0,1|1,0,0]=4 1851 B19R2.21863 O=Cc1cc(ccc1O)CSCN2CCCC2=O 62a_100000026320_100000008128 [0,1,1,0,0,1|0,0,1]=4 1852 B19R2.21863 O=Cc1cc(ccc1O)SCCN2CCCC2=O 62a_100000739059_100000186750 [0,1,1,0,0,1|0,0,1]=4 1853 B19R2.51575 Cc1c(ccc(c1C)NCCN2CCCC2=O)O 34a_200011216674_100000739059 [0,1,1,0,0,1|1,0,0]=4 1854 B19R2.51575 Cc1c(ccc(c1C)NCCN2CCCC2=O)O 7a_200011216674_100000739059 [0,1,1,0,0,1|1,0,0]=4 1855 B19R2.51575 Cc1c(ccc(c1C)SCCN2CCCC2=O)O 62a_100000739059_100012353674 [0,1,1,0,0,1|1,0,0]=4 1856 B19R2.51575 Cc1c(ccc(c1C)SCCN2CCCC2=O)O 62a_100012353674_100000739059 [0,1,1,0,0,1|1,0,0]=4 1857 B19R2.51575 Cc1c(ccc(c1F)NCCN2CCCC2=O)O 34a_200000126710_100000739059 [0,1,1,0,0,1|1,0,0]=4 1858 B19R2.51575 Cc1c(ccc(c1F)NCCN2CCCC2=O)O 7a_200000126710_100000739059 [0,1,1,0,0,1|1,0,0]=4 1859 B19R2.51575 Cc1c(ccc(c1F)SCCN2CCCC2=O)O 62a_100000739059_100010390934 [0,1,1,0,0,1|1,0,0]=4 1860 B19R2.51575 Cc1c(ccc(c1F)SCCN2CCCC2=O)O 62a_100010390934_100000739059 [0,1,1,0,0,1|1,0,0]=4 1861 B19R2.51575 Cc1c(ccc(c1N)O)SCCN2CCCC2=O 62a_100000739059_100013039247 [0,1,1,0,0,1|1,0,0]=4 1862 B19R2.51575 Cc1c(ccc(c1N)O)SCCN2CCCC2=O 62a_100013039247_100000739059 [0,1,1,0,0,1|1,0,0]=4 1863 B19R2.51575 Cc1ccc(c(c1O)Cl)NCCN2CCCC2=O 34a_100000036876_100000739059 [0,1,1,0,0,1|1,0,0]=4 1864 B19R2.51575 Cc1ccc(c(c1O)Cl)NCCN2CCCC2=O 7a_100000036876_100000739059 [0,1,1,0,0,1|1,0,0]=4 1865 B19R2.51575 Nc1c(ccc(c1O)Br)SCCN2CCCC2=O 62a_100020748643_100000739059 [0,1,1,0,0,1|1,0,0]=4 1866 B19R2.51575 O=C1CCCN1CCNc2ccc(c(c2Cl)Cl)O 34a_100012017499_100000739059 [0,1,1,0,0,1|1,0,0]=4 1867 B19R2.51575 O=C1CCCN1CCNc2ccc(c(c2Cl)Cl)O 7a_100012017499_100000739059 [0,1,1,0,0,1|1,0,0]=4 1868 B19R2.51575 O=C1CCCN1CCNc2ccc(c(c2F)Cl)O 34a_200000098347_100000739059 [0,1,1,0,0,1|1,0,0]=4 1869 B19R2.51575 O=C1CCCN1CCNc2ccc(c(c2F)Cl)O 7a_200000098347_100000739059 [0,1,1,0,0,1|1,0,0]=4 1870 B19R2.51575 O=C1CCCN1CCNc2ccc(c(c2F)F)O 34a_100015204651_100000739059 [0,1,1,0,0,1|1,0,0]=4 1871 B19R2.51575 O=C1CCCN1CCNc2ccc(c(c2F)F)O 7a_100015204651_100000739059 [0,1,1,0,0,1|1,0,0]=4 1872 B19R2.51575 O=C1CCCN1CCSc2ccc(c(c2F)F)O 62a_100000739059_100011830415 [0,1,1,0,0,1|1,0,0]=4 1873 B19R2.51575 O=C1CCCN1CCSc2ccc(c(c2F)F)O 62a_100011830415_100000739059 [0,1,1,0,0,1|1,0,0]=4 1874 B19R2.51575 O=C1CCCN1CCSc2ccc(c(c2F)O)Br 62a_100000739059_200010782288 [0,1,1,0,0,1|1,0,0]=4 1875 B19R2.51575 O=C1CCCN1CCSc2ccc(c(c2F)O)Br 62a_200010782288_100000739059 [0,1,1,0,0,1|1,0,0]=4 1876 B19R2.51575 O=C1CCCN1CCSc2ccc(c(c2F)O)F 62a_100000739059_100010167067 [0,1,1,0,0,1|1,0,0]=4 1877 B19R2.51575 O=C1CCCN1CCSc2ccc(c(c2F)O)F 62a_100010167067_100000739059 [0,1,1,0,0,1|1,0,0]=4 1878 B19R2.51704 Cc1cc(ccc1O)C(=O)CCN2CCCC2=O 1458a_100000685612_100000742232 [0,1,1,0,0,1|1,0,0]=4 1879 B19R2.51704 Cc1ccc(cc1O)C(=O)CCN2CCCC2=O 1458a_100000233767_100000742232 [0,1,1,0,0,1|1,0,0]=4 1880 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)Br)O 1458a_100000189672_100000742232 [0,1,1,0,0,1|1,0,0]=4 1881 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)Cl)O 1458a_100000212196_100000742232 [0,1,1,0,0,1|1,0,0]=4 1882 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)F)O 1458a_100000185466_100000742232 [0,1,1,0,0,1|1,0,0]=4 1883 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)I)O 1458a_100000037485_100000742232 [0,1,1,0,0,1|1,0,0]=4 1884 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)O)Br 1458a_100000689001_100000742232 [0,1,1,0,0,1|1,0,0]=4 1885 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)O)Cl 1458a_100011933997_100000742232 [0,1,1,0,0,1|1,0,0]=4 1886 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)O)F 1458a_100000035894_100000742232 [0,1,1,0,0,1|1,0,0]=4 1887 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)O)I 1458a_100000239334_100000742232 [0,1,1,0,0,1|1,0,0]=4 1888 B19R2.51704 O=C(CCN1CCCC1=O)c2ccc(c(c2)O)O 1458a_100000212155_100000742232 [0,1,1,0,0,1|0,0,0]=3 1889 B19R2.51704 O=C(CCN1CCNC1=O)c2ccc(c(c2)O)O 1458a_100000212155_100000090651 [0,1,1,0,0,1|1,0,0]=4 1890 B19R2.51704 O=C1CCCC1NCC(O)c2ccc(c(c2)O)O 34a_100000106456_100000709159 [0,1,1,0,0,1|1,0,0]=4 1891 B19R2.51728 O=C(CN1CCCC1=O)Nc2ccc(c(c2)O)O 22a_100102946323_100000189602 [0,1,1,0,0,1|0,0,1]=4 1892 B19R2.51728 O=C(CN1CCCC1=O)Nc2ccc(c(c2)O)O 527a_100102946323_100000189602 [0,1,1,0,0,1|0,0,1]=4 1893 B19R2.60843 O=C1CCCC1C(=O)CCc2ccc(c(c2)O)O 1458a_100000042615_100000211823 [0,1,1,0,0,1|1,0,0]=4 1894 B19R2.576665 Cc1cc(cc(c1N)O)SCCN2CCCC2=O 62a_100000739059_100010371313 [0,1,1,0,0,1|1,0,0]=4 1895 B19R2.576665 Cc1cc(cc(c1N)O)SCCN2CCCC2=O 62a_100010371313_100000739059 [0,1,1,0,0,1|1,0,0]=4 1896 B19R2.576665 Cc1cc(cc(c1O)Br)NCCN2CCCC2=O 34a_100010064301_100000739059 [0,1,1,0,0,1|1,0,0]=4 1897 B19R2.576665 Cc1cc(cc(c1O)Br)NCCN2CCCC2=O 7a_100010064301_100000739059 [0,1,1,0,0,1|1,0,0]=4 1898 B19R2.576665 Cc1cc(cc(c1O)Br)SCCN2CCCC2=O 62a_100000739059_100010982682 [0,1,1,0,0,1|1,0,0]=4 1899 B19R2.576665 Cc1cc(cc(c1O)Br)SCCN2CCCC2=O 62a_100010982682_100000739059 [0,1,1,0,0,1|1,0,0]=4 1900 B19R2.576665 Cc1cc(cc(c1O)C)NCCN2CCCC2=O 34a_100000703291_100000739059 [0,1,1,0,0,1|1,0,0]=4 1901 B19R2.576665 Cc1cc(cc(c1O)C)NCCN2CCCC2=O 7a_100000703291_100000739059 [0,1,1,0,0,1|1,0,0]=4 1902 B19R2.576665 Cc1cc(cc(c1O)C)SCCN2CCCC2=O 62a_100000739059_100011216129 [0,1,1,0,0,1|1,0,0]=4 1903 B19R2.576665 Cc1cc(cc(c1O)C)SCCN2CCCC2=O 62a_100011216129_100000739059 [0,1,1,0,0,1|1,0,0]=4 1904 B19R2.576665 Cc1cc(cc(c1O)Cl)SCCN2CCCC2=O 62a_100000739059_200015900153 [0,1,1,0,0,1|1,0,0]=4 1905 B19R2.576665 Cc1cc(cc(c1O)Cl)SCCN2CCCC2=O 62a_200015900153_100000739059 [0,1,1,0,0,1|1,0,0]=4 1906 B19R2.576665 Cc1cc(cc(c1O)N)SCCN2CCCC2=O 62a_100000739059_100011825904 [0,1,1,0,0,1|1,0,0]=4 1907 B19R2.576665 Cc1cc(cc(c1O)N)SCCN2CCCC2=O 62a_100011825904_100000739059 [0,1,1,0,0,1|1,0,0]=4 1908 B19R2.576665 Nc1c(cc(cc1F)SCCN2CCCC2=O)O 62a_100000739059_100015475841 [0,1,1,0,0,1|1,0,0]=4 1909 B19R2.576665 Nc1c(cc(cc1F)SCCN2CCCC2=O)O 62a_100015475841_100000739059 [0,1,1,0,0,1|1,0,0]=4 1910 B19R2.576665 Nc1cc(cc(c1O)F)SCCN2CCCC2=O 62a_100000739059_100011217383 [0,1,1,0,0,1|1,0,0]=4 1911 B19R2.576665 Nc1cc(cc(c1O)F)SCCN2CCCC2=O 62a_100011217383_100000739059 [0,1,1,0,0,1|1,0,0]=4 1912 B19R2.576665 O=C1CCCN1CCNc2cc(c(c(c2)Br)O)Br 34a_200000186426_100000739059 [0,1,1,0,0,1|1,0,0]=4 1913 B19R2.576665 O=C1CCCN1CCNc2cc(c(c(c2)Cl)Cl)O 34a_100015839415_100000739059 [0,1,1,0,0,1|1,0,0]=4 1914 B19R2.576665 O=C1CCCN1CCNc2cc(c(c(c2)Cl)Cl)O 7a_100015839415_100000739059 [0,1,1,0,0,1|1,0,0]=4 1915 B19R2.576665 O=C1CCCN1CCNc2cc(c(c(c2)Cl)O)Cl 34a_100000695418_100000739059 [0,1,1,0,0,1|1,0,0]=4 1916 B19R2.576665 O=C1CCCN1CCNc2cc(c(c(c2)Cl)O)Cl 7a_100000695418_100000739059 [0,1,1,0,0,1|1,0,0]=4 1917 B19R2.576665 O=C1CCCN1CCNc2cc(c(c(c2)F)O)F 34a_100016987357_100000739059 [0,1,1,0,0,1|1,0,0]=4 1918 B19R2.576665 O=C1CCCN1CCNc2cc(c(c(c2)F)O)F 7a_100016987357_100000739059 [0,1,1,0,0,1|1,0,0]=4 1919 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)Cl)O)Cl 62a_100000739059_100012339652 [0,1,1,0,0,1|1,0,0]=4 1920 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)Cl)O)Cl 62a_100012339652_100000739059 [0,1,1,0,0,1|1,0,0]=4 1921 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)F)F)O 62a_100000709865_100000739059 [0,1,1,0,0,1|1,0,0]=4 1922 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)F)F)O 62a_100000739059_100000709865 [0,1,1,0,0,1|1,0,0]=4 1923 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)F)O)F 62a_100000739059_100011216917 [0,1,1,0,0,1|1,0,0]=4 1924 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)F)O)F 62a_100011216917_100000739059 [0,1,1,0,0,1|1,0,0]=4 1925 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)F)O)O 62a_100000739059_100010114375 [0,1,1,0,0,1|0,0,0]=3 1926 B19R2.576665 O=C1CCCN1CCSc2cc(c(c(c2)O)O)O 62a_100000739059_100010658518 [0,1,1,0,0,1|0,0,0]=3 1927 B19R2.576665 O=C1NCCN1CCSc2cc(c(c(c2)F)O)O 62a_100000090651_100010114375 [0,1,1,0,0,1|1,0,0]=4 1928 B19R2.576665 O=C1NCCN1CCSc2cc(c(c(c2)O)O)O 62a_100000090651_100010658518 [0,1,1,0,0,1|1,0,0]=4 1929 B19R2.584345 Cc1cc(c(cc1NCCN2CCCC2=O)O)Cl 34a_100009961766_100000739059 [0,1,1,0,0,1|1,0,0]=4 1930 B19R2.584345 Cc1cc(c(cc1NCCN2CCCC2=O)O)Cl 7a_100009961766_100000739059 [0,1,1,0,0,1|1,0,0]=4 1931 B19R2.584345 Cc1cc(c(cc1O)C)NCCN2CCCC2=O 34a_100000720036_100000739059 [0,1,1,0,0,1|1,0,0]=4 1932 B19R2.584345 Cc1cc(c(cc1O)C)NCCN2CCCC2=O 7a_100000720036_100000739059 [0,1,1,0,0,1|1,0,0]=4 1933 B19R2.584345 Cc1cc(c(cc1O)C)SCCN2CCCC2=O 62a_100000698207_100000739059 [0,1,1,0,0,1|1,0,0]=4 1934 B19R2.584345 Cc1cc(c(cc1O)C)SCCN2CCCC2=O 62a_100000739059_100000698207 [0,1,1,0,0,1|1,0,0]=4 1935 B19R2.584345 Cc1cc(c(cc1O)NCCN2CCCC2=O)Cl 34a_100000092876_100000739059 [0,1,1,0,0,1|1,0,0]=4 1936 B19R2.584345 Cc1cc(c(cc1O)NCCN2CCCC2=O)Cl 7a_100000092876_100000739059 [0,1,1,0,0,1|1,0,0]=4 1937 B19R2.584345 Cc1cc(c(cc1O)NCCN2CCCC2=O)F 34a_100000117193_100000739059 [0,1,1,0,0,1|1,0,0]=4 1938 B19R2.584345 Cc1cc(c(cc1O)NCCN2CCCC2=O)F 7a_100000117193_100000739059 [0,1,1,0,0,1|1,0,0]=4 1939 B19R2.584345 Cc1cc(c(cc1O)SCCN2CCCC2=O)F 62a_100000739059_100014242602 [0,1,1,0,0,1|1,0,0]=4 1940 B19R2.584345 Cc1cc(c(cc1O)SCCN2CCCC2=O)F 62a_100014242602_100000739059 [0,1,1,0,0,1|1,0,0]=4 1941 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)F)O 62a_100000739059_100012355673 [0,1,1,0,0,1|1,0,0]=4 1942 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)F)O 62a_100012355673_100000739059 [0,1,1,0,0,1|1,0,0]=4 1943 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)N)O 62a_100000739059_200010235796 [0,1,1,0,0,1|1,0,0]=4 1944 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)N)O 62a_200010235796_100000739059 [0,1,1,0,0,1|1,0,0]=4 1945 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)O)F 62a_100000739059_100010068922 [0,1,1,0,0,1|1,0,0]=4 1946 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)O)F 62a_100010068922_100000739059 [0,1,1,0,0,1|1,0,0]=4 1947 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)O)N 62a_100000739059_200010107346 [0,1,1,0,0,1|1,0,0]=4 1948 B19R2.584345 Cc1cc(c(cc1SCCN2CCCC2=O)O)N 62a_200010107346_100000739059 [0,1,1,0,0,1|1,0,0]=4 1949 B19R2.584345 Nc1cc(c(cc1O)Cl)SCCN2CCCC2=O 62a_100000739059_100011011175 [0,1,1,0,0,1|1,0,0]=4 1950 B19R2.584345 Nc1cc(c(cc1O)Cl)SCCN2CCCC2=O 62a_100011011175_100000739059 [0,1,1,0,0,1|1,0,0]=4 1951 B19R2.584345 Nc1cc(c(cc1O)F)SCCN2CCCC2=O 62a_100000739059_100012359894 [0,1,1,0,0,1|1,0,0]=4 1952 B19R2.584345 Nc1cc(c(cc1O)F)SCCN2CCCC2=O 62a_100012359894_100000739059 [0,1,1,0,0,1|1,0,0]=4 1953 B19R2.584345 Nc1cc(c(cc1O)SCCN2CCCC2=O)F 62a_100000739059_100013038943 [0,1,1,0,0,1|1,0,0]=4 1954 B19R2.584345 Nc1cc(c(cc1O)SCCN2CCCC2=O)F 62a_100013038943_100000739059 [0,1,1,0,0,1|1,0,0]=4 1955 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Br)O)Br 34a_100011080774_100000739059 [0,1,1,0,0,1|1,0,0]=4 1956 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Br)O)Br 7a_100011080774_100000739059 [0,1,1,0,0,1|1,0,0]=4 1957 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Cl)Cl)O 34a_100000037174_100000739059 [0,1,1,0,0,1|1,0,0]=4 1958 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Cl)Cl)O 7a_100000037174_100000739059 [0,1,1,0,0,1|1,0,0]=4 1959 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Cl)O)Cl 34a_100012000071_100000739059 [0,1,1,0,0,1|1,0,0]=4 1960 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Cl)O)Cl 7a_100012000071_100000739059 [0,1,1,0,0,1|1,0,0]=4 1961 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Cl)O)F 34a_100009886023_100000739059 [0,1,1,0,0,1|1,0,0]=4 1962 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2Cl)O)F 7a_100009886023_100000739059 [0,1,1,0,0,1|1,0,0]=4 1963 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2F)Cl)O 34a_100000042052_100000739059 [0,1,1,0,0,1|1,0,0]=4 1964 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2F)Cl)O 7a_100000042052_100000739059 [0,1,1,0,0,1|1,0,0]=4 1965 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2F)F)O 34a_100011219470_100000739059 [0,1,1,0,0,1|1,0,0]=4 1966 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2F)F)O 7a_100011219470_100000739059 [0,1,1,0,0,1|1,0,0]=4 1967 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2F)O)F 34a_100020635945_100000739059 [0,1,1,0,0,1|1,0,0]=4 1968 B19R2.584345 O=C1CCCN1CCNc2cc(c(cc2F)O)F 7a_100020635945_100000739059 [0,1,1,0,0,1|1,0,0]=4 1969 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2Br)Cl)O 62a_100000739059_100021297947 [0,1,1,0,0,1|1,0,0]=4 1970 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2Br)Cl)O 62a_100021297947_100000739059 [0,1,1,0,0,1|1,0,0]=4 1971 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2F)Cl)O 62a_100000739059_100010735246 [0,1,1,0,0,1|1,0,0]=4 1972 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2F)Cl)O 62a_100010735246_100000739059 [0,1,1,0,0,1|1,0,0]=4 1973 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2F)F)O 62a_100000739059_100012457948 [0,1,1,0,0,1|1,0,0]=4 1974 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2F)F)O 62a_100012457948_100000739059 [0,1,1,0,0,1|1,0,0]=4 1975 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2F)O)F 62a_100000739059_100011830439 [0,1,1,0,0,1|1,0,0]=4 1976 B19R2.584345 O=C1CCCN1CCSc2cc(c(cc2F)O)F 62a_100011830439_100000739059 [0,1,1,0,0,1|1,0,0]=4 1977 B19R2.1291479 O=C1CCC(=O)N1CCNc2ccc(c(c2)O)O 34a_100102946323_100000736797 [0,1,1,0,0,1|0,0,1]=4 1978 B19R2.2862 COc1cc(ccc1O)CCN2CCNC(=O)C2 2230a_100000184651_100010741665 [0,1,1,0,0,1|1,0,0]=4 1979 B19R2.2862 COc1cc(ccc1O)CCN2CCOC(=O)C2 2230a_100000131268_100010741665 [0,1,1,0,0,1|1,0,0]=4 1980 B19R2.149413 CN1CCN(CC1=O)CCc2ccc(c(c2)O)O 269982a_100000187256_200010393615 [0,1,1,0,0,1|1,0,0]=4 1981 B19R2.97021 CC(=O)C(C)N1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100009814033 [0,1,1,0,0,1|0,0,0]=3 1982 B19R2.97021 CC(C(=O)N)N1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000702099 [0,1,1,0,0,1|1,0,0]=4 1983 B19R2.97021 CC1c2cc(c(cc2CCN1C(F)C(=O)N)O)O 2230a_100000735813_100009813875 [0,1,1,0,0,1|1,0,0]=4 1984 B19R2.3003332 CNC(=O)CN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000183359 [0,1,1,0,0,1|0,0,0]=3 1985 B19R2.3003332 COC(=O)CN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000747449 [0,1,1,0,0,1|0,0,0]=3 1986 B19R2.1706282 CCNC(=O)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000183381 [0,1,1,0,0,1|0,0,0]=3 1987 B19R2.1706282 CCOC(=O)CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000188475 [0,1,1,0,0,1|0,0,0]=3 1988 B19R2.1706282 O=C(CN1CCc2cc(c(cc2C1)O)O)NCO 34a_200015384465_100000185155 [0,1,1,0,0,1|1,0,0]=4 1989 B19R2.1731718 CNC(=O)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100011218921 [0,1,1,0,0,1|1,0,0]=4 1990 B19R2.1731718 CNC(=O)C(C)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000731044 [0,1,1,0,0,1|1,0,0]=4 1991 B19R2.1731718 CNC(=O)C(F)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100009813575 [0,1,1,0,0,1|1,0,0]=4 1992 B19R2.1731718 COC(=O)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000024059 [0,1,1,0,0,1|1,0,0]=4 1993 B19R2.1731718 COC(=O)C(C)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000211248 [0,1,1,0,0,1|1,0,0]=4 1994 B19R2.18903 COc1cc(ccc1CO)SCN2CCCC2=O 62a_100000026320_100011277633 [0,2,1,0,0,0|1,0,0]=4 1995 B19R2.18903 COc1cc(ccc1CO)SCN2CCCC2=O 62a_100011277633_100000026320 [0,2,1,0,0,0|1,0,0]=4 1996 B19R2.18903 COc1ccc(cc1CO)SCN2CCCC2=O 62a_100000026320_100000204679 [0,2,1,0,0,0|1,0,0]=4 1997 B19R2.18903 COc1ccc(cc1CO)SCN2CCCC2=O 62a_100000204679_100000026320 [0,2,1,0,0,0|1,0,0]=4 1998 B19R2.18903 COc1ccc(cc1OC)SCN2CCCC2=O 62a_100000026320_100011356967 [0,2,1,0,0,0|1,0,0]=4 1999 B19R2.18903 O=C1CCCN1CSc2ccc(c(c2)CO)CO 62a_100000026320_100000719600 [0,2,1,0,0,0|1,0,0]=4 2000 B19R2.18903 O=C1CCCN1CSc2ccc(c(c2)CO)CO 62a_100000719600_100000026320 [0,2,1,0,0,0|1,0,0]=4 2001 B19R2.61564 O=C1CCCN1CSc2ccc(c(c2)O)B(O)O 62a_100000026320_100010158982 [0,2,1,0,0,0|1,0,0]=4 2002 B19R2.7888 COc1cc(cc(c1O)O)SCN2CCCC2=O 62a_100000026320_200159242197 [0,2,1,0,0,0|1,0,0]=4 2003 B19R2.7888 O=Cc1cc(cc(c1O)O)SCN2CCCC2=O 62a_100000026320_100010235811 [0,2,1,0,0,0|1,0,0]=4 2004 B19R2.193731 COc1cc(c(cc1O)F)SCN2CCCC2=O 62a_100000026320_100010189133 [0,2,1,0,0,0|1,0,0]=4 2005 B19R2.149409 O=C(O)[C@@H]1CCCN1CCc2ccc(c(c2)O)O 269956a_100000743916_200010393615 [0,2,1,0,0,0|0,0,1]=4 2006 B19R2.855473 CC1c2cc(c(cc2CCN1S(=O)(=O)CCl)O)O 270084a_100000735813_100000031410 [0,2,1,0,0,0|1,0,0]=4 2007 B19R2.855473 CC1c2cc(c(cc2CCN1S(=O)(=O)CCl)O)O 274078a_100000735813_100000031410 [0,2,1,0,0,0|1,0,0]=4 2008 B19R2.855473 CCS(=O)(=O)N1CCc2cc(c(cc2C1C)O)O 270084a_100000735813_100000211323 [0,2,1,0,0,0|1,0,0]=4 2009 B19R2.855473 CCS(=O)(=O)N1CCc2cc(c(cc2C1C)O)O 274078a_100000735813_100000211323 [0,2,1,0,0,0|1,0,0]=4 2010 B19R2.14351 COc1cc2c(cc1OC)C(N(CC2)C(=O)C)C 11a_100000188947_100015343762 [0,2,1,0,0,0|0,0,0]=3 2011 B19R2.14351 COc1cc2c(cc1OC)C(N(CC2)C(=O)C)C 1626a_100000188947_100015343762 [0,2,1,0,0,0|0,0,0]=3 2012 B19R2.14351 COc1cc2c(cc1OC)C(N(CC2)C(=O)C)C 240690a_100000188947_100015343762 [0,2,1,0,0,0|0,0,0]=3 2013 B19R2.14351 COc1cc2c(cc1OC)C(N(CC2)C(=O)C)C 527a_100000188947_100103153847 [0,2,1,0,0,0|0,0,0]=3 2014 B19R2.1166277 C#CCC(=O)N1CCc2cc(c(cc2C1C)O)O 527a_100000735813_100011220946 [0,2,1,0,0,0|0,0,0]=3 2015 B19R2.1166277 C=CCC(=O)N1CCc2cc(c(cc2C1C)O)O 527a_100000735813_100000210193 [0,2,1,0,0,0|0,0,0]=3 2016 B19R2.1166277 CCCC(=O)N1CCc2cc(c(cc2C1C)O)O 527a_100000735813_100000211992 [0,2,1,0,0,0|0,0,0]=3 2017 B19R2.1166277 CCNC(=O)N1CCc2cc(c(cc2C1C)O)O 273464a_100015525214_100000735813 [0,2,1,0,0,0|0,0,0]=3 2018 B19R2.1166277 COCC(=O)N1CCc2cc(c(cc2C1C)O)O 527a_100000735813_100000210968 [0,2,1,0,0,0|0,0,0]=3 2019 B19R2.1166277 CSCC(=O)N1CCc2cc(c(cc2C1C)O)O 527a_100000735813_100000184570 [0,2,1,0,0,0|0,0,0]=3 2020 B19R2.13797 CCC(=O)N1CCc2cc(c(cc2C1)OC)OC 11a_100000185277_100000210414 [0,2,1,0,0,0|0,0,0]=3 2021 B19R2.13797 CCC(=O)N1CCc2cc(c(cc2C1)OC)OC 1626a_100000185277_100000210414 [0,2,1,0,0,0|0,0,0]=3 2022 B19R2.13797 CCC(=O)N1CCc2cc(c(cc2C1)OC)OC 240690a_100000185277_100000210414 [0,2,1,0,0,0|0,0,0]=3 2023 B19R2.13797 CCC(=O)N1CCc2cc(c(cc2C1)OC)OC 527a_100000185277_100000210414 [0,2,1,0,0,0|0,0,0]=3 2024 B19R2.13797 CNC(=O)N1CCc2cc(c(cc2C1)OC)OC 2708a_100102657272_100000185277 [0,2,1,0,0,0|1,0,0]=4 2025 B19R2.13797 CNC(=O)N1CCc2cc(c(cc2C1)OC)OC 273464a_100102657272_100000185277 [0,2,1,0,0,0|1,0,0]=4 2026 B19R2.13797 COc1cc2c(cc1OC)CN(CC2)C(=O)CO 240690a_100000185277_100000210174 [0,2,1,0,0,0|1,0,0]=4 2027 B19R2.13797 COc1cc2c(cc1OC)CN(CC2)C(=O)CO 527a_100000185277_100000210174 [0,2,1,0,0,0|1,0,0]=4 2028 B19R2.92113 CC(C)S(=O)(=O)N1CCc2cc(c(cc2C1)O)O 270084a_200015384465_100000742656 [0,2,1,0,0,0|1,0,0]=4 2029 B19R2.92113 CC(C)S(=O)(=O)N1CCc2cc(c(cc2C1)O)O 274078a_200015384465_100000742656 [0,2,1,0,0,0|1,0,0]=4 2030 B19R2.92116 CC(C)(C)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_106744555173 [0,2,1,0,0,0|0,0,0]=3 2031 B19R2.92116 CC(C)(F)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000765255 [0,2,1,0,0,0|0,0,0]=3 2032 B19R2.92116 CC(C)(O)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000242741 [0,2,1,0,0,0|0,0,0]=3 2033 B19R2.92116 CC(F)(F)C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000042251 [0,2,1,0,0,0|0,0,0]=3 2034 B19R2.92116 O=C(N1CCc2cc(c(cc2C1)O)O)C(F)(F)F 240690a_200015384465_100015355933 [0,2,1,0,0,0|1,0,0]=4 2035 B19R2.92116 [2H]C([2H])([2H])C(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_200015216371 [0,2,1,0,0,0|1,0,0]=4 2036 B19R2.3070888 CCC(C(=O)N)N1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000750255 [0,2,1,0,0,0|0,0,1]=4 2037 B19R2.3349588 CCCS(=O)(=O)N1CCc2cc(c(cc2C1)O)O 270084a_200015384465_100000211391 [0,2,1,0,0,0|1,0,0]=4 2038 B19R2.3349588 CCCS(=O)(=O)N1CCc2cc(c(cc2C1)O)O 274078a_200015384465_100000211391 [0,2,1,0,0,0|1,0,0]=4 2039 B19R2.3349588 O=S(=O)(CCBr)N1CCc2cc(c(cc2C1)O)O 270084a_200015384465_100000731045 [0,2,1,0,0,0|1,0,0]=4 2040 B19R2.3349588 O=S(=O)(CCBr)N1CCc2cc(c(cc2C1)O)O 274078a_200015384465_100000731045 [0,2,1,0,0,0|1,0,0]=4 2041 B19R2.3349588 O=S(=O)(CCCl)N1CCc2cc(c(cc2C1)O)O 270084a_200015384465_100000184613 [0,2,1,0,0,0|1,0,0]=4 2042 B19R2.3349588 O=S(=O)(CCCl)N1CCc2cc(c(cc2C1)O)O 274078a_200015384465_100000184613 [0,2,1,0,0,0|1,0,0]=4 2043 B19R2.92104 CC(=CC(=O)N1CCc2cc(c(cc2C1)O)O)C 240690a_200015384465_100000211388 [0,2,1,0,0,0|0,0,1]=4 2044 B19R2.92104 CC(=CC(=O)N1CCc2cc(c(cc2C1)O)O)Cl 240690a_200015384465_200042562850 [0,2,1,0,0,0|0,0,1]=4 2045 B19R2.92104 CC(C)CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210554 [0,2,1,0,0,0|0,0,0]=3 2046 B19R2.92104 CC(C)NC(=O)N1CCc2cc(c(cc2C1)O)O 273464a_100138425928_200015384465 [0,2,1,0,0,0|0,0,0]=3 2047 B19R2.92104 CN(C)CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000750896 [0,2,1,0,0,0|0,0,0]=3 2048 B19R2.92104 C[C@@H](O)CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100011933948 [0,2,1,0,0,0|0,0,0]=3 2049 B19R2.92104 C[S+](C)CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_200159257847 [0,2,1,0,0,0|0,0,0]=3 2050 B19R2.92104 NC(=O)CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100134613110 [0,2,1,0,0,0|0,0,1]=4 2051 B19R2.1687941 C#CCCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000692101 [0,2,1,0,0,0|0,0,0]=3 2052 B19R2.1687941 C#CCNC(=O)N1CCc2cc(c(cc2C1)O)O 273464a_100000212058_200015384465 [0,2,1,0,0,0|0,0,1]=4 2053 B19R2.1687941 C=CCCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000749702 [0,2,1,0,0,0|0,0,0]=3 2054 B19R2.1687941 C=CCNC(=O)N1CCc2cc(c(cc2C1)O)O 273464a_100020586998_200015384465 [0,2,1,0,0,0|0,0,1]=4 2055 B19R2.1687941 CC=CCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100121576822 [0,2,1,0,0,0|0,0,0]=3 2056 B19R2.1687941 CCC=CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000212282 [0,2,1,0,0,0|0,0,0]=3 2057 B19R2.1687941 CCCCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000210183 [0,2,1,0,0,0|0,0,0]=3 2058 B19R2.1687941 CCCNC(=O)N1CCc2cc(c(cc2C1)O)O 273464a_100020643023_200015384465 [0,2,1,0,0,0|0,0,0]=3 2059 B19R2.1687941 CCOCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000211967 [0,2,1,0,0,0|0,0,0]=3 2060 B19R2.1687941 CCSCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000230394 [0,2,1,0,0,0|0,0,0]=3 2061 B19R2.1687941 COC=CC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100016268678 [0,2,1,0,0,0|0,0,1]=4 2062 B19R2.1687941 COCCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000749529 [0,2,1,0,0,0|0,0,0]=3 2063 B19R2.1687941 CSCCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000174002 [0,2,1,0,0,0|0,0,0]=3 2064 B19R2.1687941 N#CCCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100011934036 [0,2,1,0,0,0|0,0,0]=3 2065 B19R2.1687941 N#CCNC(=O)N1CCc2cc(c(cc2C1)O)O 273464a_100000734998_200015384465 [0,2,1,0,0,0|0,0,1]=4 2066 B19R2.1687941 O=C(NCCF)N1CCc2cc(c(cc2C1)O)O 273464a_100000724931_200015384465 [0,2,1,0,0,0|0,0,0]=3 2067 B19R2.1687941 O=C(NCCO)N1CCc2cc(c(cc2C1)O)O 273464a_100000210304_200015384465 [0,2,1,0,0,0|0,0,0]=3 2068 B19R2.1687941 [N-]=[N+]=NCC(=O)N1CCc2cc(c(cc2C1)O)O 240690a_200015384465_100000751907 [0,2,1,0,0,0|1,0,0]=4 2069 B17R2.56712 O=C(NCCc1ccc(c(c1)O)O)C2CC2 240690a_100000210387_100000210395 [0,0,2,1,0,0|0,0,0]=3 2070 B17R2.56712 O=C(NCCc1ccc(c(c1)O)O)C2CC2 527a_100000210387_100000210395 [0,0,2,1,0,0|0,0,0]=3 2071 B17R2.56712 O=C(NCCc1ccc(c(c1)O)O)C2CO2 240690a_100000210387_100000701028 [0,0,2,1,0,0|1,0,0]=4 2072 B17R2.56712 O=C(NCCc1ccc(c(c1)O)O)C2CO2 527a_100000210387_100000701028 [0,0,2,1,0,0|1,0,0]=4 2073 B17R2.311425 CCOC(=O)C1CC1c2ccc(c(c2)O)O 271570a_100010780539_100009813601 [0,0,2,1,0,0|1,0,0]=4 2074 B17R2.410 O=C1CCC1NCCc2ccc(c(c2)O)O 34a_100000210387_100009892977 [0,0,2,1,0,0|0,0,0]=3 2075 B17R2.410 O=C1CCC1SCCc2ccc(c(c2)O)O 62a_100009892977_200010393615 [0,0,2,1,0,0|1,0,0]=4 2076 B19R3.3027039 O=C1CCC1N2CCc3cc(c(cc3C2)O)O 34a_200015384465_100009892977 [0,0,1,1,0,1|0,0,0]=3 2077 B19R3.149922 O=C(C1CC1)N2CCc3cc(c(cc3C2)O)O 240690a_200015384465_100000210395 [0,1,1,1,0,0|0,0,0]=3 2078 B19R3.149922 O=C(C1CO1)N2CCc3cc(c(cc3C2)O)O 240690a_200015384465_100000701028 [0,1,1,1,0,0|0,0,0]=3 2079 B15R2.18973 Oc1ccc(cc1O)CCN2CCC2 269982a_100000754969_200010393615 [1,0,1,0,1,0|0,0,0]=3 2080 B15R2.8200 CC(=O)N1CCc2c1cc(c(c2)O)O 271570a_203496583355_100010742161 [1,0,1,0,1,0|0,0,0]=3 2081 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 11a_100000702344_100000210414 [1,0,1,0,1,0|1,0,0]=4 2082 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 1626a_100000702344_100000210414 [1,0,1,0,1,0|1,0,0]=4 2083 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 240690a_100000702344_100000210414 [1,0,1,0,1,0|1,0,0]=4 2084 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Br 527a_100000702344_100000210414 [1,0,1,0,1,0|1,0,0]=4 2085 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 11a_100015205306_100000210414 [1,0,1,0,1,0|1,0,0]=4 2086 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 1626a_100015205306_100000210414 [1,0,1,0,1,0|1,0,0]=4 2087 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 240690a_100015205306_100000210414 [1,0,1,0,1,0|1,0,0]=4 2088 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)Cl 527a_100015205306_100000210414 [1,0,1,0,1,0|1,0,0]=4 2089 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 11a_100000766377_100000210414 [1,0,1,0,1,0|1,0,0]=4 2090 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 1626a_100000766377_100000210414 [1,0,1,0,1,0|1,0,0]=4 2091 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 240690a_100000766377_100000210414 [1,0,1,0,1,0|1,0,0]=4 2092 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)F 527a_100000766377_100000210414 [1,0,1,0,1,0|1,0,0]=4 2093 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)O 240690a_100015195982_100000210414 [1,0,1,0,1,0|0,0,0]=3 2094 B15R2.1590 CCC(=O)N1Cc2ccc(cc2C1)O 527a_100015195982_100000210414 [1,0,1,0,1,0|0,0,0]=3 2095 B15R2.1590 CNC(=O)N1Cc2ccc(cc2C1)O 2708a_100102657272_100015195982 [1,0,1,0,1,0|1,0,0]=4 2096 B15R2.1590 CNC(=O)N1Cc2ccc(cc2C1)O 273464a_100102657272_100015195982 [1,0,1,0,1,0|1,0,0]=4 2097 B15R2.1590 O=C(CO)N1Cc2ccc(cc2C1)O 240690a_100015195982_100000210174 [1,0,1,0,1,0|1,0,0]=4 2098 B15R2.1590 O=C(CO)N1Cc2ccc(cc2C1)O 527a_100015195982_100000210174 [1,0,1,0,1,0|1,0,0]=4 2099 B17R1.28782 CCc1cc(c(cc1SCCCC(=O)N)F)O 62a_100011156610_100102525003 [0,0,2,0,0,1|1,0,0]=4 2100 B17R1.28782 CCc1cc(c(cc1SCCCC(=O)N)F)O 62a_100102525003_100011156610 [0,0,2,0,0,1|1,0,0]=4 2101 B17R1.28782 CCc1cc(c(cc1SCCNC(=O)C)F)O 62a_100000189650_100011156610 [0,0,2,0,0,1|1,0,0]=4 2102 B17R1.28782 CCc1cc(c(cc1SCCNC(=O)C)F)O 62a_100011156610_100000189650 [0,0,2,0,0,1|1,0,0]=4 2103 B17R1.26531 CNC(=O)CCCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000741757 [0,0,2,0,0,1|1,0,0]=4 2104 B17R1.26531 CNC(=O)CCCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000741757 [0,0,2,0,0,1|1,0,0]=4 2105 B17R1.26531 CNC(=O)CCCNc1cc(c(cc1C)O)C 34a_100000720036_100000741757 [0,0,2,0,0,1|1,0,0]=4 2106 B17R1.26531 CNC(=O)CCCNc1cc(c(cc1C)O)C 7a_100000720036_100000741757 [0,0,2,0,0,1|1,0,0]=4 2107 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)F)O 62a_100000741757_100010068922 [0,0,2,0,0,1|1,0,0]=4 2108 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)F)O 62a_100010068922_100000741757 [0,0,2,0,0,1|1,0,0]=4 2109 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)N)O 62a_100000741757_200010107346 [0,0,2,0,0,1|1,0,0]=4 2110 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)N)O 62a_200010107346_100000741757 [0,0,2,0,0,1|1,0,0]=4 2111 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)O)C 62a_100000698207_100000741757 [0,0,2,0,0,1|1,0,0]=4 2112 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)O)C 62a_100000741757_100000698207 [0,0,2,0,0,1|1,0,0]=4 2113 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)O)F 62a_100000741757_100012355673 [0,0,2,0,0,1|1,0,0]=4 2114 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)O)F 62a_100012355673_100000741757 [0,0,2,0,0,1|1,0,0]=4 2115 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)O)N 62a_100000741757_200010235796 [0,0,2,0,0,1|1,0,0]=4 2116 B17R1.26531 CNC(=O)CCCSc1cc(c(cc1C)O)N 62a_200010235796_100000741757 [0,0,2,0,0,1|1,0,0]=4 2117 B17R2.215 O=C1CN(CCN1)CCc2ccc(cc2)O 2230a_100000184651_100009816426 [1,0,1,0,0,1|1,0,0]=4 2118 B17R2.215 O=C1CN(CCO1)CCc2ccc(cc2)O 2230a_100000131268_100009816426 [1,0,1,0,0,1|1,0,0]=4 2119 B17R2.3278 Cc1ccc(cc1)CSCN2CCCC2=O 62a_100000026320_100000210814 [1,0,1,0,0,1|1,0,0]=4 2120 B17R2.3278 Cc1ccc(cc1)CSCN2CCCC2=O 62a_100000210814_100000026320 [1,0,1,0,0,1|1,0,0]=4 2121 B17R2.3278 Cc1ccc(cc1)NCCN2CCCC2=O 34a_100000124888_100000739059 [1,0,1,0,0,1|1,0,0]=4 2122 B17R2.3278 Cc1ccc(cc1)OCCN2CCCC2=O 34a_100000210336_100000739059 [1,0,1,0,0,1|1,0,0]=4 2123 B17R2.3278 Cc1ccc(cc1)OCCN2CCCC2=O 7a_100000210336_100000739059 [1,0,1,0,0,1|1,0,0]=4 2124 B17R2.3278 Cc1ccc(cc1)SCCN2CCCC2=O 62a_100000186775_100000739059 [1,0,1,0,0,1|1,0,0]=4 2125 B17R2.3278 Cc1ccc(cc1)SCCN2CCCC2=O 62a_100000739059_100000186775 [1,0,1,0,0,1|1,0,0]=4 2126 B17R2.3278 Nc1ccc(cc1)OCCN2CCCC2=O 34a_100000185829_100000739059 [1,0,1,0,0,1|1,0,0]=4 2127 B17R2.3278 Nc1ccc(cc1)SCCN2CCCC2=O 62a_100000185761_100000739059 [1,0,1,0,0,1|1,0,0]=4 2128 B17R2.3278 Nc1ccc(cc1)SCCN2CCCC2=O 62a_100000739059_100000185761 [1,0,1,0,0,1|1,0,0]=4 2129 B17R2.3278 O=C1CCCC1NCCc2ccc(cc2)O 34a_100000743037_100000709159 [1,0,1,0,0,1|1,0,0]=4 2130 B17R2.3278 O=C1CCCC1SCCc2ccc(cc2)O 62a_100000211823_100009816426 [1,0,1,0,0,1|1,0,0]=4 2131 B17R2.3278 O=C1CCCC1SCCc2ccc(cc2)O 62a_100009816426_100000211823 [1,0,1,0,0,1|1,0,0]=4 2132 B17R2.3278 O=C1CCCN1CCNc2ccc(cc2)Br 2230a_100000210018_100000739059 [1,0,1,0,0,1|1,0,0]=4 2133 B17R2.3278 O=C1CCCN1CCNc2ccc(cc2)Br 34a_100000210018_100000739059 [1,0,1,0,0,1|1,0,0]=4 2134 B17R2.3278 O=C1CCCN1CCNc2ccc(cc2)Cl 2230a_100000210052_100000739059 [1,0,1,0,0,1|1,0,0]=4 2135 B17R2.3278 O=C1CCCN1CCNc2ccc(cc2)Cl 34a_100000210052_100000739059 [1,0,1,0,0,1|1,0,0]=4 2136 B17R2.3278 O=C1CCCN1CCNc2ccc(cc2)F 34a_100000185862_100000739059 [1,0,1,0,0,1|1,0,0]=4 2137 B17R2.3278 O=C1CCCN1CCNc2ccc(cc2)I 34a_100000185761_100000739059 [1,0,1,0,0,1|1,0,0]=4 2138 B17R2.3278 O=C1CCCN1CCNc2ccc(cc2)O 34a_100000185829_100000739059 [1,0,1,0,0,1|0,0,0]=3 2139 B17R2.3278 O=C1CCCN1CCOc2ccc(cc2)Br 34a_100000185759_100000739059 [1,0,1,0,0,1|1,0,0]=4 2140 B17R2.3278 O=C1CCCN1CCOc2ccc(cc2)Br 7a_100000185759_100000739059 [1,0,1,0,0,1|1,0,0]=4 2141 B17R2.3278 O=C1CCCN1CCOc2ccc(cc2)Cl 34a_100000210216_100000739059 [1,0,1,0,0,1|1,0,0]=4 2142 B17R2.3278 O=C1CCCN1CCOc2ccc(cc2)Cl 7a_100000210216_100000739059 [1,0,1,0,0,1|1,0,0]=4 2143 B17R2.3278 O=C1CCCN1CCOc2ccc(cc2)F 34a_100000210339_100000739059 [1,0,1,0,0,1|1,0,0]=4 2144 B17R2.3278 O=C1CCCN1CCOc2ccc(cc2)I 34a_100000212066_100000739059 [1,0,1,0,0,1|1,0,0]=4 2145 B17R2.3278 O=C1CCCN1CCOc2ccc(cc2)I 7a_100000212066_100000739059 [1,0,1,0,0,1|1,0,0]=4 2146 B17R2.3278 O=C1CCCN1CCSc2ccc(cc2)Br 62a_100000739059_100000752885 [1,0,1,0,0,1|1,0,0]=4 2147 B17R2.3278 O=C1CCCN1CCSc2ccc(cc2)Br 62a_100000752885_100000739059 [1,0,1,0,0,1|1,0,0]=4 2148 B17R2.3278 O=C1CCCN1CCSc2ccc(cc2)Cl 62a_100000739059_100000755918 [1,0,1,0,0,1|1,0,0]=4 2149 B17R2.3278 O=C1CCCN1CCSc2ccc(cc2)Cl 62a_100000755918_100000739059 [1,0,1,0,0,1|1,0,0]=4 2150 B17R2.3278 O=C1CCCN1CCSc2ccc(cc2)F 62a_100000211213_100000739059 [1,0,1,0,0,1|1,0,0]=4 2151 B17R2.3278 O=C1CCCN1CCSc2ccc(cc2)F 62a_100000739059_100000211213 [1,0,1,0,0,1|1,0,0]=4 2152 B17R2.3278 O=C1CCCN1CCSc2ccc(cc2)O 62a_100000739059_100000185759 [1,0,1,0,0,1|0,0,0]=3 2153 B17R2.3278 O=C1CCCN1CCSc2ccc(cn2)O 62a_100000685995_100000739059 [1,0,1,0,0,1|1,0,0]=4 2154 B17R2.3278 O=C1CCCN1CCSc2ccc(cn2)O 62a_100000739059_100000744096 [1,0,1,0,0,1|1,0,0]=4 2155 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)Br 62a_100000026320_100000189115 [1,0,1,0,0,1|1,0,0]=4 2156 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)Br 62a_100000189115_100000026320 [1,0,1,0,0,1|1,0,0]=4 2157 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)Cl 62a_100000026320_100000187161 [1,0,1,0,0,1|1,0,0]=4 2158 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)Cl 62a_100000187161_100000026320 [1,0,1,0,0,1|1,0,0]=4 2159 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)F 62a_100000026320_100000187164 [1,0,1,0,0,1|1,0,0]=4 2160 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)F 62a_100000198546_100000026320 [1,0,1,0,0,1|1,0,0]=4 2161 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)I 62a_100000026320_100000189116 [1,0,1,0,0,1|1,0,0]=4 2162 B17R2.3278 O=C1CCCN1CSCc2ccc(cc2)I 62a_100000189116_100000026320 [1,0,1,0,0,1|1,0,0]=4 2163 B17R2.3278 O=C1NCCN1CCSc2ccc(cc2)O 62a_100000090651_100000185759 [1,0,1,0,0,1|1,0,0]=4 2164 B17R2.3373 Cc1cccc(c1)CSCN2CCCC2=O 62a_100000026320_100000211840 [1,0,1,0,0,1|1,0,0]=4 2165 B17R2.3373 Cc1cccc(c1)CSCN2CCCC2=O 62a_100000211840_100000026320 [1,0,1,0,0,1|1,0,0]=4 2166 B17R2.3373 Cc1cccc(c1)NCCN2CCCC2=O 2230a_100000188690_100000739059 [1,0,1,0,0,1|1,0,0]=4 2167 B17R2.3373 Cc1cccc(c1)NCCN2CCCC2=O 34a_100000188690_100000739059 [1,0,1,0,0,1|1,0,0]=4 2168 B17R2.3373 Cc1cccc(c1)OCCN2CCCC2=O 34a_100000210337_100000739059 [1,0,1,0,0,1|1,0,0]=4 2169 B17R2.3373 Cc1cccc(c1)OCCN2CCCC2=O 7a_100000210337_100000739059 [1,0,1,0,0,1|1,0,0]=4 2170 B17R2.3373 Cc1cccc(c1)SCCN2CCCC2=O 62a_100000739059_100011215228 [1,0,1,0,0,1|1,0,0]=4 2171 B17R2.3373 Cc1cccc(c1)SCCN2CCCC2=O 62a_100011215228_100000739059 [1,0,1,0,0,1|1,0,0]=4 2172 B17R2.3373 Nc1cccc(c1)OCCN2CCCC2=O 34a_100000210217_100000739059 [1,0,1,0,0,1|1,0,0]=4 2173 B17R2.3373 Nc1cccc(c1)SCCN2CCCC2=O 62a_100000210019_100000739059 [1,0,1,0,0,1|1,0,0]=4 2174 B17R2.3373 Nc1cccc(c1)SCCN2CCCC2=O 62a_100000739059_100000210019 [1,0,1,0,0,1|1,0,0]=4 2175 B17R2.3373 O=C1CCCC1NCCc2cccc(c2)O 2230a_100000747277_100000211823 [1,0,1,0,0,1|1,0,0]=4 2176 B17R2.3373 O=C1CCCC1NCCc2cccc(c2)O 34a_100000747277_100000709159 [1,0,1,0,0,1|1,0,0]=4 2177 B17R2.3373 O=C1CCCN1CCNc2cccc(c2)Br 34a_100000210019_100000739059 [1,0,1,0,0,1|1,0,0]=4 2178 B17R2.3373 O=C1CCCN1CCNc2cccc(c2)Cl 34a_100000185859_100000739059 [1,0,1,0,0,1|1,0,0]=4 2179 B17R2.3373 O=C1CCCN1CCNc2cccc(c2)F 34a_100000210047_100000739059 [1,0,1,0,0,1|1,0,0]=4 2180 B17R2.3373 O=C1CCCN1CCNc2cccc(c2)I 34a_100000211102_100000739059 [1,0,1,0,0,1|1,0,0]=4 2181 B17R2.3373 O=C1CCCN1CCNc2cccc(c2)O 34a_100000210217_100000739059 [1,0,1,0,0,1|0,0,0]=3 2182 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)Br 34a_100000210342_100000739059 [1,0,1,0,0,1|1,0,0]=4 2183 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)Br 7a_100000210342_100000739059 [1,0,1,0,0,1|1,0,0]=4 2184 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)Cl 34a_100000210295_100000739059 [1,0,1,0,0,1|1,0,0]=4 2185 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)Cl 7a_100000210295_100000739059 [1,0,1,0,0,1|1,0,0]=4 2186 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)F 34a_100000210426_100000739059 [1,0,1,0,0,1|1,0,0]=4 2187 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)F 7a_100000210426_100000739059 [1,0,1,0,0,1|1,0,0]=4 2188 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)I 34a_100000211634_100000739059 [1,0,1,0,0,1|1,0,0]=4 2189 B17R2.3373 O=C1CCCN1CCOc2cccc(c2)I 7a_100000211634_100000739059 [1,0,1,0,0,1|1,0,0]=4 2190 B17R2.3373 O=C1CCCN1CCSc2cc(ccn2)O 62a_100000739059_100000762945 [1,0,1,0,0,1|1,0,0]=4 2191 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)Br 62a_100000691529_100000739059 [1,0,1,0,0,1|1,0,0]=4 2192 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)Br 62a_100000739059_100000691529 [1,0,1,0,0,1|1,0,0]=4 2193 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)Cl 62a_100000699651_100000739059 [1,0,1,0,0,1|1,0,0]=4 2194 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)Cl 62a_100000739059_100000699651 [1,0,1,0,0,1|1,0,0]=4 2195 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)F 62a_100000685547_100000739059 [1,0,1,0,0,1|1,0,0]=4 2196 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)F 62a_100000739059_100000685547 [1,0,1,0,0,1|1,0,0]=4 2197 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)O 62a_100000739059_100000211634 [1,0,1,0,0,1|0,0,0]=3 2198 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)[S] 62a_100000739059_114929384022 [1,0,1,0,0,1|0,1,0]=4 2199 B17R2.3373 O=C1CCCN1CCSc2cccc(c2)[S] 62a_114929384022_100000739059 [1,0,1,0,0,1|0,1,0]=4 2200 B17R2.3373 O=C1CCCN1CCSc2cncc(c2)O 62a_100000739059_100000754920 [1,0,1,0,0,1|1,0,0]=4 2201 B17R2.3373 O=C1CCCN1CCSc2cncc(c2)O 62a_100000754920_100000739059 [1,0,1,0,0,1|1,0,0]=4 2202 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)Br 62a_100000026320_100000211773 [1,0,1,0,0,1|1,0,0]=4 2203 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)Br 62a_100000211773_100000026320 [1,0,1,0,0,1|1,0,0]=4 2204 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)Cl 62a_100000026320_100000187163 [1,0,1,0,0,1|1,0,0]=4 2205 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)Cl 62a_100000187163_100000026320 [1,0,1,0,0,1|1,0,0]=4 2206 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)F 62a_100000026320_100000230114 [1,0,1,0,0,1|1,0,0]=4 2207 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)F 62a_100000230114_100000026320 [1,0,1,0,0,1|1,0,0]=4 2208 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)I 62a_100000026320_100011218688 [1,0,1,0,0,1|1,0,0]=4 2209 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)I 62a_100011218688_100000026320 [1,0,1,0,0,1|1,0,0]=4 2210 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)O 62a_100000026320_100011660834 [1,0,1,0,0,1|0,0,0]=3 2211 B17R2.3373 O=C1CCCN1CSCc2cccc(c2)O 62a_100011660834_100000026320 [1,0,1,0,0,1|0,0,0]=3 2212 B17R2.3373 O=C1NCCN1CCSc2cccc(c2)O 62a_100000090651_100000211634 [1,0,1,0,0,1|1,0,0]=4 2213 B17R2.9611 CCC(=O)CN1CCc2ccc(cc2C1)Br 269982a_100015189961_100000747405 [1,0,1,0,0,1|1,0,0]=4 2214 B17R2.9611 CCC(=O)CN1CCc2ccc(cc2C1)C 269982a_100011255368_100000747405 [1,0,1,0,0,1|1,0,0]=4 2215 B17R2.9611 CCC(=O)CN1CCc2ccc(cc2C1)Cl 269982a_100000690163_100000747405 [1,0,1,0,0,1|1,0,0]=4 2216 B17R2.9611 CCC(=O)CN1CCc2ccc(cc2C1)F 269982a_100000755980_100000747405 [1,0,1,0,0,1|1,0,0]=4 2217 B17R2.9611 CCC(=O)CN1CCc2ccc(cc2C1)O 269982a_100015185785_100000747405 [1,0,1,0,0,1|0,0,0]=3 2218 B17R2.9611 CCC(=O)N[C@@H]1CCc2ccc(cc2C1)O 1626a_100015730448_100000210414 [1,0,1,0,0,1|1,0,0]=4 2219 B17R2.9611 CCC(=O)N[C@@H]1CCc2ccc(cc2C1)O 240690a_100015730448_100000210414 [1,0,1,0,0,1|1,0,0]=4 2220 B17R2.9611 CCC(=O)N[C@@H]1CCc2ccc(cc2C1)O 527a_100015730448_100000210414 [1,0,1,0,0,1|1,0,0]=4 2221 B17R2.9611 CNC(=O)CN1CCc2ccc(cc2C1)O 2230a_100015185785_100000183359 [1,0,1,0,0,1|1,0,0]=4 2222 B17R2.9611 CNC(=O)CN1CCc2ccc(cc2C1)O 269982a_100015185785_100000183359 [1,0,1,0,0,1|1,0,0]=4 2223 B17R2.9611 CNC(=O)CN1CCc2ccc(cc2C1)O 34a_100015185785_100000183359 [1,0,1,0,0,1|1,0,0]=4 2224 B17R2.9611 COC(=O)CN1CCc2ccc(cc2C1)O 2230a_100015185785_100000747449 [1,0,1,0,0,1|1,0,0]=4 2225 B17R2.9611 COC(=O)CN1CCc2ccc(cc2C1)O 269982a_100015185785_100000747449 [1,0,1,0,0,1|1,0,0]=4 2226 B17R2.9611 COC(=O)CN1CCc2ccc(cc2C1)O 34a_100015185785_100000747449 [1,0,1,0,0,1|1,0,0]=4 2227 B17R2.57287 CCC(=O)N1CCOc2ccc(cc2C1)Cl 11a_100000741138_100000210414 [1,0,1,0,0,1|1,0,0]=4 2228 B17R2.57287 CCC(=O)N1CCOc2ccc(cc2C1)Cl 1626a_100000741138_100000210414 [1,0,1,0,0,1|1,0,0]=4 2229 B17R2.57287 CCC(=O)N1CCOc2ccc(cc2C1)Cl 240690a_100000741138_100000210414 [1,0,1,0,0,1|1,0,0]=4 2230 B17R2.57287 CCC(=O)N1CCOc2ccc(cc2C1)Cl 527a_100000741138_100000210414 [1,0,1,0,0,1|1,0,0]=4 2231 B19R2.193727 CCc1cc(c(cc1SC[C@@H]2CCC(=O)N2)F)O 62a_100011156610_100015189358 [0,0,1,0,0,2|1,0,0]=4 2232 B19R2.193727 CCc1cc(c(cc1SC[C@@H]2CCC(=O)N2)F)O 62a_100015189358_100011156610 [0,0,1,0,0,2|1,0,0]=4 2233 B19R2.50071 O=C1CCCCC1NCCc2ccc(c(c2)O)O 34a_100000210387_100000754470 [0,0,1,0,0,2|1,0,0]=4 2234 B19R2.50071 O=C1CCCCC1SCCc2ccc(c(c2)O)O 62a_100000204591_200010393615 [0,0,1,0,0,2|1,0,0]=4 2235 B19R2.50071 O=C1CCOCC1NCCc2ccc(c(c2)O)O 34a_100000210387_100012180262 [0,0,1,0,0,2|1,0,0]=4 2236 B19R2.50071 O=C1CCOCC1SCCc2ccc(c(c2)O)O 62a_100012180262_200010393615 [0,0,1,0,0,2|1,0,0]=4 2237 B19R2.50071 O=C1NCCCC1NCCc2ccc(c(c2)O)O 34a_100000210387_100000687798 [0,0,1,0,0,2|1,0,0]=4 2238 B19R2.50071 O=C1NCCCC1SCCc2ccc(c(c2)O)O 62a_100000687798_200010393615 [0,0,1,0,0,2|1,0,0]=4 2239 B19R2.51720 O=C1CCCN1CCNCc2ccc(c(c2)F)O 34a_100000758358_100000739059 [0,0,1,0,0,2|1,0,0]=4 2240 B19R2.51720 O=C1CCCN1CCNCc2ccc(c(c2)O)Cl 34a_100020636435_100000739059 [0,0,1,0,0,2|1,0,0]=4 2241 B19R2.51720 O=C1CCCN1CCNCc2ccc(c(c2)O)F 34a_100160469508_100000739059 [0,0,1,0,0,2|1,0,0]=4 2242 B19R2.51720 O=C1CCCN1CCNCc2ccc(c(c2)O)O 34a_100000010075_100000739059 [0,0,1,0,0,2|0,0,0]=3 2243 B19R2.51720 O=C1CCCN1CSCCc2ccc(c(c2)O)O 62a_100000026320_200010393615 [0,0,1,0,0,2|0,0,0]=3 2244 B19R2.588700 O=C1CCN(CCN1)CCc2ccc(c(c2)O)O 269982a_100000698595_200010393615 [0,0,1,0,0,2|1,0,0]=4 2245 B19R2.97022 C=C(C)CCN1CCc2cc(c(cc2C1C)O)O 2230a_100000735813_100000730704 [0,0,1,0,0,2|1,0,0]=4 2246 B19R2.97022 CC(=CCN1CCc2cc(c(cc2C1C)O)O)C 2230a_100000735813_100000761012 [0,0,1,0,0,2|1,0,0]=4 2247 B19R2.97022 CC1c2cc(c(cc2CCN1CCC(=O)N)O)O 2230a_100000735813_100000744528 [0,0,1,0,0,2|1,0,0]=4 2248 B19R2.1311590 CNC(=O)CCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100012179268 [0,0,1,0,0,2|1,0,0]=4 2249 B19R2.1311590 COC(=O)CCN1CCc2cc(c(cc2C1)O)O 34a_200015384465_100000742370 [0,0,1,0,0,2|1,0,0]=4