0 B13R1.3787 C=C(C)CNc1c(cccc1Br)C 34a_100011834072_100000748629 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.3787 C=C(C)CNc1c(cccc1C)C 34a_100000185769_100000748629 [0,0,0,0,0,0|2,0,1]=3 2 B13R1.3787 C=C(C)CNc1c(cccc1Cl)C 34a_100000756524_100000748629 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.3787 C=C(C)CNc1c(cccc1F)C 34a_100000766463_100000748629 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.3787 C=C(C)CNc1c(cccc1O)C 34a_100000743429_100000748629 [0,0,0,0,0,0|3,0,1]=4 5 B13R1.3787 C=C(C)COc1c(cccc1Br)Br 34a_100000736428_100000748629 [0,0,0,0,0,0|3,0,1]=4 6 B13R1.3787 C=C(C)COc1c(cccc1Br)Br 7a_100000736428_100000748629 [0,0,0,0,0,0|3,0,1]=4 7 B13R1.3787 C=C(C)COc1c(cccc1Br)C 34a_100009817157_100000748629 [0,0,0,0,0,0|2,0,1]=3 8 B13R1.3787 C=C(C)COc1c(cccc1Br)C 7a_100009817157_100000748629 [0,0,0,0,0,0|2,0,1]=3 9 B13R1.3787 C=C(C)COc1c(cccc1Br)Cl 34a_100010214474_100000748629 [0,0,0,0,0,0|3,0,1]=4 10 B13R1.3787 C=C(C)COc1c(cccc1Br)Cl 7a_100010214474_100000748629 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.3787 C=C(C)COc1c(cccc1Br)F 34a_100009813666_100000748629 [0,0,0,0,0,0|3,0,1]=4 12 B13R1.3787 C=C(C)COc1c(cccc1Br)F 7a_100009813666_100000748629 [0,0,0,0,0,0|3,0,1]=4 13 B13R1.3787 C=C(C)COc1c(cccc1Br)N 34a_100011934915_100000748629 [0,0,0,0,0,0|3,0,1]=4 14 B13R1.3787 C=C(C)COc1c(cccc1C)C 34a_100000210341_100000748629 [0,0,0,0,0,0|1,0,1]=2 15 B13R1.3787 C=C(C)COc1c(cccc1C)C 7a_100000210341_100000748629 [0,0,0,0,0,0|1,0,1]=2 16 B13R1.3787 C=C(C)COc1c(cccc1Cl)C 34a_100000033731_100000748629 [0,0,0,0,0,0|2,0,1]=3 17 B13R1.3787 C=C(C)COc1c(cccc1Cl)C 7a_100000033731_100000748629 [0,0,0,0,0,0|2,0,1]=3 18 B13R1.3787 C=C(C)COc1c(cccc1Cl)Cl 34a_100000211709_100000748629 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.3787 C=C(C)COc1c(cccc1Cl)Cl 7a_100000211709_100000748629 [0,0,0,0,0,0|3,0,1]=4 20 B13R1.3787 C=C(C)COc1c(cccc1Cl)F 34a_100000694953_100000748629 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.3787 C=C(C)COc1c(cccc1Cl)F 7a_100000694953_100000748629 [0,0,0,0,0,0|3,0,1]=4 22 B13R1.3787 C=C(C)COc1c(cccc1Cl)N 34a_100000754742_100000748629 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.3787 C=C(C)COc1c(cccc1F)C 34a_100011659162_100000748629 [0,0,0,0,0,0|2,0,1]=3 24 B13R1.3787 C=C(C)COc1c(cccc1F)C 7a_100011659162_100000748629 [0,0,0,0,0,0|2,0,1]=3 25 B13R1.3787 C=C(C)COc1c(cccc1F)F 34a_100000230165_100000748629 [0,0,0,0,0,0|3,0,1]=4 26 B13R1.3787 C=C(C)COc1c(cccc1F)F 7a_100000230165_100000748629 [0,0,0,0,0,0|3,0,1]=4 27 B13R1.3787 C=C(C)COc1c(cccc1F)N 34a_100011934987_100000748629 [0,0,0,0,0,0|3,0,1]=4 28 B13R1.3787 C=C(C)COc1c(cccc1I)Br 34a_100010084509_100000748629 [0,0,0,0,0,0|3,0,1]=4 29 B13R1.3787 C=C(C)COc1c(cccc1I)Br 7a_100010084509_100000748629 [0,0,0,0,0,0|3,0,1]=4 30 B13R1.3787 C=C(C)COc1c(cccc1I)Cl 34a_100010202889_100000748629 [0,0,0,0,0,0|3,0,1]=4 31 B13R1.3787 C=C(C)COc1c(cccc1I)Cl 7a_100010202889_100000748629 [0,0,0,0,0,0|3,0,1]=4 32 B13R1.3787 C=C(C)COc1c(cccc1I)F 34a_100010186298_100000748629 [0,0,0,0,0,0|3,0,1]=4 33 B13R1.3787 C=C(C)COc1c(cccc1I)F 7a_100010186298_100000748629 [0,0,0,0,0,0|3,0,1]=4 34 B13R1.3787 C=C(C)COc1c(cccc1I)N 34a_100010084371_100000748629 [0,0,0,0,0,0|3,0,1]=4 35 B13R1.3787 C=C(C)COc1c(cccc1N)C 34a_100000756359_100000748629 [0,0,0,0,0,0|2,0,1]=3 36 B13R1.3787 C=C(C)COc1c(cccc1N)C 7a_100000756359_100000748629 [0,0,0,0,0,0|2,0,1]=3 37 B13R1.3787 C=C(C)COc1c(cccc1N)N 34a_200016994477_100000748629 [0,0,0,0,0,0|3,0,1]=4 38 B13R1.3787 C=C(C)COc1c(ccnc1C)C 34a_100011934651_100000748629 [0,0,0,0,0,0|2,0,1]=3 39 B13R1.3787 C=C(C)COc1c(ccnc1C)C 7a_100011934651_100000748629 [0,0,0,0,0,0|2,0,1]=3 40 B13R1.3787 C=C(C)COc1c(ccnc1Cl)C 34a_100000696282_100000748629 [0,0,0,0,0,0|3,0,1]=4 41 B13R1.3787 C=C(C)COc1c(ccnc1Cl)C 7a_100000696282_100000748629 [0,0,0,0,0,0|3,0,1]=4 42 B13R1.3787 C=C(C)COc1c(ncnc1C)C 34a_100009878406_100000748629 [0,0,0,0,0,0|3,0,1]=4 43 B13R1.3787 C=C(C)COc1c(ncnc1C)C 7a_100009878406_100000748629 [0,0,0,0,0,0|3,0,1]=4 44 B13R1.3787 C=C(C)COc1c(occc1=O)C 34a_100000031901_100000748629 [0,0,0,0,0,0|3,0,1]=4 45 B13R1.3787 C=C(C)CSc1c(cccc1Br)C 62a_100000748629_100010141302 [0,0,0,0,0,0|2,1,1]=4 46 B13R1.3787 C=C(C)CSc1c(cccc1Br)C 62a_100010141302_100000211660 [0,0,0,0,0,0|2,1,1]=4 47 B13R1.3787 C=C(C)CSc1c(cccc1C)C 62a_100000033847_100000211660 [0,0,0,0,0,0|1,1,1]=3 48 B13R1.3787 C=C(C)CSc1c(cccc1C)C 62a_100000748629_100000033847 [0,0,0,0,0,0|1,1,1]=3 49 B13R1.3787 C=C(C)CSc1c(cccc1Cl)C 62a_100000043165_100000211660 [0,0,0,0,0,0|2,1,1]=4 50 B13R1.3787 C=C(C)CSc1c(cccc1Cl)C 62a_100000748629_100000043165 [0,0,0,0,0,0|2,1,1]=4 51 B13R1.3787 C=C(C)CSc1c(cccc1F)C 62a_100000748629_100011218421 [0,0,0,0,0,0|2,1,1]=4 52 B13R1.3787 C=C(C)CSc1c(cccc1F)C 62a_100011218421_100000211660 [0,0,0,0,0,0|2,1,1]=4 53 B13R1.3787 C=C(C)CSc1c(cccc1N)C 62a_100000684715_100000211660 [0,0,0,0,0,0|2,1,1]=4 54 B13R1.3787 C=C(C)CSc1c(cccc1N)C 62a_100000748629_100000684715 [0,0,0,0,0,0|2,1,1]=4 55 B13R1.3787 C=C(C)CSc1c(cccc1O)C 62a_100000686692_100000211660 [0,0,0,0,0,0|2,1,1]=4 56 B13R1.3787 C=C(C)CSc1c(cccc1O)C 62a_100000748629_100000686692 [0,0,0,0,0,0|2,1,1]=4 57 B13R1.3787 C=C(C)CSc1c(ccnc1C)C 62a_100000748629_100012000501 [0,0,0,0,0,0|2,1,1]=4 58 B13R1.3787 C=C(C)CSc1c(ccnc1C)C 62a_100012000501_100000211660 [0,0,0,0,0,0|2,1,1]=4 59 B13R1.3787 C=C(C)CSc1c(cncc1C)C 62a_100000748629_100009817138 [0,0,0,0,0,0|2,1,1]=4 60 B13R1.3787 C=C(C)CSc1c(cncc1C)C 62a_100009817138_100000211660 [0,0,0,0,0,0|2,1,1]=4 61 B13R1.3787 C=C(F)CNc1c(cccc1C)C 34a_100000185769_100009893438 [0,0,0,0,0,0|2,0,2]=4 62 B13R1.3787 C=C(F)COc1c(cccc1Br)C 34a_100009817157_100009893438 [0,0,0,0,0,0|2,0,2]=4 63 B13R1.3787 C=C(F)COc1c(cccc1Br)C 7a_100009817157_100000042424 [0,0,0,0,0,0|2,0,2]=4 64 B13R1.3787 C=C(F)COc1c(cccc1C)C 34a_100000210341_100009893438 [0,0,0,0,0,0|1,0,2]=3 65 B13R1.3787 C=C(F)COc1c(cccc1C)C 7a_100000210341_100000042424 [0,0,0,0,0,0|1,0,2]=3 66 B13R1.3787 C=C(F)COc1c(cccc1Cl)C 34a_100000033731_100009893438 [0,0,0,0,0,0|2,0,2]=4 67 B13R1.3787 C=C(F)COc1c(cccc1Cl)C 7a_100000033731_100000042424 [0,0,0,0,0,0|2,0,2]=4 68 B13R1.3787 C=C(F)COc1c(cccc1F)C 34a_100011659162_100009893438 [0,0,0,0,0,0|2,0,2]=4 69 B13R1.3787 C=C(F)COc1c(cccc1F)C 7a_100011659162_100000042424 [0,0,0,0,0,0|2,0,2]=4 70 B13R1.3787 C=C(F)COc1c(cccc1N)C 34a_100000756359_100009893438 [0,0,0,0,0,0|2,0,2]=4 71 B13R1.3787 C=C(F)COc1c(cccc1N)C 7a_100000756359_100000042424 [0,0,0,0,0,0|2,0,2]=4 72 B13R1.3787 C=C(F)COc1c(ccnc1C)C 34a_100011934651_100009893438 [0,0,0,0,0,0|2,0,2]=4 73 B13R1.3787 C=C(F)COc1c(ccnc1C)C 7a_100011934651_100000042424 [0,0,0,0,0,0|2,0,2]=4 74 B13R1.3787 C=C(F)CSc1c(cccc1C)C 62a_100000033847_100000042424 [0,0,0,0,0,0|1,1,2]=4 75 B13R1.3787 C=C(F)CSc1c(cccc1C)C 62a_100000042424_100000033847 [0,0,0,0,0,0|1,1,2]=4 76 B13R1.3787 CC(=O)CCc1c(cccc1C)C 1458a_200011998103_200000210301 [0,0,0,0,0,0|2,0,1]=3 77 B13R1.3787 CC(=O)COc1c(cccc1C)C 1458a_100000184085_200000210301 [0,0,0,0,0,0|1,0,1]=2 78 B13R1.3787 CC(=O)COc1c(cccc1Cl)Cl 1458a_100000184137_200000210301 [0,0,0,0,0,0|3,0,1]=4 79 B13R1.3787 CC(=O)NCc1c(cccc1C)C 11a_100000689800_100015343762 [0,0,0,0,0,0|3,0,1]=4 80 B13R1.3787 CC(=O)NCc1c(cccc1C)C 1626a_100000689800_100015343762 [0,0,0,0,0,0|3,0,1]=4 81 B13R1.3787 CC(=O)NCc1c(cccc1C)C 240690a_100000689800_100015343762 [0,0,0,0,0,0|3,0,1]=4 82 B13R1.3787 CC(=O)NCc1c(cccc1C)C 527a_100000689800_100103153847 [0,0,0,0,0,0|3,0,1]=4 83 B13R1.3787 CC(=O)NNc1c(cccc1C)C 22a_100016987787_100000070787 [0,0,0,0,0,0|3,0,1]=4 84 B13R1.3787 CC(C)CNc1c(cccc1Br)Br 34a_100000690995_100000210624 [0,0,0,0,0,0|4,0,0]=4 85 B13R1.3787 CC(C)CNc1c(cccc1Br)Cl 34a_100102946385_100000210624 [0,0,0,0,0,0|4,0,0]=4 86 B13R1.3787 CC(C)CNc1c(cccc1Br)F 34a_100000684712_100000210624 [0,0,0,0,0,0|4,0,0]=4 87 B13R1.3787 CC(C)CNc1c(cccc1Br)O 34a_100011934926_100000210624 [0,0,0,0,0,0|4,0,0]=4 88 B13R1.3787 CC(C)CNc1c(cccc1Cl)Cl 34a_100000210028_100000210624 [0,0,0,0,0,0|4,0,0]=4 89 B13R1.3787 CC(C)CNc1c(cccc1Cl)F 34a_100000760031_100000210624 [0,0,0,0,0,0|4,0,0]=4 90 B13R1.3787 CC(C)CNc1c(cccc1Cl)O 34a_100012022510_100000210624 [0,0,0,0,0,0|4,0,0]=4 91 B13R1.3787 CC(C)CNc1c(cccc1F)F 2230a_100000210704_100000210760 [0,0,0,0,0,0|4,0,0]=4 92 B13R1.3787 CC(C)CNc1c(cccc1F)F 34a_100000210704_100000210624 [0,0,0,0,0,0|4,0,0]=4 93 B13R1.3787 CC(C)CNc1c(cccc1F)O 34a_100020591140_100000210624 [0,0,0,0,0,0|4,0,0]=4 94 B13R1.3787 CC(C)CNc1c(cccc1I)F 34a_100000042321_100000210624 [0,0,0,0,0,0|4,0,0]=4 95 B13R1.3787 CC(C)COc1c(cccc1Br)Br 34a_100000736428_100000210624 [0,0,0,0,0,0|3,0,0]=3 96 B13R1.3787 CC(C)COc1c(cccc1Br)Br 7a_100000736428_100000210760 [0,0,0,0,0,0|3,0,0]=3 97 B13R1.3787 CC(C)COc1c(cccc1Br)Cl 34a_100010214474_100000210624 [0,0,0,0,0,0|3,0,0]=3 98 B13R1.3787 CC(C)COc1c(cccc1Br)Cl 7a_100010214474_100000210760 [0,0,0,0,0,0|3,0,0]=3 99 B13R1.3787 CC(C)COc1c(cccc1Br)F 34a_100009813666_100000210624 [0,0,0,0,0,0|3,0,0]=3 100 B13R1.3787 CC(C)COc1c(cccc1Br)F 7a_100009813666_100000210760 [0,0,0,0,0,0|3,0,0]=3 101 B13R1.3787 CC(C)COc1c(cccc1Br)N 34a_100011934915_100000210624 [0,0,0,0,0,0|3,0,0]=3 102 B13R1.3787 CC(C)COc1c(cccc1Cl)Cl 34a_100000211709_100000210624 [0,0,0,0,0,0|3,0,0]=3 103 B13R1.3787 CC(C)COc1c(cccc1Cl)Cl 7a_100000211709_100000210760 [0,0,0,0,0,0|3,0,0]=3 104 B13R1.3787 CC(C)COc1c(cccc1Cl)F 34a_100000694953_100000210624 [0,0,0,0,0,0|3,0,0]=3 105 B13R1.3787 CC(C)COc1c(cccc1Cl)F 7a_100000694953_100000210760 [0,0,0,0,0,0|3,0,0]=3 106 B13R1.3787 CC(C)COc1c(cccc1Cl)N 34a_100000754742_100000210624 [0,0,0,0,0,0|3,0,0]=3 107 B13R1.3787 CC(C)COc1c(cccc1F)F 34a_100000230165_100000210624 [0,0,0,0,0,0|3,0,0]=3 108 B13R1.3787 CC(C)COc1c(cccc1F)F 7a_100000230165_100000210760 [0,0,0,0,0,0|3,0,0]=3 109 B13R1.3787 CC(C)COc1c(cccc1F)N 34a_100011934987_100000210624 [0,0,0,0,0,0|3,0,0]=3 110 B13R1.3787 CC(C)COc1c(cccc1I)Br 34a_100010084509_100000210624 [0,0,0,0,0,0|3,0,0]=3 111 B13R1.3787 CC(C)COc1c(cccc1I)Br 7a_100010084509_100000210760 [0,0,0,0,0,0|3,0,0]=3 112 B13R1.3787 CC(C)COc1c(cccc1I)Cl 34a_100010202889_100000210624 [0,0,0,0,0,0|3,0,0]=3 113 B13R1.3787 CC(C)COc1c(cccc1I)Cl 7a_100010202889_100000210760 [0,0,0,0,0,0|3,0,0]=3 114 B13R1.3787 CC(C)COc1c(cccc1I)F 34a_100010186298_100000210624 [0,0,0,0,0,0|3,0,0]=3 115 B13R1.3787 CC(C)COc1c(cccc1I)F 7a_100010186298_100000210760 [0,0,0,0,0,0|3,0,0]=3 116 B13R1.3787 CC(C)COc1c(cccc1I)N 34a_100010084371_100000210624 [0,0,0,0,0,0|3,0,0]=3 117 B13R1.3787 CC(C)COc1c(cccc1N)N 34a_200016994477_100000210624 [0,0,0,0,0,0|3,0,0]=3 118 B13R1.3787 CC(C)COc1c(ccnc1Cl)Cl 34a_100000118450_100000210624 [0,0,0,0,0,0|4,0,0]=4 119 B13R1.3787 CC(C)COc1c(ccnc1Cl)Cl 7a_100000118450_100000210760 [0,0,0,0,0,0|4,0,0]=4 120 B13R1.3787 CC(C)COc1c(ccnc1Cl)F 34a_100009867227_100000210624 [0,0,0,0,0,0|4,0,0]=4 121 B13R1.3787 CC(C)COc1c(ccnc1Cl)F 7a_100009867227_100000210760 [0,0,0,0,0,0|4,0,0]=4 122 B13R1.3787 CC(C)COc1c(ccnc1Cl)I 34a_100010067911_100000210624 [0,0,0,0,0,0|4,0,0]=4 123 B13R1.3787 CC(C)COc1c(ccnc1Cl)I 7a_100010067911_100000210760 [0,0,0,0,0,0|4,0,0]=4 124 B13R1.3787 CC(C)COc1c(ccnc1Cl)N 34a_100009844647_100000210624 [0,0,0,0,0,0|4,0,0]=4 125 B13R1.3787 CC(C)COc1c(ccnc1Cl)N 7a_100009844647_100000210760 [0,0,0,0,0,0|4,0,0]=4 126 B13R1.3787 CC(C)CSc1c(cccc1Br)Br 62a_100000210624_100009994525 [0,0,0,0,0,0|3,1,0]=4 127 B13R1.3787 CC(C)CSc1c(cccc1Br)Br 62a_100009994525_100000210760 [0,0,0,0,0,0|3,1,0]=4 128 B13R1.3787 CC(C)CSc1c(cccc1Br)Cl 62a_100000210624_100010214488 [0,0,0,0,0,0|3,1,0]=4 129 B13R1.3787 CC(C)CSc1c(cccc1Br)Cl 62a_100010214488_100000210760 [0,0,0,0,0,0|3,1,0]=4 130 B13R1.3787 CC(C)CSc1c(cccc1Br)F 62a_100000210624_100011219512 [0,0,0,0,0,0|3,1,0]=4 131 B13R1.3787 CC(C)CSc1c(cccc1Br)F 62a_100011219512_100000210760 [0,0,0,0,0,0|3,1,0]=4 132 B13R1.3787 CC(C)CSc1c(cccc1Br)N 62a_100000210624_100020590159 [0,0,0,0,0,0|3,1,0]=4 133 B13R1.3787 CC(C)CSc1c(cccc1Br)N 62a_100020590159_100000210760 [0,0,0,0,0,0|3,1,0]=4 134 B13R1.3787 CC(C)CSc1c(cccc1Br)O 62a_100000210624_100010187912 [0,0,0,0,0,0|3,1,0]=4 135 B13R1.3787 CC(C)CSc1c(cccc1Br)O 62a_100010187912_100000210760 [0,0,0,0,0,0|3,1,0]=4 136 B13R1.3787 CC(C)CSc1c(cccc1Cl)Cl 62a_100000034237_100000210760 [0,0,0,0,0,0|3,1,0]=4 137 B13R1.3787 CC(C)CSc1c(cccc1Cl)Cl 62a_100000210624_100000034237 [0,0,0,0,0,0|3,1,0]=4 138 B13R1.3787 CC(C)CSc1c(cccc1Cl)F 62a_100000050007_100000210760 [0,0,0,0,0,0|3,1,0]=4 139 B13R1.3787 CC(C)CSc1c(cccc1Cl)F 62a_100000210624_100000050007 [0,0,0,0,0,0|3,1,0]=4 140 B13R1.3787 CC(C)CSc1c(cccc1Cl)N 62a_100000049713_100000210760 [0,0,0,0,0,0|3,1,0]=4 141 B13R1.3787 CC(C)CSc1c(cccc1Cl)N 62a_100000210624_100000049713 [0,0,0,0,0,0|3,1,0]=4 142 B13R1.3787 CC(C)CSc1c(cccc1Cl)O 62a_100000210624_100000050174 [0,0,0,0,0,0|3,1,0]=4 143 B13R1.3787 CC(C)CSc1c(cccc1F)F 62a_100000210624_100000693133 [0,0,0,0,0,0|3,1,0]=4 144 B13R1.3787 CC(C)CSc1c(cccc1F)F 62a_100000693133_100000210760 [0,0,0,0,0,0|3,1,0]=4 145 B13R1.3787 CC(C)CSc1c(cccc1F)N 62a_100000210624_100000690935 [0,0,0,0,0,0|3,1,0]=4 146 B13R1.3787 CC(C)CSc1c(cccc1F)N 62a_100000690935_100000210760 [0,0,0,0,0,0|3,1,0]=4 147 B13R1.3787 CC(C)CSc1c(cccc1F)O 62a_100000210624_100009820682 [0,0,0,0,0,0|3,1,0]=4 148 B13R1.3787 CC(C)CSc1c(cccc1F)O 62a_100009820682_100000210760 [0,0,0,0,0,0|3,1,0]=4 149 B13R1.3787 CC(C)CSc1c(cccc1O)N 62a_100000210624_100012183704 [0,0,0,0,0,0|3,1,0]=4 150 B13R1.3787 CC(C)CSc1c(cccc1O)N 62a_100012183704_100000210760 [0,0,0,0,0,0|3,1,0]=4 151 B13R1.3787 CC(C)CSc1c(cccc1O)O 62a_100000210624_100010205330 [0,0,0,0,0,0|3,1,0]=4 152 B13R1.3787 CC(O)CNc1c(cccc1Br)Br 34a_100000690995_100011218427 [0,0,0,0,0,0|4,0,0]=4 153 B13R1.3787 CC(O)CNc1c(cccc1Br)Cl 34a_100102946385_100011218427 [0,0,0,0,0,0|4,0,0]=4 154 B13R1.3787 CC(O)CNc1c(cccc1Br)F 34a_100000684712_100011218427 [0,0,0,0,0,0|4,0,0]=4 155 B13R1.3787 CC(O)CNc1c(cccc1Br)O 34a_100011934926_100011218427 [0,0,0,0,0,0|4,0,0]=4 156 B13R1.3787 CC(O)CNc1c(cccc1Cl)Cl 34a_100000210028_100011218427 [0,0,0,0,0,0|4,0,0]=4 157 B13R1.3787 CC(O)CNc1c(cccc1Cl)F 34a_100000760031_100011218427 [0,0,0,0,0,0|4,0,0]=4 158 B13R1.3787 CC(O)CNc1c(cccc1Cl)O 34a_100012022510_100011218427 [0,0,0,0,0,0|4,0,0]=4 159 B13R1.3787 CC(O)CNc1c(cccc1F)F 2230a_100000210704_100011218427 [0,0,0,0,0,0|4,0,0]=4 160 B13R1.3787 CC(O)CNc1c(cccc1F)F 34a_100000210704_100011218427 [0,0,0,0,0,0|4,0,0]=4 161 B13R1.3787 CC(O)CNc1c(cccc1F)O 34a_100020591140_100011218427 [0,0,0,0,0,0|4,0,0]=4 162 B13R1.3787 CC(O)CNc1c(cccc1I)F 34a_100000042321_100011218427 [0,0,0,0,0,0|4,0,0]=4 163 B13R1.3787 CC(O)COc1c(cccc1Br)Br 34a_100000736428_100011218427 [0,0,0,0,0,0|3,0,0]=3 164 B13R1.3787 CC(O)COc1c(cccc1Br)Br 7a_100000736428_100011218427 [0,0,0,0,0,0|3,0,0]=3 165 B13R1.3787 CC(O)COc1c(cccc1Br)Cl 34a_100010214474_100011218427 [0,0,0,0,0,0|3,0,0]=3 166 B13R1.3787 CC(O)COc1c(cccc1Br)Cl 7a_100010214474_100011218427 [0,0,0,0,0,0|3,0,0]=3 167 B13R1.3787 CC(O)COc1c(cccc1Br)F 34a_100009813666_100011218427 [0,0,0,0,0,0|3,0,0]=3 168 B13R1.3787 CC(O)COc1c(cccc1Br)F 7a_100009813666_100011218427 [0,0,0,0,0,0|3,0,0]=3 169 B13R1.3787 CC(O)COc1c(cccc1Br)N 34a_100011934915_100011218427 [0,0,0,0,0,0|3,0,0]=3 170 B13R1.3787 CC(O)COc1c(cccc1Cl)Cl 34a_100000211709_100011218427 [0,0,0,0,0,0|3,0,0]=3 171 B13R1.3787 CC(O)COc1c(cccc1Cl)Cl 7a_100000211709_100011218427 [0,0,0,0,0,0|3,0,0]=3 172 B13R1.3787 CC(O)COc1c(cccc1Cl)F 34a_100000694953_100011218427 [0,0,0,0,0,0|3,0,0]=3 173 B13R1.3787 CC(O)COc1c(cccc1Cl)F 7a_100000694953_100011218427 [0,0,0,0,0,0|3,0,0]=3 174 B13R1.3787 CC(O)COc1c(cccc1Cl)N 34a_100000754742_100011218427 [0,0,0,0,0,0|3,0,0]=3 175 B13R1.3787 CC(O)COc1c(cccc1F)F 34a_100000230165_100011218427 [0,0,0,0,0,0|3,0,0]=3 176 B13R1.3787 CC(O)COc1c(cccc1F)F 7a_100000230165_100011218427 [0,0,0,0,0,0|3,0,0]=3 177 B13R1.3787 CC(O)COc1c(cccc1F)N 34a_100011934987_100011218427 [0,0,0,0,0,0|3,0,0]=3 178 B13R1.3787 CC(O)COc1c(cccc1I)Br 34a_100010084509_100011218427 [0,0,0,0,0,0|3,0,0]=3 179 B13R1.3787 CC(O)COc1c(cccc1I)Br 7a_100010084509_100011218427 [0,0,0,0,0,0|3,0,0]=3 180 B13R1.3787 CC(O)COc1c(cccc1I)Cl 34a_100010202889_100011218427 [0,0,0,0,0,0|3,0,0]=3 181 B13R1.3787 CC(O)COc1c(cccc1I)Cl 7a_100010202889_100011218427 [0,0,0,0,0,0|3,0,0]=3 182 B13R1.3787 CC(O)COc1c(cccc1I)F 34a_100010186298_100011218427 [0,0,0,0,0,0|3,0,0]=3 183 B13R1.3787 CC(O)COc1c(cccc1I)F 7a_100010186298_100011218427 [0,0,0,0,0,0|3,0,0]=3 184 B13R1.3787 CC(O)COc1c(cccc1I)N 34a_100010084371_100011218427 [0,0,0,0,0,0|3,0,0]=3 185 B13R1.3787 CC(O)COc1c(cccc1N)N 34a_200016994477_100011218427 [0,0,0,0,0,0|3,0,0]=3 186 B13R1.3787 CC(O)COc1c(ccnc1Cl)Cl 34a_100000118450_100011218427 [0,0,0,0,0,0|4,0,0]=4 187 B13R1.3787 CC(O)COc1c(ccnc1Cl)Cl 7a_100000118450_100011218427 [0,0,0,0,0,0|4,0,0]=4 188 B13R1.3787 CC(O)COc1c(ccnc1Cl)F 34a_100009867227_100011218427 [0,0,0,0,0,0|4,0,0]=4 189 B13R1.3787 CC(O)COc1c(ccnc1Cl)F 7a_100009867227_100011218427 [0,0,0,0,0,0|4,0,0]=4 190 B13R1.3787 CC(O)COc1c(ccnc1Cl)I 34a_100010067911_100011218427 [0,0,0,0,0,0|4,0,0]=4 191 B13R1.3787 CC(O)COc1c(ccnc1Cl)I 7a_100010067911_100011218427 [0,0,0,0,0,0|4,0,0]=4 192 B13R1.3787 CC(O)COc1c(ccnc1Cl)N 34a_100009844647_100011218427 [0,0,0,0,0,0|4,0,0]=4 193 B13R1.3787 CC(O)COc1c(ccnc1Cl)N 7a_100009844647_100011218427 [0,0,0,0,0,0|4,0,0]=4 194 B13R1.3787 CC(O)CSc1c(cccc1Br)Br 62a_100009994525_100011218427 [0,0,0,0,0,0|3,1,0]=4 195 B13R1.3787 CC(O)CSc1c(cccc1Br)Br 62a_100011218427_100009994525 [0,0,0,0,0,0|3,1,0]=4 196 B13R1.3787 CC(O)CSc1c(cccc1Br)Cl 62a_100010214488_100011218427 [0,0,0,0,0,0|3,1,0]=4 197 B13R1.3787 CC(O)CSc1c(cccc1Br)Cl 62a_100011218427_100010214488 [0,0,0,0,0,0|3,1,0]=4 198 B13R1.3787 CC(O)CSc1c(cccc1Br)F 62a_100011218427_100011219512 [0,0,0,0,0,0|3,1,0]=4 199 B13R1.3787 CC(O)CSc1c(cccc1Br)F 62a_100011219512_100011218427 [0,0,0,0,0,0|3,1,0]=4 200 B13R1.3787 CC(O)CSc1c(cccc1Br)N 62a_100011218427_100020590159 [0,0,0,0,0,0|3,1,0]=4 201 B13R1.3787 CC(O)CSc1c(cccc1Br)N 62a_100020590159_100011218427 [0,0,0,0,0,0|3,1,0]=4 202 B13R1.3787 CC(O)CSc1c(cccc1Br)O 62a_100010187912_100011218427 [0,0,0,0,0,0|3,1,0]=4 203 B13R1.3787 CC(O)CSc1c(cccc1Br)O 62a_100011218427_100010187912 [0,0,0,0,0,0|3,1,0]=4 204 B13R1.3787 CC(O)CSc1c(cccc1Cl)Cl 62a_100000034237_100011218427 [0,0,0,0,0,0|3,1,0]=4 205 B13R1.3787 CC(O)CSc1c(cccc1Cl)Cl 62a_100011218427_100000034237 [0,0,0,0,0,0|3,1,0]=4 206 B13R1.3787 CC(O)CSc1c(cccc1Cl)F 62a_100000050007_100011218427 [0,0,0,0,0,0|3,1,0]=4 207 B13R1.3787 CC(O)CSc1c(cccc1Cl)F 62a_100011218427_100000050007 [0,0,0,0,0,0|3,1,0]=4 208 B13R1.3787 CC(O)CSc1c(cccc1Cl)N 62a_100000049713_100011218427 [0,0,0,0,0,0|3,1,0]=4 209 B13R1.3787 CC(O)CSc1c(cccc1Cl)N 62a_100011218427_100000049713 [0,0,0,0,0,0|3,1,0]=4 210 B13R1.3787 CC(O)CSc1c(cccc1Cl)O 62a_100011218427_100000050174 [0,0,0,0,0,0|3,1,0]=4 211 B13R1.3787 CC(O)CSc1c(cccc1F)F 62a_100000693133_100011218427 [0,0,0,0,0,0|3,1,0]=4 212 B13R1.3787 CC(O)CSc1c(cccc1F)F 62a_100011218427_100000693133 [0,0,0,0,0,0|3,1,0]=4 213 B13R1.3787 CC(O)CSc1c(cccc1F)N 62a_100000690935_100011218427 [0,0,0,0,0,0|3,1,0]=4 214 B13R1.3787 CC(O)CSc1c(cccc1F)N 62a_100011218427_100000690935 [0,0,0,0,0,0|3,1,0]=4 215 B13R1.3787 CC(O)CSc1c(cccc1F)O 62a_100009820682_100011218427 [0,0,0,0,0,0|3,1,0]=4 216 B13R1.3787 CC(O)CSc1c(cccc1F)O 62a_100011218427_100009820682 [0,0,0,0,0,0|3,1,0]=4 217 B13R1.3787 CC(O)CSc1c(cccc1O)N 62a_100011218427_100012183704 [0,0,0,0,0,0|3,1,0]=4 218 B13R1.3787 CC(O)CSc1c(cccc1O)N 62a_100012183704_100011218427 [0,0,0,0,0,0|3,1,0]=4 219 B13R1.3787 CC(O)CSc1c(cccc1O)O 62a_100011218427_100010205330 [0,0,0,0,0,0|3,1,0]=4 220 B13R1.3787 C[C@@H](O)CNc1c(cccc1Br)Br 34a_100000690995_100009817552 [0,0,0,0,0,0|4,0,0]=4 221 B13R1.3787 C[C@@H](O)CNc1c(cccc1Br)Cl 34a_100102946385_100009817552 [0,0,0,0,0,0|4,0,0]=4 222 B13R1.3787 C[C@@H](O)CNc1c(cccc1Br)F 34a_100000684712_100009817552 [0,0,0,0,0,0|4,0,0]=4 223 B13R1.3787 C[C@@H](O)CNc1c(cccc1Br)O 34a_100011934926_100009817552 [0,0,0,0,0,0|4,0,0]=4 224 B13R1.3787 C[C@@H](O)CNc1c(cccc1Cl)Cl 34a_100000210028_100009817552 [0,0,0,0,0,0|4,0,0]=4 225 B13R1.3787 C[C@@H](O)CNc1c(cccc1Cl)F 34a_100000760031_100009817552 [0,0,0,0,0,0|4,0,0]=4 226 B13R1.3787 C[C@@H](O)CNc1c(cccc1Cl)O 34a_100012022510_100009817552 [0,0,0,0,0,0|4,0,0]=4 227 B13R1.3787 C[C@@H](O)CNc1c(cccc1F)F 2230a_100000210704_100009817552 [0,0,0,0,0,0|4,0,0]=4 228 B13R1.3787 C[C@@H](O)CNc1c(cccc1F)F 34a_100000210704_100009817552 [0,0,0,0,0,0|4,0,0]=4 229 B13R1.3787 C[C@@H](O)CNc1c(cccc1F)O 34a_100020591140_100009817552 [0,0,0,0,0,0|4,0,0]=4 230 B13R1.3787 C[C@@H](O)CNc1c(cccc1I)F 34a_100000042321_100009817552 [0,0,0,0,0,0|4,0,0]=4 231 B13R1.3787 C[C@@H](O)COc1c(cccc1Br)Br 34a_100000736428_100009817552 [0,0,0,0,0,0|3,0,0]=3 232 B13R1.3787 C[C@@H](O)COc1c(cccc1Br)Br 7a_100000736428_100009817552 [0,0,0,0,0,0|3,0,0]=3 233 B13R1.3787 C[C@@H](O)COc1c(cccc1Br)Cl 34a_100010214474_100009817552 [0,0,0,0,0,0|3,0,0]=3 234 B13R1.3787 C[C@@H](O)COc1c(cccc1Br)Cl 7a_100010214474_100009817552 [0,0,0,0,0,0|3,0,0]=3 235 B13R1.3787 C[C@@H](O)COc1c(cccc1Br)F 34a_100009813666_100009817552 [0,0,0,0,0,0|3,0,0]=3 236 B13R1.3787 C[C@@H](O)COc1c(cccc1Br)F 7a_100009813666_100009817552 [0,0,0,0,0,0|3,0,0]=3 237 B13R1.3787 C[C@@H](O)COc1c(cccc1Br)N 34a_100011934915_100009817552 [0,0,0,0,0,0|3,0,0]=3 238 B13R1.3787 C[C@@H](O)COc1c(cccc1Cl)Cl 34a_100000211709_100009817552 [0,0,0,0,0,0|3,0,0]=3 239 B13R1.3787 C[C@@H](O)COc1c(cccc1Cl)Cl 7a_100000211709_100009817552 [0,0,0,0,0,0|3,0,0]=3 240 B13R1.3787 C[C@@H](O)COc1c(cccc1Cl)F 34a_100000694953_100009817552 [0,0,0,0,0,0|3,0,0]=3 241 B13R1.3787 C[C@@H](O)COc1c(cccc1Cl)F 7a_100000694953_100009817552 [0,0,0,0,0,0|3,0,0]=3 242 B13R1.3787 C[C@@H](O)COc1c(cccc1Cl)N 34a_100000754742_100009817552 [0,0,0,0,0,0|3,0,0]=3 243 B13R1.3787 C[C@@H](O)COc1c(cccc1F)F 34a_100000230165_100009817552 [0,0,0,0,0,0|3,0,0]=3 244 B13R1.3787 C[C@@H](O)COc1c(cccc1F)F 7a_100000230165_100009817552 [0,0,0,0,0,0|3,0,0]=3 245 B13R1.3787 C[C@@H](O)COc1c(cccc1F)N 34a_100011934987_100009817552 [0,0,0,0,0,0|3,0,0]=3 246 B13R1.3787 C[C@@H](O)COc1c(cccc1I)Br 34a_100010084509_100009817552 [0,0,0,0,0,0|3,0,0]=3 247 B13R1.3787 C[C@@H](O)COc1c(cccc1I)Br 7a_100010084509_100009817552 [0,0,0,0,0,0|3,0,0]=3 248 B13R1.3787 C[C@@H](O)COc1c(cccc1I)Cl 34a_100010202889_100009817552 [0,0,0,0,0,0|3,0,0]=3 249 B13R1.3787 C[C@@H](O)COc1c(cccc1I)Cl 7a_100010202889_100009817552 [0,0,0,0,0,0|3,0,0]=3 250 B13R1.3787 C[C@@H](O)COc1c(cccc1I)F 34a_100010186298_100009817552 [0,0,0,0,0,0|3,0,0]=3 251 B13R1.3787 C[C@@H](O)COc1c(cccc1I)F 7a_100010186298_100009817552 [0,0,0,0,0,0|3,0,0]=3 252 B13R1.3787 C[C@@H](O)COc1c(cccc1I)N 34a_100010084371_100009817552 [0,0,0,0,0,0|3,0,0]=3 253 B13R1.3787 C[C@@H](O)COc1c(cccc1N)N 34a_200016994477_100009817552 [0,0,0,0,0,0|3,0,0]=3 254 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)Cl 34a_100000118450_100009817552 [0,0,0,0,0,0|4,0,0]=4 255 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)Cl 7a_100000118450_100009817552 [0,0,0,0,0,0|4,0,0]=4 256 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)F 34a_100009867227_100009817552 [0,0,0,0,0,0|4,0,0]=4 257 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)F 7a_100009867227_100009817552 [0,0,0,0,0,0|4,0,0]=4 258 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)I 34a_100010067911_100009817552 [0,0,0,0,0,0|4,0,0]=4 259 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)I 7a_100010067911_100009817552 [0,0,0,0,0,0|4,0,0]=4 260 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)N 34a_100009844647_100009817552 [0,0,0,0,0,0|4,0,0]=4 261 B13R1.3787 C[C@@H](O)COc1c(ccnc1Cl)N 7a_100009844647_100009817552 [0,0,0,0,0,0|4,0,0]=4 262 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)Br 62a_100009817552_100009994525 [0,0,0,0,0,0|3,1,0]=4 263 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)Br 62a_100009994525_100009817552 [0,0,0,0,0,0|3,1,0]=4 264 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)Cl 62a_100009817552_100010214488 [0,0,0,0,0,0|3,1,0]=4 265 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)Cl 62a_100010214488_100009817552 [0,0,0,0,0,0|3,1,0]=4 266 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)F 62a_100009817552_100011219512 [0,0,0,0,0,0|3,1,0]=4 267 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)F 62a_100011219512_100009817552 [0,0,0,0,0,0|3,1,0]=4 268 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)N 62a_100009817552_100020590159 [0,0,0,0,0,0|3,1,0]=4 269 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)N 62a_100020590159_100009817552 [0,0,0,0,0,0|3,1,0]=4 270 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)O 62a_100009817552_100010187912 [0,0,0,0,0,0|3,1,0]=4 271 B13R1.3787 C[C@@H](O)CSc1c(cccc1Br)O 62a_100010187912_100009817552 [0,0,0,0,0,0|3,1,0]=4 272 B13R1.3787 C[C@@H](O)CSc1c(cccc1Cl)Cl 62a_100000034237_100009817552 [0,0,0,0,0,0|3,1,0]=4 273 B13R1.3787 C[C@@H](O)CSc1c(cccc1Cl)Cl 62a_100009817552_100000034237 [0,0,0,0,0,0|3,1,0]=4 274 B13R1.3787 C[C@@H](O)CSc1c(cccc1Cl)F 62a_100000050007_100009817552 [0,0,0,0,0,0|3,1,0]=4 275 B13R1.3787 C[C@@H](O)CSc1c(cccc1Cl)F 62a_100009817552_100000050007 [0,0,0,0,0,0|3,1,0]=4 276 B13R1.3787 C[C@@H](O)CSc1c(cccc1Cl)N 62a_100000049713_100009817552 [0,0,0,0,0,0|3,1,0]=4 277 B13R1.3787 C[C@@H](O)CSc1c(cccc1Cl)N 62a_100009817552_100000049713 [0,0,0,0,0,0|3,1,0]=4 278 B13R1.3787 C[C@@H](O)CSc1c(cccc1Cl)O 62a_100009817552_100000050174 [0,0,0,0,0,0|3,1,0]=4 279 B13R1.3787 C[C@@H](O)CSc1c(cccc1F)F 62a_100000693133_100009817552 [0,0,0,0,0,0|3,1,0]=4 280 B13R1.3787 C[C@@H](O)CSc1c(cccc1F)F 62a_100009817552_100000693133 [0,0,0,0,0,0|3,1,0]=4 281 B13R1.3787 C[C@@H](O)CSc1c(cccc1F)N 62a_100000690935_100009817552 [0,0,0,0,0,0|3,1,0]=4 282 B13R1.3787 C[C@@H](O)CSc1c(cccc1F)N 62a_100009817552_100000690935 [0,0,0,0,0,0|3,1,0]=4 283 B13R1.3787 C[C@@H](O)CSc1c(cccc1F)O 62a_100009817552_100009820682 [0,0,0,0,0,0|3,1,0]=4 284 B13R1.3787 C[C@@H](O)CSc1c(cccc1F)O 62a_100009820682_100009817552 [0,0,0,0,0,0|3,1,0]=4 285 B13R1.3787 C[C@@H](O)CSc1c(cccc1O)N 62a_100009817552_100012183704 [0,0,0,0,0,0|3,1,0]=4 286 B13R1.3787 C[C@@H](O)CSc1c(cccc1O)N 62a_100012183704_100009817552 [0,0,0,0,0,0|3,1,0]=4 287 B13R1.3787 C[C@@H](O)CSc1c(cccc1O)O 62a_100009817552_100010205330 [0,0,0,0,0,0|3,1,0]=4 288 B13R1.3787 Cc1ccc[n+](c1SCC(C)C)[O-] 62a_100000210624_100116209805 [0,0,0,0,0,0|3,1,0]=4 289 B13R1.3787 Cc1ccc[n+](c1SCC(C)O)[O-] 62a_100011218427_100116209805 [0,0,0,0,0,0|3,1,0]=4 290 B13R1.3787 Cc1ccc[n+](c1SC[C@@H](C)O)[O-] 62a_100009817552_100116209805 [0,0,0,0,0,0|3,1,0]=4 291 B13R1.3787 Cc1cccc(c1C=CC(C)C)C 271570a_100016257149_100000033847 [0,0,0,0,0,0|2,0,1]=3 292 B13R1.3787 Cc1cccc(c1C=CC(C)C)Cl 271570a_100016257149_100000043165 [0,0,0,0,0,0|3,0,1]=4 293 B13R1.3787 Cc1cccc(c1C=CC(C)C)F 271570a_100016257149_100012349962 [0,0,0,0,0,0|3,0,1]=4 294 B13R1.3787 Cc1cccc(c1C=CC(C)C)N 271570a_100016257149_100000684715 [0,0,0,0,0,0|3,0,1]=4 295 B13R1.3787 Cc1cccc(c1C=CC(C)C)O 271570a_100016257149_100000686692 [0,0,0,0,0,0|3,0,1]=4 296 B13R1.3787 Cc1cccc(c1C=CC(C)O)C 271570a_200011019289_100000033847 [0,0,0,0,0,0|2,0,1]=3 297 B13R1.3787 Cc1cccc(c1C=CC(C)O)Cl 271570a_200011019289_100000043165 [0,0,0,0,0,0|3,0,1]=4 298 B13R1.3787 Cc1cccc(c1C=CC(C)O)F 271570a_200011019289_100012349962 [0,0,0,0,0,0|3,0,1]=4 299 B13R1.3787 Cc1cccc(c1C=CC(C)O)N 271570a_200011019289_100000684715 [0,0,0,0,0,0|3,0,1]=4 300 B13R1.3787 Cc1cccc(c1C=CC(C)O)O 271570a_200011019289_100000686692 [0,0,0,0,0,0|3,0,1]=4 301 B13R1.3787 Cc1cccc(c1CCC(=O)[13CH3])C 1458a_200011998103_200025704644 [0,0,0,0,0,0|2,0,1]=3 302 B13R1.3787 Cc1cccc(c1CNC(C)C)Br 207a_100138425928_100009881667 [0,0,0,0,0,0|4,0,0]=4 303 B13R1.3787 Cc1cccc(c1CNC(C)C)Br 2230a_100138425928_100010146847 [0,0,0,0,0,0|4,0,0]=4 304 B13R1.3787 Cc1cccc(c1CNC(C)C)Br 34a_100138425928_100010146847 [0,0,0,0,0,0|4,0,0]=4 305 B13R1.3787 Cc1cccc(c1CNC(C)C)C 207a_100138425928_100000758299 [0,0,0,0,0,0|3,0,0]=3 306 B13R1.3787 Cc1cccc(c1CNC(C)C)C 2230a_100138425928_100000758300 [0,0,0,0,0,0|3,0,0]=3 307 B13R1.3787 Cc1cccc(c1CNC(C)C)C 34a_100000689800_100000210206 [0,0,0,0,0,0|3,0,0]=3 308 B13R1.3787 Cc1cccc(c1CNC(C)C)C 34a_100138425928_100000758300 [0,0,0,0,0,0|3,0,0]=3 309 B13R1.3787 Cc1cccc(c1CNC(C)C)Cl 207a_100138425928_100000041122 [0,0,0,0,0,0|4,0,0]=4 310 B13R1.3787 Cc1cccc(c1CNC(C)C)F 207a_100138425928_100000069827 [0,0,0,0,0,0|4,0,0]=4 311 B13R1.3787 Cc1cccc(c1CNC(C)C)F 2230a_100138425928_100009814554 [0,0,0,0,0,0|4,0,0]=4 312 B13R1.3787 Cc1cccc(c1CNC(C)C)F 34a_100000762012_100000210206 [0,0,0,0,0,0|4,0,0]=4 313 B13R1.3787 Cc1cccc(c1CNC(C)C)F 34a_100138425928_100009814554 [0,0,0,0,0,0|4,0,0]=4 314 B13R1.3787 Cc1cccc(c1CNC(C)C)I 2230a_100138425928_100010150146 [0,0,0,0,0,0|4,0,0]=4 315 B13R1.3787 Cc1cccc(c1CNC(C)C)I 34a_100138425928_100010150146 [0,0,0,0,0,0|4,0,0]=4 316 B13R1.3787 Cc1cccc(c1COC(C)C)Br 34a_100000212225_100010146847 [0,0,0,0,0,0|4,0,0]=4 317 B13R1.3787 Cc1cccc(c1COC(C)C)C 34a_100000212225_100000758300 [0,0,0,0,0,0|3,0,0]=3 318 B13R1.3787 Cc1cccc(c1COC(C)C)C 34a_100011933981_100000210206 [0,0,0,0,0,0|3,0,0]=3 319 B13R1.3787 Cc1cccc(c1COC(C)C)C 7a_100011933981_100000210206 [0,0,0,0,0,0|3,0,0]=3 320 B13R1.3787 Cc1cccc(c1COC(C)C)Cl 34a_100000082531_100000210206 [0,0,0,0,0,0|4,0,0]=4 321 B13R1.3787 Cc1cccc(c1COC(C)C)Cl 7a_100000082531_100000210206 [0,0,0,0,0,0|4,0,0]=4 322 B13R1.3787 Cc1cccc(c1COC(C)C)F 34a_100000057874_100000210206 [0,0,0,0,0,0|4,0,0]=4 323 B13R1.3787 Cc1cccc(c1COC(C)C)F 34a_100000212225_100009814554 [0,0,0,0,0,0|4,0,0]=4 324 B13R1.3787 Cc1cccc(c1COC(C)C)F 7a_100000057874_100000210206 [0,0,0,0,0,0|4,0,0]=4 325 B13R1.3787 Cc1cccc(c1COC(C)C)I 34a_100000212225_100010150146 [0,0,0,0,0,0|4,0,0]=4 326 B13R1.3787 Cc1cccc(c1CSC(C)C)Br 62a_100000210206_100010146847 [0,0,0,0,0,0|4,0,0]=4 327 B13R1.3787 Cc1cccc(c1CSC(C)C)Br 62a_100010146847_100000210206 [0,0,0,0,0,0|4,0,0]=4 328 B13R1.3787 Cc1cccc(c1CSC(C)C)C 62a_100000210206_100000758300 [0,0,0,0,0,0|3,0,0]=3 329 B13R1.3787 Cc1cccc(c1CSC(C)C)C 62a_100000758300_100000210206 [0,0,0,0,0,0|3,0,0]=3 330 B13R1.3787 Cc1cccc(c1CSC(C)C)F 62a_100000210206_100009814554 [0,0,0,0,0,0|4,0,0]=4 331 B13R1.3787 Cc1cccc(c1CSC(C)C)F 62a_100009814554_100000210206 [0,0,0,0,0,0|4,0,0]=4 332 B13R1.3787 Cc1cccc(c1CSC(C)C)I 62a_100000210206_100010150146 [0,0,0,0,0,0|4,0,0]=4 333 B13R1.3787 Cc1cccc(c1CSC(C)C)I 62a_100010150146_100000210206 [0,0,0,0,0,0|4,0,0]=4 334 B13R1.3787 Cc1cccc(c1NCC(=O)N)Br 34a_100011834072_100000187820 [0,0,0,0,0,0|3,0,1]=4 335 B13R1.3787 Cc1cccc(c1NCC(=O)N)C 34a_100000185769_100000187820 [0,0,0,0,0,0|2,0,1]=3 336 B13R1.3787 Cc1cccc(c1NCC(=O)N)Cl 34a_100000756524_100000187820 [0,0,0,0,0,0|3,0,1]=4 337 B13R1.3787 Cc1cccc(c1NCC(=O)N)F 34a_100000766463_100000187820 [0,0,0,0,0,0|3,0,1]=4 338 B13R1.3787 Cc1cccc(c1NCC(=O)N)O 34a_100000743429_100000187820 [0,0,0,0,0,0|3,0,1]=4 339 B13R1.3787 Cc1cccc(c1NCC(=O)[O-])C 34a_100000185769_100020667443 [0,0,0,0,0,0|3,0,1]=4 340 B13R1.3787 Cc1cccc(c1NCC(C)C)Br 34a_100011834072_100000210624 [0,0,0,0,0,0|3,0,0]=3 341 B13R1.3787 Cc1cccc(c1NCC(C)C)C 34a_100000185769_100000210624 [0,0,0,0,0,0|2,0,0]=2 342 B13R1.3787 Cc1cccc(c1NCC(C)C)Cl 34a_100000756524_100000210624 [0,0,0,0,0,0|3,0,0]=3 343 B13R1.3787 Cc1cccc(c1NCC(C)C)F 34a_100000766463_100000210624 [0,0,0,0,0,0|3,0,0]=3 344 B13R1.3787 Cc1cccc(c1NCC(C)C)O 34a_100000743429_100000210624 [0,0,0,0,0,0|3,0,0]=3 345 B13R1.3787 Cc1cccc(c1NCC(C)O)Br 34a_100011834072_100011218427 [0,0,0,0,0,0|3,0,0]=3 346 B13R1.3787 Cc1cccc(c1NCC(C)O)C 34a_100000185769_100011218427 [0,0,0,0,0,0|2,0,0]=2 347 B13R1.3787 Cc1cccc(c1NCC(C)O)Cl 34a_100000756524_100011218427 [0,0,0,0,0,0|3,0,0]=3 348 B13R1.3787 Cc1cccc(c1NCC(C)O)F 34a_100000766463_100011218427 [0,0,0,0,0,0|3,0,0]=3 349 B13R1.3787 Cc1cccc(c1NCC(C)O)O 34a_100000743429_100011218427 [0,0,0,0,0,0|3,0,0]=3 350 B13R1.3787 Cc1cccc(c1NCC(F)F)Br 34a_100011834072_100011934356 [0,0,0,0,0,0|4,0,0]=4 351 B13R1.3787 Cc1cccc(c1NCC(F)F)C 34a_100000185769_100011934356 [0,0,0,0,0,0|3,0,0]=3 352 B13R1.3787 Cc1cccc(c1NCC(F)F)Cl 34a_100000756524_100011934356 [0,0,0,0,0,0|4,0,0]=4 353 B13R1.3787 Cc1cccc(c1NCC(F)F)F 34a_100000766463_100011934356 [0,0,0,0,0,0|4,0,0]=4 354 B13R1.3787 Cc1cccc(c1NCC(F)F)O 34a_100000743429_100011934356 [0,0,0,0,0,0|4,0,0]=4 355 B13R1.3787 Cc1cccc(c1NC[C@@H](C)O)Br 34a_100011834072_100009817552 [0,0,0,0,0,0|3,0,0]=3 356 B13R1.3787 Cc1cccc(c1NC[C@@H](C)O)C 34a_100000185769_100009817552 [0,0,0,0,0,0|2,0,0]=2 357 B13R1.3787 Cc1cccc(c1NC[C@@H](C)O)Cl 34a_100000756524_100009817552 [0,0,0,0,0,0|3,0,0]=3 358 B13R1.3787 Cc1cccc(c1NC[C@@H](C)O)F 34a_100000766463_100009817552 [0,0,0,0,0,0|3,0,0]=3 359 B13R1.3787 Cc1cccc(c1NC[C@@H](C)O)O 34a_100000743429_100009817552 [0,0,0,0,0,0|3,0,0]=3 360 B13R1.3787 Cc1cccc(c1NC[N+](=O)[O-])C 34a_100000185769_100000761209 [0,0,0,0,0,0|4,0,0]=4 361 B13R1.3787 Cc1cccc(c1OCC(=O)N)Br 34a_100009817157_100000187820 [0,0,0,0,0,0|2,0,1]=3 362 B13R1.3787 Cc1cccc(c1OCC(=O)N)Br 7a_100009817157_100000187820 [0,0,0,0,0,0|2,0,1]=3 363 B13R1.3787 Cc1cccc(c1OCC(=O)N)C 34a_100000210341_100000187820 [0,0,0,0,0,0|1,0,1]=2 364 B13R1.3787 Cc1cccc(c1OCC(=O)N)C 7a_100000210341_100000187820 [0,0,0,0,0,0|1,0,1]=2 365 B13R1.3787 Cc1cccc(c1OCC(=O)N)Cl 34a_100000033731_100000187820 [0,0,0,0,0,0|2,0,1]=3 366 B13R1.3787 Cc1cccc(c1OCC(=O)N)Cl 7a_100000033731_100000187820 [0,0,0,0,0,0|2,0,1]=3 367 B13R1.3787 Cc1cccc(c1OCC(=O)N)F 34a_100011659162_100000187820 [0,0,0,0,0,0|2,0,1]=3 368 B13R1.3787 Cc1cccc(c1OCC(=O)N)F 7a_100011659162_100000187820 [0,0,0,0,0,0|2,0,1]=3 369 B13R1.3787 Cc1cccc(c1OCC(=O)N)N 34a_100000756359_100000187820 [0,0,0,0,0,0|2,0,1]=3 370 B13R1.3787 Cc1cccc(c1OCC(=O)N)N 7a_100000756359_100000187820 [0,0,0,0,0,0|2,0,1]=3 371 B13R1.3787 Cc1cccc(c1OCC(=O)[13CH3])C 1458a_100000184085_200025704644 [0,0,0,0,0,0|1,0,1]=2 372 B13R1.3787 Cc1cccc(c1OCC(=O)[O-])Br 34a_100009817157_100020667443 [0,0,0,0,0,0|3,0,1]=4 373 B13R1.3787 Cc1cccc(c1OCC(=O)[O-])C 34a_100000210341_100020667443 [0,0,0,0,0,0|2,0,1]=3 374 B13R1.3787 Cc1cccc(c1OCC(=O)[O-])Cl 34a_100000033731_100020667443 [0,0,0,0,0,0|3,0,1]=4 375 B13R1.3787 Cc1cccc(c1OCC(=O)[O-])F 34a_100011659162_100020667443 [0,0,0,0,0,0|3,0,1]=4 376 B13R1.3787 Cc1cccc(c1OCC(=O)[O-])N 34a_100000756359_100020667443 [0,0,0,0,0,0|3,0,1]=4 377 B13R1.3787 Cc1cccc(c1OCC(C)C)Br 34a_100009817157_100000210624 [0,0,0,0,0,0|2,0,0]=2 378 B13R1.3787 Cc1cccc(c1OCC(C)C)Br 7a_100009817157_100000210760 [0,0,0,0,0,0|2,0,0]=2 379 B13R1.3787 Cc1cccc(c1OCC(C)C)C 34a_100000210341_100000210624 [0,0,0,0,0,0|1,0,0]=1 380 B13R1.3787 Cc1cccc(c1OCC(C)C)C 7a_100000210341_100000210760 [0,0,0,0,0,0|1,0,0]=1 381 B13R1.3787 Cc1cccc(c1OCC(C)C)Cl 34a_100000033731_100000210624 [0,0,0,0,0,0|2,0,0]=2 382 B13R1.3787 Cc1cccc(c1OCC(C)C)Cl 7a_100000033731_100000210760 [0,0,0,0,0,0|2,0,0]=2 383 B13R1.3787 Cc1cccc(c1OCC(C)C)F 34a_100011659162_100000210624 [0,0,0,0,0,0|2,0,0]=2 384 B13R1.3787 Cc1cccc(c1OCC(C)C)F 7a_100011659162_100000210760 [0,0,0,0,0,0|2,0,0]=2 385 B13R1.3787 Cc1cccc(c1OCC(C)C)N 34a_100000756359_100000210624 [0,0,0,0,0,0|2,0,0]=2 386 B13R1.3787 Cc1cccc(c1OCC(C)C)N 7a_100000756359_100000210760 [0,0,0,0,0,0|2,0,0]=2 387 B13R1.3787 Cc1cccc(c1OCC(C)O)Br 34a_100009817157_100011218427 [0,0,0,0,0,0|2,0,0]=2 388 B13R1.3787 Cc1cccc(c1OCC(C)O)Br 7a_100009817157_100011218427 [0,0,0,0,0,0|2,0,0]=2 389 B13R1.3787 Cc1cccc(c1OCC(C)O)C 34a_100000210341_100011218427 [0,0,0,0,0,0|1,0,0]=1 390 B13R1.3787 Cc1cccc(c1OCC(C)O)C 7a_100000210341_100011218427 [0,0,0,0,0,0|1,0,0]=1 391 B13R1.3787 Cc1cccc(c1OCC(C)O)Cl 34a_100000033731_100011218427 [0,0,0,0,0,0|2,0,0]=2 392 B13R1.3787 Cc1cccc(c1OCC(C)O)Cl 7a_100000033731_100011218427 [0,0,0,0,0,0|2,0,0]=2 393 B13R1.3787 Cc1cccc(c1OCC(C)O)F 34a_100011659162_100011218427 [0,0,0,0,0,0|2,0,0]=2 394 B13R1.3787 Cc1cccc(c1OCC(C)O)F 7a_100011659162_100011218427 [0,0,0,0,0,0|2,0,0]=2 395 B13R1.3787 Cc1cccc(c1OCC(C)O)N 34a_100000756359_100011218427 [0,0,0,0,0,0|2,0,0]=2 396 B13R1.3787 Cc1cccc(c1OCC(C)O)N 7a_100000756359_100011218427 [0,0,0,0,0,0|2,0,0]=2 397 B13R1.3787 Cc1cccc(c1OCC(F)F)Br 34a_100009817157_100011934356 [0,0,0,0,0,0|3,0,0]=3 398 B13R1.3787 Cc1cccc(c1OCC(F)F)Br 7a_100009817157_100011934356 [0,0,0,0,0,0|3,0,0]=3 399 B13R1.3787 Cc1cccc(c1OCC(F)F)C 34a_100000210341_100011934356 [0,0,0,0,0,0|2,0,0]=2 400 B13R1.3787 Cc1cccc(c1OCC(F)F)C 7a_100000210341_100011934356 [0,0,0,0,0,0|2,0,0]=2 401 B13R1.3787 Cc1cccc(c1OCC(F)F)Cl 34a_100000033731_100011934356 [0,0,0,0,0,0|3,0,0]=3 402 B13R1.3787 Cc1cccc(c1OCC(F)F)Cl 7a_100000033731_100011934356 [0,0,0,0,0,0|3,0,0]=3 403 B13R1.3787 Cc1cccc(c1OCC(F)F)F 34a_100011659162_100011934356 [0,0,0,0,0,0|3,0,0]=3 404 B13R1.3787 Cc1cccc(c1OCC(F)F)F 7a_100011659162_100011934356 [0,0,0,0,0,0|3,0,0]=3 405 B13R1.3787 Cc1cccc(c1OCC(F)F)N 34a_100000756359_100011934356 [0,0,0,0,0,0|3,0,0]=3 406 B13R1.3787 Cc1cccc(c1OCC(F)F)N 7a_100000756359_100011934356 [0,0,0,0,0,0|3,0,0]=3 407 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)Br 34a_100009817157_100009817552 [0,0,0,0,0,0|2,0,0]=2 408 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)Br 7a_100009817157_100009817552 [0,0,0,0,0,0|2,0,0]=2 409 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)C 34a_100000210341_100009817552 [0,0,0,0,0,0|1,0,0]=1 410 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)C 7a_100000210341_100009817552 [0,0,0,0,0,0|1,0,0]=1 411 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)Cl 34a_100000033731_100009817552 [0,0,0,0,0,0|2,0,0]=2 412 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)Cl 7a_100000033731_100009817552 [0,0,0,0,0,0|2,0,0]=2 413 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)F 34a_100011659162_100009817552 [0,0,0,0,0,0|2,0,0]=2 414 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)F 7a_100011659162_100009817552 [0,0,0,0,0,0|2,0,0]=2 415 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)N 34a_100000756359_100009817552 [0,0,0,0,0,0|2,0,0]=2 416 B13R1.3787 Cc1cccc(c1OC[C@@H](C)O)N 7a_100000756359_100009817552 [0,0,0,0,0,0|2,0,0]=2 417 B13R1.3787 Cc1cccc(c1OC[N+](=O)[O-])Br 34a_100009817157_100000761209 [0,0,0,0,0,0|4,0,0]=4 418 B13R1.3787 Cc1cccc(c1OC[N+](=O)[O-])C 34a_100000210341_100000761209 [0,0,0,0,0,0|3,0,0]=3 419 B13R1.3787 Cc1cccc(c1OC[N+](=O)[O-])Cl 34a_100000033731_100000761209 [0,0,0,0,0,0|4,0,0]=4 420 B13R1.3787 Cc1cccc(c1OC[N+](=O)[O-])F 34a_100011659162_100000761209 [0,0,0,0,0,0|4,0,0]=4 421 B13R1.3787 Cc1cccc(c1OC[N+](=O)[O-])N 34a_100000756359_100000761209 [0,0,0,0,0,0|4,0,0]=4 422 B13R1.3787 Cc1cccc(c1SCC(=O)N)Br 62a_100000747473_100010141302 [0,0,0,0,0,0|2,1,1]=4 423 B13R1.3787 Cc1cccc(c1SCC(=O)N)Br 62a_100010141302_100000747473 [0,0,0,0,0,0|2,1,1]=4 424 B13R1.3787 Cc1cccc(c1SCC(=O)N)C 62a_100000033847_100000747473 [0,0,0,0,0,0|1,1,1]=3 425 B13R1.3787 Cc1cccc(c1SCC(=O)N)C 62a_100000747473_100000033847 [0,0,0,0,0,0|1,1,1]=3 426 B13R1.3787 Cc1cccc(c1SCC(=O)N)Cl 62a_100000043165_100000747473 [0,0,0,0,0,0|2,1,1]=4 427 B13R1.3787 Cc1cccc(c1SCC(=O)N)Cl 62a_100000747473_100000043165 [0,0,0,0,0,0|2,1,1]=4 428 B13R1.3787 Cc1cccc(c1SCC(=O)N)F 62a_100000747473_100011218421 [0,0,0,0,0,0|2,1,1]=4 429 B13R1.3787 Cc1cccc(c1SCC(=O)N)F 62a_100011218421_100000747473 [0,0,0,0,0,0|2,1,1]=4 430 B13R1.3787 Cc1cccc(c1SCC(=O)N)N 62a_100000684715_100000747473 [0,0,0,0,0,0|2,1,1]=4 431 B13R1.3787 Cc1cccc(c1SCC(=O)N)N 62a_100000747473_100000684715 [0,0,0,0,0,0|2,1,1]=4 432 B13R1.3787 Cc1cccc(c1SCC(=O)N)O 62a_100000686692_100000747473 [0,0,0,0,0,0|2,1,1]=4 433 B13R1.3787 Cc1cccc(c1SCC(=O)N)O 62a_100000747473_100000686692 [0,0,0,0,0,0|2,1,1]=4 434 B13R1.3787 Cc1cccc(c1SCC(=O)[O-])C 62a_100000033847_100020667443 [0,0,0,0,0,0|2,1,1]=4 435 B13R1.3787 Cc1cccc(c1SCC(=O)[O-])C 62a_100020667443_100000033847 [0,0,0,0,0,0|2,1,1]=4 436 B13R1.3787 Cc1cccc(c1SCC(C)C)Br 62a_100000210624_100010141302 [0,0,0,0,0,0|2,1,0]=3 437 B13R1.3787 Cc1cccc(c1SCC(C)C)Br 62a_100010141302_100000210760 [0,0,0,0,0,0|2,1,0]=3 438 B13R1.3787 Cc1cccc(c1SCC(C)C)C 62a_100000033847_100000210760 [0,0,0,0,0,0|1,1,0]=2 439 B13R1.3787 Cc1cccc(c1SCC(C)C)C 62a_100000210624_100000033847 [0,0,0,0,0,0|1,1,0]=2 440 B13R1.3787 Cc1cccc(c1SCC(C)C)Cl 62a_100000043165_100000210760 [0,0,0,0,0,0|2,1,0]=3 441 B13R1.3787 Cc1cccc(c1SCC(C)C)Cl 62a_100000210624_100000043165 [0,0,0,0,0,0|2,1,0]=3 442 B13R1.3787 Cc1cccc(c1SCC(C)C)F 62a_100000210624_100011218421 [0,0,0,0,0,0|2,1,0]=3 443 B13R1.3787 Cc1cccc(c1SCC(C)C)F 62a_100011218421_100000210760 [0,0,0,0,0,0|2,1,0]=3 444 B13R1.3787 Cc1cccc(c1SCC(C)C)N 62a_100000210624_100000684715 [0,0,0,0,0,0|2,1,0]=3 445 B13R1.3787 Cc1cccc(c1SCC(C)C)N 62a_100000684715_100000210760 [0,0,0,0,0,0|2,1,0]=3 446 B13R1.3787 Cc1cccc(c1SCC(C)C)O 62a_100000210624_100000686692 [0,0,0,0,0,0|2,1,0]=3 447 B13R1.3787 Cc1cccc(c1SCC(C)C)O 62a_100000686692_100000210760 [0,0,0,0,0,0|2,1,0]=3 448 B13R1.3787 Cc1cccc(c1SCC(C)O)Br 62a_100010141302_100011218427 [0,0,0,0,0,0|2,1,0]=3 449 B13R1.3787 Cc1cccc(c1SCC(C)O)Br 62a_100011218427_100010141302 [0,0,0,0,0,0|2,1,0]=3 450 B13R1.3787 Cc1cccc(c1SCC(C)O)C 62a_100000033847_100011218427 [0,0,0,0,0,0|1,1,0]=2 451 B13R1.3787 Cc1cccc(c1SCC(C)O)C 62a_100011218427_100000033847 [0,0,0,0,0,0|1,1,0]=2 452 B13R1.3787 Cc1cccc(c1SCC(C)O)Cl 62a_100000043165_100011218427 [0,0,0,0,0,0|2,1,0]=3 453 B13R1.3787 Cc1cccc(c1SCC(C)O)Cl 62a_100011218427_100000043165 [0,0,0,0,0,0|2,1,0]=3 454 B13R1.3787 Cc1cccc(c1SCC(C)O)F 62a_100011218421_100011218427 [0,0,0,0,0,0|2,1,0]=3 455 B13R1.3787 Cc1cccc(c1SCC(C)O)F 62a_100011218427_100011218421 [0,0,0,0,0,0|2,1,0]=3 456 B13R1.3787 Cc1cccc(c1SCC(C)O)N 62a_100000684715_100011218427 [0,0,0,0,0,0|2,1,0]=3 457 B13R1.3787 Cc1cccc(c1SCC(C)O)N 62a_100011218427_100000684715 [0,0,0,0,0,0|2,1,0]=3 458 B13R1.3787 Cc1cccc(c1SCC(C)O)O 62a_100000686692_100011218427 [0,0,0,0,0,0|2,1,0]=3 459 B13R1.3787 Cc1cccc(c1SCC(C)O)O 62a_100011218427_100000686692 [0,0,0,0,0,0|2,1,0]=3 460 B13R1.3787 Cc1cccc(c1SCC(F)F)Br 62a_100010141302_100011934356 [0,0,0,0,0,0|3,1,0]=4 461 B13R1.3787 Cc1cccc(c1SCC(F)F)Br 62a_100011934356_100010141302 [0,0,0,0,0,0|3,1,0]=4 462 B13R1.3787 Cc1cccc(c1SCC(F)F)C 62a_100000033847_100011934356 [0,0,0,0,0,0|2,1,0]=3 463 B13R1.3787 Cc1cccc(c1SCC(F)F)C 62a_100011934356_100000033847 [0,0,0,0,0,0|2,1,0]=3 464 B13R1.3787 Cc1cccc(c1SCC(F)F)Cl 62a_100000043165_100011934356 [0,0,0,0,0,0|3,1,0]=4 465 B13R1.3787 Cc1cccc(c1SCC(F)F)Cl 62a_100011934356_100000043165 [0,0,0,0,0,0|3,1,0]=4 466 B13R1.3787 Cc1cccc(c1SCC(F)F)F 62a_100011218421_100011934356 [0,0,0,0,0,0|3,1,0]=4 467 B13R1.3787 Cc1cccc(c1SCC(F)F)F 62a_100011934356_100011218421 [0,0,0,0,0,0|3,1,0]=4 468 B13R1.3787 Cc1cccc(c1SCC(F)F)N 62a_100000684715_100011934356 [0,0,0,0,0,0|3,1,0]=4 469 B13R1.3787 Cc1cccc(c1SCC(F)F)N 62a_100011934356_100000684715 [0,0,0,0,0,0|3,1,0]=4 470 B13R1.3787 Cc1cccc(c1SCC(F)F)O 62a_100000686692_100011934356 [0,0,0,0,0,0|3,1,0]=4 471 B13R1.3787 Cc1cccc(c1SCC(F)F)O 62a_100011934356_100000686692 [0,0,0,0,0,0|3,1,0]=4 472 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)Br 62a_100009817552_100010141302 [0,0,0,0,0,0|2,1,0]=3 473 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)Br 62a_100010141302_100009817552 [0,0,0,0,0,0|2,1,0]=3 474 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)C 62a_100000033847_100009817552 [0,0,0,0,0,0|1,1,0]=2 475 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)C 62a_100009817552_100000033847 [0,0,0,0,0,0|1,1,0]=2 476 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)Cl 62a_100000043165_100009817552 [0,0,0,0,0,0|2,1,0]=3 477 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)Cl 62a_100009817552_100000043165 [0,0,0,0,0,0|2,1,0]=3 478 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)F 62a_100009817552_100011218421 [0,0,0,0,0,0|2,1,0]=3 479 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)F 62a_100011218421_100009817552 [0,0,0,0,0,0|2,1,0]=3 480 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)N 62a_100000684715_100009817552 [0,0,0,0,0,0|2,1,0]=3 481 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)N 62a_100009817552_100000684715 [0,0,0,0,0,0|2,1,0]=3 482 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)O 62a_100000686692_100009817552 [0,0,0,0,0,0|2,1,0]=3 483 B13R1.3787 Cc1cccc(c1SC[C@@H](C)O)O 62a_100009817552_100000686692 [0,0,0,0,0,0|2,1,0]=3 484 B13R1.3787 Cc1cccc(c1SC[N+](=O)[O-])C 62a_100000033847_100000761209 [0,0,0,0,0,0|3,1,0]=4 485 B13R1.3787 Cc1ccnc(c1C=CC(C)C)C 271570a_100016257149_100012000501 [0,0,0,0,0,0|3,0,1]=4 486 B13R1.3787 Cc1ccnc(c1C=CC(C)O)C 271570a_200011019289_100012000501 [0,0,0,0,0,0|3,0,1]=4 487 B13R1.3787 Cc1ccnc(c1NCC(C)C)F 27a_100000210953_100009818256 [0,0,0,0,0,0|4,0,0]=4 488 B13R1.3787 Cc1ccnc(c1NCC(C)O)F 27a_100000210904_100009818256 [0,0,0,0,0,0|4,0,0]=4 489 B13R1.3787 Cc1ccnc(c1OCC(=O)N)C 34a_100011934651_100000187820 [0,0,0,0,0,0|2,0,1]=3 490 B13R1.3787 Cc1ccnc(c1OCC(=O)N)C 7a_100011934651_100000187820 [0,0,0,0,0,0|2,0,1]=3 491 B13R1.3787 Cc1ccnc(c1OCC(=O)N)Cl 34a_100000696282_100000187820 [0,0,0,0,0,0|3,0,1]=4 492 B13R1.3787 Cc1ccnc(c1OCC(=O)N)Cl 7a_100000696282_100000187820 [0,0,0,0,0,0|3,0,1]=4 493 B13R1.3787 Cc1ccnc(c1OCC(=O)[O-])C 34a_100011934651_100020667443 [0,0,0,0,0,0|3,0,1]=4 494 B13R1.3787 Cc1ccnc(c1OCC(C)C)C 34a_100011934651_100000210624 [0,0,0,0,0,0|2,0,0]=2 495 B13R1.3787 Cc1ccnc(c1OCC(C)C)C 7a_100011934651_100000210760 [0,0,0,0,0,0|2,0,0]=2 496 B13R1.3787 Cc1ccnc(c1OCC(C)C)Cl 34a_100000696282_100000210624 [0,0,0,0,0,0|3,0,0]=3 497 B13R1.3787 Cc1ccnc(c1OCC(C)C)Cl 7a_100000696282_100000210760 [0,0,0,0,0,0|3,0,0]=3 498 B13R1.3787 Cc1ccnc(c1OCC(C)O)C 34a_100011934651_100011218427 [0,0,0,0,0,0|2,0,0]=2 499 B13R1.3787 Cc1ccnc(c1OCC(C)O)C 7a_100011934651_100011218427 [0,0,0,0,0,0|2,0,0]=2 500 B13R1.3787 Cc1ccnc(c1OCC(C)O)Cl 34a_100000696282_100011218427 [0,0,0,0,0,0|3,0,0]=3 501 B13R1.3787 Cc1ccnc(c1OCC(C)O)Cl 7a_100000696282_100011218427 [0,0,0,0,0,0|3,0,0]=3 502 B13R1.3787 Cc1ccnc(c1OCC(F)F)C 34a_100011934651_100011934356 [0,0,0,0,0,0|3,0,0]=3 503 B13R1.3787 Cc1ccnc(c1OCC(F)F)C 7a_100011934651_100011934356 [0,0,0,0,0,0|3,0,0]=3 504 B13R1.3787 Cc1ccnc(c1OCC(F)F)Cl 34a_100000696282_100011934356 [0,0,0,0,0,0|4,0,0]=4 505 B13R1.3787 Cc1ccnc(c1OCC(F)F)Cl 7a_100000696282_100011934356 [0,0,0,0,0,0|4,0,0]=4 506 B13R1.3787 Cc1ccnc(c1OC[C@@H](C)O)C 34a_100011934651_100009817552 [0,0,0,0,0,0|2,0,0]=2 507 B13R1.3787 Cc1ccnc(c1OC[C@@H](C)O)C 7a_100011934651_100009817552 [0,0,0,0,0,0|2,0,0]=2 508 B13R1.3787 Cc1ccnc(c1OC[C@@H](C)O)Cl 34a_100000696282_100009817552 [0,0,0,0,0,0|3,0,0]=3 509 B13R1.3787 Cc1ccnc(c1OC[C@@H](C)O)Cl 7a_100000696282_100009817552 [0,0,0,0,0,0|3,0,0]=3 510 B13R1.3787 Cc1ccnc(c1OC[N+](=O)[O-])C 34a_100011934651_100000761209 [0,0,0,0,0,0|4,0,0]=4 511 B13R1.3787 Cc1ccnc(c1SCC(=O)N)C 62a_100000747473_100012000501 [0,0,0,0,0,0|2,1,1]=4 512 B13R1.3787 Cc1ccnc(c1SCC(=O)N)C 62a_100012000501_100000747473 [0,0,0,0,0,0|2,1,1]=4 513 B13R1.3787 Cc1ccnc(c1SCC(C)C)C 62a_100000210624_100012000501 [0,0,0,0,0,0|2,1,0]=3 514 B13R1.3787 Cc1ccnc(c1SCC(C)C)C 62a_100012000501_100000210760 [0,0,0,0,0,0|2,1,0]=3 515 B13R1.3787 Cc1ccnc(c1SCC(C)C)Cl 62a_100000210624_100010248874 [0,0,0,0,0,0|3,1,0]=4 516 B13R1.3787 Cc1ccnc(c1SCC(C)C)Cl 62a_100010248874_100000210760 [0,0,0,0,0,0|3,1,0]=4 517 B13R1.3787 Cc1ccnc(c1SCC(C)C)F 62a_100000210624_100009818256 [0,0,0,0,0,0|3,1,0]=4 518 B13R1.3787 Cc1ccnc(c1SCC(C)C)F 62a_100009818256_100000210760 [0,0,0,0,0,0|3,1,0]=4 519 B13R1.3787 Cc1ccnc(c1SCC(C)C)N 62a_100000210624_100011998619 [0,0,0,0,0,0|3,1,0]=4 520 B13R1.3787 Cc1ccnc(c1SCC(C)C)N 62a_100011998619_100000210760 [0,0,0,0,0,0|3,1,0]=4 521 B13R1.3787 Cc1ccnc(c1SCC(C)C)O 62a_100000210624_100012000493 [0,0,0,0,0,0|3,1,0]=4 522 B13R1.3787 Cc1ccnc(c1SCC(C)C)O 62a_100012000493_100000210760 [0,0,0,0,0,0|3,1,0]=4 523 B13R1.3787 Cc1ccnc(c1SCC(C)O)C 62a_100011218427_100012000501 [0,0,0,0,0,0|2,1,0]=3 524 B13R1.3787 Cc1ccnc(c1SCC(C)O)C 62a_100012000501_100011218427 [0,0,0,0,0,0|2,1,0]=3 525 B13R1.3787 Cc1ccnc(c1SCC(C)O)Cl 62a_100010248874_100011218427 [0,0,0,0,0,0|3,1,0]=4 526 B13R1.3787 Cc1ccnc(c1SCC(C)O)Cl 62a_100011218427_100010248874 [0,0,0,0,0,0|3,1,0]=4 527 B13R1.3787 Cc1ccnc(c1SCC(C)O)F 62a_100009818256_100011218427 [0,0,0,0,0,0|3,1,0]=4 528 B13R1.3787 Cc1ccnc(c1SCC(C)O)F 62a_100011218427_100009818256 [0,0,0,0,0,0|3,1,0]=4 529 B13R1.3787 Cc1ccnc(c1SCC(C)O)N 62a_100011218427_100011998619 [0,0,0,0,0,0|3,1,0]=4 530 B13R1.3787 Cc1ccnc(c1SCC(C)O)N 62a_100011998619_100011218427 [0,0,0,0,0,0|3,1,0]=4 531 B13R1.3787 Cc1ccnc(c1SCC(C)O)O 62a_100011218427_100012000493 [0,0,0,0,0,0|3,1,0]=4 532 B13R1.3787 Cc1ccnc(c1SCC(C)O)O 62a_100012000493_100011218427 [0,0,0,0,0,0|3,1,0]=4 533 B13R1.3787 Cc1ccnc(c1SCC(F)F)C 62a_100011934356_100012000501 [0,0,0,0,0,0|3,1,0]=4 534 B13R1.3787 Cc1ccnc(c1SCC(F)F)C 62a_100012000501_100011934356 [0,0,0,0,0,0|3,1,0]=4 535 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)C 62a_100009817552_100012000501 [0,0,0,0,0,0|2,1,0]=3 536 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)C 62a_100012000501_100009817552 [0,0,0,0,0,0|2,1,0]=3 537 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)Cl 62a_100009817552_100010248874 [0,0,0,0,0,0|3,1,0]=4 538 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)Cl 62a_100010248874_100009817552 [0,0,0,0,0,0|3,1,0]=4 539 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)F 62a_100009817552_100009818256 [0,0,0,0,0,0|3,1,0]=4 540 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)F 62a_100009818256_100009817552 [0,0,0,0,0,0|3,1,0]=4 541 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)N 62a_100009817552_100011998619 [0,0,0,0,0,0|3,1,0]=4 542 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)N 62a_100011998619_100009817552 [0,0,0,0,0,0|3,1,0]=4 543 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)O 62a_100009817552_100012000493 [0,0,0,0,0,0|3,1,0]=4 544 B13R1.3787 Cc1ccnc(c1SC[C@@H](C)O)O 62a_100012000493_100009817552 [0,0,0,0,0,0|3,1,0]=4 545 B13R1.3787 Cc1cncc(c1C=CC(C)C)C 271570a_100016257149_100009817138 [0,0,0,0,0,0|3,0,1]=4 546 B13R1.3787 Cc1cncc(c1C=CC(C)O)C 271570a_200011019289_100009817138 [0,0,0,0,0,0|3,0,1]=4 547 B13R1.3787 Cc1cncc(c1SCC(=O)N)C 62a_100000747473_100009817138 [0,0,0,0,0,0|2,1,1]=4 548 B13R1.3787 Cc1cncc(c1SCC(=O)N)C 62a_100009817138_100000747473 [0,0,0,0,0,0|2,1,1]=4 549 B13R1.3787 Cc1cncc(c1SCC(C)C)C 62a_100000210624_100009817138 [0,0,0,0,0,0|2,1,0]=3 550 B13R1.3787 Cc1cncc(c1SCC(C)C)C 62a_100009817138_100000210760 [0,0,0,0,0,0|2,1,0]=3 551 B13R1.3787 Cc1cncc(c1SCC(C)O)C 62a_100009817138_100011218427 [0,0,0,0,0,0|2,1,0]=3 552 B13R1.3787 Cc1cncc(c1SCC(C)O)C 62a_100011218427_100009817138 [0,0,0,0,0,0|2,1,0]=3 553 B13R1.3787 Cc1cncc(c1SCC(F)F)C 62a_100009817138_100011934356 [0,0,0,0,0,0|3,1,0]=4 554 B13R1.3787 Cc1cncc(c1SCC(F)F)C 62a_100011934356_100009817138 [0,0,0,0,0,0|3,1,0]=4 555 B13R1.3787 Cc1cncc(c1SC[C@@H](C)O)C 62a_100009817138_100009817552 [0,0,0,0,0,0|2,1,0]=3 556 B13R1.3787 Cc1cncc(c1SC[C@@H](C)O)C 62a_100009817552_100009817138 [0,0,0,0,0,0|2,1,0]=3 557 B13R1.3787 Cc1nccc(c1SCC(C)C)N 62a_100000210624_100010243816 [0,0,0,0,0,0|3,1,0]=4 558 B13R1.3787 Cc1nccc(c1SCC(C)C)N 62a_100010243816_100000210760 [0,0,0,0,0,0|3,1,0]=4 559 B13R1.3787 Cc1nccc(c1SCC(C)O)N 62a_100010243816_100011218427 [0,0,0,0,0,0|3,1,0]=4 560 B13R1.3787 Cc1nccc(c1SCC(C)O)N 62a_100011218427_100010243816 [0,0,0,0,0,0|3,1,0]=4 561 B13R1.3787 Cc1nccc(c1SC[C@@H](C)O)N 62a_100009817552_100010243816 [0,0,0,0,0,0|3,1,0]=4 562 B13R1.3787 Cc1nccc(c1SC[C@@H](C)O)N 62a_100010243816_100009817552 [0,0,0,0,0,0|3,1,0]=4 563 B13R1.3787 Cc1ncnc(c1NCC(C)C)C 27a_100000210953_100009820708 [0,0,0,0,0,0|4,0,0]=4 564 B13R1.3787 Cc1ncnc(c1NCC(C)O)C 27a_100000210904_100009820708 [0,0,0,0,0,0|4,0,0]=4 565 B13R1.3787 Cc1ncnc(c1OCC(=O)N)C 34a_100009878406_100000187820 [0,0,0,0,0,0|3,0,1]=4 566 B13R1.3787 Cc1ncnc(c1OCC(=O)N)C 7a_100009878406_100000187820 [0,0,0,0,0,0|3,0,1]=4 567 B13R1.3787 Cc1ncnc(c1OCC(C)C)C 34a_100009878406_100000210624 [0,0,0,0,0,0|3,0,0]=3 568 B13R1.3787 Cc1ncnc(c1OCC(C)C)C 7a_100009878406_100000210760 [0,0,0,0,0,0|3,0,0]=3 569 B13R1.3787 Cc1ncnc(c1OCC(C)O)C 34a_100009878406_100011218427 [0,0,0,0,0,0|3,0,0]=3 570 B13R1.3787 Cc1ncnc(c1OCC(C)O)C 7a_100009878406_100011218427 [0,0,0,0,0,0|3,0,0]=3 571 B13R1.3787 Cc1ncnc(c1OCC(F)F)C 34a_100009878406_100011934356 [0,0,0,0,0,0|4,0,0]=4 572 B13R1.3787 Cc1ncnc(c1OCC(F)F)C 7a_100009878406_100011934356 [0,0,0,0,0,0|4,0,0]=4 573 B13R1.3787 Cc1ncnc(c1OC[C@@H](C)O)C 34a_100009878406_100009817552 [0,0,0,0,0,0|3,0,0]=3 574 B13R1.3787 Cc1ncnc(c1OC[C@@H](C)O)C 7a_100009878406_100009817552 [0,0,0,0,0,0|3,0,0]=3 575 B13R1.3787 Cc1ncnc(c1SCC(C)C)C 62a_100000210624_100009820708 [0,0,0,0,0,0|3,1,0]=4 576 B13R1.3787 Cc1ncnc(c1SCC(C)C)C 62a_100009820708_100000210760 [0,0,0,0,0,0|3,1,0]=4 577 B13R1.3787 Cc1ncnc(c1SCC(C)O)C 62a_100009820708_100011218427 [0,0,0,0,0,0|3,1,0]=4 578 B13R1.3787 Cc1ncnc(c1SCC(C)O)C 62a_100011218427_100009820708 [0,0,0,0,0,0|3,1,0]=4 579 B13R1.3787 Cc1ncnc(c1SC[C@@H](C)O)C 62a_100009817552_100009820708 [0,0,0,0,0,0|3,1,0]=4 580 B13R1.3787 Cc1ncnc(c1SC[C@@H](C)O)C 62a_100009820708_100009817552 [0,0,0,0,0,0|3,1,0]=4 581 B13R1.3787 Cc1occc(=O)c1OCC(=O)N 34a_100000031901_100000187820 [0,0,0,0,0,0|3,0,1]=4 582 B13R1.3787 Cc1occc(=O)c1OCC(C)C 34a_100000031901_100000210624 [0,0,0,0,0,0|3,0,0]=3 583 B13R1.3787 Cc1occc(=O)c1OCC(C)O 34a_100000031901_100011218427 [0,0,0,0,0,0|3,0,0]=3 584 B13R1.3787 Cc1occc(=O)c1OCC(F)F 34a_100000031901_100011934356 [0,0,0,0,0,0|4,0,0]=4 585 B13R1.3787 Cc1occc(=O)c1OC[C@@H](C)O 34a_100000031901_100009817552 [0,0,0,0,0,0|3,0,0]=3 586 B13R1.3787 FC(F)COc1c(cccc1Br)Br 34a_100000736428_100011934356 [0,0,0,0,0,0|4,0,0]=4 587 B13R1.3787 FC(F)COc1c(cccc1Br)Br 7a_100000736428_100011934356 [0,0,0,0,0,0|4,0,0]=4 588 B13R1.3787 FC(F)COc1c(cccc1Br)Cl 34a_100010214474_100011934356 [0,0,0,0,0,0|4,0,0]=4 589 B13R1.3787 FC(F)COc1c(cccc1Br)Cl 7a_100010214474_100011934356 [0,0,0,0,0,0|4,0,0]=4 590 B13R1.3787 FC(F)COc1c(cccc1Cl)Cl 34a_100000211709_100011934356 [0,0,0,0,0,0|4,0,0]=4 591 B13R1.3787 FC(F)COc1c(cccc1Cl)Cl 7a_100000211709_100011934356 [0,0,0,0,0,0|4,0,0]=4 592 B13R1.3787 FC(F)COc1c(cccc1I)Br 34a_100010084509_100011934356 [0,0,0,0,0,0|4,0,0]=4 593 B13R1.3787 FC(F)COc1c(cccc1I)Br 7a_100010084509_100011934356 [0,0,0,0,0,0|4,0,0]=4 594 B13R1.3787 FC(F)COc1c(cccc1I)Cl 34a_100010202889_100011934356 [0,0,0,0,0,0|4,0,0]=4 595 B13R1.3787 FC(F)COc1c(cccc1I)Cl 7a_100010202889_100011934356 [0,0,0,0,0,0|4,0,0]=4 596 B13R1.3787 Fc1cccc(c1OCC(F)F)Br 34a_100009813666_100011934356 [0,0,0,0,0,0|4,0,0]=4 597 B13R1.3787 Fc1cccc(c1OCC(F)F)Br 7a_100009813666_100011934356 [0,0,0,0,0,0|4,0,0]=4 598 B13R1.3787 Fc1cccc(c1OCC(F)F)Cl 34a_100000694953_100011934356 [0,0,0,0,0,0|4,0,0]=4 599 B13R1.3787 Fc1cccc(c1OCC(F)F)Cl 7a_100000694953_100011934356 [0,0,0,0,0,0|4,0,0]=4 600 B13R1.3787 Fc1cccc(c1OCC(F)F)F 34a_100000230165_100011934356 [0,0,0,0,0,0|4,0,0]=4 601 B13R1.3787 Fc1cccc(c1OCC(F)F)F 7a_100000230165_100011934356 [0,0,0,0,0,0|4,0,0]=4 602 B13R1.3787 Fc1cccc(c1OCC(F)F)I 34a_100010186298_100011934356 [0,0,0,0,0,0|4,0,0]=4 603 B13R1.3787 Fc1cccc(c1OCC(F)F)I 7a_100010186298_100011934356 [0,0,0,0,0,0|4,0,0]=4 604 B13R1.3787 NC(=O)COc1c(cccc1Br)Br 34a_100000736428_100000187820 [0,0,0,0,0,0|3,0,1]=4 605 B13R1.3787 NC(=O)COc1c(cccc1Br)Br 7a_100000736428_100000187820 [0,0,0,0,0,0|3,0,1]=4 606 B13R1.3787 NC(=O)COc1c(cccc1Br)Cl 34a_100010214474_100000187820 [0,0,0,0,0,0|3,0,1]=4 607 B13R1.3787 NC(=O)COc1c(cccc1Br)Cl 7a_100010214474_100000187820 [0,0,0,0,0,0|3,0,1]=4 608 B13R1.3787 NC(=O)COc1c(cccc1Br)F 34a_100009813666_100000187820 [0,0,0,0,0,0|3,0,1]=4 609 B13R1.3787 NC(=O)COc1c(cccc1Br)F 7a_100009813666_100000187820 [0,0,0,0,0,0|3,0,1]=4 610 B13R1.3787 NC(=O)COc1c(cccc1Br)N 34a_100011934915_100000187820 [0,0,0,0,0,0|3,0,1]=4 611 B13R1.3787 NC(=O)COc1c(cccc1Cl)Cl 34a_100000211709_100000187820 [0,0,0,0,0,0|3,0,1]=4 612 B13R1.3787 NC(=O)COc1c(cccc1Cl)Cl 7a_100000211709_100000187820 [0,0,0,0,0,0|3,0,1]=4 613 B13R1.3787 NC(=O)COc1c(cccc1Cl)F 34a_100000694953_100000187820 [0,0,0,0,0,0|3,0,1]=4 614 B13R1.3787 NC(=O)COc1c(cccc1Cl)F 7a_100000694953_100000187820 [0,0,0,0,0,0|3,0,1]=4 615 B13R1.3787 NC(=O)COc1c(cccc1Cl)N 34a_100000754742_100000187820 [0,0,0,0,0,0|3,0,1]=4 616 B13R1.3787 NC(=O)COc1c(cccc1F)F 34a_100000230165_100000187820 [0,0,0,0,0,0|3,0,1]=4 617 B13R1.3787 NC(=O)COc1c(cccc1F)F 7a_100000230165_100000187820 [0,0,0,0,0,0|3,0,1]=4 618 B13R1.3787 NC(=O)COc1c(cccc1F)N 34a_100011934987_100000187820 [0,0,0,0,0,0|3,0,1]=4 619 B13R1.3787 NC(=O)COc1c(cccc1I)Br 34a_100010084509_100000187820 [0,0,0,0,0,0|3,0,1]=4 620 B13R1.3787 NC(=O)COc1c(cccc1I)Br 7a_100010084509_100000187820 [0,0,0,0,0,0|3,0,1]=4 621 B13R1.3787 NC(=O)COc1c(cccc1I)Cl 34a_100010202889_100000187820 [0,0,0,0,0,0|3,0,1]=4 622 B13R1.3787 NC(=O)COc1c(cccc1I)Cl 7a_100010202889_100000187820 [0,0,0,0,0,0|3,0,1]=4 623 B13R1.3787 NC(=O)COc1c(cccc1I)F 34a_100010186298_100000187820 [0,0,0,0,0,0|3,0,1]=4 624 B13R1.3787 NC(=O)COc1c(cccc1I)F 7a_100010186298_100000187820 [0,0,0,0,0,0|3,0,1]=4 625 B13R1.3787 NC(=O)COc1c(cccc1I)N 34a_100010084371_100000187820 [0,0,0,0,0,0|3,0,1]=4 626 B13R1.3787 NC(=O)COc1c(cccc1N)N 34a_200016994477_100000187820 [0,0,0,0,0,0|3,0,1]=4 627 B13R1.3787 Nc1cccc(c1OCC(F)F)Br 34a_100011934915_100011934356 [0,0,0,0,0,0|4,0,0]=4 628 B13R1.3787 Nc1cccc(c1OCC(F)F)Cl 34a_100000754742_100011934356 [0,0,0,0,0,0|4,0,0]=4 629 B13R1.3787 Nc1cccc(c1OCC(F)F)F 34a_100011934987_100011934356 [0,0,0,0,0,0|4,0,0]=4 630 B13R1.3787 Nc1cccc(c1OCC(F)F)I 34a_100010084371_100011934356 [0,0,0,0,0,0|4,0,0]=4 631 B13R1.3787 Nc1cccc(c1OCC(F)F)N 34a_200016994477_100011934356 [0,0,0,0,0,0|4,0,0]=4 632 B13R1.3787 [13CH3]C(=O)COc1c(cccc1Cl)Cl 1458a_100000184137_200025704644 [0,0,0,0,0,0|3,0,1]=4 633 B12R1.125 C=C(C)CNc1ccccc1C 34a_100015192222_100000748629 [1,0,0,0,0,0|2,0,1]=4 634 B12R1.125 C=C(C)COc1ccccc1Br 34a_100000181306_100000748629 [1,0,0,0,0,0|2,0,1]=4 635 B12R1.125 C=C(C)COc1ccccc1Br 7a_100000181306_100000748629 [1,0,0,0,0,0|2,0,1]=4 636 B12R1.125 C=C(C)COc1ccccc1C 34a_100000210338_100000748629 [1,0,0,0,0,0|1,0,1]=3 637 B12R1.125 C=C(C)COc1ccccc1C 7a_100000210338_100000748629 [1,0,0,0,0,0|1,0,1]=3 638 B12R1.125 C=C(C)COc1ccccc1Cl 34a_100000210172_100000748629 [1,0,0,0,0,0|2,0,1]=4 639 B12R1.125 C=C(C)COc1ccccc1Cl 7a_100000210172_100000748629 [1,0,0,0,0,0|2,0,1]=4 640 B12R1.125 C=C(C)COc1ccccc1F 34a_100000210171_100000748629 [1,0,0,0,0,0|2,0,1]=4 641 B12R1.125 C=C(C)COc1ccccc1F 7a_100000210171_100000748629 [1,0,0,0,0,0|2,0,1]=4 642 B12R1.125 C=C(C)COc1ccccc1I 34a_100000739446_100000748629 [1,0,0,0,0,0|2,0,1]=4 643 B12R1.125 C=C(C)COc1ccccc1I 7a_100000739446_100000748629 [1,0,0,0,0,0|2,0,1]=4 644 B12R1.125 C=C(C)COc1ccccc1N 34a_100000185747_100000748629 [1,0,0,0,0,0|2,0,1]=4 645 B12R1.125 C=C(C)COc1ccccc1N 7a_100000185747_100000748629 [1,0,0,0,0,0|2,0,1]=4 646 B12R1.125 C=C(C)COc1cccnc1C 34a_100000745507_100000748629 [1,0,0,0,0,0|2,0,1]=4 647 B12R1.125 C=C(C)COc1cccnc1C 7a_100000745507_100000748629 [1,0,0,0,0,0|2,0,1]=4 648 B12R1.125 C=C(C)COc1ccncc1C 34a_100000694293_100000748629 [1,0,0,0,0,0|2,0,1]=4 649 B12R1.125 C=C(C)COc1cnccc1C 34a_100011997053_100000748629 [1,0,0,0,0,0|2,0,1]=4 650 B12R1.125 C=C(C)COc1cnccc1C 7a_100011997053_100000748629 [1,0,0,0,0,0|2,0,1]=4 651 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000210755_100000211660 [1,0,0,0,0,0|1,1,1]=4 652 B12R1.125 C=C(C)CSc1ccccc1C 62a_100000748629_100000210755 [1,0,0,0,0,0|1,1,1]=4 653 B12R1.125 C=C(F)COc1ccccc1C 34a_100000210338_100009893438 [1,0,0,0,0,0|1,0,2]=4 654 B12R1.125 C=C(F)COc1ccccc1C 7a_100000210338_100000042424 [1,0,0,0,0,0|1,0,2]=4 655 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000070787_100011713688 [1,0,0,0,0,0|2,0,1]=4 656 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000748742_200000210301 [1,0,0,0,0,0|2,0,1]=4 657 B12R1.125 CC(=O)COc1ccccc1Br 1458a_100000216496_200000210301 [1,0,0,0,0,0|2,0,1]=4 658 B12R1.125 CC(=O)COc1ccccc1C 1458a_100000182418_200000210301 [1,0,0,0,0,0|1,0,1]=3 659 B12R1.125 CC(=O)COc1ccccc1Cl 1458a_100000185159_200000210301 [1,0,0,0,0,0|2,0,1]=4 660 B12R1.125 CC(=O)COc1ccccc1F 1458a_100000182486_200000210301 [1,0,0,0,0,0|2,0,1]=4 661 B12R1.125 CC(=O)COc1ccccc1O 1458a_100000183020_200000210301 [1,0,0,0,0,0|2,0,1]=4 662 B12R1.125 CC(=O)CSc1ccccc1C 1458a_100000183026_200000210301 [1,0,0,0,0,0|1,1,1]=4 663 B12R1.125 CC(C)CNc1ccccc1Br 34a_100000210017_100000210624 [1,0,0,0,0,0|3,0,0]=4 664 B12R1.125 CC(C)CNc1ccccc1Cl 34a_100000185783_100000210624 [1,0,0,0,0,0|3,0,0]=4 665 B12R1.125 CC(C)CNc1ccccc1F 34a_100000210422_100000210624 [1,0,0,0,0,0|3,0,0]=4 666 B12R1.125 CC(C)CNc1ccccc1I 34a_100000210053_100000210624 [1,0,0,0,0,0|3,0,0]=4 667 B12R1.125 CC(C)CNc1ccccc1O 34a_100000185747_100000210624 [1,0,0,0,0,0|3,0,0]=4 668 B12R1.125 CC(C)COc1cccc[n+]1[O-] 7a_100000211761_100000210760 [1,0,0,0,0,0|3,0,0]=4 669 B12R1.125 CC(C)COc1ccccc1Br 34a_100000181306_100000210624 [1,0,0,0,0,0|2,0,0]=3 670 B12R1.125 CC(C)COc1ccccc1Br 7a_100000181306_100000210760 [1,0,0,0,0,0|2,0,0]=3 671 B12R1.125 CC(C)COc1ccccc1Cl 34a_100000210172_100000210624 [1,0,0,0,0,0|2,0,0]=3 672 B12R1.125 CC(C)COc1ccccc1Cl 7a_100000210172_100000210760 [1,0,0,0,0,0|2,0,0]=3 673 B12R1.125 CC(C)COc1ccccc1F 34a_100000210171_100000210624 [1,0,0,0,0,0|2,0,0]=3 674 B12R1.125 CC(C)COc1ccccc1F 7a_100000210171_100000210760 [1,0,0,0,0,0|2,0,0]=3 675 B12R1.125 CC(C)COc1ccccc1I 34a_100000739446_100000210624 [1,0,0,0,0,0|2,0,0]=3 676 B12R1.125 CC(C)COc1ccccc1I 7a_100000739446_100000210760 [1,0,0,0,0,0|2,0,0]=3 677 B12R1.125 CC(C)COc1ccccc1N 34a_100000185747_100000210624 [1,0,0,0,0,0|2,0,0]=3 678 B12R1.125 CC(C)COc1ccccc1N 7a_100000185747_100000210760 [1,0,0,0,0,0|2,0,0]=3 679 B12R1.125 CC(C)COc1cccnc1Br 34a_100000744436_100000210624 [1,0,0,0,0,0|3,0,0]=4 680 B12R1.125 CC(C)COc1cccnc1Br 7a_100000744436_100000210760 [1,0,0,0,0,0|3,0,0]=4 681 B12R1.125 CC(C)COc1cccnc1Cl 34a_100000757616_100000210624 [1,0,0,0,0,0|3,0,0]=4 682 B12R1.125 CC(C)COc1cccnc1Cl 7a_100000757616_100000210760 [1,0,0,0,0,0|3,0,0]=4 683 B12R1.125 CC(C)COc1cccnc1F 34a_100000061740_100000210624 [1,0,0,0,0,0|3,0,0]=4 684 B12R1.125 CC(C)COc1cccnc1F 7a_100000061740_100000210760 [1,0,0,0,0,0|3,0,0]=4 685 B12R1.125 CC(C)COc1cccnc1I 34a_100000034122_100000210624 [1,0,0,0,0,0|3,0,0]=4 686 B12R1.125 CC(C)COc1cccnc1I 7a_100000034122_100000210760 [1,0,0,0,0,0|3,0,0]=4 687 B12R1.125 CC(C)COc1cccnc1N 34a_100000211975_100000210624 [1,0,0,0,0,0|3,0,0]=4 688 B12R1.125 CC(C)COc1cccnc1N 7a_100000211975_100000210760 [1,0,0,0,0,0|3,0,0]=4 689 B12R1.125 CC(C)COc1cccoc1=O 34a_100000077404_100000210624 [1,0,0,0,0,0|3,0,0]=4 690 B12R1.125 CC(C)COc1cccoc1=O 7a_100000077404_100000210760 [1,0,0,0,0,0|3,0,0]=4 691 B12R1.125 CC(C)COc1ccncc1Br 34a_100011996408_100000210624 [1,0,0,0,0,0|3,0,0]=4 692 B12R1.125 CC(C)COc1ccncc1Cl 34a_100011997054_100000210624 [1,0,0,0,0,0|3,0,0]=4 693 B12R1.125 CC(C)COc1ccncc1F 34a_200000081243_100000210624 [1,0,0,0,0,0|3,0,0]=4 694 B12R1.125 CC(C)COc1cnccc1Cl 34a_100011996695_100000210624 [1,0,0,0,0,0|3,0,0]=4 695 B12R1.125 CC(C)COc1cnccc1I 34a_100000050107_100000210624 [1,0,0,0,0,0|3,0,0]=4 696 B12R1.125 CC(C)COc1cnccc1N 34a_100000753702_100000210624 [1,0,0,0,0,0|3,0,0]=4 697 B12R1.125 CC(C)COc1coccc1=O 34a_100000060831_100000210624 [1,0,0,0,0,0|3,0,0]=4 698 B12R1.125 CC(C)COc1ncccc1Cl 34a_100011290957_100000210624 [1,0,0,0,0,0|3,0,0]=4 699 B12R1.125 CC(C)COc1ncccc1F 34a_100011219419_100000210624 [1,0,0,0,0,0|3,0,0]=4 700 B12R1.125 CC(C)COc1ncccc1N 34a_100000746358_100000210624 [1,0,0,0,0,0|3,0,0]=4 701 B12R1.125 CC(C)CSc1cccc[n+]1C 62a_100000210624_100000212160 [1,0,0,0,0,0|2,1,0]=4 702 B12R1.125 CC(C)CSc1ccccc1Br 62a_100000210624_100000695589 [1,0,0,0,0,0|2,1,0]=4 703 B12R1.125 CC(C)CSc1ccccc1Br 62a_100000695589_100000210760 [1,0,0,0,0,0|2,1,0]=4 704 B12R1.125 CC(C)CSc1ccccc1Cl 62a_100000210624_100000764095 [1,0,0,0,0,0|2,1,0]=4 705 B12R1.125 CC(C)CSc1ccccc1Cl 62a_100000764095_100000210760 [1,0,0,0,0,0|2,1,0]=4 706 B12R1.125 CC(C)CSc1ccccc1F 62a_100000210624_100011215700 [1,0,0,0,0,0|2,1,0]=4 707 B12R1.125 CC(C)CSc1ccccc1F 62a_100011215700_100000210760 [1,0,0,0,0,0|2,1,0]=4 708 B12R1.125 CC(C)CSc1ccccc1N 62a_100000210017_100000210760 [1,0,0,0,0,0|2,1,0]=4 709 B12R1.125 CC(C)CSc1ccccc1N 62a_100000210624_100000210017 [1,0,0,0,0,0|2,1,0]=4 710 B12R1.125 CC(C)CSc1ccccc1O 62a_100000210624_100000739446 [1,0,0,0,0,0|2,1,0]=4 711 B12R1.125 CC(C)CSc1ccccc1O 62a_100000739446_100000210760 [1,0,0,0,0,0|2,1,0]=4 712 B12R1.125 CC(O)CNc1ccccc1Br 34a_100000210017_100011218427 [1,0,0,0,0,0|3,0,0]=4 713 B12R1.125 CC(O)CNc1ccccc1Cl 34a_100000185783_100011218427 [1,0,0,0,0,0|3,0,0]=4 714 B12R1.125 CC(O)CNc1ccccc1F 34a_100000210422_100011218427 [1,0,0,0,0,0|3,0,0]=4 715 B12R1.125 CC(O)CNc1ccccc1I 34a_100000210053_100011218427 [1,0,0,0,0,0|3,0,0]=4 716 B12R1.125 CC(O)CNc1ccccc1O 34a_100000185747_100011218427 [1,0,0,0,0,0|3,0,0]=4 717 B12R1.125 CC(O)COc1cccc[n+]1[O-] 7a_100000211761_100011218427 [1,0,0,0,0,0|3,0,0]=4 718 B12R1.125 CC(O)COc1ccccc1Br 34a_100000181306_100011218427 [1,0,0,0,0,0|2,0,0]=3 719 B12R1.125 CC(O)COc1ccccc1Br 7a_100000181306_100011218427 [1,0,0,0,0,0|2,0,0]=3 720 B12R1.125 CC(O)COc1ccccc1Cl 34a_100000210172_100011218427 [1,0,0,0,0,0|2,0,0]=3 721 B12R1.125 CC(O)COc1ccccc1Cl 7a_100000210172_100011218427 [1,0,0,0,0,0|2,0,0]=3 722 B12R1.125 CC(O)COc1ccccc1F 34a_100000210171_100011218427 [1,0,0,0,0,0|2,0,0]=3 723 B12R1.125 CC(O)COc1ccccc1F 7a_100000210171_100011218427 [1,0,0,0,0,0|2,0,0]=3 724 B12R1.125 CC(O)COc1ccccc1I 34a_100000739446_100011218427 [1,0,0,0,0,0|2,0,0]=3 725 B12R1.125 CC(O)COc1ccccc1I 7a_100000739446_100011218427 [1,0,0,0,0,0|2,0,0]=3 726 B12R1.125 CC(O)COc1ccccc1N 34a_100000185747_100011218427 [1,0,0,0,0,0|2,0,0]=3 727 B12R1.125 CC(O)COc1ccccc1N 7a_100000185747_100011218427 [1,0,0,0,0,0|2,0,0]=3 728 B12R1.125 CC(O)COc1cccnc1Br 34a_100000744436_100011218427 [1,0,0,0,0,0|3,0,0]=4 729 B12R1.125 CC(O)COc1cccnc1Br 7a_100000744436_100011218427 [1,0,0,0,0,0|3,0,0]=4 730 B12R1.125 CC(O)COc1cccnc1Cl 34a_100000757616_100011218427 [1,0,0,0,0,0|3,0,0]=4 731 B12R1.125 CC(O)COc1cccnc1Cl 7a_100000757616_100011218427 [1,0,0,0,0,0|3,0,0]=4 732 B12R1.125 CC(O)COc1cccnc1F 34a_100000061740_100011218427 [1,0,0,0,0,0|3,0,0]=4 733 B12R1.125 CC(O)COc1cccnc1F 7a_100000061740_100011218427 [1,0,0,0,0,0|3,0,0]=4 734 B12R1.125 CC(O)COc1cccnc1I 34a_100000034122_100011218427 [1,0,0,0,0,0|3,0,0]=4 735 B12R1.125 CC(O)COc1cccnc1I 7a_100000034122_100011218427 [1,0,0,0,0,0|3,0,0]=4 736 B12R1.125 CC(O)COc1cccnc1N 34a_100000211975_100011218427 [1,0,0,0,0,0|3,0,0]=4 737 B12R1.125 CC(O)COc1cccnc1N 7a_100000211975_100011218427 [1,0,0,0,0,0|3,0,0]=4 738 B12R1.125 CC(O)COc1cccoc1=O 34a_100000077404_100011218427 [1,0,0,0,0,0|3,0,0]=4 739 B12R1.125 CC(O)COc1cccoc1=O 7a_100000077404_100011218427 [1,0,0,0,0,0|3,0,0]=4 740 B12R1.125 CC(O)COc1ccncc1Br 34a_100011996408_100011218427 [1,0,0,0,0,0|3,0,0]=4 741 B12R1.125 CC(O)COc1ccncc1Cl 34a_100011997054_100011218427 [1,0,0,0,0,0|3,0,0]=4 742 B12R1.125 CC(O)COc1ccncc1F 34a_200000081243_100011218427 [1,0,0,0,0,0|3,0,0]=4 743 B12R1.125 CC(O)COc1cnccc1Cl 34a_100011996695_100011218427 [1,0,0,0,0,0|3,0,0]=4 744 B12R1.125 CC(O)COc1cnccc1I 34a_100000050107_100011218427 [1,0,0,0,0,0|3,0,0]=4 745 B12R1.125 CC(O)COc1cnccc1N 34a_100000753702_100011218427 [1,0,0,0,0,0|3,0,0]=4 746 B12R1.125 CC(O)COc1coccc1=O 34a_100000060831_100011218427 [1,0,0,0,0,0|3,0,0]=4 747 B12R1.125 CC(O)COc1ncccc1Cl 34a_100011290957_100011218427 [1,0,0,0,0,0|3,0,0]=4 748 B12R1.125 CC(O)COc1ncccc1F 34a_100011219419_100011218427 [1,0,0,0,0,0|3,0,0]=4 749 B12R1.125 CC(O)COc1ncccc1N 34a_100000746358_100011218427 [1,0,0,0,0,0|3,0,0]=4 750 B12R1.125 CC(O)CSc1cccc[n+]1C 62a_100011218427_100000212160 [1,0,0,0,0,0|2,1,0]=4 751 B12R1.125 CC(O)CSc1ccccc1Br 62a_100000695589_100011218427 [1,0,0,0,0,0|2,1,0]=4 752 B12R1.125 CC(O)CSc1ccccc1Br 62a_100011218427_100000695589 [1,0,0,0,0,0|2,1,0]=4 753 B12R1.125 CC(O)CSc1ccccc1Cl 62a_100000764095_100011218427 [1,0,0,0,0,0|2,1,0]=4 754 B12R1.125 CC(O)CSc1ccccc1Cl 62a_100011218427_100000764095 [1,0,0,0,0,0|2,1,0]=4 755 B12R1.125 CC(O)CSc1ccccc1F 62a_100011215700_100011218427 [1,0,0,0,0,0|2,1,0]=4 756 B12R1.125 CC(O)CSc1ccccc1F 62a_100011218427_100011215700 [1,0,0,0,0,0|2,1,0]=4 757 B12R1.125 CC(O)CSc1ccccc1N 62a_100000210017_100011218427 [1,0,0,0,0,0|2,1,0]=4 758 B12R1.125 CC(O)CSc1ccccc1N 62a_100011218427_100000210017 [1,0,0,0,0,0|2,1,0]=4 759 B12R1.125 CC(O)CSc1ccccc1O 62a_100000739446_100011218427 [1,0,0,0,0,0|2,1,0]=4 760 B12R1.125 CC(O)CSc1ccccc1O 62a_100011218427_100000739446 [1,0,0,0,0,0|2,1,0]=4 761 B12R1.125 C[C@@H](O)CNc1ccccc1Br 34a_100000210017_100009817552 [1,0,0,0,0,0|3,0,0]=4 762 B12R1.125 C[C@@H](O)CNc1ccccc1Cl 34a_100000185783_100009817552 [1,0,0,0,0,0|3,0,0]=4 763 B12R1.125 C[C@@H](O)CNc1ccccc1F 34a_100000210422_100009817552 [1,0,0,0,0,0|3,0,0]=4 764 B12R1.125 C[C@@H](O)CNc1ccccc1I 34a_100000210053_100009817552 [1,0,0,0,0,0|3,0,0]=4 765 B12R1.125 C[C@@H](O)CNc1ccccc1O 34a_100000185747_100009817552 [1,0,0,0,0,0|3,0,0]=4 766 B12R1.125 C[C@@H](O)COc1cccc[n+]1[O-] 7a_100000211761_100009817552 [1,0,0,0,0,0|3,0,0]=4 767 B12R1.125 C[C@@H](O)COc1ccccc1Br 34a_100000181306_100009817552 [1,0,0,0,0,0|2,0,0]=3 768 B12R1.125 C[C@@H](O)COc1ccccc1Br 7a_100000181306_100009817552 [1,0,0,0,0,0|2,0,0]=3 769 B12R1.125 C[C@@H](O)COc1ccccc1Cl 34a_100000210172_100009817552 [1,0,0,0,0,0|2,0,0]=3 770 B12R1.125 C[C@@H](O)COc1ccccc1Cl 7a_100000210172_100009817552 [1,0,0,0,0,0|2,0,0]=3 771 B12R1.125 C[C@@H](O)COc1ccccc1F 34a_100000210171_100009817552 [1,0,0,0,0,0|2,0,0]=3 772 B12R1.125 C[C@@H](O)COc1ccccc1F 7a_100000210171_100009817552 [1,0,0,0,0,0|2,0,0]=3 773 B12R1.125 C[C@@H](O)COc1ccccc1I 34a_100000739446_100009817552 [1,0,0,0,0,0|2,0,0]=3 774 B12R1.125 C[C@@H](O)COc1ccccc1I 7a_100000739446_100009817552 [1,0,0,0,0,0|2,0,0]=3 775 B12R1.125 C[C@@H](O)COc1ccccc1N 34a_100000185747_100009817552 [1,0,0,0,0,0|2,0,0]=3 776 B12R1.125 C[C@@H](O)COc1ccccc1N 7a_100000185747_100009817552 [1,0,0,0,0,0|2,0,0]=3 777 B12R1.125 C[C@@H](O)COc1cccnc1Br 34a_100000744436_100009817552 [1,0,0,0,0,0|3,0,0]=4 778 B12R1.125 C[C@@H](O)COc1cccnc1Br 7a_100000744436_100009817552 [1,0,0,0,0,0|3,0,0]=4 779 B12R1.125 C[C@@H](O)COc1cccnc1Cl 34a_100000757616_100009817552 [1,0,0,0,0,0|3,0,0]=4 780 B12R1.125 C[C@@H](O)COc1cccnc1Cl 7a_100000757616_100009817552 [1,0,0,0,0,0|3,0,0]=4 781 B12R1.125 C[C@@H](O)COc1cccnc1F 34a_100000061740_100009817552 [1,0,0,0,0,0|3,0,0]=4 782 B12R1.125 C[C@@H](O)COc1cccnc1F 7a_100000061740_100009817552 [1,0,0,0,0,0|3,0,0]=4 783 B12R1.125 C[C@@H](O)COc1cccnc1I 34a_100000034122_100009817552 [1,0,0,0,0,0|3,0,0]=4 784 B12R1.125 C[C@@H](O)COc1cccnc1I 7a_100000034122_100009817552 [1,0,0,0,0,0|3,0,0]=4 785 B12R1.125 C[C@@H](O)COc1cccnc1N 34a_100000211975_100009817552 [1,0,0,0,0,0|3,0,0]=4 786 B12R1.125 C[C@@H](O)COc1cccnc1N 7a_100000211975_100009817552 [1,0,0,0,0,0|3,0,0]=4 787 B12R1.125 C[C@@H](O)COc1cccoc1=O 34a_100000077404_100009817552 [1,0,0,0,0,0|3,0,0]=4 788 B12R1.125 C[C@@H](O)COc1cccoc1=O 7a_100000077404_100009817552 [1,0,0,0,0,0|3,0,0]=4 789 B12R1.125 C[C@@H](O)COc1ccncc1Br 34a_100011996408_100009817552 [1,0,0,0,0,0|3,0,0]=4 790 B12R1.125 C[C@@H](O)COc1ccncc1Cl 34a_100011997054_100009817552 [1,0,0,0,0,0|3,0,0]=4 791 B12R1.125 C[C@@H](O)COc1ccncc1F 34a_200000081243_100009817552 [1,0,0,0,0,0|3,0,0]=4 792 B12R1.125 C[C@@H](O)COc1cnccc1Cl 34a_100011996695_100009817552 [1,0,0,0,0,0|3,0,0]=4 793 B12R1.125 C[C@@H](O)COc1cnccc1I 34a_100000050107_100009817552 [1,0,0,0,0,0|3,0,0]=4 794 B12R1.125 C[C@@H](O)COc1cnccc1N 34a_100000753702_100009817552 [1,0,0,0,0,0|3,0,0]=4 795 B12R1.125 C[C@@H](O)COc1coccc1=O 34a_100000060831_100009817552 [1,0,0,0,0,0|3,0,0]=4 796 B12R1.125 C[C@@H](O)COc1ncccc1Cl 34a_100011290957_100009817552 [1,0,0,0,0,0|3,0,0]=4 797 B12R1.125 C[C@@H](O)COc1ncccc1F 34a_100011219419_100009817552 [1,0,0,0,0,0|3,0,0]=4 798 B12R1.125 C[C@@H](O)COc1ncccc1N 34a_100000746358_100009817552 [1,0,0,0,0,0|3,0,0]=4 799 B12R1.125 C[C@@H](O)CSc1cccc[n+]1C 62a_100009817552_100000212160 [1,0,0,0,0,0|2,1,0]=4 800 B12R1.125 C[C@@H](O)CSc1ccccc1Br 62a_100000695589_100009817552 [1,0,0,0,0,0|2,1,0]=4 801 B12R1.125 C[C@@H](O)CSc1ccccc1Br 62a_100009817552_100000695589 [1,0,0,0,0,0|2,1,0]=4 802 B12R1.125 C[C@@H](O)CSc1ccccc1Cl 62a_100000764095_100009817552 [1,0,0,0,0,0|2,1,0]=4 803 B12R1.125 C[C@@H](O)CSc1ccccc1Cl 62a_100009817552_100000764095 [1,0,0,0,0,0|2,1,0]=4 804 B12R1.125 C[C@@H](O)CSc1ccccc1F 62a_100009817552_100011215700 [1,0,0,0,0,0|2,1,0]=4 805 B12R1.125 C[C@@H](O)CSc1ccccc1F 62a_100011215700_100009817552 [1,0,0,0,0,0|2,1,0]=4 806 B12R1.125 C[C@@H](O)CSc1ccccc1N 62a_100000210017_100009817552 [1,0,0,0,0,0|2,1,0]=4 807 B12R1.125 C[C@@H](O)CSc1ccccc1N 62a_100009817552_100000210017 [1,0,0,0,0,0|2,1,0]=4 808 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100000739446_100009817552 [1,0,0,0,0,0|2,1,0]=4 809 B12R1.125 C[C@@H](O)CSc1ccccc1O 62a_100009817552_100000739446 [1,0,0,0,0,0|2,1,0]=4 810 B12R1.125 Cc1ccccc1C=CC(C)C 271570a_100016257149_100000210755 [1,0,0,0,0,0|2,0,1]=4 811 B12R1.125 Cc1ccccc1C=CC(C)O 271570a_200011019289_100000210755 [1,0,0,0,0,0|2,0,1]=4 812 B12R1.125 Cc1ccccc1CCC(=O)[13CH3] 1458a_100000748742_200025704644 [1,0,0,0,0,0|2,0,1]=4 813 B12R1.125 Cc1ccccc1CCN(C)C 2230a_100102631434_100011713688 [1,0,0,0,0,0|3,0,0]=4 814 B12R1.125 Cc1ccccc1CCN(C)C 269982a_100102631434_100011713688 [1,0,0,0,0,0|3,0,0]=4 815 B12R1.125 Cc1ccccc1CNC(C)C 207a_100138425928_100000211143 [1,0,0,0,0,0|3,0,0]=4 816 B12R1.125 Cc1ccccc1CNC(C)C 2230a_100138425928_100000211839 [1,0,0,0,0,0|3,0,0]=4 817 B12R1.125 Cc1ccccc1CNC(C)C 34a_100000174972_100000210206 [1,0,0,0,0,0|3,0,0]=4 818 B12R1.125 Cc1ccccc1CNC(C)C 34a_100138425928_100000211839 [1,0,0,0,0,0|3,0,0]=4 819 B12R1.125 Cc1ccccc1COC(C)C 34a_100000212225_100000211839 [1,0,0,0,0,0|3,0,0]=4 820 B12R1.125 Cc1ccccc1COC(C)C 34a_100000698903_100000210206 [1,0,0,0,0,0|3,0,0]=4 821 B12R1.125 Cc1ccccc1COC(C)C 7a_100000698903_100000210206 [1,0,0,0,0,0|3,0,0]=4 822 B12R1.125 Cc1ccccc1CSC(C)C 62a_100000210206_100000211839 [1,0,0,0,0,0|3,0,0]=4 823 B12R1.125 Cc1ccccc1CSC(C)C 62a_100000211839_100000210206 [1,0,0,0,0,0|3,0,0]=4 824 B12R1.125 Cc1ccccc1NCC(=O)N 34a_100015192222_100000187820 [1,0,0,0,0,0|2,0,1]=4 825 B12R1.125 Cc1ccccc1NCC(C)C 34a_100015192222_100000210624 [1,0,0,0,0,0|2,0,0]=3 826 B12R1.125 Cc1ccccc1NCC(C)O 34a_100015192222_100011218427 [1,0,0,0,0,0|2,0,0]=3 827 B12R1.125 Cc1ccccc1NCC(F)F 34a_100015192222_100011934356 [1,0,0,0,0,0|3,0,0]=4 828 B12R1.125 Cc1ccccc1NC[C@@H](C)O 34a_100015192222_100009817552 [1,0,0,0,0,0|2,0,0]=3 829 B12R1.125 Cc1ccccc1OCC(=O)N 34a_100000210338_100000187820 [1,0,0,0,0,0|1,0,1]=3 830 B12R1.125 Cc1ccccc1OCC(=O)N 7a_100000210338_100000187820 [1,0,0,0,0,0|1,0,1]=3 831 B12R1.125 Cc1ccccc1OCC(=O)[13CH3] 1458a_100000182418_200025704644 [1,0,0,0,0,0|1,0,1]=3 832 B12R1.125 Cc1ccccc1OCC(=O)[O-] 34a_100000210338_100020667443 [1,0,0,0,0,0|2,0,1]=4 833 B12R1.125 Cc1ccccc1OCC(C)C 34a_100000210338_100000210624 [1,0,0,0,0,0|1,0,0]=2 834 B12R1.125 Cc1ccccc1OCC(C)C 7a_100000210338_100000210760 [1,0,0,0,0,0|1,0,0]=2 835 B12R1.125 Cc1ccccc1OCC(C)O 34a_100000210338_100011218427 [1,0,0,0,0,0|1,0,0]=2 836 B12R1.125 Cc1ccccc1OCC(C)O 7a_100000210338_100011218427 [1,0,0,0,0,0|1,0,0]=2 837 B12R1.125 Cc1ccccc1OCC(F)F 34a_100000210338_100011934356 [1,0,0,0,0,0|2,0,0]=3 838 B12R1.125 Cc1ccccc1OCC(F)F 7a_100000210338_100011934356 [1,0,0,0,0,0|2,0,0]=3 839 B12R1.125 Cc1ccccc1OC[C@@H](C)O 34a_100000210338_100009817552 [1,0,0,0,0,0|1,0,0]=2 840 B12R1.125 Cc1ccccc1OC[C@@H](C)O 7a_100000210338_100009817552 [1,0,0,0,0,0|1,0,0]=2 841 B12R1.125 Cc1ccccc1OC[N+](=O)[O-] 34a_100000210338_100000761209 [1,0,0,0,0,0|3,0,0]=4 842 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000210755_100000747473 [1,0,0,0,0,0|1,1,1]=4 843 B12R1.125 Cc1ccccc1SCC(=O)N 62a_100000747473_100000210755 [1,0,0,0,0,0|1,1,1]=4 844 B12R1.125 Cc1ccccc1SCC(=O)[13CH3] 1458a_100000183026_200025704644 [1,0,0,0,0,0|1,1,1]=4 845 B12R1.125 Cc1ccccc1SCC(C)C 62a_100000210624_100000210755 [1,0,0,0,0,0|1,1,0]=3 846 B12R1.125 Cc1ccccc1SCC(C)C 62a_100000210755_100000210760 [1,0,0,0,0,0|1,1,0]=3 847 B12R1.125 Cc1ccccc1SCC(C)O 62a_100000210755_100011218427 [1,0,0,0,0,0|1,1,0]=3 848 B12R1.125 Cc1ccccc1SCC(C)O 62a_100011218427_100000210755 [1,0,0,0,0,0|1,1,0]=3 849 B12R1.125 Cc1ccccc1SCC(F)F 62a_100000210755_100011934356 [1,0,0,0,0,0|2,1,0]=4 850 B12R1.125 Cc1ccccc1SCC(F)F 62a_100011934356_100000210755 [1,0,0,0,0,0|2,1,0]=4 851 B12R1.125 Cc1ccccc1SC[C@@H](C)O 62a_100000210755_100009817552 [1,0,0,0,0,0|1,1,0]=3 852 B12R1.125 Cc1ccccc1SC[C@@H](C)O 62a_100009817552_100000210755 [1,0,0,0,0,0|1,1,0]=3 853 B12R1.125 Cc1cccnc1SCC(C)C 62a_100000210624_100000751373 [1,0,0,0,0,0|2,1,0]=4 854 B12R1.125 Cc1cccnc1SCC(C)C 62a_100000751373_100000210760 [1,0,0,0,0,0|2,1,0]=4 855 B12R1.125 Cc1cccnc1SCC(C)O 62a_100000751373_100011218427 [1,0,0,0,0,0|2,1,0]=4 856 B12R1.125 Cc1cccnc1SCC(C)O 62a_100011218427_100000751373 [1,0,0,0,0,0|2,1,0]=4 857 B12R1.125 Cc1cccnc1SC[C@@H](C)O 62a_100000751373_100009817552 [1,0,0,0,0,0|2,1,0]=4 858 B12R1.125 Cc1cccnc1SC[C@@H](C)O 62a_100009817552_100000751373 [1,0,0,0,0,0|2,1,0]=4 859 B12R1.125 Cc1ccncc1OCC(=O)N 34a_100011997053_100000187820 [1,0,0,0,0,0|2,0,1]=4 860 B12R1.125 Cc1ccncc1OCC(=O)N 7a_100011997053_100000187820 [1,0,0,0,0,0|2,0,1]=4 861 B12R1.125 Cc1ccncc1OCC(C)C 34a_100011997053_100000210624 [1,0,0,0,0,0|2,0,0]=3 862 B12R1.125 Cc1ccncc1OCC(C)C 7a_100011997053_100000210760 [1,0,0,0,0,0|2,0,0]=3 863 B12R1.125 Cc1ccncc1OCC(C)O 34a_100011997053_100011218427 [1,0,0,0,0,0|2,0,0]=3 864 B12R1.125 Cc1ccncc1OCC(C)O 7a_100011997053_100011218427 [1,0,0,0,0,0|2,0,0]=3 865 B12R1.125 Cc1ccncc1OCC(F)F 34a_100011997053_100011934356 [1,0,0,0,0,0|3,0,0]=4 866 B12R1.125 Cc1ccncc1OCC(F)F 7a_100011997053_100011934356 [1,0,0,0,0,0|3,0,0]=4 867 B12R1.125 Cc1ccncc1OC[C@@H](C)O 34a_100011997053_100009817552 [1,0,0,0,0,0|2,0,0]=3 868 B12R1.125 Cc1ccncc1OC[C@@H](C)O 7a_100011997053_100009817552 [1,0,0,0,0,0|2,0,0]=3 869 B12R1.125 Cc1ccncc1SCC(C)C 62a_100000210624_100000761580 [1,0,0,0,0,0|2,1,0]=4 870 B12R1.125 Cc1ccncc1SCC(C)C 62a_100000761580_100000210760 [1,0,0,0,0,0|2,1,0]=4 871 B12R1.125 Cc1ccncc1SCC(C)O 62a_100000761580_100011218427 [1,0,0,0,0,0|2,1,0]=4 872 B12R1.125 Cc1ccncc1SCC(C)O 62a_100011218427_100000761580 [1,0,0,0,0,0|2,1,0]=4 873 B12R1.125 Cc1ccncc1SC[C@@H](C)O 62a_100000761580_100009817552 [1,0,0,0,0,0|2,1,0]=4 874 B12R1.125 Cc1ccncc1SC[C@@H](C)O 62a_100009817552_100000761580 [1,0,0,0,0,0|2,1,0]=4 875 B12R1.125 Cc1cnccc1NCC(C)C 27a_100000210953_100000765111 [1,0,0,0,0,0|3,0,0]=4 876 B12R1.125 Cc1cnccc1NCC(C)O 27a_100000210904_100000765111 [1,0,0,0,0,0|3,0,0]=4 877 B12R1.125 Cc1cnccc1OCC(=O)N 34a_100000694293_100000187820 [1,0,0,0,0,0|2,0,1]=4 878 B12R1.125 Cc1cnccc1OCC(C)C 34a_100000694293_100000210624 [1,0,0,0,0,0|2,0,0]=3 879 B12R1.125 Cc1cnccc1OCC(C)O 34a_100000694293_100011218427 [1,0,0,0,0,0|2,0,0]=3 880 B12R1.125 Cc1cnccc1OCC(F)F 34a_100000694293_100011934356 [1,0,0,0,0,0|3,0,0]=4 881 B12R1.125 Cc1cnccc1OC[C@@H](C)O 34a_100000694293_100009817552 [1,0,0,0,0,0|2,0,0]=3 882 B12R1.125 Cc1cnccc1SCC(C)C 62a_100000210624_100000765111 [1,0,0,0,0,0|2,1,0]=4 883 B12R1.125 Cc1cnccc1SCC(C)C 62a_100000765111_100000210760 [1,0,0,0,0,0|2,1,0]=4 884 B12R1.125 Cc1cnccc1SCC(C)O 62a_100000765111_100011218427 [1,0,0,0,0,0|2,1,0]=4 885 B12R1.125 Cc1cnccc1SCC(C)O 62a_100011218427_100000765111 [1,0,0,0,0,0|2,1,0]=4 886 B12R1.125 Cc1cnccc1SC[C@@H](C)O 62a_100000765111_100009817552 [1,0,0,0,0,0|2,1,0]=4 887 B12R1.125 Cc1cnccc1SC[C@@H](C)O 62a_100009817552_100000765111 [1,0,0,0,0,0|2,1,0]=4 888 B12R1.125 Cc1ncccc1OCC(=O)N 34a_100000745507_100000187820 [1,0,0,0,0,0|2,0,1]=4 889 B12R1.125 Cc1ncccc1OCC(=O)N 7a_100000745507_100000187820 [1,0,0,0,0,0|2,0,1]=4 890 B12R1.125 Cc1ncccc1OCC(C)C 34a_100000745507_100000210624 [1,0,0,0,0,0|2,0,0]=3 891 B12R1.125 Cc1ncccc1OCC(C)C 7a_100000745507_100000210760 [1,0,0,0,0,0|2,0,0]=3 892 B12R1.125 Cc1ncccc1OCC(C)O 34a_100000745507_100011218427 [1,0,0,0,0,0|2,0,0]=3 893 B12R1.125 Cc1ncccc1OCC(C)O 7a_100000745507_100011218427 [1,0,0,0,0,0|2,0,0]=3 894 B12R1.125 Cc1ncccc1OCC(F)F 34a_100000745507_100011934356 [1,0,0,0,0,0|3,0,0]=4 895 B12R1.125 Cc1ncccc1OCC(F)F 7a_100000745507_100011934356 [1,0,0,0,0,0|3,0,0]=4 896 B12R1.125 Cc1ncccc1OC[C@@H](C)O 34a_100000745507_100009817552 [1,0,0,0,0,0|2,0,0]=3 897 B12R1.125 Cc1ncccc1OC[C@@H](C)O 7a_100000745507_100009817552 [1,0,0,0,0,0|2,0,0]=3 898 B12R1.125 Cc1ncccc1SCC(C)C 62a_100000210624_100000751574 [1,0,0,0,0,0|2,1,0]=4 899 B12R1.125 Cc1ncccc1SCC(C)C 62a_100000751574_100000210760 [1,0,0,0,0,0|2,1,0]=4 900 B12R1.125 Cc1ncccc1SCC(C)O 62a_100000751574_100011218427 [1,0,0,0,0,0|2,1,0]=4 901 B12R1.125 Cc1ncccc1SCC(C)O 62a_100011218427_100000751574 [1,0,0,0,0,0|2,1,0]=4 902 B12R1.125 Cc1ncccc1SC[C@@H](C)O 62a_100000751574_100009817552 [1,0,0,0,0,0|2,1,0]=4 903 B12R1.125 Cc1ncccc1SC[C@@H](C)O 62a_100009817552_100000751574 [1,0,0,0,0,0|2,1,0]=4 904 B12R1.125 Cc1nccnc1OCC(C)C 34a_100000766352_100000210624 [1,0,0,0,0,0|3,0,0]=4 905 B12R1.125 Cc1nccnc1OCC(C)O 34a_100000766352_100011218427 [1,0,0,0,0,0|3,0,0]=4 906 B12R1.125 Cc1nccnc1OC[C@@H](C)O 34a_100000766352_100009817552 [1,0,0,0,0,0|3,0,0]=4 907 B12R1.125 FC(F)COc1ccccc1Br 34a_100000181306_100011934356 [1,0,0,0,0,0|3,0,0]=4 908 B12R1.125 FC(F)COc1ccccc1Br 7a_100000181306_100011934356 [1,0,0,0,0,0|3,0,0]=4 909 B12R1.125 FC(F)COc1ccccc1Cl 34a_100000210172_100011934356 [1,0,0,0,0,0|3,0,0]=4 910 B12R1.125 FC(F)COc1ccccc1Cl 7a_100000210172_100011934356 [1,0,0,0,0,0|3,0,0]=4 911 B12R1.125 FC(F)COc1ccccc1I 34a_100000739446_100011934356 [1,0,0,0,0,0|3,0,0]=4 912 B12R1.125 FC(F)COc1ccccc1I 7a_100000739446_100011934356 [1,0,0,0,0,0|3,0,0]=4 913 B12R1.125 Fc1ccccc1OCC(F)F 34a_100000210171_100011934356 [1,0,0,0,0,0|3,0,0]=4 914 B12R1.125 Fc1ccccc1OCC(F)F 7a_100000210171_100011934356 [1,0,0,0,0,0|3,0,0]=4 915 B12R1.125 NC(=O)COc1ccccc1Br 34a_100000181306_100000187820 [1,0,0,0,0,0|2,0,1]=4 916 B12R1.125 NC(=O)COc1ccccc1Br 7a_100000181306_100000187820 [1,0,0,0,0,0|2,0,1]=4 917 B12R1.125 NC(=O)COc1ccccc1Cl 34a_100000210172_100000187820 [1,0,0,0,0,0|2,0,1]=4 918 B12R1.125 NC(=O)COc1ccccc1Cl 7a_100000210172_100000187820 [1,0,0,0,0,0|2,0,1]=4 919 B12R1.125 NC(=O)COc1ccccc1F 34a_100000210171_100000187820 [1,0,0,0,0,0|2,0,1]=4 920 B12R1.125 NC(=O)COc1ccccc1F 7a_100000210171_100000187820 [1,0,0,0,0,0|2,0,1]=4 921 B12R1.125 NC(=O)COc1ccccc1I 34a_100000739446_100000187820 [1,0,0,0,0,0|2,0,1]=4 922 B12R1.125 NC(=O)COc1ccccc1I 7a_100000739446_100000187820 [1,0,0,0,0,0|2,0,1]=4 923 B12R1.125 NC(=O)COc1ccccc1N 34a_100000185747_100000187820 [1,0,0,0,0,0|2,0,1]=4 924 B12R1.125 NC(=O)COc1ccccc1N 7a_100000185747_100000187820 [1,0,0,0,0,0|2,0,1]=4 925 B12R1.125 NC(=O)COc1ccccc1O 271570a_203496583355_200000148491 [1,0,0,0,0,0|2,0,1]=4 926 B12R1.125 Nc1ccccc1OCC(F)F 34a_100000185747_100011934356 [1,0,0,0,0,0|3,0,0]=4 927 B12R1.125 Nc1ccccc1OCC(F)F 7a_100000185747_100011934356 [1,0,0,0,0,0|3,0,0]=4 928 B12R1.125 Oc1ccccc1OCC(F)F 271570a_203496583355_100000692002 [1,0,0,0,0,0|3,0,0]=4 929 B12R1.125 [13CH3]C(=O)COc1ccccc1Br 1458a_100000216496_200025704644 [1,0,0,0,0,0|2,0,1]=4 930 B12R1.125 [13CH3]C(=O)COc1ccccc1Cl 1458a_100000185159_200025704644 [1,0,0,0,0,0|2,0,1]=4 931 B12R1.125 [13CH3]C(=O)COc1ccccc1F 1458a_100000182486_200025704644 [1,0,0,0,0,0|2,0,1]=4 932 B12R1.125 [13CH3]C(=O)COc1ccccc1O 1458a_100000183020_200025704644 [1,0,0,0,0,0|2,0,1]=4 933 B12R1.1631 C#CCNc1c(cccc1C)C 34a_100000185769_100000184674 [1,0,0,0,0,0|1,0,2]=4 934 B12R1.1631 C#CCOc1c(cccc1Br)C 34a_100009817157_100000184674 [1,0,0,0,0,0|1,0,2]=4 935 B12R1.1631 C#CCOc1c(cccc1Br)C 7a_100009817157_100000038162 [1,0,0,0,0,0|1,0,2]=4 936 B12R1.1631 C#CCOc1c(cccc1C)C 34a_100000210341_100000184674 [1,0,0,0,0,0|0,0,2]=3 937 B12R1.1631 C#CCOc1c(cccc1C)C 7a_100000210341_100000038162 [1,0,0,0,0,0|0,0,2]=3 938 B12R1.1631 C#CCOc1c(cccc1Cl)C 34a_100000033731_100000184674 [1,0,0,0,0,0|1,0,2]=4 939 B12R1.1631 C#CCOc1c(cccc1Cl)C 7a_100000033731_100000038162 [1,0,0,0,0,0|1,0,2]=4 940 B12R1.1631 C#CCOc1c(cccc1F)C 34a_100011659162_100000184674 [1,0,0,0,0,0|1,0,2]=4 941 B12R1.1631 C#CCOc1c(cccc1F)C 7a_100011659162_100000038162 [1,0,0,0,0,0|1,0,2]=4 942 B12R1.1631 C#CCOc1c(cccc1N)C 34a_100000756359_100000184674 [1,0,0,0,0,0|1,0,2]=4 943 B12R1.1631 C#CCOc1c(cccc1N)C 7a_100000756359_100000038162 [1,0,0,0,0,0|1,0,2]=4 944 B12R1.1631 C#CCOc1c(ccnc1C)C 34a_100011934651_100000184674 [1,0,0,0,0,0|1,0,2]=4 945 B12R1.1631 C#CCOc1c(ccnc1C)C 7a_100011934651_100000038162 [1,0,0,0,0,0|1,0,2]=4 946 B12R1.1631 C#CCSc1c(cccc1C)C 62a_100000038162_100000033847 [1,0,0,0,0,0|0,1,2]=4 947 B12R1.1631 C=CCNc1c(cccc1C)C 34a_100000185769_100015514636 [1,0,0,0,0,0|1,0,2]=4 948 B12R1.1631 C=CCOc1c(cccc1Br)C 34a_100009817157_100015514636 [1,0,0,0,0,0|1,0,2]=4 949 B12R1.1631 C=CCOc1c(cccc1Br)C 7a_100009817157_100015514636 [1,0,0,0,0,0|1,0,2]=4 950 B12R1.1631 C=CCOc1c(cccc1C)C 34a_100000210341_100015514636 [1,0,0,0,0,0|0,0,2]=3 951 B12R1.1631 C=CCOc1c(cccc1C)C 7a_100000210341_100015514636 [1,0,0,0,0,0|0,0,2]=3 952 B12R1.1631 C=CCOc1c(cccc1Cl)C 34a_100000033731_100015514636 [1,0,0,0,0,0|1,0,2]=4 953 B12R1.1631 C=CCOc1c(cccc1Cl)C 7a_100000033731_100015514636 [1,0,0,0,0,0|1,0,2]=4 954 B12R1.1631 C=CCOc1c(cccc1F)C 34a_100011659162_100015514636 [1,0,0,0,0,0|1,0,2]=4 955 B12R1.1631 C=CCOc1c(cccc1F)C 7a_100011659162_100015514636 [1,0,0,0,0,0|1,0,2]=4 956 B12R1.1631 C=CCOc1c(cccc1N)C 34a_100000756359_100015514636 [1,0,0,0,0,0|1,0,2]=4 957 B12R1.1631 C=CCOc1c(cccc1N)C 7a_100000756359_100015514636 [1,0,0,0,0,0|1,0,2]=4 958 B12R1.1631 C=CCOc1c(ccnc1C)C 34a_100011934651_100015514636 [1,0,0,0,0,0|1,0,2]=4 959 B12R1.1631 C=CCOc1c(ccnc1C)C 7a_100011934651_100015514636 [1,0,0,0,0,0|1,0,2]=4 960 B12R1.1631 C=CCSc1c(cccc1C)C 62a_100000033847_100000210623 [1,0,0,0,0,0|0,1,2]=4 961 B12R1.1631 C=CCSc1c(cccc1C)C 62a_100000210623_100000033847 [1,0,0,0,0,0|0,1,2]=4 962 B12R1.1631 CC=NNc1c(cccc1C)C 4a_100016987787_200000210099 [1,0,0,0,0,0|2,0,1]=4 963 B12R1.1631 CCCCc1c(ccc[n+]1[O-])C 271570a_100020621405_100116209805 [1,0,0,0,0,0|3,0,0]=4 964 B12R1.1631 CCCCc1c(cccc1Br)Br 271570a_100020621405_100009994525 [1,0,0,0,0,0|3,0,0]=4 965 B12R1.1631 CCCCc1c(cccc1Br)Cl 271570a_100020621405_100010214488 [1,0,0,0,0,0|3,0,0]=4 966 B12R1.1631 CCCCc1c(cccc1Br)F 271570a_100020621405_100011219512 [1,0,0,0,0,0|3,0,0]=4 967 B12R1.1631 CCCCc1c(cccc1Br)N 271570a_100020621405_100020590159 [1,0,0,0,0,0|3,0,0]=4 968 B12R1.1631 CCCCc1c(cccc1Br)O 271570a_100020621405_100010187912 [1,0,0,0,0,0|3,0,0]=4 969 B12R1.1631 CCCCc1c(cccc1C)C 271570a_100020621405_100000033847 [1,0,0,0,0,0|1,0,0]=2 970 B12R1.1631 CCCCc1c(cccc1Cl)C 271570a_100020621405_100000043165 [1,0,0,0,0,0|2,0,0]=3 971 B12R1.1631 CCCCc1c(cccc1Cl)Cl 271570a_100020621405_100000034237 [1,0,0,0,0,0|3,0,0]=4 972 B12R1.1631 CCCCc1c(cccc1Cl)F 271570a_100020621405_100000050007 [1,0,0,0,0,0|3,0,0]=4 973 B12R1.1631 CCCCc1c(cccc1Cl)N 271570a_100020621405_100000049713 [1,0,0,0,0,0|3,0,0]=4 974 B12R1.1631 CCCCc1c(cccc1Cl)O 271570a_100020621405_100000050174 [1,0,0,0,0,0|3,0,0]=4 975 B12R1.1631 CCCCc1c(cccc1F)C 271570a_100020621405_100012349962 [1,0,0,0,0,0|2,0,0]=3 976 B12R1.1631 CCCCc1c(cccc1F)F 271570a_100020621405_100000693133 [1,0,0,0,0,0|3,0,0]=4 977 B12R1.1631 CCCCc1c(cccc1F)N 271570a_100020621405_100011934729 [1,0,0,0,0,0|3,0,0]=4 978 B12R1.1631 CCCCc1c(cccc1F)O 271570a_100020621405_100009820682 [1,0,0,0,0,0|3,0,0]=4 979 B12R1.1631 CCCCc1c(cccc1N)C 271570a_100020621405_100000684715 [1,0,0,0,0,0|2,0,0]=3 980 B12R1.1631 CCCCc1c(cccc1O)C 271570a_100020621405_100000686692 [1,0,0,0,0,0|2,0,0]=3 981 B12R1.1631 CCCCc1c(cccc1O)N 271570a_100020621405_100012183704 [1,0,0,0,0,0|3,0,0]=4 982 B12R1.1631 CCCCc1c(cccc1O)O 271570a_100020621405_100010205330 [1,0,0,0,0,0|3,0,0]=4 983 B12R1.1631 CCCCc1c(ccnc1C)C 271570a_100020621405_100012000501 [1,0,0,0,0,0|2,0,0]=3 984 B12R1.1631 CCCCc1c(ccnc1C)N 271570a_100020621405_100010243816 [1,0,0,0,0,0|3,0,0]=4 985 B12R1.1631 CCCCc1c(ccnc1F)C 271570a_100020621405_100009818256 [1,0,0,0,0,0|3,0,0]=4 986 B12R1.1631 CCCCc1c(ccnc1N)C 271570a_100020621405_100011998619 [1,0,0,0,0,0|3,0,0]=4 987 B12R1.1631 CCCCc1c(ccnc1O)C 271570a_100020621405_100012000493 [1,0,0,0,0,0|3,0,0]=4 988 B12R1.1631 CCCCc1c(cncc1C)C 271570a_100020621405_100009817138 [1,0,0,0,0,0|2,0,0]=3 989 B12R1.1631 CCCCc1c(ncnc1C)C 271570a_100020621405_100009820708 [1,0,0,0,0,0|3,0,0]=4 990 B12R1.1631 CCCNc1c(cccc1Br)Br 34a_100000690995_100000210303 [1,0,0,0,0,0|3,0,0]=4 991 B12R1.1631 CCCNc1c(cccc1Br)C 34a_100011834072_100000210303 [1,0,0,0,0,0|2,0,0]=3 992 B12R1.1631 CCCNc1c(cccc1Br)Cl 34a_100102946385_100000210303 [1,0,0,0,0,0|3,0,0]=4 993 B12R1.1631 CCCNc1c(cccc1Br)F 34a_100000684712_100000210303 [1,0,0,0,0,0|3,0,0]=4 994 B12R1.1631 CCCNc1c(cccc1Br)O 34a_100011934926_100000210303 [1,0,0,0,0,0|3,0,0]=4 995 B12R1.1631 CCCNc1c(cccc1C)C 34a_100000185769_100000210303 [1,0,0,0,0,0|1,0,0]=2 996 B12R1.1631 CCCNc1c(cccc1Cl)C 34a_100000756524_100000210303 [1,0,0,0,0,0|2,0,0]=3 997 B12R1.1631 CCCNc1c(cccc1Cl)Cl 34a_100000210028_100000210303 [1,0,0,0,0,0|3,0,0]=4 998 B12R1.1631 CCCNc1c(cccc1Cl)F 34a_100000760031_100000210303 [1,0,0,0,0,0|3,0,0]=4 999 B12R1.1631 CCCNc1c(cccc1Cl)O 34a_100012022510_100000210303 [1,0,0,0,0,0|3,0,0]=4 1000 B12R1.1631 CCCNc1c(cccc1F)C 34a_100000766463_100000210303 [1,0,0,0,0,0|2,0,0]=3 1001 B12R1.1631 CCCNc1c(cccc1F)F 2230a_100000210704_100000210303 [1,0,0,0,0,0|3,0,0]=4 1002 B12R1.1631 CCCNc1c(cccc1F)F 34a_100000210704_100000210303 [1,0,0,0,0,0|3,0,0]=4 1003 B12R1.1631 CCCNc1c(cccc1F)O 34a_100020591140_100000210303 [1,0,0,0,0,0|3,0,0]=4 1004 B12R1.1631 CCCNc1c(cccc1I)F 34a_100000042321_100000210303 [1,0,0,0,0,0|3,0,0]=4 1005 B12R1.1631 CCCNc1c(cccc1O)C 34a_100000743429_100000210303 [1,0,0,0,0,0|2,0,0]=3 1006 B12R1.1631 CCCOc1c(cccc1Br)Br 34a_100000736428_100000210303 [1,0,0,0,0,0|2,0,0]=3 1007 B12R1.1631 CCCOc1c(cccc1Br)Br 7a_100000736428_100000210303 [1,0,0,0,0,0|2,0,0]=3 1008 B12R1.1631 CCCOc1c(cccc1Br)C 34a_100009817157_100000210303 [1,0,0,0,0,0|1,0,0]=2 1009 B12R1.1631 CCCOc1c(cccc1Br)C 7a_100009817157_100000210303 [1,0,0,0,0,0|1,0,0]=2 1010 B12R1.1631 CCCOc1c(cccc1Br)Cl 34a_100010214474_100000210303 [1,0,0,0,0,0|2,0,0]=3 1011 B12R1.1631 CCCOc1c(cccc1Br)Cl 7a_100010214474_100000210303 [1,0,0,0,0,0|2,0,0]=3 1012 B12R1.1631 CCCOc1c(cccc1Br)F 34a_100009813666_100000210303 [1,0,0,0,0,0|2,0,0]=3 1013 B12R1.1631 CCCOc1c(cccc1Br)F 7a_100009813666_100000210303 [1,0,0,0,0,0|2,0,0]=3 1014 B12R1.1631 CCCOc1c(cccc1Br)N 34a_100011934915_100000210303 [1,0,0,0,0,0|2,0,0]=3 1015 B12R1.1631 CCCOc1c(cccc1C)C 34a_100000210341_100000210303 [1,0,0,0,0,0|0,0,0]=1 1016 B12R1.1631 CCCOc1c(cccc1C)C 7a_100000210341_100000210303 [1,0,0,0,0,0|0,0,0]=1 1017 B12R1.1631 CCCOc1c(cccc1Cl)C 34a_100000033731_100000210303 [1,0,0,0,0,0|1,0,0]=2 1018 B12R1.1631 CCCOc1c(cccc1Cl)C 7a_100000033731_100000210303 [1,0,0,0,0,0|1,0,0]=2 1019 B12R1.1631 CCCOc1c(cccc1Cl)Cl 34a_100000211709_100000210303 [1,0,0,0,0,0|2,0,0]=3 1020 B12R1.1631 CCCOc1c(cccc1Cl)Cl 7a_100000211709_100000210303 [1,0,0,0,0,0|2,0,0]=3 1021 B12R1.1631 CCCOc1c(cccc1Cl)F 34a_100000694953_100000210303 [1,0,0,0,0,0|2,0,0]=3 1022 B12R1.1631 CCCOc1c(cccc1Cl)F 7a_100000694953_100000210303 [1,0,0,0,0,0|2,0,0]=3 1023 B12R1.1631 CCCOc1c(cccc1Cl)N 34a_100000754742_100000210303 [1,0,0,0,0,0|2,0,0]=3 1024 B12R1.1631 CCCOc1c(cccc1F)C 34a_100011659162_100000210303 [1,0,0,0,0,0|1,0,0]=2 1025 B12R1.1631 CCCOc1c(cccc1F)C 7a_100011659162_100000210303 [1,0,0,0,0,0|1,0,0]=2 1026 B12R1.1631 CCCOc1c(cccc1F)F 34a_100000230165_100000210303 [1,0,0,0,0,0|2,0,0]=3 1027 B12R1.1631 CCCOc1c(cccc1F)F 7a_100000230165_100000210303 [1,0,0,0,0,0|2,0,0]=3 1028 B12R1.1631 CCCOc1c(cccc1F)N 34a_100011934987_100000210303 [1,0,0,0,0,0|2,0,0]=3 1029 B12R1.1631 CCCOc1c(cccc1I)Br 34a_100010084509_100000210303 [1,0,0,0,0,0|2,0,0]=3 1030 B12R1.1631 CCCOc1c(cccc1I)Br 7a_100010084509_100000210303 [1,0,0,0,0,0|2,0,0]=3 1031 B12R1.1631 CCCOc1c(cccc1I)Cl 34a_100010202889_100000210303 [1,0,0,0,0,0|2,0,0]=3 1032 B12R1.1631 CCCOc1c(cccc1I)Cl 7a_100010202889_100000210303 [1,0,0,0,0,0|2,0,0]=3 1033 B12R1.1631 CCCOc1c(cccc1I)F 34a_100010186298_100000210303 [1,0,0,0,0,0|2,0,0]=3 1034 B12R1.1631 CCCOc1c(cccc1I)F 7a_100010186298_100000210303 [1,0,0,0,0,0|2,0,0]=3 1035 B12R1.1631 CCCOc1c(cccc1I)N 34a_100010084371_100000210303 [1,0,0,0,0,0|2,0,0]=3 1036 B12R1.1631 CCCOc1c(cccc1N)C 34a_100000756359_100000210303 [1,0,0,0,0,0|1,0,0]=2 1037 B12R1.1631 CCCOc1c(cccc1N)C 7a_100000756359_100000210303 [1,0,0,0,0,0|1,0,0]=2 1038 B12R1.1631 CCCOc1c(cccc1N)N 34a_200016994477_100000210303 [1,0,0,0,0,0|2,0,0]=3 1039 B12R1.1631 CCCOc1c(ccnc1C)C 34a_100011934651_100000210303 [1,0,0,0,0,0|1,0,0]=2 1040 B12R1.1631 CCCOc1c(ccnc1C)C 7a_100011934651_100000210303 [1,0,0,0,0,0|1,0,0]=2 1041 B12R1.1631 CCCOc1c(ccnc1Cl)C 34a_100000696282_100000210303 [1,0,0,0,0,0|2,0,0]=3 1042 B12R1.1631 CCCOc1c(ccnc1Cl)C 7a_100000696282_100000210303 [1,0,0,0,0,0|2,0,0]=3 1043 B12R1.1631 CCCOc1c(ccnc1Cl)Cl 34a_100000118450_100000210303 [1,0,0,0,0,0|3,0,0]=4 1044 B12R1.1631 CCCOc1c(ccnc1Cl)Cl 7a_100000118450_100000210303 [1,0,0,0,0,0|3,0,0]=4 1045 B12R1.1631 CCCOc1c(ccnc1Cl)F 34a_100009867227_100000210303 [1,0,0,0,0,0|3,0,0]=4 1046 B12R1.1631 CCCOc1c(ccnc1Cl)F 7a_100009867227_100000210303 [1,0,0,0,0,0|3,0,0]=4 1047 B12R1.1631 CCCOc1c(ccnc1Cl)I 34a_100010067911_100000210303 [1,0,0,0,0,0|3,0,0]=4 1048 B12R1.1631 CCCOc1c(ccnc1Cl)I 7a_100010067911_100000210303 [1,0,0,0,0,0|3,0,0]=4 1049 B12R1.1631 CCCOc1c(ccnc1Cl)N 34a_100009844647_100000210303 [1,0,0,0,0,0|3,0,0]=4 1050 B12R1.1631 CCCOc1c(ccnc1Cl)N 7a_100009844647_100000210303 [1,0,0,0,0,0|3,0,0]=4 1051 B12R1.1631 CCCOc1c(ncnc1C)C 34a_100009878406_100000210303 [1,0,0,0,0,0|2,0,0]=3 1052 B12R1.1631 CCCOc1c(ncnc1C)C 7a_100009878406_100000210303 [1,0,0,0,0,0|2,0,0]=3 1053 B12R1.1631 CCCOc1c(occc1=O)C 34a_100000031901_100000210303 [1,0,0,0,0,0|2,0,0]=3 1054 B12R1.1631 CCCSc1c(ccc[n+]1[O-])C 62a_100000210303_100116209805 [1,0,0,0,0,0|2,1,0]=4 1055 B12R1.1631 CCCSc1c(cccc1Br)Br 62a_100000210303_100009994525 [1,0,0,0,0,0|2,1,0]=4 1056 B12R1.1631 CCCSc1c(cccc1Br)Br 62a_100009994525_100000210303 [1,0,0,0,0,0|2,1,0]=4 1057 B12R1.1631 CCCSc1c(cccc1Br)C 62a_100000210303_100010141302 [1,0,0,0,0,0|1,1,0]=3 1058 B12R1.1631 CCCSc1c(cccc1Br)C 62a_100010141302_100000210303 [1,0,0,0,0,0|1,1,0]=3 1059 B12R1.1631 CCCSc1c(cccc1Br)Cl 62a_100000210303_100010214488 [1,0,0,0,0,0|2,1,0]=4 1060 B12R1.1631 CCCSc1c(cccc1Br)Cl 62a_100010214488_100000210303 [1,0,0,0,0,0|2,1,0]=4 1061 B12R1.1631 CCCSc1c(cccc1Br)F 62a_100000210303_100011219512 [1,0,0,0,0,0|2,1,0]=4 1062 B12R1.1631 CCCSc1c(cccc1Br)F 62a_100011219512_100000210303 [1,0,0,0,0,0|2,1,0]=4 1063 B12R1.1631 CCCSc1c(cccc1Br)N 62a_100000210303_100020590159 [1,0,0,0,0,0|2,1,0]=4 1064 B12R1.1631 CCCSc1c(cccc1Br)N 62a_100020590159_100000210303 [1,0,0,0,0,0|2,1,0]=4 1065 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100000210303_100010187912 [1,0,0,0,0,0|2,1,0]=4 1066 B12R1.1631 CCCSc1c(cccc1Br)O 62a_100010187912_100000210303 [1,0,0,0,0,0|2,1,0]=4 1067 B12R1.1631 CCCSc1c(cccc1C)C 62a_100000033847_100000210303 [1,0,0,0,0,0|0,1,0]=2 1068 B12R1.1631 CCCSc1c(cccc1C)C 62a_100000210303_100000033847 [1,0,0,0,0,0|0,1,0]=2 1069 B12R1.1631 CCCSc1c(cccc1Cl)C 62a_100000043165_100000210303 [1,0,0,0,0,0|1,1,0]=3 1070 B12R1.1631 CCCSc1c(cccc1Cl)C 62a_100000210303_100000043165 [1,0,0,0,0,0|1,1,0]=3 1071 B12R1.1631 CCCSc1c(cccc1Cl)Cl 62a_100000034237_100000210303 [1,0,0,0,0,0|2,1,0]=4 1072 B12R1.1631 CCCSc1c(cccc1Cl)Cl 62a_100000210303_100000034237 [1,0,0,0,0,0|2,1,0]=4 1073 B12R1.1631 CCCSc1c(cccc1Cl)F 62a_100000050007_100000210303 [1,0,0,0,0,0|2,1,0]=4 1074 B12R1.1631 CCCSc1c(cccc1Cl)F 62a_100000210303_100000050007 [1,0,0,0,0,0|2,1,0]=4 1075 B12R1.1631 CCCSc1c(cccc1Cl)N 62a_100000049713_100000210303 [1,0,0,0,0,0|2,1,0]=4 1076 B12R1.1631 CCCSc1c(cccc1Cl)N 62a_100000210303_100000049713 [1,0,0,0,0,0|2,1,0]=4 1077 B12R1.1631 CCCSc1c(cccc1Cl)O 62a_100000210303_100000050174 [1,0,0,0,0,0|2,1,0]=4 1078 B12R1.1631 CCCSc1c(cccc1F)C 62a_100000210303_100011218421 [1,0,0,0,0,0|1,1,0]=3 1079 B12R1.1631 CCCSc1c(cccc1F)C 62a_100011218421_100000210303 [1,0,0,0,0,0|1,1,0]=3 1080 B12R1.1631 CCCSc1c(cccc1F)F 62a_100000210303_100000693133 [1,0,0,0,0,0|2,1,0]=4 1081 B12R1.1631 CCCSc1c(cccc1F)F 62a_100000693133_100000210303 [1,0,0,0,0,0|2,1,0]=4 1082 B12R1.1631 CCCSc1c(cccc1F)N 62a_100000210303_100000690935 [1,0,0,0,0,0|2,1,0]=4 1083 B12R1.1631 CCCSc1c(cccc1F)N 62a_100000690935_100000210303 [1,0,0,0,0,0|2,1,0]=4 1084 B12R1.1631 CCCSc1c(cccc1F)O 62a_100000210303_100009820682 [1,0,0,0,0,0|2,1,0]=4 1085 B12R1.1631 CCCSc1c(cccc1F)O 62a_100009820682_100000210303 [1,0,0,0,0,0|2,1,0]=4 1086 B12R1.1631 CCCSc1c(cccc1N)C 62a_100000210303_100000684715 [1,0,0,0,0,0|1,1,0]=3 1087 B12R1.1631 CCCSc1c(cccc1N)C 62a_100000684715_100000210303 [1,0,0,0,0,0|1,1,0]=3 1088 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000210303_100000686692 [1,0,0,0,0,0|1,1,0]=3 1089 B12R1.1631 CCCSc1c(cccc1O)C 62a_100000686692_100000210303 [1,0,0,0,0,0|1,1,0]=3 1090 B12R1.1631 CCCSc1c(cccc1O)N 62a_100000210303_100012183704 [1,0,0,0,0,0|2,1,0]=4 1091 B12R1.1631 CCCSc1c(cccc1O)N 62a_100012183704_100000210303 [1,0,0,0,0,0|2,1,0]=4 1092 B12R1.1631 CCCSc1c(cccc1O)O 62a_100000210303_100010205330 [1,0,0,0,0,0|2,1,0]=4 1093 B12R1.1631 CCCSc1c(ccnc1C)C 62a_100000210303_100012000501 [1,0,0,0,0,0|1,1,0]=3 1094 B12R1.1631 CCCSc1c(ccnc1C)C 62a_100012000501_100000210303 [1,0,0,0,0,0|1,1,0]=3 1095 B12R1.1631 CCCSc1c(ccnc1C)N 62a_100000210303_100010243816 [1,0,0,0,0,0|2,1,0]=4 1096 B12R1.1631 CCCSc1c(ccnc1C)N 62a_100010243816_100000210303 [1,0,0,0,0,0|2,1,0]=4 1097 B12R1.1631 CCCSc1c(ccnc1Cl)C 62a_100000210303_100010248874 [1,0,0,0,0,0|2,1,0]=4 1098 B12R1.1631 CCCSc1c(ccnc1Cl)C 62a_100010248874_100000210303 [1,0,0,0,0,0|2,1,0]=4 1099 B12R1.1631 CCCSc1c(ccnc1F)C 62a_100000210303_100009818256 [1,0,0,0,0,0|2,1,0]=4 1100 B12R1.1631 CCCSc1c(ccnc1F)C 62a_100009818256_100000210303 [1,0,0,0,0,0|2,1,0]=4 1101 B12R1.1631 CCCSc1c(ccnc1N)C 62a_100000210303_100011998619 [1,0,0,0,0,0|2,1,0]=4 1102 B12R1.1631 CCCSc1c(ccnc1N)C 62a_100011998619_100000210303 [1,0,0,0,0,0|2,1,0]=4 1103 B12R1.1631 CCCSc1c(ccnc1O)C 62a_100000210303_100012000493 [1,0,0,0,0,0|2,1,0]=4 1104 B12R1.1631 CCCSc1c(ccnc1O)C 62a_100012000493_100000210303 [1,0,0,0,0,0|2,1,0]=4 1105 B12R1.1631 CCCSc1c(cncc1C)C 62a_100000210303_100009817138 [1,0,0,0,0,0|1,1,0]=3 1106 B12R1.1631 CCCSc1c(cncc1C)C 62a_100009817138_100000210303 [1,0,0,0,0,0|1,1,0]=3 1107 B12R1.1631 CCCSc1c(ncnc1C)C 62a_100000210303_100009820708 [1,0,0,0,0,0|2,1,0]=4 1108 B12R1.1631 CCCSc1c(ncnc1C)C 62a_100009820708_100000210303 [1,0,0,0,0,0|2,1,0]=4 1109 B12R1.1631 CCNCc1c(cccc1Br)C 207a_100015525214_100009881667 [1,0,0,0,0,0|3,0,0]=4 1110 B12R1.1631 CCNCc1c(cccc1Br)C 2230a_100015525214_100010146847 [1,0,0,0,0,0|3,0,0]=4 1111 B12R1.1631 CCNCc1c(cccc1Br)C 270004a_100015525214_100009881667 [1,0,0,0,0,0|3,0,0]=4 1112 B12R1.1631 CCNCc1c(cccc1C)C 207a_100015525214_100000758299 [1,0,0,0,0,0|2,0,0]=3 1113 B12R1.1631 CCNCc1c(cccc1C)C 2230a_100015525214_100000758300 [1,0,0,0,0,0|2,0,0]=3 1114 B12R1.1631 CCNCc1c(cccc1C)C 270004a_100015525214_100000758299 [1,0,0,0,0,0|2,0,0]=3 1115 B12R1.1631 CCNCc1c(cccc1C)C 34a_100000689800_100000210202 [1,0,0,0,0,0|2,0,0]=3 1116 B12R1.1631 CCNCc1c(cccc1Cl)C 207a_100015525214_100000041122 [1,0,0,0,0,0|3,0,0]=4 1117 B12R1.1631 CCNCc1c(cccc1Cl)C 270004a_100015525214_100000041122 [1,0,0,0,0,0|3,0,0]=4 1118 B12R1.1631 CCNCc1c(cccc1F)C 207a_100015525214_100000069827 [1,0,0,0,0,0|3,0,0]=4 1119 B12R1.1631 CCNCc1c(cccc1F)C 2230a_100015525214_100009814554 [1,0,0,0,0,0|3,0,0]=4 1120 B12R1.1631 CCNCc1c(cccc1F)C 270004a_100015525214_100000069827 [1,0,0,0,0,0|3,0,0]=4 1121 B12R1.1631 CCNCc1c(cccc1F)C 34a_100000762012_100000210202 [1,0,0,0,0,0|3,0,0]=4 1122 B12R1.1631 CCNCc1c(cccc1I)C 2230a_100015525214_100010150146 [1,0,0,0,0,0|3,0,0]=4 1123 B12R1.1631 CCOCc1c(cccc1Br)C 34a_100121572206_100010146847 [1,0,0,0,0,0|3,0,0]=4 1124 B12R1.1631 CCOCc1c(cccc1C)C 34a_100011933981_100000210202 [1,0,0,0,0,0|2,0,0]=3 1125 B12R1.1631 CCOCc1c(cccc1C)C 34a_100121572206_100000758300 [1,0,0,0,0,0|2,0,0]=3 1126 B12R1.1631 CCOCc1c(cccc1C)C 7a_100011933981_100000210202 [1,0,0,0,0,0|2,0,0]=3 1127 B12R1.1631 CCOCc1c(cccc1Cl)C 34a_100000082531_100000210202 [1,0,0,0,0,0|3,0,0]=4 1128 B12R1.1631 CCOCc1c(cccc1Cl)C 7a_100000082531_100000210202 [1,0,0,0,0,0|3,0,0]=4 1129 B12R1.1631 CCOCc1c(cccc1F)C 34a_100000057874_100000210202 [1,0,0,0,0,0|3,0,0]=4 1130 B12R1.1631 CCOCc1c(cccc1F)C 34a_100121572206_100009814554 [1,0,0,0,0,0|3,0,0]=4 1131 B12R1.1631 CCOCc1c(cccc1F)C 7a_100000057874_100000210202 [1,0,0,0,0,0|3,0,0]=4 1132 B12R1.1631 CCOCc1c(cccc1I)C 34a_100121572206_100010150146 [1,0,0,0,0,0|3,0,0]=4 1133 B12R1.1631 CCSCc1c(cccc1Br)C 62a_100000210202_100010146847 [1,0,0,0,0,0|3,0,0]=4 1134 B12R1.1631 CCSCc1c(cccc1Br)C 62a_100010146847_100000210202 [1,0,0,0,0,0|3,0,0]=4 1135 B12R1.1631 CCSCc1c(cccc1C)C 62a_100000210202_100000758300 [1,0,0,0,0,0|2,0,0]=3 1136 B12R1.1631 CCSCc1c(cccc1C)C 62a_100000758300_100000210202 [1,0,0,0,0,0|2,0,0]=3 1137 B12R1.1631 CCSCc1c(cccc1F)C 62a_100000210202_100009814554 [1,0,0,0,0,0|3,0,0]=4 1138 B12R1.1631 CCSCc1c(cccc1F)C 62a_100009814554_100000210202 [1,0,0,0,0,0|3,0,0]=4 1139 B12R1.1631 CCSCc1c(cccc1I)C 62a_100000210202_100010150146 [1,0,0,0,0,0|3,0,0]=4 1140 B12R1.1631 CCSCc1c(cccc1I)C 62a_100010150146_100000210202 [1,0,0,0,0,0|3,0,0]=4 1141 B12R1.1631 COCSc1c(cccc1Br)C 62a_100000766300_100010141302 [1,0,0,0,0,0|2,1,0]=4 1142 B12R1.1631 COCSc1c(cccc1Br)C 62a_100010141302_100000766300 [1,0,0,0,0,0|2,1,0]=4 1143 B12R1.1631 COCSc1c(cccc1C)C 62a_100000033847_100000766300 [1,0,0,0,0,0|1,1,0]=3 1144 B12R1.1631 COCSc1c(cccc1C)C 62a_100000766300_100000033847 [1,0,0,0,0,0|1,1,0]=3 1145 B12R1.1631 COCSc1c(cccc1Cl)C 62a_100000043165_100000766300 [1,0,0,0,0,0|2,1,0]=4 1146 B12R1.1631 COCSc1c(cccc1Cl)C 62a_100000766300_100000043165 [1,0,0,0,0,0|2,1,0]=4 1147 B12R1.1631 COCSc1c(cccc1F)C 62a_100000766300_100011218421 [1,0,0,0,0,0|2,1,0]=4 1148 B12R1.1631 COCSc1c(cccc1F)C 62a_100011218421_100000766300 [1,0,0,0,0,0|2,1,0]=4 1149 B12R1.1631 COCSc1c(cccc1N)C 62a_100000684715_100000766300 [1,0,0,0,0,0|2,1,0]=4 1150 B12R1.1631 COCSc1c(cccc1N)C 62a_100000766300_100000684715 [1,0,0,0,0,0|2,1,0]=4 1151 B12R1.1631 COCSc1c(cccc1O)C 62a_100000686692_100000766300 [1,0,0,0,0,0|2,1,0]=4 1152 B12R1.1631 COCSc1c(cccc1O)C 62a_100000766300_100000686692 [1,0,0,0,0,0|2,1,0]=4 1153 B12R1.1631 COCSc1c(ccnc1C)C 62a_100000766300_100012000501 [1,0,0,0,0,0|2,1,0]=4 1154 B12R1.1631 COCSc1c(ccnc1C)C 62a_100012000501_100000766300 [1,0,0,0,0,0|2,1,0]=4 1155 B12R1.1631 COCSc1c(cncc1C)C 62a_100000766300_100009817138 [1,0,0,0,0,0|2,1,0]=4 1156 B12R1.1631 COCSc1c(cncc1C)C 62a_100009817138_100000766300 [1,0,0,0,0,0|2,1,0]=4 1157 B12R1.1631 CSCNc1c(cccc1Br)C 34a_100011834072_100011218213 [1,0,0,0,0,0|3,0,0]=4 1158 B12R1.1631 CSCNc1c(cccc1C)C 34a_100000185769_100011218213 [1,0,0,0,0,0|2,0,0]=3 1159 B12R1.1631 CSCNc1c(cccc1Cl)C 34a_100000756524_100011218213 [1,0,0,0,0,0|3,0,0]=4 1160 B12R1.1631 CSCNc1c(cccc1F)C 34a_100000766463_100011218213 [1,0,0,0,0,0|3,0,0]=4 1161 B12R1.1631 CSCNc1c(cccc1O)C 34a_100000743429_100011218213 [1,0,0,0,0,0|3,0,0]=4 1162 B12R1.1631 CSCOc1c(cccc1Br)Br 34a_100000736428_100011218213 [1,0,0,0,0,0|3,0,0]=4 1163 B12R1.1631 CSCOc1c(cccc1Br)C 34a_100009817157_100011218213 [1,0,0,0,0,0|2,0,0]=3 1164 B12R1.1631 CSCOc1c(cccc1Br)Cl 34a_100010214474_100011218213 [1,0,0,0,0,0|3,0,0]=4 1165 B12R1.1631 CSCOc1c(cccc1Br)F 34a_100009813666_100011218213 [1,0,0,0,0,0|3,0,0]=4 1166 B12R1.1631 CSCOc1c(cccc1Br)N 34a_100011934915_100011218213 [1,0,0,0,0,0|3,0,0]=4 1167 B12R1.1631 CSCOc1c(cccc1C)C 34a_100000210341_100011218213 [1,0,0,0,0,0|1,0,0]=2 1168 B12R1.1631 CSCOc1c(cccc1Cl)C 34a_100000033731_100011218213 [1,0,0,0,0,0|2,0,0]=3 1169 B12R1.1631 CSCOc1c(cccc1Cl)Cl 34a_100000211709_100011218213 [1,0,0,0,0,0|3,0,0]=4 1170 B12R1.1631 CSCOc1c(cccc1Cl)F 34a_100000694953_100011218213 [1,0,0,0,0,0|3,0,0]=4 1171 B12R1.1631 CSCOc1c(cccc1Cl)N 34a_100000754742_100011218213 [1,0,0,0,0,0|3,0,0]=4 1172 B12R1.1631 CSCOc1c(cccc1F)C 34a_100011659162_100011218213 [1,0,0,0,0,0|2,0,0]=3 1173 B12R1.1631 CSCOc1c(cccc1F)F 34a_100000230165_100011218213 [1,0,0,0,0,0|3,0,0]=4 1174 B12R1.1631 CSCOc1c(cccc1F)N 34a_100011934987_100011218213 [1,0,0,0,0,0|3,0,0]=4 1175 B12R1.1631 CSCOc1c(cccc1I)Br 34a_100010084509_100011218213 [1,0,0,0,0,0|3,0,0]=4 1176 B12R1.1631 CSCOc1c(cccc1I)Cl 34a_100010202889_100011218213 [1,0,0,0,0,0|3,0,0]=4 1177 B12R1.1631 CSCOc1c(cccc1I)F 34a_100010186298_100011218213 [1,0,0,0,0,0|3,0,0]=4 1178 B12R1.1631 CSCOc1c(cccc1I)N 34a_100010084371_100011218213 [1,0,0,0,0,0|3,0,0]=4 1179 B12R1.1631 CSCOc1c(cccc1N)C 34a_100000756359_100011218213 [1,0,0,0,0,0|2,0,0]=3 1180 B12R1.1631 CSCOc1c(cccc1N)N 34a_200016994477_100011218213 [1,0,0,0,0,0|3,0,0]=4 1181 B12R1.1631 CSCOc1c(ccnc1C)C 34a_100011934651_100011218213 [1,0,0,0,0,0|2,0,0]=3 1182 B12R1.1631 CSCOc1c(ccnc1Cl)C 34a_100000696282_100011218213 [1,0,0,0,0,0|3,0,0]=4 1183 B12R1.1631 CSCOc1c(ncnc1C)C 34a_100009878406_100011218213 [1,0,0,0,0,0|3,0,0]=4 1184 B12R1.1631 CSCOc1c(occc1=O)C 34a_100000031901_100011218213 [1,0,0,0,0,0|3,0,0]=4 1185 B12R1.1631 CSCSc1c(cccc1Br)C 62a_100010141302_100011218213 [1,0,0,0,0,0|2,1,0]=4 1186 B12R1.1631 CSCSc1c(cccc1Br)C 62a_100011218213_100010141302 [1,0,0,0,0,0|2,1,0]=4 1187 B12R1.1631 CSCSc1c(cccc1C)C 62a_100000033847_100011218213 [1,0,0,0,0,0|1,1,0]=3 1188 B12R1.1631 CSCSc1c(cccc1C)C 62a_100011218213_100000033847 [1,0,0,0,0,0|1,1,0]=3 1189 B12R1.1631 CSCSc1c(cccc1Cl)C 62a_100000043165_100011218213 [1,0,0,0,0,0|2,1,0]=4 1190 B12R1.1631 CSCSc1c(cccc1Cl)C 62a_100011218213_100000043165 [1,0,0,0,0,0|2,1,0]=4 1191 B12R1.1631 CSCSc1c(cccc1F)C 62a_100011218213_100011218421 [1,0,0,0,0,0|2,1,0]=4 1192 B12R1.1631 CSCSc1c(cccc1F)C 62a_100011218421_100011218213 [1,0,0,0,0,0|2,1,0]=4 1193 B12R1.1631 CSCSc1c(cccc1N)C 62a_100000684715_100011218213 [1,0,0,0,0,0|2,1,0]=4 1194 B12R1.1631 CSCSc1c(cccc1N)C 62a_100011218213_100000684715 [1,0,0,0,0,0|2,1,0]=4 1195 B12R1.1631 CSCSc1c(cccc1O)C 62a_100000686692_100011218213 [1,0,0,0,0,0|2,1,0]=4 1196 B12R1.1631 CSCSc1c(cccc1O)C 62a_100011218213_100000686692 [1,0,0,0,0,0|2,1,0]=4 1197 B12R1.1631 CSCSc1c(ccnc1C)C 62a_100011218213_100012000501 [1,0,0,0,0,0|2,1,0]=4 1198 B12R1.1631 CSCSc1c(ccnc1C)C 62a_100012000501_100011218213 [1,0,0,0,0,0|2,1,0]=4 1199 B12R1.1631 CSCSc1c(cncc1C)C 62a_100009817138_100011218213 [1,0,0,0,0,0|2,1,0]=4 1200 B12R1.1631 CSCSc1c(cncc1C)C 62a_100011218213_100009817138 [1,0,0,0,0,0|2,1,0]=4 1201 B12R1.1631 Cc1cccc(c1CNCF)C 34a_100000689800_100015361967 [1,0,0,0,0,0|3,0,0]=4 1202 B12R1.1631 Cc1cccc(c1COCF)C 34a_100011933981_100015361967 [1,0,0,0,0,0|3,0,0]=4 1203 B12R1.1631 Cc1cccc(c1COCF)C 7a_100011933981_100015361967 [1,0,0,0,0,0|3,0,0]=4 1204 B12R1.1631 Cc1cccc(c1CSCF)C 62a_100000758300_100015361967 [1,0,0,0,0,0|3,0,0]=4 1205 B12R1.1631 Cc1cccc(c1CSCF)C 62a_100015361967_100000758300 [1,0,0,0,0,0|3,0,0]=4 1206 B12R1.1631 Cc1cccc(c1NCC=O)C 34a_100000185769_200009817547 [1,0,0,0,0,0|2,0,1]=4 1207 B12R1.1631 Cc1cccc(c1NCCF)Br 34a_100011834072_100011217306 [1,0,0,0,0,0|3,0,0]=4 1208 B12R1.1631 Cc1cccc(c1NCCF)C 34a_100000185769_100011217306 [1,0,0,0,0,0|2,0,0]=3 1209 B12R1.1631 Cc1cccc(c1NCCF)Cl 34a_100000756524_100011217306 [1,0,0,0,0,0|3,0,0]=4 1210 B12R1.1631 Cc1cccc(c1NCCF)F 34a_100000766463_100011217306 [1,0,0,0,0,0|3,0,0]=4 1211 B12R1.1631 Cc1cccc(c1NCCF)O 34a_100000743429_100011217306 [1,0,0,0,0,0|3,0,0]=4 1212 B12R1.1631 Cc1cccc(c1NCCO)Br 34a_100011834072_100000211926 [1,0,0,0,0,0|3,0,0]=4 1213 B12R1.1631 Cc1cccc(c1NCCO)C 34a_100000185769_100000211926 [1,0,0,0,0,0|2,0,0]=3 1214 B12R1.1631 Cc1cccc(c1NCCO)Cl 34a_100000756524_100000211926 [1,0,0,0,0,0|3,0,0]=4 1215 B12R1.1631 Cc1cccc(c1NCCO)F 34a_100000766463_100000211926 [1,0,0,0,0,0|3,0,0]=4 1216 B12R1.1631 Cc1cccc(c1NCCO)O 34a_100000743429_100000211926 [1,0,0,0,0,0|3,0,0]=4 1217 B12R1.1631 Cc1cccc(c1OCC#N)Br 7a_100009817157_100011215382 [1,0,0,0,0,0|1,0,2]=4 1218 B12R1.1631 Cc1cccc(c1OCC#N)C 7a_100000210341_100011215382 [1,0,0,0,0,0|0,0,2]=3 1219 B12R1.1631 Cc1cccc(c1OCC#N)Cl 7a_100000033731_100011215382 [1,0,0,0,0,0|1,0,2]=4 1220 B12R1.1631 Cc1cccc(c1OCC#N)F 7a_100011659162_100011215382 [1,0,0,0,0,0|1,0,2]=4 1221 B12R1.1631 Cc1cccc(c1OCC#N)N 7a_100000756359_100011215382 [1,0,0,0,0,0|1,0,2]=4 1222 B12R1.1631 Cc1cccc(c1OCC=O)Br 34a_100009817157_200009817547 [1,0,0,0,0,0|2,0,1]=4 1223 B12R1.1631 Cc1cccc(c1OCC=O)Br 7a_100009817157_200015260668 [1,0,0,0,0,0|2,0,1]=4 1224 B12R1.1631 Cc1cccc(c1OCC=O)C 34a_100000210341_200009817547 [1,0,0,0,0,0|1,0,1]=3 1225 B12R1.1631 Cc1cccc(c1OCC=O)C 7a_100000210341_200015260668 [1,0,0,0,0,0|1,0,1]=3 1226 B12R1.1631 Cc1cccc(c1OCC=O)Cl 34a_100000033731_200009817547 [1,0,0,0,0,0|2,0,1]=4 1227 B12R1.1631 Cc1cccc(c1OCC=O)Cl 7a_100000033731_200015260668 [1,0,0,0,0,0|2,0,1]=4 1228 B12R1.1631 Cc1cccc(c1OCC=O)F 34a_100011659162_200009817547 [1,0,0,0,0,0|2,0,1]=4 1229 B12R1.1631 Cc1cccc(c1OCC=O)F 7a_100011659162_200015260668 [1,0,0,0,0,0|2,0,1]=4 1230 B12R1.1631 Cc1cccc(c1OCC=O)N 34a_100000756359_200009817547 [1,0,0,0,0,0|2,0,1]=4 1231 B12R1.1631 Cc1cccc(c1OCC=O)N 7a_100000756359_200015260668 [1,0,0,0,0,0|2,0,1]=4 1232 B12R1.1631 Cc1cccc(c1OCCF)Br 34a_100009817157_100011217306 [1,0,0,0,0,0|2,0,0]=3 1233 B12R1.1631 Cc1cccc(c1OCCF)Br 7a_100009817157_100011217306 [1,0,0,0,0,0|2,0,0]=3 1234 B12R1.1631 Cc1cccc(c1OCCF)C 34a_100000210341_100011217306 [1,0,0,0,0,0|1,0,0]=2 1235 B12R1.1631 Cc1cccc(c1OCCF)C 7a_100000210341_100011217306 [1,0,0,0,0,0|1,0,0]=2 1236 B12R1.1631 Cc1cccc(c1OCCF)Cl 34a_100000033731_100011217306 [1,0,0,0,0,0|2,0,0]=3 1237 B12R1.1631 Cc1cccc(c1OCCF)Cl 7a_100000033731_100011217306 [1,0,0,0,0,0|2,0,0]=3 1238 B12R1.1631 Cc1cccc(c1OCCF)F 34a_100011659162_100011217306 [1,0,0,0,0,0|2,0,0]=3 1239 B12R1.1631 Cc1cccc(c1OCCF)F 7a_100011659162_100011217306 [1,0,0,0,0,0|2,0,0]=3 1240 B12R1.1631 Cc1cccc(c1OCCF)N 34a_100000756359_100011217306 [1,0,0,0,0,0|2,0,0]=3 1241 B12R1.1631 Cc1cccc(c1OCCF)N 7a_100000756359_100011217306 [1,0,0,0,0,0|2,0,0]=3 1242 B12R1.1631 Cc1cccc(c1OCCO)Br 34a_100009817157_100000211926 [1,0,0,0,0,0|2,0,0]=3 1243 B12R1.1631 Cc1cccc(c1OCCO)Br 7a_100009817157_100000211926 [1,0,0,0,0,0|2,0,0]=3 1244 B12R1.1631 Cc1cccc(c1OCCO)C 34a_100000210341_100000211926 [1,0,0,0,0,0|1,0,0]=2 1245 B12R1.1631 Cc1cccc(c1OCCO)C 7a_100000210341_100000211926 [1,0,0,0,0,0|1,0,0]=2 1246 B12R1.1631 Cc1cccc(c1OCCO)Cl 34a_100000033731_100000211926 [1,0,0,0,0,0|2,0,0]=3 1247 B12R1.1631 Cc1cccc(c1OCCO)Cl 7a_100000033731_100000211926 [1,0,0,0,0,0|2,0,0]=3 1248 B12R1.1631 Cc1cccc(c1OCCO)F 34a_100011659162_100000211926 [1,0,0,0,0,0|2,0,0]=3 1249 B12R1.1631 Cc1cccc(c1OCCO)F 7a_100011659162_100000211926 [1,0,0,0,0,0|2,0,0]=3 1250 B12R1.1631 Cc1cccc(c1OCCO)N 34a_100000756359_100000211926 [1,0,0,0,0,0|2,0,0]=3 1251 B12R1.1631 Cc1cccc(c1OCCO)N 7a_100000756359_100000211926 [1,0,0,0,0,0|2,0,0]=3 1252 B12R1.1631 Cc1cccc(c1SCC#N)C 62a_100000033847_100011215382 [1,0,0,0,0,0|0,1,2]=4 1253 B12R1.1631 Cc1cccc(c1SCC#N)C 62a_100011215382_100000033847 [1,0,0,0,0,0|0,1,2]=4 1254 B12R1.1631 Cc1cccc(c1SCC=O)C 62a_100000033847_200015260668 [1,0,0,0,0,0|1,1,1]=4 1255 B12R1.1631 Cc1cccc(c1SCC=O)C 62a_200015260668_100000033847 [1,0,0,0,0,0|1,1,1]=4 1256 B12R1.1631 Cc1cccc(c1SCCF)Br 62a_100010141302_100011217306 [1,0,0,0,0,0|2,1,0]=4 1257 B12R1.1631 Cc1cccc(c1SCCF)Br 62a_100011217306_100010141302 [1,0,0,0,0,0|2,1,0]=4 1258 B12R1.1631 Cc1cccc(c1SCCF)C 62a_100000033847_100011217306 [1,0,0,0,0,0|1,1,0]=3 1259 B12R1.1631 Cc1cccc(c1SCCF)C 62a_100011217306_100000033847 [1,0,0,0,0,0|1,1,0]=3 1260 B12R1.1631 Cc1cccc(c1SCCF)Cl 62a_100000043165_100011217306 [1,0,0,0,0,0|2,1,0]=4 1261 B12R1.1631 Cc1cccc(c1SCCF)Cl 62a_100011217306_100000043165 [1,0,0,0,0,0|2,1,0]=4 1262 B12R1.1631 Cc1cccc(c1SCCF)F 62a_100011217306_100011218421 [1,0,0,0,0,0|2,1,0]=4 1263 B12R1.1631 Cc1cccc(c1SCCF)F 62a_100011218421_100011217306 [1,0,0,0,0,0|2,1,0]=4 1264 B12R1.1631 Cc1cccc(c1SCCF)N 62a_100000684715_100011217306 [1,0,0,0,0,0|2,1,0]=4 1265 B12R1.1631 Cc1cccc(c1SCCF)N 62a_100011217306_100000684715 [1,0,0,0,0,0|2,1,0]=4 1266 B12R1.1631 Cc1cccc(c1SCCF)O 62a_100000686692_100011217306 [1,0,0,0,0,0|2,1,0]=4 1267 B12R1.1631 Cc1cccc(c1SCCF)O 62a_100011217306_100000686692 [1,0,0,0,0,0|2,1,0]=4 1268 B12R1.1631 Cc1cccc(c1SCCO)Br 62a_100000211926_100010141302 [1,0,0,0,0,0|2,1,0]=4 1269 B12R1.1631 Cc1cccc(c1SCCO)Br 62a_100010141302_100000211926 [1,0,0,0,0,0|2,1,0]=4 1270 B12R1.1631 Cc1cccc(c1SCCO)C 62a_100000033847_100000211926 [1,0,0,0,0,0|1,1,0]=3 1271 B12R1.1631 Cc1cccc(c1SCCO)C 62a_100000211926_100000033847 [1,0,0,0,0,0|1,1,0]=3 1272 B12R1.1631 Cc1cccc(c1SCCO)Cl 62a_100000043165_100000211926 [1,0,0,0,0,0|2,1,0]=4 1273 B12R1.1631 Cc1cccc(c1SCCO)Cl 62a_100000211926_100000043165 [1,0,0,0,0,0|2,1,0]=4 1274 B12R1.1631 Cc1cccc(c1SCCO)F 62a_100000211926_100011218421 [1,0,0,0,0,0|2,1,0]=4 1275 B12R1.1631 Cc1cccc(c1SCCO)F 62a_100011218421_100000211926 [1,0,0,0,0,0|2,1,0]=4 1276 B12R1.1631 Cc1cccc(c1SCCO)N 62a_100000211926_100000684715 [1,0,0,0,0,0|2,1,0]=4 1277 B12R1.1631 Cc1cccc(c1SCCO)N 62a_100000684715_100000211926 [1,0,0,0,0,0|2,1,0]=4 1278 B12R1.1631 Cc1cccc(c1SCCO)O 62a_100000211926_100000686692 [1,0,0,0,0,0|2,1,0]=4 1279 B12R1.1631 Cc1cccc(c1SCCO)O 62a_100000686692_100000211926 [1,0,0,0,0,0|2,1,0]=4 1280 B12R1.1631 Cc1ccnc(c1OCC#N)C 7a_100011934651_100011215382 [1,0,0,0,0,0|1,0,2]=4 1281 B12R1.1631 Cc1ccnc(c1OCC=O)C 34a_100011934651_200009817547 [1,0,0,0,0,0|2,0,1]=4 1282 B12R1.1631 Cc1ccnc(c1OCC=O)C 7a_100011934651_200015260668 [1,0,0,0,0,0|2,0,1]=4 1283 B12R1.1631 Cc1ccnc(c1OCCF)C 34a_100011934651_100011217306 [1,0,0,0,0,0|2,0,0]=3 1284 B12R1.1631 Cc1ccnc(c1OCCF)C 7a_100011934651_100011217306 [1,0,0,0,0,0|2,0,0]=3 1285 B12R1.1631 Cc1ccnc(c1OCCF)Cl 34a_100000696282_100011217306 [1,0,0,0,0,0|3,0,0]=4 1286 B12R1.1631 Cc1ccnc(c1OCCF)Cl 7a_100000696282_100011217306 [1,0,0,0,0,0|3,0,0]=4 1287 B12R1.1631 Cc1ccnc(c1OCCO)C 34a_100011934651_100000211926 [1,0,0,0,0,0|2,0,0]=3 1288 B12R1.1631 Cc1ccnc(c1OCCO)C 7a_100011934651_100000211926 [1,0,0,0,0,0|2,0,0]=3 1289 B12R1.1631 Cc1ccnc(c1OCCO)Cl 34a_100000696282_100000211926 [1,0,0,0,0,0|3,0,0]=4 1290 B12R1.1631 Cc1ccnc(c1OCCO)Cl 7a_100000696282_100000211926 [1,0,0,0,0,0|3,0,0]=4 1291 B12R1.1631 Cc1ccnc(c1SCCF)C 62a_100011217306_100012000501 [1,0,0,0,0,0|2,1,0]=4 1292 B12R1.1631 Cc1ccnc(c1SCCF)C 62a_100012000501_100011217306 [1,0,0,0,0,0|2,1,0]=4 1293 B12R1.1631 Cc1ccnc(c1SCCO)C 62a_100000211926_100012000501 [1,0,0,0,0,0|2,1,0]=4 1294 B12R1.1631 Cc1ccnc(c1SCCO)C 62a_100012000501_100000211926 [1,0,0,0,0,0|2,1,0]=4 1295 B12R1.1631 Cc1cncc(c1SCCF)C 62a_100009817138_100011217306 [1,0,0,0,0,0|2,1,0]=4 1296 B12R1.1631 Cc1cncc(c1SCCF)C 62a_100011217306_100009817138 [1,0,0,0,0,0|2,1,0]=4 1297 B12R1.1631 Cc1cncc(c1SCCO)C 62a_100000211926_100009817138 [1,0,0,0,0,0|2,1,0]=4 1298 B12R1.1631 Cc1cncc(c1SCCO)C 62a_100009817138_100000211926 [1,0,0,0,0,0|2,1,0]=4 1299 B12R1.1631 Cc1ncnc(c1OCCF)C 34a_100009878406_100011217306 [1,0,0,0,0,0|3,0,0]=4 1300 B12R1.1631 Cc1ncnc(c1OCCF)C 7a_100009878406_100011217306 [1,0,0,0,0,0|3,0,0]=4 1301 B12R1.1631 Cc1ncnc(c1OCCO)C 34a_100009878406_100000211926 [1,0,0,0,0,0|3,0,0]=4 1302 B12R1.1631 Cc1ncnc(c1OCCO)C 7a_100009878406_100000211926 [1,0,0,0,0,0|3,0,0]=4 1303 B12R1.1631 Cc1occc(=O)c1OCCF 34a_100000031901_100011217306 [1,0,0,0,0,0|3,0,0]=4 1304 B12R1.1631 Cc1occc(=O)c1OCCO 34a_100000031901_100000211926 [1,0,0,0,0,0|3,0,0]=4 1305 B12R1.1631 FCCOc1c(cccc1Br)Br 34a_100000736428_100011217306 [1,0,0,0,0,0|3,0,0]=4 1306 B12R1.1631 FCCOc1c(cccc1Br)Br 7a_100000736428_100011217306 [1,0,0,0,0,0|3,0,0]=4 1307 B12R1.1631 FCCOc1c(cccc1Br)Cl 34a_100010214474_100011217306 [1,0,0,0,0,0|3,0,0]=4 1308 B12R1.1631 FCCOc1c(cccc1Br)Cl 7a_100010214474_100011217306 [1,0,0,0,0,0|3,0,0]=4 1309 B12R1.1631 FCCOc1c(cccc1Br)F 34a_100009813666_100011217306 [1,0,0,0,0,0|3,0,0]=4 1310 B12R1.1631 FCCOc1c(cccc1Br)F 7a_100009813666_100011217306 [1,0,0,0,0,0|3,0,0]=4 1311 B12R1.1631 FCCOc1c(cccc1Cl)Cl 34a_100000211709_100011217306 [1,0,0,0,0,0|3,0,0]=4 1312 B12R1.1631 FCCOc1c(cccc1Cl)Cl 7a_100000211709_100011217306 [1,0,0,0,0,0|3,0,0]=4 1313 B12R1.1631 FCCOc1c(cccc1Cl)F 34a_100000694953_100011217306 [1,0,0,0,0,0|3,0,0]=4 1314 B12R1.1631 FCCOc1c(cccc1Cl)F 7a_100000694953_100011217306 [1,0,0,0,0,0|3,0,0]=4 1315 B12R1.1631 FCCOc1c(cccc1F)F 34a_100000230165_100011217306 [1,0,0,0,0,0|3,0,0]=4 1316 B12R1.1631 FCCOc1c(cccc1F)F 7a_100000230165_100011217306 [1,0,0,0,0,0|3,0,0]=4 1317 B12R1.1631 FCCOc1c(cccc1I)Br 34a_100010084509_100011217306 [1,0,0,0,0,0|3,0,0]=4 1318 B12R1.1631 FCCOc1c(cccc1I)Br 7a_100010084509_100011217306 [1,0,0,0,0,0|3,0,0]=4 1319 B12R1.1631 FCCOc1c(cccc1I)Cl 34a_100010202889_100011217306 [1,0,0,0,0,0|3,0,0]=4 1320 B12R1.1631 FCCOc1c(cccc1I)Cl 7a_100010202889_100011217306 [1,0,0,0,0,0|3,0,0]=4 1321 B12R1.1631 FCCOc1c(cccc1I)F 34a_100010186298_100011217306 [1,0,0,0,0,0|3,0,0]=4 1322 B12R1.1631 FCCOc1c(cccc1I)F 7a_100010186298_100011217306 [1,0,0,0,0,0|3,0,0]=4 1323 B12R1.1631 Nc1cccc(c1OCCF)Br 34a_100011934915_100011217306 [1,0,0,0,0,0|3,0,0]=4 1324 B12R1.1631 Nc1cccc(c1OCCF)Cl 34a_100000754742_100011217306 [1,0,0,0,0,0|3,0,0]=4 1325 B12R1.1631 Nc1cccc(c1OCCF)F 34a_100011934987_100011217306 [1,0,0,0,0,0|3,0,0]=4 1326 B12R1.1631 Nc1cccc(c1OCCF)I 34a_100010084371_100011217306 [1,0,0,0,0,0|3,0,0]=4 1327 B12R1.1631 Nc1cccc(c1OCCF)N 34a_200016994477_100011217306 [1,0,0,0,0,0|3,0,0]=4 1328 B12R1.1631 Nc1cccc(c1OCCO)Br 34a_100011934915_100000211926 [1,0,0,0,0,0|3,0,0]=4 1329 B12R1.1631 Nc1cccc(c1OCCO)Cl 34a_100000754742_100000211926 [1,0,0,0,0,0|3,0,0]=4 1330 B12R1.1631 Nc1cccc(c1OCCO)F 34a_100011934987_100000211926 [1,0,0,0,0,0|3,0,0]=4 1331 B12R1.1631 Nc1cccc(c1OCCO)I 34a_100010084371_100000211926 [1,0,0,0,0,0|3,0,0]=4 1332 B12R1.1631 Nc1cccc(c1OCCO)N 34a_200016994477_100000211926 [1,0,0,0,0,0|3,0,0]=4 1333 B12R1.1631 OCCOc1c(cccc1Br)Br 34a_100000736428_100000211926 [1,0,0,0,0,0|3,0,0]=4 1334 B12R1.1631 OCCOc1c(cccc1Br)Br 7a_100000736428_100000211926 [1,0,0,0,0,0|3,0,0]=4 1335 B12R1.1631 OCCOc1c(cccc1Br)Cl 34a_100010214474_100000211926 [1,0,0,0,0,0|3,0,0]=4 1336 B12R1.1631 OCCOc1c(cccc1Br)Cl 7a_100010214474_100000211926 [1,0,0,0,0,0|3,0,0]=4 1337 B12R1.1631 OCCOc1c(cccc1Br)F 34a_100009813666_100000211926 [1,0,0,0,0,0|3,0,0]=4 1338 B12R1.1631 OCCOc1c(cccc1Br)F 7a_100009813666_100000211926 [1,0,0,0,0,0|3,0,0]=4 1339 B12R1.1631 OCCOc1c(cccc1Cl)Cl 34a_100000211709_100000211926 [1,0,0,0,0,0|3,0,0]=4 1340 B12R1.1631 OCCOc1c(cccc1Cl)Cl 7a_100000211709_100000211926 [1,0,0,0,0,0|3,0,0]=4 1341 B12R1.1631 OCCOc1c(cccc1Cl)F 34a_100000694953_100000211926 [1,0,0,0,0,0|3,0,0]=4 1342 B12R1.1631 OCCOc1c(cccc1Cl)F 7a_100000694953_100000211926 [1,0,0,0,0,0|3,0,0]=4 1343 B12R1.1631 OCCOc1c(cccc1F)F 34a_100000230165_100000211926 [1,0,0,0,0,0|3,0,0]=4 1344 B12R1.1631 OCCOc1c(cccc1F)F 7a_100000230165_100000211926 [1,0,0,0,0,0|3,0,0]=4 1345 B12R1.1631 OCCOc1c(cccc1I)Br 34a_100010084509_100000211926 [1,0,0,0,0,0|3,0,0]=4 1346 B12R1.1631 OCCOc1c(cccc1I)Br 7a_100010084509_100000211926 [1,0,0,0,0,0|3,0,0]=4 1347 B12R1.1631 OCCOc1c(cccc1I)Cl 34a_100010202889_100000211926 [1,0,0,0,0,0|3,0,0]=4 1348 B12R1.1631 OCCOc1c(cccc1I)Cl 7a_100010202889_100000211926 [1,0,0,0,0,0|3,0,0]=4 1349 B12R1.1631 OCCOc1c(cccc1I)F 34a_100010186298_100000211926 [1,0,0,0,0,0|3,0,0]=4 1350 B12R1.1631 OCCOc1c(cccc1I)F 7a_100010186298_100000211926 [1,0,0,0,0,0|3,0,0]=4 1351 B14R1.2172 C=C(C)CNc1c(cccc1CC)C 2230a_100000210048_100000748629 [0,1,0,0,0,0|2,0,1]=4 1352 B14R1.2172 C=C(C)CNc1c(cccc1CC)C 34a_100000210048_100000748629 [0,1,0,0,0,0|2,0,1]=4 1353 B14R1.2172 C=C(C)CNc1c(cccc1CC)C 7a_100000210048_100000748629 [0,1,0,0,0,0|2,0,1]=4 1354 B14R1.2172 C=C(C)CNc1c(cccc1CO)C 34a_100011215590_100000748629 [0,1,0,0,0,0|2,0,1]=4 1355 B14R1.2172 C=C(C)CNc1c(cccc1OC)C 2230a_100000758225_100000748629 [0,1,0,0,0,0|2,0,1]=4 1356 B14R1.2172 C=C(C)CNc1c(cccc1OC)C 34a_100000758225_100000748629 [0,1,0,0,0,0|2,0,1]=4 1357 B14R1.2172 C=C(C)COc1c(cccc1C#N)C 34a_100011659161_100000748629 [0,1,0,0,0,0|1,0,2]=4 1358 B14R1.2172 C=C(C)COc1c(cccc1C#N)C 7a_100011659161_100000748629 [0,1,0,0,0,0|1,0,2]=4 1359 B14R1.2172 C=C(C)COc1c(cccc1CC)Br 34a_200010001580_100000748629 [0,1,0,0,0,0|2,0,1]=4 1360 B14R1.2172 C=C(C)COc1c(cccc1CC)Br 7a_200010001580_100000748629 [0,1,0,0,0,0|2,0,1]=4 1361 B14R1.2172 C=C(C)COc1c(cccc1CC)C 34a_100000034007_100000748629 [0,1,0,0,0,0|1,0,1]=3 1362 B14R1.2172 C=C(C)COc1c(cccc1CC)C 7a_100000034007_100000748629 [0,1,0,0,0,0|1,0,1]=3 1363 B14R1.2172 C=C(C)COc1c(cccc1CN)C 34a_100020639391_100000748629 [0,1,0,0,0,0|1,0,1]=3 1364 B14R1.2172 C=C(C)COc1c(cccc1CO)F 34a_100011997349_100000748629 [0,1,0,0,0,0|2,0,1]=4 1365 B14R1.2172 C=C(C)COc1c(cccc1CO)F 7a_100011997349_100000748629 [0,1,0,0,0,0|2,0,1]=4 1366 B14R1.2172 C=C(C)COc1c(cccc1OC)Br 34a_100000686866_100000748629 [0,1,0,0,0,0|2,0,1]=4 1367 B14R1.2172 C=C(C)COc1c(cccc1OC)C 34a_100011219253_100000748629 [0,1,0,0,0,0|1,0,1]=3 1368 B14R1.2172 C=C(C)COc1c(cccc1OC)C 7a_100011219253_100000748629 [0,1,0,0,0,0|1,0,1]=3 1369 B14R1.2172 C=C(C)COc1c(cccc1OC)Cl 34a_100009851661_100000748629 [0,1,0,0,0,0|2,0,1]=4 1370 B14R1.2172 C=C(C)COc1c(cccc1OC)Cl 7a_100009851661_100000748629 [0,1,0,0,0,0|2,0,1]=4 1371 B14R1.2172 C=C(C)COc1c(cccc1OC)F 34a_100000036725_100000748629 [0,1,0,0,0,0|2,0,1]=4 1372 B14R1.2172 C=C(C)COc1c(cccc1OC)F 7a_100000036725_100000748629 [0,1,0,0,0,0|2,0,1]=4 1373 B14R1.2172 C=C(C)COc1c(cccc1OC)N 34a_100000123586_100000748629 [0,1,0,0,0,0|2,0,1]=4 1374 B14R1.2172 C=C(C)CSc1c(cccc1CC)C 62a_100000036235_100000211660 [0,1,0,0,0,0|1,1,1]=4 1375 B14R1.2172 C=C(C)CSc1c(cccc1CC)C 62a_100000748629_100000036235 [0,1,0,0,0,0|1,1,1]=4 1376 B14R1.2172 C=C(C)CSc1c(cccc1CO)C 62a_100000748629_100011659289 [0,1,0,0,0,0|1,1,1]=4 1377 B14R1.2172 C=C(C)CSc1c(cccc1CO)C 62a_100011659289_100000211660 [0,1,0,0,0,0|1,1,1]=4 1378 B14R1.2172 C=C(C)CSc1c(cccc1OC)C 62a_100000748629_100010191535 [0,1,0,0,0,0|1,1,1]=4 1379 B14R1.2172 C=C(C)CSc1c(cccc1OC)C 62a_100010191535_100000211660 [0,1,0,0,0,0|1,1,1]=4 1380 B14R1.2172 C=C(F)COc1c(cccc1CC)C 34a_100000034007_100009893438 [0,1,0,0,0,0|1,0,2]=4 1381 B14R1.2172 C=C(F)COc1c(cccc1CC)C 7a_100000034007_100000042424 [0,1,0,0,0,0|1,0,2]=4 1382 B14R1.2172 C=C(F)COc1c(cccc1CN)C 34a_100020639391_100009893438 [0,1,0,0,0,0|1,0,2]=4 1383 B14R1.2172 C=C(F)COc1c(cccc1OC)C 34a_100011219253_100009893438 [0,1,0,0,0,0|1,0,2]=4 1384 B14R1.2172 C=C(F)COc1c(cccc1OC)C 7a_100011219253_100000042424 [0,1,0,0,0,0|1,0,2]=4 1385 B14R1.2172 CC(C)CNc1c(cccc1CO)Cl 34a_100012182729_100000210624 [0,1,0,0,0,0|3,0,0]=4 1386 B14R1.2172 CC(C)CNc1c(cccc1CO)F 34a_100000692437_100000210624 [0,1,0,0,0,0|3,0,0]=4 1387 B14R1.2172 CC(C)COc1c(cccc1C#N)Br 34a_100009817103_100000210624 [0,1,0,0,0,0|2,0,1]=4 1388 B14R1.2172 CC(C)COc1c(cccc1C#N)Cl 34a_100009866432_100000210624 [0,1,0,0,0,0|2,0,1]=4 1389 B14R1.2172 CC(C)COc1c(cccc1C#N)Cl 7a_100009866432_100000210760 [0,1,0,0,0,0|2,0,1]=4 1390 B14R1.2172 CC(C)COc1c(cccc1C#N)F 34a_100000117915_100000210624 [0,1,0,0,0,0|2,0,1]=4 1391 B14R1.2172 CC(C)COc1c(cccc1C#N)F 7a_100000117915_100000210760 [0,1,0,0,0,0|2,0,1]=4 1392 B14R1.2172 CC(C)COc1c(cccc1CO)F 34a_100011997349_100000210624 [0,1,0,0,0,0|2,0,0]=3 1393 B14R1.2172 CC(C)COc1c(cccc1CO)F 7a_100011997349_100000210760 [0,1,0,0,0,0|2,0,0]=3 1394 B14R1.2172 CC(C)CSc1c(cccc1CN)F 62a_100000210624_100020638964 [0,1,0,0,0,0|2,1,0]=4 1395 B14R1.2172 CC(C)CSc1c(cccc1CN)F 62a_100020638964_100000210760 [0,1,0,0,0,0|2,1,0]=4 1396 B14R1.2172 CC(C)CSc1c(cccc1CO)Br 62a_100000210624_100010146604 [0,1,0,0,0,0|2,1,0]=4 1397 B14R1.2172 CC(C)CSc1c(cccc1CO)Br 62a_100010146604_100000210760 [0,1,0,0,0,0|2,1,0]=4 1398 B14R1.2172 CC(C)CSc1c(cccc1CO)F 62a_100000210624_100012351117 [0,1,0,0,0,0|2,1,0]=4 1399 B14R1.2172 CC(C)CSc1c(cccc1CO)F 62a_100012351117_100000210760 [0,1,0,0,0,0|2,1,0]=4 1400 B14R1.2172 CC(O)CNc1c(cccc1CO)Cl 34a_100012182729_100011218427 [0,1,0,0,0,0|3,0,0]=4 1401 B14R1.2172 CC(O)CNc1c(cccc1CO)F 34a_100000692437_100011218427 [0,1,0,0,0,0|3,0,0]=4 1402 B14R1.2172 CC(O)COc1c(cccc1C#N)Br 34a_100009817103_100011218427 [0,1,0,0,0,0|2,0,1]=4 1403 B14R1.2172 CC(O)COc1c(cccc1C#N)Cl 34a_100009866432_100011218427 [0,1,0,0,0,0|2,0,1]=4 1404 B14R1.2172 CC(O)COc1c(cccc1C#N)Cl 7a_100009866432_100011218427 [0,1,0,0,0,0|2,0,1]=4 1405 B14R1.2172 CC(O)COc1c(cccc1C#N)F 34a_100000117915_100011218427 [0,1,0,0,0,0|2,0,1]=4 1406 B14R1.2172 CC(O)COc1c(cccc1C#N)F 7a_100000117915_100011218427 [0,1,0,0,0,0|2,0,1]=4 1407 B14R1.2172 CC(O)COc1c(cccc1CO)F 34a_100011997349_100011218427 [0,1,0,0,0,0|2,0,0]=3 1408 B14R1.2172 CC(O)COc1c(cccc1CO)F 7a_100011997349_100011218427 [0,1,0,0,0,0|2,0,0]=3 1409 B14R1.2172 CC(O)CSc1c(cccc1CN)F 62a_100011218427_100020638964 [0,1,0,0,0,0|2,1,0]=4 1410 B14R1.2172 CC(O)CSc1c(cccc1CN)F 62a_100020638964_100011218427 [0,1,0,0,0,0|2,1,0]=4 1411 B14R1.2172 CC(O)CSc1c(cccc1CO)Br 62a_100010146604_100011218427 [0,1,0,0,0,0|2,1,0]=4 1412 B14R1.2172 CC(O)CSc1c(cccc1CO)Br 62a_100011218427_100010146604 [0,1,0,0,0,0|2,1,0]=4 1413 B14R1.2172 CC(O)CSc1c(cccc1CO)F 62a_100011218427_100012351117 [0,1,0,0,0,0|2,1,0]=4 1414 B14R1.2172 CC(O)CSc1c(cccc1CO)F 62a_100012351117_100011218427 [0,1,0,0,0,0|2,1,0]=4 1415 B14R1.2172 CCc1cccc(c1C=CC(C)C)C 271570a_100016257149_100000036235 [0,1,0,0,0,0|2,0,1]=4 1416 B14R1.2172 CCc1cccc(c1C=CC(C)O)C 271570a_200011019289_100000036235 [0,1,0,0,0,0|2,0,1]=4 1417 B14R1.2172 CCc1cccc(c1NCC(=O)N)C 2230a_100000210048_100000747473 [0,1,0,0,0,0|2,0,1]=4 1418 B14R1.2172 CCc1cccc(c1NCC(=O)N)C 34a_100000210048_100000187820 [0,1,0,0,0,0|2,0,1]=4 1419 B14R1.2172 CCc1cccc(c1NCC(=O)N)C 7a_100000210048_100000187820 [0,1,0,0,0,0|2,0,1]=4 1420 B14R1.2172 CCc1cccc(c1NCC(C)C)C 2230a_100000210048_100000210760 [0,1,0,0,0,0|2,0,0]=3 1421 B14R1.2172 CCc1cccc(c1NCC(C)C)C 34a_100000210048_100000210624 [0,1,0,0,0,0|2,0,0]=3 1422 B14R1.2172 CCc1cccc(c1NCC(C)C)C 7a_100000210048_100000210760 [0,1,0,0,0,0|2,0,0]=3 1423 B14R1.2172 CCc1cccc(c1NCC(C)O)C 2230a_100000210048_100011218427 [0,1,0,0,0,0|2,0,0]=3 1424 B14R1.2172 CCc1cccc(c1NCC(C)O)C 34a_100000210048_100011218427 [0,1,0,0,0,0|2,0,0]=3 1425 B14R1.2172 CCc1cccc(c1NCC(C)O)C 7a_100000210048_100011218427 [0,1,0,0,0,0|2,0,0]=3 1426 B14R1.2172 CCc1cccc(c1NCC(F)F)C 2230a_100000210048_100011934356 [0,1,0,0,0,0|3,0,0]=4 1427 B14R1.2172 CCc1cccc(c1NCC(F)F)C 34a_100000210048_100011934356 [0,1,0,0,0,0|3,0,0]=4 1428 B14R1.2172 CCc1cccc(c1NCC(F)F)C 7a_100000210048_100011934356 [0,1,0,0,0,0|3,0,0]=4 1429 B14R1.2172 CCc1cccc(c1NC[C@@H](C)O)C 2230a_100000210048_100009817552 [0,1,0,0,0,0|2,0,0]=3 1430 B14R1.2172 CCc1cccc(c1NC[C@@H](C)O)C 34a_100000210048_100009817552 [0,1,0,0,0,0|2,0,0]=3 1431 B14R1.2172 CCc1cccc(c1NC[C@@H](C)O)C 7a_100000210048_100009817552 [0,1,0,0,0,0|2,0,0]=3 1432 B14R1.2172 CCc1cccc(c1OCC(=O)N)Br 34a_200010001580_100000187820 [0,1,0,0,0,0|2,0,1]=4 1433 B14R1.2172 CCc1cccc(c1OCC(=O)N)Br 7a_200010001580_100000187820 [0,1,0,0,0,0|2,0,1]=4 1434 B14R1.2172 CCc1cccc(c1OCC(=O)N)C 34a_100000034007_100000187820 [0,1,0,0,0,0|1,0,1]=3 1435 B14R1.2172 CCc1cccc(c1OCC(=O)N)C 7a_100000034007_100000187820 [0,1,0,0,0,0|1,0,1]=3 1436 B14R1.2172 CCc1cccc(c1OCC(=O)[O-])C 34a_100000034007_100020667443 [0,1,0,0,0,0|2,0,1]=4 1437 B14R1.2172 CCc1cccc(c1OCC(C)C)Br 34a_200010001580_100000210624 [0,1,0,0,0,0|2,0,0]=3 1438 B14R1.2172 CCc1cccc(c1OCC(C)C)Br 7a_200010001580_100000210760 [0,1,0,0,0,0|2,0,0]=3 1439 B14R1.2172 CCc1cccc(c1OCC(C)C)C 34a_100000034007_100000210624 [0,1,0,0,0,0|1,0,0]=2 1440 B14R1.2172 CCc1cccc(c1OCC(C)C)C 7a_100000034007_100000210760 [0,1,0,0,0,0|1,0,0]=2 1441 B14R1.2172 CCc1cccc(c1OCC(C)O)Br 34a_200010001580_100011218427 [0,1,0,0,0,0|2,0,0]=3 1442 B14R1.2172 CCc1cccc(c1OCC(C)O)Br 7a_200010001580_100011218427 [0,1,0,0,0,0|2,0,0]=3 1443 B14R1.2172 CCc1cccc(c1OCC(C)O)C 34a_100000034007_100011218427 [0,1,0,0,0,0|1,0,0]=2 1444 B14R1.2172 CCc1cccc(c1OCC(C)O)C 7a_100000034007_100011218427 [0,1,0,0,0,0|1,0,0]=2 1445 B14R1.2172 CCc1cccc(c1OCC(F)F)Br 34a_200010001580_100011934356 [0,1,0,0,0,0|3,0,0]=4 1446 B14R1.2172 CCc1cccc(c1OCC(F)F)Br 7a_200010001580_100011934356 [0,1,0,0,0,0|3,0,0]=4 1447 B14R1.2172 CCc1cccc(c1OCC(F)F)C 34a_100000034007_100011934356 [0,1,0,0,0,0|2,0,0]=3 1448 B14R1.2172 CCc1cccc(c1OCC(F)F)C 7a_100000034007_100011934356 [0,1,0,0,0,0|2,0,0]=3 1449 B14R1.2172 CCc1cccc(c1OC[C@@H](C)O)Br 34a_200010001580_100009817552 [0,1,0,0,0,0|2,0,0]=3 1450 B14R1.2172 CCc1cccc(c1OC[C@@H](C)O)Br 7a_200010001580_100009817552 [0,1,0,0,0,0|2,0,0]=3 1451 B14R1.2172 CCc1cccc(c1OC[C@@H](C)O)C 34a_100000034007_100009817552 [0,1,0,0,0,0|1,0,0]=2 1452 B14R1.2172 CCc1cccc(c1OC[C@@H](C)O)C 7a_100000034007_100009817552 [0,1,0,0,0,0|1,0,0]=2 1453 B14R1.2172 CCc1cccc(c1OC[N+](=O)[O-])C 34a_100000034007_100000761209 [0,1,0,0,0,0|3,0,0]=4 1454 B14R1.2172 CCc1cccc(c1SCC(=O)N)C 62a_100000036235_100000747473 [0,1,0,0,0,0|1,1,1]=4 1455 B14R1.2172 CCc1cccc(c1SCC(=O)N)C 62a_100000747473_100000036235 [0,1,0,0,0,0|1,1,1]=4 1456 B14R1.2172 CCc1cccc(c1SCC(C)C)C 62a_100000036235_100000210760 [0,1,0,0,0,0|1,1,0]=3 1457 B14R1.2172 CCc1cccc(c1SCC(C)C)C 62a_100000210624_100000036235 [0,1,0,0,0,0|1,1,0]=3 1458 B14R1.2172 CCc1cccc(c1SCC(C)O)C 62a_100000036235_100011218427 [0,1,0,0,0,0|1,1,0]=3 1459 B14R1.2172 CCc1cccc(c1SCC(C)O)C 62a_100011218427_100000036235 [0,1,0,0,0,0|1,1,0]=3 1460 B14R1.2172 CCc1cccc(c1SCC(F)F)C 62a_100000036235_100011934356 [0,1,0,0,0,0|2,1,0]=4 1461 B14R1.2172 CCc1cccc(c1SCC(F)F)C 62a_100011934356_100000036235 [0,1,0,0,0,0|2,1,0]=4 1462 B14R1.2172 CCc1cccc(c1SC[C@@H](C)O)C 62a_100000036235_100009817552 [0,1,0,0,0,0|1,1,0]=3 1463 B14R1.2172 CCc1cccc(c1SC[C@@H](C)O)C 62a_100009817552_100000036235 [0,1,0,0,0,0|1,1,0]=3 1464 B14R1.2172 CCc1occc(=O)c1OCC(C)C 34a_100000033269_100000210624 [0,1,0,0,0,0|3,0,0]=4 1465 B14R1.2172 CCc1occc(=O)c1OCC(C)O 34a_100000033269_100011218427 [0,1,0,0,0,0|3,0,0]=4 1466 B14R1.2172 CCc1occc(=O)c1OC[C@@H](C)O 34a_100000033269_100009817552 [0,1,0,0,0,0|3,0,0]=4 1467 B14R1.2172 COc1cccc(c1CNC(C)C)C 207a_100138425928_100000050978 [0,1,0,0,0,0|3,0,0]=4 1468 B14R1.2172 COc1cccc(c1NCC(=O)N)C 2230a_100000758225_100000747473 [0,1,0,0,0,0|2,0,1]=4 1469 B14R1.2172 COc1cccc(c1NCC(=O)N)C 34a_100000758225_100000187820 [0,1,0,0,0,0|2,0,1]=4 1470 B14R1.2172 COc1cccc(c1NCC(C)C)Br 34a_100000708083_100000210624 [0,1,0,0,0,0|3,0,0]=4 1471 B14R1.2172 COc1cccc(c1NCC(C)C)C 2230a_100000758225_100000210760 [0,1,0,0,0,0|2,0,0]=3 1472 B14R1.2172 COc1cccc(c1NCC(C)C)C 34a_100000758225_100000210624 [0,1,0,0,0,0|2,0,0]=3 1473 B14R1.2172 COc1cccc(c1NCC(C)C)Cl 34a_100011309317_100000210624 [0,1,0,0,0,0|3,0,0]=4 1474 B14R1.2172 COc1cccc(c1NCC(C)C)F 34a_100000686744_100000210624 [0,1,0,0,0,0|3,0,0]=4 1475 B14R1.2172 COc1cccc(c1NCC(C)C)O 34a_100012022766_100000210624 [0,1,0,0,0,0|3,0,0]=4 1476 B14R1.2172 COc1cccc(c1NCC(C)O)Br 34a_100000708083_100011218427 [0,1,0,0,0,0|3,0,0]=4 1477 B14R1.2172 COc1cccc(c1NCC(C)O)C 2230a_100000758225_100011218427 [0,1,0,0,0,0|2,0,0]=3 1478 B14R1.2172 COc1cccc(c1NCC(C)O)C 34a_100000758225_100011218427 [0,1,0,0,0,0|2,0,0]=3 1479 B14R1.2172 COc1cccc(c1NCC(C)O)Cl 34a_100011309317_100011218427 [0,1,0,0,0,0|3,0,0]=4 1480 B14R1.2172 COc1cccc(c1NCC(C)O)F 34a_100000686744_100011218427 [0,1,0,0,0,0|3,0,0]=4 1481 B14R1.2172 COc1cccc(c1NCC(C)O)O 34a_100012022766_100011218427 [0,1,0,0,0,0|3,0,0]=4 1482 B14R1.2172 COc1cccc(c1NCC(F)F)C 2230a_100000758225_100011934356 [0,1,0,0,0,0|3,0,0]=4 1483 B14R1.2172 COc1cccc(c1NCC(F)F)C 34a_100000758225_100011934356 [0,1,0,0,0,0|3,0,0]=4 1484 B14R1.2172 COc1cccc(c1NC[C@@H](C)O)Br 34a_100000708083_100009817552 [0,1,0,0,0,0|3,0,0]=4 1485 B14R1.2172 COc1cccc(c1NC[C@@H](C)O)C 2230a_100000758225_100009817552 [0,1,0,0,0,0|2,0,0]=3 1486 B14R1.2172 COc1cccc(c1NC[C@@H](C)O)C 34a_100000758225_100009817552 [0,1,0,0,0,0|2,0,0]=3 1487 B14R1.2172 COc1cccc(c1NC[C@@H](C)O)Cl 34a_100011309317_100009817552 [0,1,0,0,0,0|3,0,0]=4 1488 B14R1.2172 COc1cccc(c1NC[C@@H](C)O)F 34a_100000686744_100009817552 [0,1,0,0,0,0|3,0,0]=4 1489 B14R1.2172 COc1cccc(c1NC[C@@H](C)O)O 34a_100012022766_100009817552 [0,1,0,0,0,0|3,0,0]=4 1490 B14R1.2172 COc1cccc(c1OCC(=O)N)Br 34a_100000686866_100000187820 [0,1,0,0,0,0|2,0,1]=4 1491 B14R1.2172 COc1cccc(c1OCC(=O)N)C 34a_100011219253_100000187820 [0,1,0,0,0,0|1,0,1]=3 1492 B14R1.2172 COc1cccc(c1OCC(=O)N)C 7a_100011219253_100000187820 [0,1,0,0,0,0|1,0,1]=3 1493 B14R1.2172 COc1cccc(c1OCC(=O)N)Cl 34a_100009851661_100000187820 [0,1,0,0,0,0|2,0,1]=4 1494 B14R1.2172 COc1cccc(c1OCC(=O)N)Cl 7a_100009851661_100000187820 [0,1,0,0,0,0|2,0,1]=4 1495 B14R1.2172 COc1cccc(c1OCC(=O)N)F 34a_100000036725_100000187820 [0,1,0,0,0,0|2,0,1]=4 1496 B14R1.2172 COc1cccc(c1OCC(=O)N)F 7a_100000036725_100000187820 [0,1,0,0,0,0|2,0,1]=4 1497 B14R1.2172 COc1cccc(c1OCC(=O)N)N 34a_100000123586_100000187820 [0,1,0,0,0,0|2,0,1]=4 1498 B14R1.2172 COc1cccc(c1OCC(=O)[O-])C 34a_100011219253_100020667443 [0,1,0,0,0,0|2,0,1]=4 1499 B14R1.2172 COc1cccc(c1OCC(C)C)Br 34a_100000686866_100000210624 [0,1,0,0,0,0|2,0,0]=3 1500 B14R1.2172 COc1cccc(c1OCC(C)C)C 34a_100011219253_100000210624 [0,1,0,0,0,0|1,0,0]=2 1501 B14R1.2172 COc1cccc(c1OCC(C)C)C 7a_100011219253_100000210760 [0,1,0,0,0,0|1,0,0]=2 1502 B14R1.2172 COc1cccc(c1OCC(C)C)Cl 34a_100009851661_100000210624 [0,1,0,0,0,0|2,0,0]=3 1503 B14R1.2172 COc1cccc(c1OCC(C)C)Cl 7a_100009851661_100000210760 [0,1,0,0,0,0|2,0,0]=3 1504 B14R1.2172 COc1cccc(c1OCC(C)C)F 34a_100000036725_100000210624 [0,1,0,0,0,0|2,0,0]=3 1505 B14R1.2172 COc1cccc(c1OCC(C)C)F 7a_100000036725_100000210760 [0,1,0,0,0,0|2,0,0]=3 1506 B14R1.2172 COc1cccc(c1OCC(C)C)N 34a_100000123586_100000210624 [0,1,0,0,0,0|2,0,0]=3 1507 B14R1.2172 COc1cccc(c1OCC(C)O)Br 34a_100000686866_100011218427 [0,1,0,0,0,0|2,0,0]=3 1508 B14R1.2172 COc1cccc(c1OCC(C)O)C 34a_100011219253_100011218427 [0,1,0,0,0,0|1,0,0]=2 1509 B14R1.2172 COc1cccc(c1OCC(C)O)C 7a_100011219253_100011218427 [0,1,0,0,0,0|1,0,0]=2 1510 B14R1.2172 COc1cccc(c1OCC(C)O)Cl 34a_100009851661_100011218427 [0,1,0,0,0,0|2,0,0]=3 1511 B14R1.2172 COc1cccc(c1OCC(C)O)Cl 7a_100009851661_100011218427 [0,1,0,0,0,0|2,0,0]=3 1512 B14R1.2172 COc1cccc(c1OCC(C)O)F 34a_100000036725_100011218427 [0,1,0,0,0,0|2,0,0]=3 1513 B14R1.2172 COc1cccc(c1OCC(C)O)F 7a_100000036725_100011218427 [0,1,0,0,0,0|2,0,0]=3 1514 B14R1.2172 COc1cccc(c1OCC(C)O)N 34a_100000123586_100011218427 [0,1,0,0,0,0|2,0,0]=3 1515 B14R1.2172 COc1cccc(c1OCC(F)F)Br 34a_100000686866_100011934356 [0,1,0,0,0,0|3,0,0]=4 1516 B14R1.2172 COc1cccc(c1OCC(F)F)C 34a_100011219253_100011934356 [0,1,0,0,0,0|2,0,0]=3 1517 B14R1.2172 COc1cccc(c1OCC(F)F)C 7a_100011219253_100011934356 [0,1,0,0,0,0|2,0,0]=3 1518 B14R1.2172 COc1cccc(c1OCC(F)F)Cl 34a_100009851661_100011934356 [0,1,0,0,0,0|3,0,0]=4 1519 B14R1.2172 COc1cccc(c1OCC(F)F)Cl 7a_100009851661_100011934356 [0,1,0,0,0,0|3,0,0]=4 1520 B14R1.2172 COc1cccc(c1OCC(F)F)F 34a_100000036725_100011934356 [0,1,0,0,0,0|3,0,0]=4 1521 B14R1.2172 COc1cccc(c1OCC(F)F)F 7a_100000036725_100011934356 [0,1,0,0,0,0|3,0,0]=4 1522 B14R1.2172 COc1cccc(c1OCC(F)F)N 34a_100000123586_100011934356 [0,1,0,0,0,0|3,0,0]=4 1523 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)Br 34a_100000686866_100009817552 [0,1,0,0,0,0|2,0,0]=3 1524 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)C 34a_100011219253_100009817552 [0,1,0,0,0,0|1,0,0]=2 1525 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)C 7a_100011219253_100009817552 [0,1,0,0,0,0|1,0,0]=2 1526 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)Cl 34a_100009851661_100009817552 [0,1,0,0,0,0|2,0,0]=3 1527 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)Cl 7a_100009851661_100009817552 [0,1,0,0,0,0|2,0,0]=3 1528 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)F 34a_100000036725_100009817552 [0,1,0,0,0,0|2,0,0]=3 1529 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)F 7a_100000036725_100009817552 [0,1,0,0,0,0|2,0,0]=3 1530 B14R1.2172 COc1cccc(c1OC[C@@H](C)O)N 34a_100000123586_100009817552 [0,1,0,0,0,0|2,0,0]=3 1531 B14R1.2172 COc1cccc(c1OC[N+](=O)[O-])C 34a_100011219253_100000761209 [0,1,0,0,0,0|3,0,0]=4 1532 B14R1.2172 COc1cccc(c1SCC(=O)N)C 62a_100000747473_100010191535 [0,1,0,0,0,0|1,1,1]=4 1533 B14R1.2172 COc1cccc(c1SCC(=O)N)C 62a_100010191535_100000747473 [0,1,0,0,0,0|1,1,1]=4 1534 B14R1.2172 COc1cccc(c1SCC(C)C)Br 62a_100000210624_100010131421 [0,1,0,0,0,0|2,1,0]=4 1535 B14R1.2172 COc1cccc(c1SCC(C)C)Br 62a_100010131421_100000210760 [0,1,0,0,0,0|2,1,0]=4 1536 B14R1.2172 COc1cccc(c1SCC(C)C)C 62a_100000210624_100010191535 [0,1,0,0,0,0|1,1,0]=3 1537 B14R1.2172 COc1cccc(c1SCC(C)C)C 62a_100010191535_100000210760 [0,1,0,0,0,0|1,1,0]=3 1538 B14R1.2172 COc1cccc(c1SCC(C)C)F 62a_100000210624_100000703912 [0,1,0,0,0,0|2,1,0]=4 1539 B14R1.2172 COc1cccc(c1SCC(C)C)F 62a_100000703912_100000210760 [0,1,0,0,0,0|2,1,0]=4 1540 B14R1.2172 COc1cccc(c1SCC(C)C)N 62a_100000210624_100000703447 [0,1,0,0,0,0|2,1,0]=4 1541 B14R1.2172 COc1cccc(c1SCC(C)C)N 62a_100000703447_100000210760 [0,1,0,0,0,0|2,1,0]=4 1542 B14R1.2172 COc1cccc(c1SCC(C)C)O 62a_100000210624_100010202623 [0,1,0,0,0,0|2,1,0]=4 1543 B14R1.2172 COc1cccc(c1SCC(C)O)Br 62a_100010131421_100011218427 [0,1,0,0,0,0|2,1,0]=4 1544 B14R1.2172 COc1cccc(c1SCC(C)O)Br 62a_100011218427_100010131421 [0,1,0,0,0,0|2,1,0]=4 1545 B14R1.2172 COc1cccc(c1SCC(C)O)C 62a_100010191535_100011218427 [0,1,0,0,0,0|1,1,0]=3 1546 B14R1.2172 COc1cccc(c1SCC(C)O)C 62a_100011218427_100010191535 [0,1,0,0,0,0|1,1,0]=3 1547 B14R1.2172 COc1cccc(c1SCC(C)O)F 62a_100000703912_100011218427 [0,1,0,0,0,0|2,1,0]=4 1548 B14R1.2172 COc1cccc(c1SCC(C)O)F 62a_100011218427_100000703912 [0,1,0,0,0,0|2,1,0]=4 1549 B14R1.2172 COc1cccc(c1SCC(C)O)N 62a_100000703447_100011218427 [0,1,0,0,0,0|2,1,0]=4 1550 B14R1.2172 COc1cccc(c1SCC(C)O)N 62a_100011218427_100000703447 [0,1,0,0,0,0|2,1,0]=4 1551 B14R1.2172 COc1cccc(c1SCC(C)O)O 62a_100011218427_100010202623 [0,1,0,0,0,0|2,1,0]=4 1552 B14R1.2172 COc1cccc(c1SCC(F)F)C 62a_100010191535_100011934356 [0,1,0,0,0,0|2,1,0]=4 1553 B14R1.2172 COc1cccc(c1SCC(F)F)C 62a_100011934356_100010191535 [0,1,0,0,0,0|2,1,0]=4 1554 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)Br 62a_100009817552_100010131421 [0,1,0,0,0,0|2,1,0]=4 1555 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)Br 62a_100010131421_100009817552 [0,1,0,0,0,0|2,1,0]=4 1556 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)C 62a_100009817552_100010191535 [0,1,0,0,0,0|1,1,0]=3 1557 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)C 62a_100010191535_100009817552 [0,1,0,0,0,0|1,1,0]=3 1558 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)F 62a_100000703912_100009817552 [0,1,0,0,0,0|2,1,0]=4 1559 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)F 62a_100009817552_100000703912 [0,1,0,0,0,0|2,1,0]=4 1560 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)N 62a_100000703447_100009817552 [0,1,0,0,0,0|2,1,0]=4 1561 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)N 62a_100009817552_100000703447 [0,1,0,0,0,0|2,1,0]=4 1562 B14R1.2172 COc1cccc(c1SC[C@@H](C)O)O 62a_100009817552_100010202623 [0,1,0,0,0,0|2,1,0]=4 1563 B14R1.2172 COc1nccc(c1SCC(C)C)C 62a_100000210624_100012353928 [0,1,0,0,0,0|2,1,0]=4 1564 B14R1.2172 COc1nccc(c1SCC(C)C)C 62a_100012353928_100000210760 [0,1,0,0,0,0|2,1,0]=4 1565 B14R1.2172 COc1nccc(c1SCC(C)O)C 62a_100011218427_100012353928 [0,1,0,0,0,0|2,1,0]=4 1566 B14R1.2172 COc1nccc(c1SCC(C)O)C 62a_100012353928_100011218427 [0,1,0,0,0,0|2,1,0]=4 1567 B14R1.2172 COc1nccc(c1SC[C@@H](C)O)C 62a_100009817552_100012353928 [0,1,0,0,0,0|2,1,0]=4 1568 B14R1.2172 COc1nccc(c1SC[C@@H](C)O)C 62a_100012353928_100009817552 [0,1,0,0,0,0|2,1,0]=4 1569 B14R1.2172 C[C@@H](O)CNc1c(cccc1CO)Cl 34a_100012182729_100009817552 [0,1,0,0,0,0|3,0,0]=4 1570 B14R1.2172 C[C@@H](O)CNc1c(cccc1CO)F 34a_100000692437_100009817552 [0,1,0,0,0,0|3,0,0]=4 1571 B14R1.2172 C[C@@H](O)COc1c(cccc1C#N)Br 34a_100009817103_100009817552 [0,1,0,0,0,0|2,0,1]=4 1572 B14R1.2172 C[C@@H](O)COc1c(cccc1C#N)Cl 34a_100009866432_100009817552 [0,1,0,0,0,0|2,0,1]=4 1573 B14R1.2172 C[C@@H](O)COc1c(cccc1C#N)Cl 7a_100009866432_100009817552 [0,1,0,0,0,0|2,0,1]=4 1574 B14R1.2172 C[C@@H](O)COc1c(cccc1C#N)F 34a_100000117915_100009817552 [0,1,0,0,0,0|2,0,1]=4 1575 B14R1.2172 C[C@@H](O)COc1c(cccc1C#N)F 7a_100000117915_100009817552 [0,1,0,0,0,0|2,0,1]=4 1576 B14R1.2172 C[C@@H](O)COc1c(cccc1CO)F 34a_100011997349_100009817552 [0,1,0,0,0,0|2,0,0]=3 1577 B14R1.2172 C[C@@H](O)COc1c(cccc1CO)F 7a_100011997349_100009817552 [0,1,0,0,0,0|2,0,0]=3 1578 B14R1.2172 C[C@@H](O)CSc1c(cccc1CN)F 62a_100009817552_100020638964 [0,1,0,0,0,0|2,1,0]=4 1579 B14R1.2172 C[C@@H](O)CSc1c(cccc1CN)F 62a_100020638964_100009817552 [0,1,0,0,0,0|2,1,0]=4 1580 B14R1.2172 C[C@@H](O)CSc1c(cccc1CO)Br 62a_100009817552_100010146604 [0,1,0,0,0,0|2,1,0]=4 1581 B14R1.2172 C[C@@H](O)CSc1c(cccc1CO)Br 62a_100010146604_100009817552 [0,1,0,0,0,0|2,1,0]=4 1582 B14R1.2172 C[C@@H](O)CSc1c(cccc1CO)F 62a_100009817552_100012351117 [0,1,0,0,0,0|2,1,0]=4 1583 B14R1.2172 C[C@@H](O)CSc1c(cccc1CO)F 62a_100012351117_100009817552 [0,1,0,0,0,0|2,1,0]=4 1584 B14R1.2172 Cc1cccc(c1C=CC(C)C)CO 271570a_100016257149_100011659289 [0,1,0,0,0,0|2,0,1]=4 1585 B14R1.2172 Cc1cccc(c1C=CC(C)O)CO 271570a_200011019289_100011659289 [0,1,0,0,0,0|2,0,1]=4 1586 B14R1.2172 Cc1cccc(c1NCC(=O)N)CO 34a_100011215590_100000187820 [0,1,0,0,0,0|2,0,1]=4 1587 B14R1.2172 Cc1cccc(c1NCC(C)C)C#N 2230a_100011826843_100000210760 [0,1,0,0,0,0|2,0,1]=4 1588 B14R1.2172 Cc1cccc(c1NCC(C)C)CO 34a_100011215590_100000210624 [0,1,0,0,0,0|2,0,0]=3 1589 B14R1.2172 Cc1cccc(c1NCC(C)O)C#N 2230a_100011826843_100011218427 [0,1,0,0,0,0|2,0,1]=4 1590 B14R1.2172 Cc1cccc(c1NCC(C)O)CO 34a_100011215590_100011218427 [0,1,0,0,0,0|2,0,0]=3 1591 B14R1.2172 Cc1cccc(c1NCC(F)F)CO 34a_100011215590_100011934356 [0,1,0,0,0,0|3,0,0]=4 1592 B14R1.2172 Cc1cccc(c1NC[C@@H](C)O)C#N 2230a_100011826843_100009817552 [0,1,0,0,0,0|2,0,1]=4 1593 B14R1.2172 Cc1cccc(c1NC[C@@H](C)O)CO 34a_100011215590_100009817552 [0,1,0,0,0,0|2,0,0]=3 1594 B14R1.2172 Cc1cccc(c1OCC(=O)N)C#N 34a_100011659161_100000187820 [0,1,0,0,0,0|1,0,2]=4 1595 B14R1.2172 Cc1cccc(c1OCC(=O)N)C#N 7a_100011659161_100000187820 [0,1,0,0,0,0|1,0,2]=4 1596 B14R1.2172 Cc1cccc(c1OCC(=O)N)CN 34a_100020639391_100000187820 [0,1,0,0,0,0|1,0,1]=3 1597 B14R1.2172 Cc1cccc(c1OCC(=O)[O-])CN 34a_100020639391_100020667443 [0,1,0,0,0,0|2,0,1]=4 1598 B14R1.2172 Cc1cccc(c1OCC(C)C)C#N 34a_100011659161_100000210624 [0,1,0,0,0,0|1,0,1]=3 1599 B14R1.2172 Cc1cccc(c1OCC(C)C)C#N 7a_100011659161_100000210760 [0,1,0,0,0,0|1,0,1]=3 1600 B14R1.2172 Cc1cccc(c1OCC(C)C)CN 34a_100020639391_100000210624 [0,1,0,0,0,0|1,0,0]=2 1601 B14R1.2172 Cc1cccc(c1OCC(C)O)C#N 34a_100011659161_100011218427 [0,1,0,0,0,0|1,0,1]=3 1602 B14R1.2172 Cc1cccc(c1OCC(C)O)C#N 7a_100011659161_100011218427 [0,1,0,0,0,0|1,0,1]=3 1603 B14R1.2172 Cc1cccc(c1OCC(C)O)CN 34a_100020639391_100011218427 [0,1,0,0,0,0|1,0,0]=2 1604 B14R1.2172 Cc1cccc(c1OCC(F)F)C#N 34a_100011659161_100011934356 [0,1,0,0,0,0|2,0,1]=4 1605 B14R1.2172 Cc1cccc(c1OCC(F)F)C#N 7a_100011659161_100011934356 [0,1,0,0,0,0|2,0,1]=4 1606 B14R1.2172 Cc1cccc(c1OCC(F)F)CN 34a_100020639391_100011934356 [0,1,0,0,0,0|2,0,0]=3 1607 B14R1.2172 Cc1cccc(c1OC[C@@H](C)O)C#N 34a_100011659161_100009817552 [0,1,0,0,0,0|1,0,1]=3 1608 B14R1.2172 Cc1cccc(c1OC[C@@H](C)O)C#N 7a_100011659161_100009817552 [0,1,0,0,0,0|1,0,1]=3 1609 B14R1.2172 Cc1cccc(c1OC[C@@H](C)O)CN 34a_100020639391_100009817552 [0,1,0,0,0,0|1,0,0]=2 1610 B14R1.2172 Cc1cccc(c1OC[N+](=O)[O-])CN 34a_100020639391_100000761209 [0,1,0,0,0,0|3,0,0]=4 1611 B14R1.2172 Cc1cccc(c1SCC(=O)N)CO 62a_100000747473_100011659289 [0,1,0,0,0,0|1,1,1]=4 1612 B14R1.2172 Cc1cccc(c1SCC(=O)N)CO 62a_100011659289_100000747473 [0,1,0,0,0,0|1,1,1]=4 1613 B14R1.2172 Cc1cccc(c1SCC(C)C)C#N 62a_100000210624_100011934862 [0,1,0,0,0,0|1,1,1]=4 1614 B14R1.2172 Cc1cccc(c1SCC(C)C)C=O 62a_100000210624_100012186367 [0,1,0,0,0,0|1,1,1]=4 1615 B14R1.2172 Cc1cccc(c1SCC(C)C)C=O 62a_100012186367_100000210760 [0,1,0,0,0,0|1,1,1]=4 1616 B14R1.2172 Cc1cccc(c1SCC(C)C)CO 62a_100000210624_100011659289 [0,1,0,0,0,0|1,1,0]=3 1617 B14R1.2172 Cc1cccc(c1SCC(C)C)CO 62a_100011659289_100000210760 [0,1,0,0,0,0|1,1,0]=3 1618 B14R1.2172 Cc1cccc(c1SCC(C)O)C#N 62a_100011218427_100011934862 [0,1,0,0,0,0|1,1,1]=4 1619 B14R1.2172 Cc1cccc(c1SCC(C)O)C=O 62a_100011218427_100012186367 [0,1,0,0,0,0|1,1,1]=4 1620 B14R1.2172 Cc1cccc(c1SCC(C)O)C=O 62a_100012186367_100011218427 [0,1,0,0,0,0|1,1,1]=4 1621 B14R1.2172 Cc1cccc(c1SCC(C)O)CO 62a_100011218427_100011659289 [0,1,0,0,0,0|1,1,0]=3 1622 B14R1.2172 Cc1cccc(c1SCC(C)O)CO 62a_100011659289_100011218427 [0,1,0,0,0,0|1,1,0]=3 1623 B14R1.2172 Cc1cccc(c1SCC(F)F)CO 62a_100011659289_100011934356 [0,1,0,0,0,0|2,1,0]=4 1624 B14R1.2172 Cc1cccc(c1SCC(F)F)CO 62a_100011934356_100011659289 [0,1,0,0,0,0|2,1,0]=4 1625 B14R1.2172 Cc1cccc(c1SC[C@@H](C)O)C#N 62a_100009817552_100011934862 [0,1,0,0,0,0|1,1,1]=4 1626 B14R1.2172 Cc1cccc(c1SC[C@@H](C)O)C=O 62a_100009817552_100012186367 [0,1,0,0,0,0|1,1,1]=4 1627 B14R1.2172 Cc1cccc(c1SC[C@@H](C)O)C=O 62a_100012186367_100009817552 [0,1,0,0,0,0|1,1,1]=4 1628 B14R1.2172 Cc1cccc(c1SC[C@@H](C)O)CO 62a_100009817552_100011659289 [0,1,0,0,0,0|1,1,0]=3 1629 B14R1.2172 Cc1cccc(c1SC[C@@H](C)O)CO 62a_100011659289_100009817552 [0,1,0,0,0,0|1,1,0]=3 1630 B14R1.2172 NC(=O)COc1c(cccc1CO)F 34a_100011997349_100000187820 [0,1,0,0,0,0|2,0,1]=4 1631 B14R1.2172 NC(=O)COc1c(cccc1CO)F 7a_100011997349_100000187820 [0,1,0,0,0,0|2,0,1]=4 1632 B14R1.2172 OCc1cccc(c1OCC(F)F)F 34a_100011997349_100011934356 [0,1,0,0,0,0|3,0,0]=4 1633 B14R1.2172 OCc1cccc(c1OCC(F)F)F 7a_100011997349_100011934356 [0,1,0,0,0,0|3,0,0]=4 1634 B14R1.3152 C=C(C)CNc1c(cc(cc1C)Br)C 34a_100000737279_100000748629 [0,1,0,0,0,0|2,0,1]=4 1635 B14R1.3152 C=C(C)CNc1c(cc(cc1C)Br)C 7a_100000737279_100000748629 [0,1,0,0,0,0|2,0,1]=4 1636 B14R1.3152 C=C(C)CNc1c(cc(cc1C)C)C 34a_100000210045_100000748629 [0,1,0,0,0,0|2,0,1]=4 1637 B14R1.3152 C=C(C)CNc1c(cc(cc1C)C)C 7a_100000210045_100000748629 [0,1,0,0,0,0|2,0,1]=4 1638 B14R1.3152 C=C(C)CNc1c(cc(cc1C)Cl)C 34a_100000692879_100000748629 [0,1,0,0,0,0|2,0,1]=4 1639 B14R1.3152 C=C(C)CNc1c(cc(cc1C)Cl)C 7a_100000692879_100000748629 [0,1,0,0,0,0|2,0,1]=4 1640 B14R1.3152 C=C(C)CNc1c(cc(cc1C)F)C 34a_100011290887_100000748629 [0,1,0,0,0,0|2,0,1]=4 1641 B14R1.3152 C=C(C)CNc1c(cc(cc1C)F)C 7a_100011290887_100000748629 [0,1,0,0,0,0|2,0,1]=4 1642 B14R1.3152 C=C(C)CNc1c(cc(cc1C)I)C 7a_100011356821_100000748629 [0,1,0,0,0,0|2,0,1]=4 1643 B14R1.3152 C=C(C)CNc1c(cc(cc1C)O)C 34a_100011934200_100000748629 [0,1,0,0,0,0|2,0,1]=4 1644 B14R1.3152 C=C(C)COc1c(cc(cc1Br)Br)C 34a_100000186369_100000748629 [0,1,0,0,0,0|2,0,1]=4 1645 B14R1.3152 C=C(C)COc1c(cc(cc1Br)Br)C 7a_100000186369_100000748629 [0,1,0,0,0,0|2,0,1]=4 1646 B14R1.3152 C=C(C)COc1c(cc(cc1Br)C)C 34a_100011934984_100000748629 [0,1,0,0,0,0|2,0,1]=4 1647 B14R1.3152 C=C(C)COc1c(cc(cc1Br)C)C 7a_100011934984_100000748629 [0,1,0,0,0,0|2,0,1]=4 1648 B14R1.3152 C=C(C)COc1c(cc(cc1Br)Cl)C 34a_100012337756_100000748629 [0,1,0,0,0,0|2,0,1]=4 1649 B14R1.3152 C=C(C)COc1c(cc(cc1Br)Cl)C 7a_100012337756_100000748629 [0,1,0,0,0,0|2,0,1]=4 1650 B14R1.3152 C=C(C)COc1c(cc(cc1Br)I)C 34a_100010982682_100000748629 [0,1,0,0,0,0|2,0,1]=4 1651 B14R1.3152 C=C(C)COc1c(cc(cc1Br)I)C 7a_100010982682_100000748629 [0,1,0,0,0,0|2,0,1]=4 1652 B14R1.3152 C=C(C)COc1c(cc(cc1Br)N)C 34a_100010064301_100000748629 [0,1,0,0,0,0|2,0,1]=4 1653 B14R1.3152 C=C(C)COc1c(cc(cc1Br)N)C 7a_100010064301_100000748629 [0,1,0,0,0,0|2,0,1]=4 1654 B14R1.3152 C=C(C)COc1c(cc(cc1C)Br)C 34a_100000187306_100000748629 [0,1,0,0,0,0|1,0,1]=3 1655 B14R1.3152 C=C(C)COc1c(cc(cc1C)Br)C 7a_100000187306_100000748629 [0,1,0,0,0,0|1,0,1]=3 1656 B14R1.3152 C=C(C)COc1c(cc(cc1C)C)C 34a_100000212074_100000748629 [0,1,0,0,0,0|1,0,1]=3 1657 B14R1.3152 C=C(C)COc1c(cc(cc1C)C)C 7a_100000212074_100000748629 [0,1,0,0,0,0|1,0,1]=3 1658 B14R1.3152 C=C(C)COc1c(cc(cc1C)Cl)C 34a_100000211519_100000748629 [0,1,0,0,0,0|1,0,1]=3 1659 B14R1.3152 C=C(C)COc1c(cc(cc1C)Cl)C 7a_100000211519_100000748629 [0,1,0,0,0,0|1,0,1]=3 1660 B14R1.3152 C=C(C)COc1c(cc(cc1C)F)C 34a_100000081862_100000748629 [0,1,0,0,0,0|1,0,1]=3 1661 B14R1.3152 C=C(C)COc1c(cc(cc1C)F)C 7a_100000081862_100000748629 [0,1,0,0,0,0|1,0,1]=3 1662 B14R1.3152 C=C(C)COc1c(cc(cc1C)I)C 34a_100011216129_100000748629 [0,1,0,0,0,0|1,0,1]=3 1663 B14R1.3152 C=C(C)COc1c(cc(cc1C)I)C 7a_100011216129_100000748629 [0,1,0,0,0,0|1,0,1]=3 1664 B14R1.3152 C=C(C)COc1c(cc(cc1C)N)C 34a_100000703291_100000748629 [0,1,0,0,0,0|1,0,1]=3 1665 B14R1.3152 C=C(C)COc1c(cc(cc1C)N)C 7a_100000703291_100000748629 [0,1,0,0,0,0|1,0,1]=3 1666 B14R1.3152 C=C(C)COc1c(cc(cc1Cl)Br)C 34a_100000211485_100000748629 [0,1,0,0,0,0|2,0,1]=4 1667 B14R1.3152 C=C(C)COc1c(cc(cc1Cl)Br)C 7a_100000211485_100000748629 [0,1,0,0,0,0|2,0,1]=4 1668 B14R1.3152 C=C(C)COc1c(cc(cc1Cl)Cl)C 34a_100011218458_100000748629 [0,1,0,0,0,0|2,0,1]=4 1669 B14R1.3152 C=C(C)COc1c(cc(cc1Cl)Cl)C 7a_100011218458_100000748629 [0,1,0,0,0,0|2,0,1]=4 1670 B14R1.3152 C=C(C)COc1c(cc(cc1Cl)I)C 34a_200015900153_100000748629 [0,1,0,0,0,0|2,0,1]=4 1671 B14R1.3152 C=C(C)COc1c(cc(cc1Cl)I)C 7a_200015900153_100000748629 [0,1,0,0,0,0|2,0,1]=4 1672 B14R1.3152 C=C(C)COc1c(cc(cc1I)Cl)C 34a_100012343667_100000748629 [0,1,0,0,0,0|2,0,1]=4 1673 B14R1.3152 C=C(C)COc1c(cc(cc1I)Cl)C 7a_100012343667_100000748629 [0,1,0,0,0,0|2,0,1]=4 1674 B14R1.3152 C=C(C)COc1c(cc(cc1N)Br)C 34a_100011825904_100000748629 [0,1,0,0,0,0|2,0,1]=4 1675 B14R1.3152 C=C(C)COc1c(cc(cc1N)Br)C 7a_100011825904_100000748629 [0,1,0,0,0,0|2,0,1]=4 1676 B14R1.3152 C=C(C)COc1c(cc(cc1N)C)C 34a_100011216242_100000748629 [0,1,0,0,0,0|2,0,1]=4 1677 B14R1.3152 C=C(C)COc1c(cc(cc1N)C)C 7a_100011216242_100000748629 [0,1,0,0,0,0|2,0,1]=4 1678 B14R1.3152 C=C(C)COc1c(cc(cc1N)F)C 34a_100000130126_100000748629 [0,1,0,0,0,0|2,0,1]=4 1679 B14R1.3152 C=C(C)COc1c(cc(cc1N)F)C 7a_100000130126_100000748629 [0,1,0,0,0,0|2,0,1]=4 1680 B14R1.3152 C=C(C)CSc1c(cc(cc1C)Br)C 62a_100000748629_100009814048 [0,1,0,0,0,0|1,1,1]=4 1681 B14R1.3152 C=C(C)CSc1c(cc(cc1C)Br)C 62a_100009814048_100000211660 [0,1,0,0,0,0|1,1,1]=4 1682 B14R1.3152 C=C(C)CSc1c(cc(cc1C)C)C 62a_100000748629_100011204320 [0,1,0,0,0,0|1,1,1]=4 1683 B14R1.3152 C=C(C)CSc1c(cc(cc1C)C)C 62a_100011204320_100000211660 [0,1,0,0,0,0|1,1,1]=4 1684 B14R1.3152 C=C(C)CSc1c(cc(cc1C)Cl)C 62a_100000748629_100010244930 [0,1,0,0,0,0|1,1,1]=4 1685 B14R1.3152 C=C(C)CSc1c(cc(cc1C)Cl)C 62a_100010244930_100000211660 [0,1,0,0,0,0|1,1,1]=4 1686 B14R1.3152 C=C(C)CSc1c(cc(cc1C)F)C 62a_100000748629_100012356666 [0,1,0,0,0,0|1,1,1]=4 1687 B14R1.3152 C=C(C)CSc1c(cc(cc1C)F)C 62a_100012356666_100000211660 [0,1,0,0,0,0|1,1,1]=4 1688 B14R1.3152 C=C(C)CSc1c(cc(cc1C)N)C 62a_100000215964_100000211660 [0,1,0,0,0,0|1,1,1]=4 1689 B14R1.3152 C=C(C)CSc1c(cc(cc1C)N)C 62a_100000748629_100000215964 [0,1,0,0,0,0|1,1,1]=4 1690 B14R1.3152 C=C(C)CSc1c(cc(cc1C)O)C 62a_100000243743_100000211660 [0,1,0,0,0,0|1,1,1]=4 1691 B14R1.3152 C=C(C)CSc1c(cc(cc1C)O)C 62a_100000748629_100000243743 [0,1,0,0,0,0|1,1,1]=4 1692 B14R1.3152 C=C(F)COc1c(cc(cc1C)Br)C 34a_100000187306_100009893438 [0,1,0,0,0,0|1,0,2]=4 1693 B14R1.3152 C=C(F)COc1c(cc(cc1C)Br)C 7a_100000187306_100000042424 [0,1,0,0,0,0|1,0,2]=4 1694 B14R1.3152 C=C(F)COc1c(cc(cc1C)C)C 34a_100000212074_100009893438 [0,1,0,0,0,0|1,0,2]=4 1695 B14R1.3152 C=C(F)COc1c(cc(cc1C)C)C 7a_100000212074_100000042424 [0,1,0,0,0,0|1,0,2]=4 1696 B14R1.3152 C=C(F)COc1c(cc(cc1C)Cl)C 34a_100000211519_100009893438 [0,1,0,0,0,0|1,0,2]=4 1697 B14R1.3152 C=C(F)COc1c(cc(cc1C)Cl)C 7a_100000211519_100000042424 [0,1,0,0,0,0|1,0,2]=4 1698 B14R1.3152 C=C(F)COc1c(cc(cc1C)F)C 34a_100000081862_100009893438 [0,1,0,0,0,0|1,0,2]=4 1699 B14R1.3152 C=C(F)COc1c(cc(cc1C)F)C 7a_100000081862_100000042424 [0,1,0,0,0,0|1,0,2]=4 1700 B14R1.3152 C=C(F)COc1c(cc(cc1C)I)C 34a_100011216129_100009893438 [0,1,0,0,0,0|1,0,2]=4 1701 B14R1.3152 C=C(F)COc1c(cc(cc1C)I)C 7a_100011216129_100000042424 [0,1,0,0,0,0|1,0,2]=4 1702 B14R1.3152 C=C(F)COc1c(cc(cc1C)N)C 34a_100000703291_100009893438 [0,1,0,0,0,0|1,0,2]=4 1703 B14R1.3152 C=C(F)COc1c(cc(cc1C)N)C 7a_100000703291_100000042424 [0,1,0,0,0,0|1,0,2]=4 1704 B14R1.3152 CC(=O)COc1c(cc(cc1C)Br)C 1458a_100009812269_200000210301 [0,1,0,0,0,0|1,0,1]=3 1705 B14R1.3152 CC(=O)COc1c(cc(cc1C)C)C 1458a_200000183695_200000210301 [0,1,0,0,0,0|1,0,1]=3 1706 B14R1.3152 CC(=O)COc1c(cc(cc1C)Cl)C 1458a_100000183735_200000210301 [0,1,0,0,0,0|1,0,1]=3 1707 B14R1.3152 CC(=O)COc1c(cc(cc1Cl)Br)C 1458a_100000179748_200000210301 [0,1,0,0,0,0|2,0,1]=4 1708 B14R1.3152 CC(=O)COc1c(cc(cc1Cl)C)C 1458a_200000013560_200000210301 [0,1,0,0,0,0|2,0,1]=4 1709 B14R1.3152 CC(=O)COc1c(cc(cc1Cl)Cl)C 1458a_100000013561_200000210301 [0,1,0,0,0,0|2,0,1]=4 1710 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)Br 34a_100000210219_100000210624 [0,1,0,0,0,0|3,0,0]=4 1711 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)Br 7a_100000210219_100000210760 [0,1,0,0,0,0|3,0,0]=4 1712 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)Cl 34a_100012337755_100000210624 [0,1,0,0,0,0|3,0,0]=4 1713 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)Cl 7a_100012337755_100000210760 [0,1,0,0,0,0|3,0,0]=4 1714 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)F 34a_100011216695_100000210624 [0,1,0,0,0,0|3,0,0]=4 1715 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)F 7a_100011216695_100000210760 [0,1,0,0,0,0|3,0,0]=4 1716 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)N 34a_100010781877_100000210624 [0,1,0,0,0,0|3,0,0]=4 1717 B14R1.3152 CC(C)COc1c(cc(cc1Br)Br)N 7a_100010781877_100000210760 [0,1,0,0,0,0|3,0,0]=4 1718 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)Br 34a_100012337757_100000210624 [0,1,0,0,0,0|3,0,0]=4 1719 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)Br 7a_100012337757_100000210760 [0,1,0,0,0,0|3,0,0]=4 1720 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)Cl 34a_200000243811_100000210624 [0,1,0,0,0,0|3,0,0]=4 1721 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100000210760 [0,1,0,0,0,0|3,0,0]=4 1722 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)F 34a_100011830412_100000210624 [0,1,0,0,0,0|3,0,0]=4 1723 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)F 7a_100011830412_100000210760 [0,1,0,0,0,0|3,0,0]=4 1724 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)N 34a_106741647128_100000210624 [0,1,0,0,0,0|3,0,0]=4 1725 B14R1.3152 CC(C)COc1c(cc(cc1Br)Cl)N 7a_106741647128_100000210760 [0,1,0,0,0,0|3,0,0]=4 1726 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)Br 34a_100011215434_100000210624 [0,1,0,0,0,0|3,0,0]=4 1727 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)Br 7a_100011215434_100000210760 [0,1,0,0,0,0|3,0,0]=4 1728 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)Cl 34a_100011830411_100000210624 [0,1,0,0,0,0|3,0,0]=4 1729 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)Cl 7a_100011830411_100000210760 [0,1,0,0,0,0|3,0,0]=4 1730 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)F 34a_100000688693_100000210624 [0,1,0,0,0,0|3,0,0]=4 1731 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)F 7a_100000688693_100000210760 [0,1,0,0,0,0|3,0,0]=4 1732 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)N 34a_200011217456_100000210624 [0,1,0,0,0,0|3,0,0]=4 1733 B14R1.3152 CC(C)COc1c(cc(cc1Br)F)N 7a_200011217456_100000210760 [0,1,0,0,0,0|3,0,0]=4 1734 B14R1.3152 CC(C)COc1c(cc(cc1Br)N)Br 34a_200000186426_100000210624 [0,1,0,0,0,0|3,0,0]=4 1735 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Br)Cl 34a_100000753780_100000210624 [0,1,0,0,0,0|3,0,0]=4 1736 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100000210760 [0,1,0,0,0,0|3,0,0]=4 1737 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Br)F 34a_100011216646_100000210624 [0,1,0,0,0,0|3,0,0]=4 1738 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Br)F 7a_100011216646_100000210760 [0,1,0,0,0,0|3,0,0]=4 1739 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Br)N 34a_100000694353_100000210624 [0,1,0,0,0,0|3,0,0]=4 1740 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Br)N 7a_100000694353_100000210760 [0,1,0,0,0,0|3,0,0]=4 1741 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Cl)Cl 34a_100000210218_100000210624 [0,1,0,0,0,0|3,0,0]=4 1742 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100000210760 [0,1,0,0,0,0|3,0,0]=4 1743 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Cl)N 34a_100000695819_100000210624 [0,1,0,0,0,0|3,0,0]=4 1744 B14R1.3152 CC(C)COc1c(cc(cc1Cl)Cl)N 7a_100000695819_100000210760 [0,1,0,0,0,0|3,0,0]=4 1745 B14R1.3152 CC(C)COc1c(cc(cc1Cl)F)Cl 34a_100011217724_100000210624 [0,1,0,0,0,0|3,0,0]=4 1746 B14R1.3152 CC(C)COc1c(cc(cc1Cl)F)Cl 7a_100011217724_100000210760 [0,1,0,0,0,0|3,0,0]=4 1747 B14R1.3152 CC(C)COc1c(cc(cc1Cl)F)F 34a_100011935252_100000210624 [0,1,0,0,0,0|3,0,0]=4 1748 B14R1.3152 CC(C)COc1c(cc(cc1Cl)F)F 7a_100011935252_100000210760 [0,1,0,0,0,0|3,0,0]=4 1749 B14R1.3152 CC(C)COc1c(cc(cc1Cl)I)Cl 7a_100012339652_100000210760 [0,1,0,0,0,0|3,0,0]=4 1750 B14R1.3152 CC(C)COc1c(cc(cc1Cl)N)Cl 34a_100000695418_100000210624 [0,1,0,0,0,0|3,0,0]=4 1751 B14R1.3152 CC(C)COc1c(cc(cc1Cl)N)Cl 7a_100000695418_100000210760 [0,1,0,0,0,0|3,0,0]=4 1752 B14R1.3152 CC(C)COc1c(cc(cc1F)Br)F 34a_100011216917_100000210624 [0,1,0,0,0,0|3,0,0]=4 1753 B14R1.3152 CC(C)COc1c(cc(cc1F)Br)F 7a_100011216917_100000210760 [0,1,0,0,0,0|3,0,0]=4 1754 B14R1.3152 CC(C)COc1c(cc(cc1F)Br)N 34a_100011217383_100000210624 [0,1,0,0,0,0|3,0,0]=4 1755 B14R1.3152 CC(C)COc1c(cc(cc1F)Br)N 7a_100011217383_100000210760 [0,1,0,0,0,0|3,0,0]=4 1756 B14R1.3152 CC(C)COc1c(cc(cc1F)Cl)F 34a_100011830429_100000210624 [0,1,0,0,0,0|3,0,0]=4 1757 B14R1.3152 CC(C)COc1c(cc(cc1F)Cl)F 7a_100011830429_100000210760 [0,1,0,0,0,0|3,0,0]=4 1758 B14R1.3152 CC(C)COc1c(cc(cc1F)F)F 34a_100011218396_100000210624 [0,1,0,0,0,0|3,0,0]=4 1759 B14R1.3152 CC(C)COc1c(cc(cc1F)F)F 7a_100011218396_100000210760 [0,1,0,0,0,0|3,0,0]=4 1760 B14R1.3152 CC(C)COc1c(cc(cc1F)F)N 34a_100015205836_100000210624 [0,1,0,0,0,0|3,0,0]=4 1761 B14R1.3152 CC(C)COc1c(cc(cc1F)F)N 7a_100015205836_100000210760 [0,1,0,0,0,0|3,0,0]=4 1762 B14R1.3152 CC(C)COc1c(cc(cc1F)I)F 34a_200011830255_100000210624 [0,1,0,0,0,0|3,0,0]=4 1763 B14R1.3152 CC(C)COc1c(cc(cc1F)I)F 7a_200011830255_100000210760 [0,1,0,0,0,0|3,0,0]=4 1764 B14R1.3152 CC(C)COc1c(cc(cc1F)N)F 34a_100016987357_100000210624 [0,1,0,0,0,0|3,0,0]=4 1765 B14R1.3152 CC(C)COc1c(cc(cc1F)N)F 7a_100016987357_100000210760 [0,1,0,0,0,0|3,0,0]=4 1766 B14R1.3152 CC(C)COc1c(cc(cc1I)Br)F 34a_100013354677_100000210624 [0,1,0,0,0,0|3,0,0]=4 1767 B14R1.3152 CC(C)COc1c(cc(cc1I)Br)F 7a_100013354677_100000210760 [0,1,0,0,0,0|3,0,0]=4 1768 B14R1.3152 CC(C)COc1c(cc(cc1I)Br)I 7a_100009997433_100000210760 [0,1,0,0,0,0|3,0,0]=4 1769 B14R1.3152 CC(C)COc1c(cc(cc1I)Br)N 7a_100016071998_100000210760 [0,1,0,0,0,0|3,0,0]=4 1770 B14R1.3152 CC(C)COc1c(cc(cc1I)Cl)Cl 34a_200012339341_100000210624 [0,1,0,0,0,0|3,0,0]=4 1771 B14R1.3152 CC(C)COc1c(cc(cc1I)Cl)Cl 7a_200012339341_100000210760 [0,1,0,0,0,0|3,0,0]=4 1772 B14R1.3152 CC(C)COc1c(cc(cc1I)Cl)I 7a_100000730656_100000210760 [0,1,0,0,0,0|3,0,0]=4 1773 B14R1.3152 CC(C)COc1c(cc(cc1I)F)Br 34a_200013085147_100000210624 [0,1,0,0,0,0|3,0,0]=4 1774 B14R1.3152 CC(C)COc1c(cc(cc1I)F)Br 7a_200013085147_100000210760 [0,1,0,0,0,0|3,0,0]=4 1775 B14R1.3152 CC(C)COc1c(cc(cc1I)F)F 34a_200013204775_100000210624 [0,1,0,0,0,0|3,0,0]=4 1776 B14R1.3152 CC(C)COc1c(cc(cc1I)F)F 7a_200013204775_100000210760 [0,1,0,0,0,0|3,0,0]=4 1777 B14R1.3152 CC(C)COc1c(cc(cc1I)I)Cl 7a_100009997439_100000210760 [0,1,0,0,0,0|3,0,0]=4 1778 B14R1.3152 CC(C)COc1c(cc(cc1I)I)I 7a_100000210296_100000210760 [0,1,0,0,0,0|3,0,0]=4 1779 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)Br 34a_100000210219_100011218427 [0,1,0,0,0,0|3,0,0]=4 1780 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)Br 7a_100000210219_100011218427 [0,1,0,0,0,0|3,0,0]=4 1781 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)Cl 34a_100012337755_100011218427 [0,1,0,0,0,0|3,0,0]=4 1782 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)Cl 7a_100012337755_100011218427 [0,1,0,0,0,0|3,0,0]=4 1783 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)F 34a_100011216695_100011218427 [0,1,0,0,0,0|3,0,0]=4 1784 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)F 7a_100011216695_100011218427 [0,1,0,0,0,0|3,0,0]=4 1785 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)N 34a_100010781877_100011218427 [0,1,0,0,0,0|3,0,0]=4 1786 B14R1.3152 CC(O)COc1c(cc(cc1Br)Br)N 7a_100010781877_100011218427 [0,1,0,0,0,0|3,0,0]=4 1787 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)Br 34a_100012337757_100011218427 [0,1,0,0,0,0|3,0,0]=4 1788 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)Br 7a_100012337757_100011218427 [0,1,0,0,0,0|3,0,0]=4 1789 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)Cl 34a_200000243811_100011218427 [0,1,0,0,0,0|3,0,0]=4 1790 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100011218427 [0,1,0,0,0,0|3,0,0]=4 1791 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)F 34a_100011830412_100011218427 [0,1,0,0,0,0|3,0,0]=4 1792 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)F 7a_100011830412_100011218427 [0,1,0,0,0,0|3,0,0]=4 1793 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)N 34a_106741647128_100011218427 [0,1,0,0,0,0|3,0,0]=4 1794 B14R1.3152 CC(O)COc1c(cc(cc1Br)Cl)N 7a_106741647128_100011218427 [0,1,0,0,0,0|3,0,0]=4 1795 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)Br 34a_100011215434_100011218427 [0,1,0,0,0,0|3,0,0]=4 1796 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)Br 7a_100011215434_100011218427 [0,1,0,0,0,0|3,0,0]=4 1797 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)Cl 34a_100011830411_100011218427 [0,1,0,0,0,0|3,0,0]=4 1798 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)Cl 7a_100011830411_100011218427 [0,1,0,0,0,0|3,0,0]=4 1799 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)F 34a_100000688693_100011218427 [0,1,0,0,0,0|3,0,0]=4 1800 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)F 7a_100000688693_100011218427 [0,1,0,0,0,0|3,0,0]=4 1801 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)N 34a_200011217456_100011218427 [0,1,0,0,0,0|3,0,0]=4 1802 B14R1.3152 CC(O)COc1c(cc(cc1Br)F)N 7a_200011217456_100011218427 [0,1,0,0,0,0|3,0,0]=4 1803 B14R1.3152 CC(O)COc1c(cc(cc1Br)N)Br 34a_200000186426_100011218427 [0,1,0,0,0,0|3,0,0]=4 1804 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Br)Cl 34a_100000753780_100011218427 [0,1,0,0,0,0|3,0,0]=4 1805 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100011218427 [0,1,0,0,0,0|3,0,0]=4 1806 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Br)F 34a_100011216646_100011218427 [0,1,0,0,0,0|3,0,0]=4 1807 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Br)F 7a_100011216646_100011218427 [0,1,0,0,0,0|3,0,0]=4 1808 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Br)N 34a_100000694353_100011218427 [0,1,0,0,0,0|3,0,0]=4 1809 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Br)N 7a_100000694353_100011218427 [0,1,0,0,0,0|3,0,0]=4 1810 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Cl)Cl 34a_100000210218_100011218427 [0,1,0,0,0,0|3,0,0]=4 1811 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100011218427 [0,1,0,0,0,0|3,0,0]=4 1812 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Cl)N 34a_100000695819_100011218427 [0,1,0,0,0,0|3,0,0]=4 1813 B14R1.3152 CC(O)COc1c(cc(cc1Cl)Cl)N 7a_100000695819_100011218427 [0,1,0,0,0,0|3,0,0]=4 1814 B14R1.3152 CC(O)COc1c(cc(cc1Cl)F)Cl 34a_100011217724_100011218427 [0,1,0,0,0,0|3,0,0]=4 1815 B14R1.3152 CC(O)COc1c(cc(cc1Cl)F)Cl 7a_100011217724_100011218427 [0,1,0,0,0,0|3,0,0]=4 1816 B14R1.3152 CC(O)COc1c(cc(cc1Cl)F)F 34a_100011935252_100011218427 [0,1,0,0,0,0|3,0,0]=4 1817 B14R1.3152 CC(O)COc1c(cc(cc1Cl)F)F 7a_100011935252_100011218427 [0,1,0,0,0,0|3,0,0]=4 1818 B14R1.3152 CC(O)COc1c(cc(cc1Cl)I)Cl 7a_100012339652_100011218427 [0,1,0,0,0,0|3,0,0]=4 1819 B14R1.3152 CC(O)COc1c(cc(cc1Cl)N)Cl 34a_100000695418_100011218427 [0,1,0,0,0,0|3,0,0]=4 1820 B14R1.3152 CC(O)COc1c(cc(cc1Cl)N)Cl 7a_100000695418_100011218427 [0,1,0,0,0,0|3,0,0]=4 1821 B14R1.3152 CC(O)COc1c(cc(cc1F)Br)F 34a_100011216917_100011218427 [0,1,0,0,0,0|3,0,0]=4 1822 B14R1.3152 CC(O)COc1c(cc(cc1F)Br)F 7a_100011216917_100011218427 [0,1,0,0,0,0|3,0,0]=4 1823 B14R1.3152 CC(O)COc1c(cc(cc1F)Br)N 34a_100011217383_100011218427 [0,1,0,0,0,0|3,0,0]=4 1824 B14R1.3152 CC(O)COc1c(cc(cc1F)Br)N 7a_100011217383_100011218427 [0,1,0,0,0,0|3,0,0]=4 1825 B14R1.3152 CC(O)COc1c(cc(cc1F)Cl)F 34a_100011830429_100011218427 [0,1,0,0,0,0|3,0,0]=4 1826 B14R1.3152 CC(O)COc1c(cc(cc1F)Cl)F 7a_100011830429_100011218427 [0,1,0,0,0,0|3,0,0]=4 1827 B14R1.3152 CC(O)COc1c(cc(cc1F)F)F 34a_100011218396_100011218427 [0,1,0,0,0,0|3,0,0]=4 1828 B14R1.3152 CC(O)COc1c(cc(cc1F)F)F 7a_100011218396_100011218427 [0,1,0,0,0,0|3,0,0]=4 1829 B14R1.3152 CC(O)COc1c(cc(cc1F)F)N 34a_100015205836_100011218427 [0,1,0,0,0,0|3,0,0]=4 1830 B14R1.3152 CC(O)COc1c(cc(cc1F)F)N 7a_100015205836_100011218427 [0,1,0,0,0,0|3,0,0]=4 1831 B14R1.3152 CC(O)COc1c(cc(cc1F)I)F 34a_200011830255_100011218427 [0,1,0,0,0,0|3,0,0]=4 1832 B14R1.3152 CC(O)COc1c(cc(cc1F)I)F 7a_200011830255_100011218427 [0,1,0,0,0,0|3,0,0]=4 1833 B14R1.3152 CC(O)COc1c(cc(cc1F)N)F 34a_100016987357_100011218427 [0,1,0,0,0,0|3,0,0]=4 1834 B14R1.3152 CC(O)COc1c(cc(cc1F)N)F 7a_100016987357_100011218427 [0,1,0,0,0,0|3,0,0]=4 1835 B14R1.3152 CC(O)COc1c(cc(cc1I)Br)F 34a_100013354677_100011218427 [0,1,0,0,0,0|3,0,0]=4 1836 B14R1.3152 CC(O)COc1c(cc(cc1I)Br)F 7a_100013354677_100011218427 [0,1,0,0,0,0|3,0,0]=4 1837 B14R1.3152 CC(O)COc1c(cc(cc1I)Br)I 7a_100009997433_100011218427 [0,1,0,0,0,0|3,0,0]=4 1838 B14R1.3152 CC(O)COc1c(cc(cc1I)Br)N 7a_100016071998_100011218427 [0,1,0,0,0,0|3,0,0]=4 1839 B14R1.3152 CC(O)COc1c(cc(cc1I)Cl)Cl 34a_200012339341_100011218427 [0,1,0,0,0,0|3,0,0]=4 1840 B14R1.3152 CC(O)COc1c(cc(cc1I)Cl)Cl 7a_200012339341_100011218427 [0,1,0,0,0,0|3,0,0]=4 1841 B14R1.3152 CC(O)COc1c(cc(cc1I)Cl)I 7a_100000730656_100011218427 [0,1,0,0,0,0|3,0,0]=4 1842 B14R1.3152 CC(O)COc1c(cc(cc1I)F)Br 34a_200013085147_100011218427 [0,1,0,0,0,0|3,0,0]=4 1843 B14R1.3152 CC(O)COc1c(cc(cc1I)F)Br 7a_200013085147_100011218427 [0,1,0,0,0,0|3,0,0]=4 1844 B14R1.3152 CC(O)COc1c(cc(cc1I)F)F 34a_200013204775_100011218427 [0,1,0,0,0,0|3,0,0]=4 1845 B14R1.3152 CC(O)COc1c(cc(cc1I)F)F 7a_200013204775_100011218427 [0,1,0,0,0,0|3,0,0]=4 1846 B14R1.3152 CC(O)COc1c(cc(cc1I)I)Cl 7a_100009997439_100011218427 [0,1,0,0,0,0|3,0,0]=4 1847 B14R1.3152 CC(O)COc1c(cc(cc1I)I)I 7a_100000210296_100011218427 [0,1,0,0,0,0|3,0,0]=4 1848 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)Br 34a_100000210219_100009817552 [0,1,0,0,0,0|3,0,0]=4 1849 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)Br 7a_100000210219_100009817552 [0,1,0,0,0,0|3,0,0]=4 1850 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)Cl 34a_100012337755_100009817552 [0,1,0,0,0,0|3,0,0]=4 1851 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)Cl 7a_100012337755_100009817552 [0,1,0,0,0,0|3,0,0]=4 1852 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)F 34a_100011216695_100009817552 [0,1,0,0,0,0|3,0,0]=4 1853 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)F 7a_100011216695_100009817552 [0,1,0,0,0,0|3,0,0]=4 1854 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)N 34a_100010781877_100009817552 [0,1,0,0,0,0|3,0,0]=4 1855 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Br)N 7a_100010781877_100009817552 [0,1,0,0,0,0|3,0,0]=4 1856 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)Br 34a_100012337757_100009817552 [0,1,0,0,0,0|3,0,0]=4 1857 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)Br 7a_100012337757_100009817552 [0,1,0,0,0,0|3,0,0]=4 1858 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)Cl 34a_200000243811_100009817552 [0,1,0,0,0,0|3,0,0]=4 1859 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100009817552 [0,1,0,0,0,0|3,0,0]=4 1860 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)F 34a_100011830412_100009817552 [0,1,0,0,0,0|3,0,0]=4 1861 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)F 7a_100011830412_100009817552 [0,1,0,0,0,0|3,0,0]=4 1862 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)N 34a_106741647128_100009817552 [0,1,0,0,0,0|3,0,0]=4 1863 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)Cl)N 7a_106741647128_100009817552 [0,1,0,0,0,0|3,0,0]=4 1864 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)Br 34a_100011215434_100009817552 [0,1,0,0,0,0|3,0,0]=4 1865 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)Br 7a_100011215434_100009817552 [0,1,0,0,0,0|3,0,0]=4 1866 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)Cl 34a_100011830411_100009817552 [0,1,0,0,0,0|3,0,0]=4 1867 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)Cl 7a_100011830411_100009817552 [0,1,0,0,0,0|3,0,0]=4 1868 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)F 34a_100000688693_100009817552 [0,1,0,0,0,0|3,0,0]=4 1869 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)F 7a_100000688693_100009817552 [0,1,0,0,0,0|3,0,0]=4 1870 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)N 34a_200011217456_100009817552 [0,1,0,0,0,0|3,0,0]=4 1871 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)F)N 7a_200011217456_100009817552 [0,1,0,0,0,0|3,0,0]=4 1872 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Br)N)Br 34a_200000186426_100009817552 [0,1,0,0,0,0|3,0,0]=4 1873 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Br)Cl 34a_100000753780_100009817552 [0,1,0,0,0,0|3,0,0]=4 1874 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100009817552 [0,1,0,0,0,0|3,0,0]=4 1875 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Br)F 34a_100011216646_100009817552 [0,1,0,0,0,0|3,0,0]=4 1876 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Br)F 7a_100011216646_100009817552 [0,1,0,0,0,0|3,0,0]=4 1877 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Br)N 34a_100000694353_100009817552 [0,1,0,0,0,0|3,0,0]=4 1878 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Br)N 7a_100000694353_100009817552 [0,1,0,0,0,0|3,0,0]=4 1879 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Cl)Cl 34a_100000210218_100009817552 [0,1,0,0,0,0|3,0,0]=4 1880 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100009817552 [0,1,0,0,0,0|3,0,0]=4 1881 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Cl)N 34a_100000695819_100009817552 [0,1,0,0,0,0|3,0,0]=4 1882 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)Cl)N 7a_100000695819_100009817552 [0,1,0,0,0,0|3,0,0]=4 1883 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)F)Cl 34a_100011217724_100009817552 [0,1,0,0,0,0|3,0,0]=4 1884 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)F)Cl 7a_100011217724_100009817552 [0,1,0,0,0,0|3,0,0]=4 1885 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)F)F 34a_100011935252_100009817552 [0,1,0,0,0,0|3,0,0]=4 1886 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)F)F 7a_100011935252_100009817552 [0,1,0,0,0,0|3,0,0]=4 1887 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)I)Cl 7a_100012339652_100009817552 [0,1,0,0,0,0|3,0,0]=4 1888 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)N)Cl 34a_100000695418_100009817552 [0,1,0,0,0,0|3,0,0]=4 1889 B14R1.3152 C[C@@H](O)COc1c(cc(cc1Cl)N)Cl 7a_100000695418_100009817552 [0,1,0,0,0,0|3,0,0]=4 1890 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)Br)F 34a_100011216917_100009817552 [0,1,0,0,0,0|3,0,0]=4 1891 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)Br)F 7a_100011216917_100009817552 [0,1,0,0,0,0|3,0,0]=4 1892 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)Br)N 34a_100011217383_100009817552 [0,1,0,0,0,0|3,0,0]=4 1893 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)Br)N 7a_100011217383_100009817552 [0,1,0,0,0,0|3,0,0]=4 1894 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)Cl)F 34a_100011830429_100009817552 [0,1,0,0,0,0|3,0,0]=4 1895 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)Cl)F 7a_100011830429_100009817552 [0,1,0,0,0,0|3,0,0]=4 1896 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)F)F 34a_100011218396_100009817552 [0,1,0,0,0,0|3,0,0]=4 1897 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)F)F 7a_100011218396_100009817552 [0,1,0,0,0,0|3,0,0]=4 1898 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)F)N 34a_100015205836_100009817552 [0,1,0,0,0,0|3,0,0]=4 1899 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)F)N 7a_100015205836_100009817552 [0,1,0,0,0,0|3,0,0]=4 1900 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)I)F 34a_200011830255_100009817552 [0,1,0,0,0,0|3,0,0]=4 1901 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)I)F 7a_200011830255_100009817552 [0,1,0,0,0,0|3,0,0]=4 1902 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)N)F 34a_100016987357_100009817552 [0,1,0,0,0,0|3,0,0]=4 1903 B14R1.3152 C[C@@H](O)COc1c(cc(cc1F)N)F 7a_100016987357_100009817552 [0,1,0,0,0,0|3,0,0]=4 1904 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)Br)F 34a_100013354677_100009817552 [0,1,0,0,0,0|3,0,0]=4 1905 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)Br)F 7a_100013354677_100009817552 [0,1,0,0,0,0|3,0,0]=4 1906 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)Br)I 7a_100009997433_100009817552 [0,1,0,0,0,0|3,0,0]=4 1907 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)Br)N 7a_100016071998_100009817552 [0,1,0,0,0,0|3,0,0]=4 1908 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)Cl)Cl 34a_200012339341_100009817552 [0,1,0,0,0,0|3,0,0]=4 1909 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)Cl)Cl 7a_200012339341_100009817552 [0,1,0,0,0,0|3,0,0]=4 1910 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)Cl)I 7a_100000730656_100009817552 [0,1,0,0,0,0|3,0,0]=4 1911 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)F)Br 34a_200013085147_100009817552 [0,1,0,0,0,0|3,0,0]=4 1912 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)F)Br 7a_200013085147_100009817552 [0,1,0,0,0,0|3,0,0]=4 1913 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)F)F 34a_200013204775_100009817552 [0,1,0,0,0,0|3,0,0]=4 1914 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)F)F 7a_200013204775_100009817552 [0,1,0,0,0,0|3,0,0]=4 1915 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)I)Cl 7a_100009997439_100009817552 [0,1,0,0,0,0|3,0,0]=4 1916 B14R1.3152 C[C@@H](O)COc1c(cc(cc1I)I)I 7a_100000210296_100009817552 [0,1,0,0,0,0|3,0,0]=4 1917 B14R1.3152 Cc1cc(c(c(c1)Br)NCC(C)C)C 34a_100000688863_100000210624 [0,1,0,0,0,0|3,0,0]=4 1918 B14R1.3152 Cc1cc(c(c(c1)Br)NCC(C)O)C 34a_100000688863_100011218427 [0,1,0,0,0,0|3,0,0]=4 1919 B14R1.3152 Cc1cc(c(c(c1)Br)NC[C@@H](C)O)C 34a_100000688863_100009817552 [0,1,0,0,0,0|3,0,0]=4 1920 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(=O)N)C 34a_100011934984_100000187820 [0,1,0,0,0,0|2,0,1]=4 1921 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(=O)N)C 7a_100011934984_100000187820 [0,1,0,0,0,0|2,0,1]=4 1922 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)C)Br 34a_100000203795_100000210624 [0,1,0,0,0,0|3,0,0]=4 1923 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)C)Br 7a_100000203795_100000210760 [0,1,0,0,0,0|3,0,0]=4 1924 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)C)C 34a_100011934984_100000210624 [0,1,0,0,0,0|2,0,0]=3 1925 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)C)C 7a_100011934984_100000210760 [0,1,0,0,0,0|2,0,0]=3 1926 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)C)F 34a_200010713133_100000210624 [0,1,0,0,0,0|3,0,0]=4 1927 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)C)F 7a_200010713133_100000210760 [0,1,0,0,0,0|3,0,0]=4 1928 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)O)Br 34a_100000203795_100011218427 [0,1,0,0,0,0|3,0,0]=4 1929 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)O)Br 7a_100000203795_100011218427 [0,1,0,0,0,0|3,0,0]=4 1930 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)O)C 34a_100011934984_100011218427 [0,1,0,0,0,0|2,0,0]=3 1931 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)O)C 7a_100011934984_100011218427 [0,1,0,0,0,0|2,0,0]=3 1932 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)O)F 34a_200010713133_100011218427 [0,1,0,0,0,0|3,0,0]=4 1933 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(C)O)F 7a_200010713133_100011218427 [0,1,0,0,0,0|3,0,0]=4 1934 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(F)F)C 34a_100011934984_100011934356 [0,1,0,0,0,0|3,0,0]=4 1935 B14R1.3152 Cc1cc(c(c(c1)Br)OCC(F)F)C 7a_100011934984_100011934356 [0,1,0,0,0,0|3,0,0]=4 1936 B14R1.3152 Cc1cc(c(c(c1)Br)OC[C@@H](C)O)Br 34a_100000203795_100009817552 [0,1,0,0,0,0|3,0,0]=4 1937 B14R1.3152 Cc1cc(c(c(c1)Br)OC[C@@H](C)O)Br 7a_100000203795_100009817552 [0,1,0,0,0,0|3,0,0]=4 1938 B14R1.3152 Cc1cc(c(c(c1)Br)OC[C@@H](C)O)C 34a_100011934984_100009817552 [0,1,0,0,0,0|2,0,0]=3 1939 B14R1.3152 Cc1cc(c(c(c1)Br)OC[C@@H](C)O)C 7a_100011934984_100009817552 [0,1,0,0,0,0|2,0,0]=3 1940 B14R1.3152 Cc1cc(c(c(c1)Br)OC[C@@H](C)O)F 34a_200010713133_100009817552 [0,1,0,0,0,0|3,0,0]=4 1941 B14R1.3152 Cc1cc(c(c(c1)Br)OC[C@@H](C)O)F 7a_200010713133_100009817552 [0,1,0,0,0,0|3,0,0]=4 1942 B14R1.3152 Cc1cc(c(c(c1)Br)SCC(C)C)C 62a_100000210624_200012353697 [0,1,0,0,0,0|2,1,0]=4 1943 B14R1.3152 Cc1cc(c(c(c1)Br)SCC(C)C)C 62a_200012353697_100000210760 [0,1,0,0,0,0|2,1,0]=4 1944 B14R1.3152 Cc1cc(c(c(c1)Br)SCC(C)O)C 62a_100011218427_200012353697 [0,1,0,0,0,0|2,1,0]=4 1945 B14R1.3152 Cc1cc(c(c(c1)Br)SCC(C)O)C 62a_200012353697_100011218427 [0,1,0,0,0,0|2,1,0]=4 1946 B14R1.3152 Cc1cc(c(c(c1)Br)SC[C@@H](C)O)C 62a_100009817552_200012353697 [0,1,0,0,0,0|2,1,0]=4 1947 B14R1.3152 Cc1cc(c(c(c1)Br)SC[C@@H](C)O)C 62a_200012353697_100009817552 [0,1,0,0,0,0|2,1,0]=4 1948 B14R1.3152 Cc1cc(c(c(c1)C)C=CC(C)C)C 271570a_100016257149_100011204320 [0,1,0,0,0,0|2,0,1]=4 1949 B14R1.3152 Cc1cc(c(c(c1)C)C=CC(C)O)C 271570a_200011019289_100011204320 [0,1,0,0,0,0|2,0,1]=4 1950 B14R1.3152 Cc1cc(c(c(c1)C)CNC(C)C)C 207a_100138425928_100000211105 [0,1,0,0,0,0|3,0,0]=4 1951 B14R1.3152 Cc1cc(c(c(c1)C)CNC(C)C)C 2230a_100000737526_100000210206 [0,1,0,0,0,0|3,0,0]=4 1952 B14R1.3152 Cc1cc(c(c(c1)C)CNC(C)C)C 2230a_100138425928_100000749405 [0,1,0,0,0,0|3,0,0]=4 1953 B14R1.3152 Cc1cc(c(c(c1)C)CNC(C)C)C 34a_100000737526_100000210206 [0,1,0,0,0,0|3,0,0]=4 1954 B14R1.3152 Cc1cc(c(c(c1)C)CNC(C)C)C 34a_100138425928_100000749405 [0,1,0,0,0,0|3,0,0]=4 1955 B14R1.3152 Cc1cc(c(c(c1)C)COC(C)C)C 34a_100000212225_100000749405 [0,1,0,0,0,0|3,0,0]=4 1956 B14R1.3152 Cc1cc(c(c(c1)C)COC(C)C)C 34a_100011215277_100000210206 [0,1,0,0,0,0|3,0,0]=4 1957 B14R1.3152 Cc1cc(c(c(c1)C)COC(C)C)C 7a_100011215277_100000210206 [0,1,0,0,0,0|3,0,0]=4 1958 B14R1.3152 Cc1cc(c(c(c1)C)CSC(C)C)C 62a_100000210206_100000749405 [0,1,0,0,0,0|3,0,0]=4 1959 B14R1.3152 Cc1cc(c(c(c1)C)CSC(C)C)C 62a_100000749405_100000210206 [0,1,0,0,0,0|3,0,0]=4 1960 B14R1.3152 Cc1cc(c(c(c1)C)NCC(=O)N)C 34a_100000210045_100000187820 [0,1,0,0,0,0|2,0,1]=4 1961 B14R1.3152 Cc1cc(c(c(c1)C)NCC(=O)N)C 7a_100000210045_100000187820 [0,1,0,0,0,0|2,0,1]=4 1962 B14R1.3152 Cc1cc(c(c(c1)C)NCC(C)C)C 34a_100000210045_100000210624 [0,1,0,0,0,0|2,0,0]=3 1963 B14R1.3152 Cc1cc(c(c(c1)C)NCC(C)C)C 7a_100000210045_100000210760 [0,1,0,0,0,0|2,0,0]=3 1964 B14R1.3152 Cc1cc(c(c(c1)C)NCC(C)O)C 34a_100000210045_100011218427 [0,1,0,0,0,0|2,0,0]=3 1965 B14R1.3152 Cc1cc(c(c(c1)C)NCC(C)O)C 7a_100000210045_100011218427 [0,1,0,0,0,0|2,0,0]=3 1966 B14R1.3152 Cc1cc(c(c(c1)C)NCC(F)F)C 34a_100000210045_100011934356 [0,1,0,0,0,0|3,0,0]=4 1967 B14R1.3152 Cc1cc(c(c(c1)C)NCC(F)F)C 7a_100000210045_100011934356 [0,1,0,0,0,0|3,0,0]=4 1968 B14R1.3152 Cc1cc(c(c(c1)C)NC[C@@H](C)O)C 34a_100000210045_100009817552 [0,1,0,0,0,0|2,0,0]=3 1969 B14R1.3152 Cc1cc(c(c(c1)C)NC[C@@H](C)O)C 7a_100000210045_100009817552 [0,1,0,0,0,0|2,0,0]=3 1970 B14R1.3152 Cc1cc(c(c(c1)C)OCC(=O)N)C 34a_100000212074_100000187820 [0,1,0,0,0,0|1,0,1]=3 1971 B14R1.3152 Cc1cc(c(c(c1)C)OCC(=O)N)C 7a_100000212074_100000187820 [0,1,0,0,0,0|1,0,1]=3 1972 B14R1.3152 Cc1cc(c(c(c1)C)OCC(=O)[13CH3])C 1458a_200000183695_200025704644 [0,1,0,0,0,0|1,0,1]=3 1973 B14R1.3152 Cc1cc(c(c(c1)C)OCC(=O)[O-])C 34a_100000212074_100020667443 [0,1,0,0,0,0|2,0,1]=4 1974 B14R1.3152 Cc1cc(c(c(c1)C)OCC(C)C)C 34a_100000212074_100000210624 [0,1,0,0,0,0|1,0,0]=2 1975 B14R1.3152 Cc1cc(c(c(c1)C)OCC(C)C)C 7a_100000212074_100000210760 [0,1,0,0,0,0|1,0,0]=2 1976 B14R1.3152 Cc1cc(c(c(c1)C)OCC(C)O)C 34a_100000212074_100011218427 [0,1,0,0,0,0|1,0,0]=2 1977 B14R1.3152 Cc1cc(c(c(c1)C)OCC(C)O)C 7a_100000212074_100011218427 [0,1,0,0,0,0|1,0,0]=2 1978 B14R1.3152 Cc1cc(c(c(c1)C)OCC(F)F)C 34a_100000212074_100011934356 [0,1,0,0,0,0|2,0,0]=3 1979 B14R1.3152 Cc1cc(c(c(c1)C)OCC(F)F)C 7a_100000212074_100011934356 [0,1,0,0,0,0|2,0,0]=3 1980 B14R1.3152 Cc1cc(c(c(c1)C)OC[C@@H](C)O)C 34a_100000212074_100009817552 [0,1,0,0,0,0|1,0,0]=2 1981 B14R1.3152 Cc1cc(c(c(c1)C)OC[C@@H](C)O)C 7a_100000212074_100009817552 [0,1,0,0,0,0|1,0,0]=2 1982 B14R1.3152 Cc1cc(c(c(c1)C)OC[N+](=O)[O-])C 34a_100000212074_100000761209 [0,1,0,0,0,0|3,0,0]=4 1983 B14R1.3152 Cc1cc(c(c(c1)C)SCC(=O)N)C 62a_100000747473_100011204320 [0,1,0,0,0,0|1,1,1]=4 1984 B14R1.3152 Cc1cc(c(c(c1)C)SCC(=O)N)C 62a_100011204320_100000747473 [0,1,0,0,0,0|1,1,1]=4 1985 B14R1.3152 Cc1cc(c(c(c1)C)SCC(C)C)C 62a_100000210624_100011204320 [0,1,0,0,0,0|1,1,0]=3 1986 B14R1.3152 Cc1cc(c(c(c1)C)SCC(C)C)C 62a_100011204320_100000210760 [0,1,0,0,0,0|1,1,0]=3 1987 B14R1.3152 Cc1cc(c(c(c1)C)SCC(C)O)C 62a_100011204320_100011218427 [0,1,0,0,0,0|1,1,0]=3 1988 B14R1.3152 Cc1cc(c(c(c1)C)SCC(C)O)C 62a_100011218427_100011204320 [0,1,0,0,0,0|1,1,0]=3 1989 B14R1.3152 Cc1cc(c(c(c1)C)SCC(F)F)C 62a_100011204320_100011934356 [0,1,0,0,0,0|2,1,0]=4 1990 B14R1.3152 Cc1cc(c(c(c1)C)SCC(F)F)C 62a_100011934356_100011204320 [0,1,0,0,0,0|2,1,0]=4 1991 B14R1.3152 Cc1cc(c(c(c1)C)SC[C@@H](C)O)C 62a_100009817552_100011204320 [0,1,0,0,0,0|1,1,0]=3 1992 B14R1.3152 Cc1cc(c(c(c1)C)SC[C@@H](C)O)C 62a_100011204320_100009817552 [0,1,0,0,0,0|1,1,0]=3 1993 B14R1.3152 Cc1cc(c(c(c1)Cl)NCC(C)C)C 34a_100000211461_100000210624 [0,1,0,0,0,0|3,0,0]=4 1994 B14R1.3152 Cc1cc(c(c(c1)Cl)NCC(C)C)C 7a_100000211461_100000210760 [0,1,0,0,0,0|3,0,0]=4 1995 B14R1.3152 Cc1cc(c(c(c1)Cl)NCC(C)O)C 34a_100000211461_100011218427 [0,1,0,0,0,0|3,0,0]=4 1996 B14R1.3152 Cc1cc(c(c(c1)Cl)NCC(C)O)C 7a_100000211461_100011218427 [0,1,0,0,0,0|3,0,0]=4 1997 B14R1.3152 Cc1cc(c(c(c1)Cl)NC[C@@H](C)O)C 34a_100000211461_100009817552 [0,1,0,0,0,0|3,0,0]=4 1998 B14R1.3152 Cc1cc(c(c(c1)Cl)NC[C@@H](C)O)C 7a_100000211461_100009817552 [0,1,0,0,0,0|3,0,0]=4 1999 B14R1.3152 Cc1cc(c(c(c1)Cl)OCC(=O)[13CH3])C 1458a_200000013560_200025704644 [0,1,0,0,0,0|2,0,1]=4 2000 B14R1.3152 Cc1cc(c(c(c1)Cl)OCC(C)C)Cl 34a_100000034925_100000210624 [0,1,0,0,0,0|3,0,0]=4 2001 B14R1.3152 Cc1cc(c(c(c1)Cl)OCC(C)C)Cl 7a_100000034925_100000210760 [0,1,0,0,0,0|3,0,0]=4 2002 B14R1.3152 Cc1cc(c(c(c1)Cl)OCC(C)O)Cl 34a_100000034925_100011218427 [0,1,0,0,0,0|3,0,0]=4 2003 B14R1.3152 Cc1cc(c(c(c1)Cl)OCC(C)O)Cl 7a_100000034925_100011218427 [0,1,0,0,0,0|3,0,0]=4 2004 B14R1.3152 Cc1cc(c(c(c1)Cl)OC[C@@H](C)O)Cl 34a_100000034925_100009817552 [0,1,0,0,0,0|3,0,0]=4 2005 B14R1.3152 Cc1cc(c(c(c1)Cl)OC[C@@H](C)O)Cl 7a_100000034925_100009817552 [0,1,0,0,0,0|3,0,0]=4 2006 B14R1.3152 Cc1cc(c(c(c1)I)OCC(C)C)F 34a_200135191068_100000210624 [0,1,0,0,0,0|3,0,0]=4 2007 B14R1.3152 Cc1cc(c(c(c1)I)OCC(C)C)F 7a_200135191068_100000210760 [0,1,0,0,0,0|3,0,0]=4 2008 B14R1.3152 Cc1cc(c(c(c1)I)OCC(C)O)F 34a_200135191068_100011218427 [0,1,0,0,0,0|3,0,0]=4 2009 B14R1.3152 Cc1cc(c(c(c1)I)OCC(C)O)F 7a_200135191068_100011218427 [0,1,0,0,0,0|3,0,0]=4 2010 B14R1.3152 Cc1cc(c(c(c1)I)OC[C@@H](C)O)F 34a_200135191068_100009817552 [0,1,0,0,0,0|3,0,0]=4 2011 B14R1.3152 Cc1cc(c(c(c1)I)OC[C@@H](C)O)F 7a_200135191068_100009817552 [0,1,0,0,0,0|3,0,0]=4 2012 B14R1.3152 Cc1cc(c(c(c1)N)OCC(=O)N)C 34a_100011216242_100000187820 [0,1,0,0,0,0|2,0,1]=4 2013 B14R1.3152 Cc1cc(c(c(c1)N)OCC(=O)N)C 7a_100011216242_100000187820 [0,1,0,0,0,0|2,0,1]=4 2014 B14R1.3152 Cc1cc(c(c(c1)N)OCC(C)C)C 34a_100011216242_100000210624 [0,1,0,0,0,0|2,0,0]=3 2015 B14R1.3152 Cc1cc(c(c(c1)N)OCC(C)C)C 7a_100011216242_100000210760 [0,1,0,0,0,0|2,0,0]=3 2016 B14R1.3152 Cc1cc(c(c(c1)N)OCC(C)O)C 34a_100011216242_100011218427 [0,1,0,0,0,0|2,0,0]=3 2017 B14R1.3152 Cc1cc(c(c(c1)N)OCC(C)O)C 7a_100011216242_100011218427 [0,1,0,0,0,0|2,0,0]=3 2018 B14R1.3152 Cc1cc(c(c(c1)N)OCC(F)F)C 34a_100011216242_100011934356 [0,1,0,0,0,0|3,0,0]=4 2019 B14R1.3152 Cc1cc(c(c(c1)N)OCC(F)F)C 7a_100011216242_100011934356 [0,1,0,0,0,0|3,0,0]=4 2020 B14R1.3152 Cc1cc(c(c(c1)N)OC[C@@H](C)O)C 34a_100011216242_100009817552 [0,1,0,0,0,0|2,0,0]=3 2021 B14R1.3152 Cc1cc(c(c(c1)N)OC[C@@H](C)O)C 7a_100011216242_100009817552 [0,1,0,0,0,0|2,0,0]=3 2022 B14R1.3152 Cc1cc(c(c(c1)O)OCC(=O)N)C 271570a_203496583355_200010173088 [0,1,0,0,0,0|2,0,1]=4 2023 B14R1.3152 Cc1cc(c(c(c1)O)SCC(C)C)C 62a_100000210624_100010342985 [0,1,0,0,0,0|2,1,0]=4 2024 B14R1.3152 Cc1cc(c(c(c1)O)SCC(C)C)C 62a_100010342985_100000210760 [0,1,0,0,0,0|2,1,0]=4 2025 B14R1.3152 Cc1cc(c(c(c1)O)SCC(C)O)C 62a_100010342985_100011218427 [0,1,0,0,0,0|2,1,0]=4 2026 B14R1.3152 Cc1cc(c(c(c1)O)SCC(C)O)C 62a_100011218427_100010342985 [0,1,0,0,0,0|2,1,0]=4 2027 B14R1.3152 Cc1cc(c(c(c1)O)SC[C@@H](C)O)C 62a_100009817552_100010342985 [0,1,0,0,0,0|2,1,0]=4 2028 B14R1.3152 Cc1cc(c(c(c1)O)SC[C@@H](C)O)C 62a_100010342985_100009817552 [0,1,0,0,0,0|2,1,0]=4 2029 B14R1.3152 Cc1cc(cc(c1C=CC(C)C)C)Br 271570a_100016257149_100009814048 [0,1,0,0,0,0|2,0,1]=4 2030 B14R1.3152 Cc1cc(cc(c1C=CC(C)C)C)Cl 271570a_100016257149_100010244930 [0,1,0,0,0,0|2,0,1]=4 2031 B14R1.3152 Cc1cc(cc(c1C=CC(C)C)C)F 271570a_100016257149_100012356666 [0,1,0,0,0,0|2,0,1]=4 2032 B14R1.3152 Cc1cc(cc(c1C=CC(C)C)C)O 271570a_100016257149_100000243743 [0,1,0,0,0,0|2,0,1]=4 2033 B14R1.3152 Cc1cc(cc(c1C=CC(C)O)C)Br 271570a_200011019289_100009814048 [0,1,0,0,0,0|2,0,1]=4 2034 B14R1.3152 Cc1cc(cc(c1C=CC(C)O)C)Cl 271570a_200011019289_100010244930 [0,1,0,0,0,0|2,0,1]=4 2035 B14R1.3152 Cc1cc(cc(c1C=CC(C)O)C)F 271570a_200011019289_100012356666 [0,1,0,0,0,0|2,0,1]=4 2036 B14R1.3152 Cc1cc(cc(c1C=CC(C)O)C)O 271570a_200011019289_100000243743 [0,1,0,0,0,0|2,0,1]=4 2037 B14R1.3152 Cc1cc(cc(c1CNC(C)C)C)Br 207a_100138425928_100010238521 [0,1,0,0,0,0|3,0,0]=4 2038 B14R1.3152 Cc1cc(cc(c1CNC(C)C)C)Cl 207a_100138425928_100000693520 [0,1,0,0,0,0|3,0,0]=4 2039 B14R1.3152 Cc1cc(cc(c1CNC(C)C)C)F 207a_100138425928_100012179923 [0,1,0,0,0,0|3,0,0]=4 2040 B14R1.3152 Cc1cc(cc(c1CNC(C)C)C)O 207a_100138425928_100011827661 [0,1,0,0,0,0|3,0,0]=4 2041 B14R1.3152 Cc1cc(cc(c1COC(C)C)C)Br 34a_100010128451_100000210206 [0,1,0,0,0,0|3,0,0]=4 2042 B14R1.3152 Cc1cc(cc(c1COC(C)C)C)Br 7a_100010128451_100000210206 [0,1,0,0,0,0|3,0,0]=4 2043 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)Br 34a_100000737279_100000187820 [0,1,0,0,0,0|2,0,1]=4 2044 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)Br 7a_100000737279_100000187820 [0,1,0,0,0,0|2,0,1]=4 2045 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)Cl 34a_100000692879_100000187820 [0,1,0,0,0,0|2,0,1]=4 2046 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)Cl 7a_100000692879_100000187820 [0,1,0,0,0,0|2,0,1]=4 2047 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)F 34a_100011290887_100000187820 [0,1,0,0,0,0|2,0,1]=4 2048 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)F 7a_100011290887_100000187820 [0,1,0,0,0,0|2,0,1]=4 2049 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)I 7a_100011356821_100000187820 [0,1,0,0,0,0|2,0,1]=4 2050 B14R1.3152 Cc1cc(cc(c1NCC(=O)N)C)O 34a_100011934200_100000187820 [0,1,0,0,0,0|2,0,1]=4 2051 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Br)Br 34a_100012047207_100000210624 [0,1,0,0,0,0|3,0,0]=4 2052 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Br)Br 7a_100012047207_100000210760 [0,1,0,0,0,0|3,0,0]=4 2053 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Br)Cl 34a_100012353696_100000210624 [0,1,0,0,0,0|3,0,0]=4 2054 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Br)Cl 7a_100012353696_100000210760 [0,1,0,0,0,0|3,0,0]=4 2055 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Br)F 34a_100011216670_100000210624 [0,1,0,0,0,0|3,0,0]=4 2056 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Br)F 7a_100011216670_100000210760 [0,1,0,0,0,0|3,0,0]=4 2057 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)Br 34a_100000737279_100000210624 [0,1,0,0,0,0|2,0,0]=3 2058 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)Br 7a_100000737279_100000210760 [0,1,0,0,0,0|2,0,0]=3 2059 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)Cl 34a_100000692879_100000210624 [0,1,0,0,0,0|2,0,0]=3 2060 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)Cl 7a_100000692879_100000210760 [0,1,0,0,0,0|2,0,0]=3 2061 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)F 34a_100011290887_100000210624 [0,1,0,0,0,0|2,0,0]=3 2062 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)F 7a_100011290887_100000210760 [0,1,0,0,0,0|2,0,0]=3 2063 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)I 7a_100011356821_100000210760 [0,1,0,0,0,0|2,0,0]=3 2064 B14R1.3152 Cc1cc(cc(c1NCC(C)C)C)O 34a_100011934200_100000210624 [0,1,0,0,0,0|2,0,0]=3 2065 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Cl)Br 34a_100000741131_100000210624 [0,1,0,0,0,0|3,0,0]=4 2066 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Cl)Br 7a_100000741131_100000210760 [0,1,0,0,0,0|3,0,0]=4 2067 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Cl)Cl 34a_100011215104_100000210624 [0,1,0,0,0,0|3,0,0]=4 2068 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Cl)Cl 7a_100011215104_100000210760 [0,1,0,0,0,0|3,0,0]=4 2069 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Cl)F 34a_100000725997_100000210624 [0,1,0,0,0,0|3,0,0]=4 2070 B14R1.3152 Cc1cc(cc(c1NCC(C)C)Cl)F 7a_100000725997_100000210760 [0,1,0,0,0,0|3,0,0]=4 2071 B14R1.3152 Cc1cc(cc(c1NCC(C)C)F)Br 34a_100000709789_100000210624 [0,1,0,0,0,0|3,0,0]=4 2072 B14R1.3152 Cc1cc(cc(c1NCC(C)C)F)Br 7a_100000709789_100000210760 [0,1,0,0,0,0|3,0,0]=4 2073 B14R1.3152 Cc1cc(cc(c1NCC(C)C)F)Cl 34a_100012017672_100000210624 [0,1,0,0,0,0|3,0,0]=4 2074 B14R1.3152 Cc1cc(cc(c1NCC(C)C)F)Cl 7a_100012017672_100000210760 [0,1,0,0,0,0|3,0,0]=4 2075 B14R1.3152 Cc1cc(cc(c1NCC(C)C)I)Br 7a_200000690823_100000210760 [0,1,0,0,0,0|3,0,0]=4 2076 B14R1.3152 Cc1cc(cc(c1NCC(C)C)I)Cl 7a_100012344046_100000210760 [0,1,0,0,0,0|3,0,0]=4 2077 B14R1.3152 Cc1cc(cc(c1NCC(C)C)O)Br 34a_100010371313_100000210624 [0,1,0,0,0,0|3,0,0]=4 2078 B14R1.3152 Cc1cc(cc(c1NCC(C)C)O)Br 7a_100010371313_100000210760 [0,1,0,0,0,0|3,0,0]=4 2079 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Br)Br 34a_100012047207_100011218427 [0,1,0,0,0,0|3,0,0]=4 2080 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Br)Br 7a_100012047207_100011218427 [0,1,0,0,0,0|3,0,0]=4 2081 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Br)Cl 34a_100012353696_100011218427 [0,1,0,0,0,0|3,0,0]=4 2082 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Br)Cl 7a_100012353696_100011218427 [0,1,0,0,0,0|3,0,0]=4 2083 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Br)F 34a_100011216670_100011218427 [0,1,0,0,0,0|3,0,0]=4 2084 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Br)F 7a_100011216670_100011218427 [0,1,0,0,0,0|3,0,0]=4 2085 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)Br 34a_100000737279_100011218427 [0,1,0,0,0,0|2,0,0]=3 2086 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)Br 7a_100000737279_100011218427 [0,1,0,0,0,0|2,0,0]=3 2087 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)Cl 34a_100000692879_100011218427 [0,1,0,0,0,0|2,0,0]=3 2088 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)Cl 7a_100000692879_100011218427 [0,1,0,0,0,0|2,0,0]=3 2089 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)F 34a_100011290887_100011218427 [0,1,0,0,0,0|2,0,0]=3 2090 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)F 7a_100011290887_100011218427 [0,1,0,0,0,0|2,0,0]=3 2091 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)I 7a_100011356821_100011218427 [0,1,0,0,0,0|2,0,0]=3 2092 B14R1.3152 Cc1cc(cc(c1NCC(C)O)C)O 34a_100011934200_100011218427 [0,1,0,0,0,0|2,0,0]=3 2093 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Cl)Br 34a_100000741131_100011218427 [0,1,0,0,0,0|3,0,0]=4 2094 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Cl)Br 7a_100000741131_100011218427 [0,1,0,0,0,0|3,0,0]=4 2095 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Cl)Cl 34a_100011215104_100011218427 [0,1,0,0,0,0|3,0,0]=4 2096 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Cl)Cl 7a_100011215104_100011218427 [0,1,0,0,0,0|3,0,0]=4 2097 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Cl)F 34a_100000725997_100011218427 [0,1,0,0,0,0|3,0,0]=4 2098 B14R1.3152 Cc1cc(cc(c1NCC(C)O)Cl)F 7a_100000725997_100011218427 [0,1,0,0,0,0|3,0,0]=4 2099 B14R1.3152 Cc1cc(cc(c1NCC(C)O)F)Br 34a_100000709789_100011218427 [0,1,0,0,0,0|3,0,0]=4 2100 B14R1.3152 Cc1cc(cc(c1NCC(C)O)F)Br 7a_100000709789_100011218427 [0,1,0,0,0,0|3,0,0]=4 2101 B14R1.3152 Cc1cc(cc(c1NCC(C)O)F)Cl 34a_100012017672_100011218427 [0,1,0,0,0,0|3,0,0]=4 2102 B14R1.3152 Cc1cc(cc(c1NCC(C)O)F)Cl 7a_100012017672_100011218427 [0,1,0,0,0,0|3,0,0]=4 2103 B14R1.3152 Cc1cc(cc(c1NCC(C)O)I)Br 7a_200000690823_100011218427 [0,1,0,0,0,0|3,0,0]=4 2104 B14R1.3152 Cc1cc(cc(c1NCC(C)O)I)Cl 7a_100012344046_100011218427 [0,1,0,0,0,0|3,0,0]=4 2105 B14R1.3152 Cc1cc(cc(c1NCC(C)O)O)Br 34a_100010371313_100011218427 [0,1,0,0,0,0|3,0,0]=4 2106 B14R1.3152 Cc1cc(cc(c1NCC(C)O)O)Br 7a_100010371313_100011218427 [0,1,0,0,0,0|3,0,0]=4 2107 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)Br 34a_100000737279_100011934356 [0,1,0,0,0,0|3,0,0]=4 2108 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)Br 7a_100000737279_100011934356 [0,1,0,0,0,0|3,0,0]=4 2109 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)Cl 34a_100000692879_100011934356 [0,1,0,0,0,0|3,0,0]=4 2110 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)Cl 7a_100000692879_100011934356 [0,1,0,0,0,0|3,0,0]=4 2111 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)F 34a_100011290887_100011934356 [0,1,0,0,0,0|3,0,0]=4 2112 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)F 7a_100011290887_100011934356 [0,1,0,0,0,0|3,0,0]=4 2113 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)I 7a_100011356821_100011934356 [0,1,0,0,0,0|3,0,0]=4 2114 B14R1.3152 Cc1cc(cc(c1NCC(F)F)C)O 34a_100011934200_100011934356 [0,1,0,0,0,0|3,0,0]=4 2115 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Br)Br 34a_100012047207_100009817552 [0,1,0,0,0,0|3,0,0]=4 2116 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Br)Br 7a_100012047207_100009817552 [0,1,0,0,0,0|3,0,0]=4 2117 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Br)Cl 34a_100012353696_100009817552 [0,1,0,0,0,0|3,0,0]=4 2118 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Br)Cl 7a_100012353696_100009817552 [0,1,0,0,0,0|3,0,0]=4 2119 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Br)F 34a_100011216670_100009817552 [0,1,0,0,0,0|3,0,0]=4 2120 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Br)F 7a_100011216670_100009817552 [0,1,0,0,0,0|3,0,0]=4 2121 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)Br 34a_100000737279_100009817552 [0,1,0,0,0,0|2,0,0]=3 2122 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)Br 7a_100000737279_100009817552 [0,1,0,0,0,0|2,0,0]=3 2123 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)Cl 34a_100000692879_100009817552 [0,1,0,0,0,0|2,0,0]=3 2124 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)Cl 7a_100000692879_100009817552 [0,1,0,0,0,0|2,0,0]=3 2125 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)F 34a_100011290887_100009817552 [0,1,0,0,0,0|2,0,0]=3 2126 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)F 7a_100011290887_100009817552 [0,1,0,0,0,0|2,0,0]=3 2127 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)I 7a_100011356821_100009817552 [0,1,0,0,0,0|2,0,0]=3 2128 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)C)O 34a_100011934200_100009817552 [0,1,0,0,0,0|2,0,0]=3 2129 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Cl)Br 34a_100000741131_100009817552 [0,1,0,0,0,0|3,0,0]=4 2130 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Cl)Br 7a_100000741131_100009817552 [0,1,0,0,0,0|3,0,0]=4 2131 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Cl)Cl 34a_100011215104_100009817552 [0,1,0,0,0,0|3,0,0]=4 2132 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Cl)Cl 7a_100011215104_100009817552 [0,1,0,0,0,0|3,0,0]=4 2133 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Cl)F 34a_100000725997_100009817552 [0,1,0,0,0,0|3,0,0]=4 2134 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)Cl)F 7a_100000725997_100009817552 [0,1,0,0,0,0|3,0,0]=4 2135 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)F)Br 34a_100000709789_100009817552 [0,1,0,0,0,0|3,0,0]=4 2136 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)F)Br 7a_100000709789_100009817552 [0,1,0,0,0,0|3,0,0]=4 2137 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)F)Cl 34a_100012017672_100009817552 [0,1,0,0,0,0|3,0,0]=4 2138 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)F)Cl 7a_100012017672_100009817552 [0,1,0,0,0,0|3,0,0]=4 2139 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)I)Br 7a_200000690823_100009817552 [0,1,0,0,0,0|3,0,0]=4 2140 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)I)Cl 7a_100012344046_100009817552 [0,1,0,0,0,0|3,0,0]=4 2141 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)O)Br 34a_100010371313_100009817552 [0,1,0,0,0,0|3,0,0]=4 2142 B14R1.3152 Cc1cc(cc(c1NC[C@@H](C)O)O)Br 7a_100010371313_100009817552 [0,1,0,0,0,0|3,0,0]=4 2143 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)Br 34a_100000186369_100000187820 [0,1,0,0,0,0|2,0,1]=4 2144 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)Br 7a_100000186369_100000187820 [0,1,0,0,0,0|2,0,1]=4 2145 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)Cl 34a_100012337756_100000187820 [0,1,0,0,0,0|2,0,1]=4 2146 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)Cl 7a_100012337756_100000187820 [0,1,0,0,0,0|2,0,1]=4 2147 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)I 34a_100010982682_100000187820 [0,1,0,0,0,0|2,0,1]=4 2148 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)I 7a_100010982682_100000187820 [0,1,0,0,0,0|2,0,1]=4 2149 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)N 34a_100010064301_100000187820 [0,1,0,0,0,0|2,0,1]=4 2150 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Br)N 7a_100010064301_100000187820 [0,1,0,0,0,0|2,0,1]=4 2151 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)Br 34a_100000187306_100000187820 [0,1,0,0,0,0|1,0,1]=3 2152 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)Br 7a_100000187306_100000187820 [0,1,0,0,0,0|1,0,1]=3 2153 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)Cl 34a_100000211519_100000187820 [0,1,0,0,0,0|1,0,1]=3 2154 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)Cl 7a_100000211519_100000187820 [0,1,0,0,0,0|1,0,1]=3 2155 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)F 34a_100000081862_100000187820 [0,1,0,0,0,0|1,0,1]=3 2156 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)F 7a_100000081862_100000187820 [0,1,0,0,0,0|1,0,1]=3 2157 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)I 34a_100011216129_100000187820 [0,1,0,0,0,0|1,0,1]=3 2158 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)I 7a_100011216129_100000187820 [0,1,0,0,0,0|1,0,1]=3 2159 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)N 34a_100000703291_100000187820 [0,1,0,0,0,0|1,0,1]=3 2160 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)C)N 7a_100000703291_100000187820 [0,1,0,0,0,0|1,0,1]=3 2161 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Cl)Br 34a_100000211485_100000187820 [0,1,0,0,0,0|2,0,1]=4 2162 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Cl)Br 7a_100000211485_100000187820 [0,1,0,0,0,0|2,0,1]=4 2163 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Cl)Cl 34a_100011218458_100000187820 [0,1,0,0,0,0|2,0,1]=4 2164 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Cl)Cl 7a_100011218458_100000187820 [0,1,0,0,0,0|2,0,1]=4 2165 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Cl)I 34a_200015900153_100000187820 [0,1,0,0,0,0|2,0,1]=4 2166 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)Cl)I 7a_200015900153_100000187820 [0,1,0,0,0,0|2,0,1]=4 2167 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)I)Cl 34a_100012343667_100000187820 [0,1,0,0,0,0|2,0,1]=4 2168 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)I)Cl 7a_100012343667_100000187820 [0,1,0,0,0,0|2,0,1]=4 2169 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)N)Br 34a_100011825904_100000187820 [0,1,0,0,0,0|2,0,1]=4 2170 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)N)Br 7a_100011825904_100000187820 [0,1,0,0,0,0|2,0,1]=4 2171 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)N)F 34a_100000130126_100000187820 [0,1,0,0,0,0|2,0,1]=4 2172 B14R1.3152 Cc1cc(cc(c1OCC(=O)N)N)F 7a_100000130126_100000187820 [0,1,0,0,0,0|2,0,1]=4 2173 B14R1.3152 Cc1cc(cc(c1OCC(=O)[13CH3])C)Br 1458a_100009812269_200025704644 [0,1,0,0,0,0|1,0,1]=3 2174 B14R1.3152 Cc1cc(cc(c1OCC(=O)[13CH3])C)Cl 1458a_100000183735_200025704644 [0,1,0,0,0,0|1,0,1]=3 2175 B14R1.3152 Cc1cc(cc(c1OCC(=O)[13CH3])Cl)Br 1458a_100000179748_200025704644 [0,1,0,0,0,0|2,0,1]=4 2176 B14R1.3152 Cc1cc(cc(c1OCC(=O)[13CH3])Cl)Cl 1458a_100000013561_200025704644 [0,1,0,0,0,0|2,0,1]=4 2177 B14R1.3152 Cc1cc(cc(c1OCC(=O)[O-])C)Br 34a_100000187306_100020667443 [0,1,0,0,0,0|2,0,1]=4 2178 B14R1.3152 Cc1cc(cc(c1OCC(=O)[O-])C)Cl 34a_100000211519_100020667443 [0,1,0,0,0,0|2,0,1]=4 2179 B14R1.3152 Cc1cc(cc(c1OCC(=O)[O-])C)F 34a_100000081862_100020667443 [0,1,0,0,0,0|2,0,1]=4 2180 B14R1.3152 Cc1cc(cc(c1OCC(=O)[O-])C)I 34a_100011216129_100020667443 [0,1,0,0,0,0|2,0,1]=4 2181 B14R1.3152 Cc1cc(cc(c1OCC(=O)[O-])C)N 34a_100000703291_100020667443 [0,1,0,0,0,0|2,0,1]=4 2182 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)Br 34a_100000186369_100000210624 [0,1,0,0,0,0|2,0,0]=3 2183 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)Br 7a_100000186369_100000210760 [0,1,0,0,0,0|2,0,0]=3 2184 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)Cl 34a_100012337756_100000210624 [0,1,0,0,0,0|2,0,0]=3 2185 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)Cl 7a_100012337756_100000210760 [0,1,0,0,0,0|2,0,0]=3 2186 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)I 34a_100010982682_100000210624 [0,1,0,0,0,0|2,0,0]=3 2187 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)I 7a_100010982682_100000210760 [0,1,0,0,0,0|2,0,0]=3 2188 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)N 34a_100010064301_100000210624 [0,1,0,0,0,0|2,0,0]=3 2189 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Br)N 7a_100010064301_100000210760 [0,1,0,0,0,0|2,0,0]=3 2190 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)Br 34a_100000187306_100000210624 [0,1,0,0,0,0|1,0,0]=2 2191 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)Br 7a_100000187306_100000210760 [0,1,0,0,0,0|1,0,0]=2 2192 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)Cl 34a_100000211519_100000210624 [0,1,0,0,0,0|1,0,0]=2 2193 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)Cl 7a_100000211519_100000210760 [0,1,0,0,0,0|1,0,0]=2 2194 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)F 34a_100000081862_100000210624 [0,1,0,0,0,0|1,0,0]=2 2195 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)F 7a_100000081862_100000210760 [0,1,0,0,0,0|1,0,0]=2 2196 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)I 34a_100011216129_100000210624 [0,1,0,0,0,0|1,0,0]=2 2197 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)I 7a_100011216129_100000210760 [0,1,0,0,0,0|1,0,0]=2 2198 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)N 34a_100000703291_100000210624 [0,1,0,0,0,0|1,0,0]=2 2199 B14R1.3152 Cc1cc(cc(c1OCC(C)C)C)N 7a_100000703291_100000210760 [0,1,0,0,0,0|1,0,0]=2 2200 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Cl)Br 34a_100000211485_100000210624 [0,1,0,0,0,0|2,0,0]=3 2201 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Cl)Br 7a_100000211485_100000210760 [0,1,0,0,0,0|2,0,0]=3 2202 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Cl)Cl 34a_100011218458_100000210624 [0,1,0,0,0,0|2,0,0]=3 2203 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Cl)Cl 7a_100011218458_100000210760 [0,1,0,0,0,0|2,0,0]=3 2204 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Cl)I 34a_200015900153_100000210624 [0,1,0,0,0,0|2,0,0]=3 2205 B14R1.3152 Cc1cc(cc(c1OCC(C)C)Cl)I 7a_200015900153_100000210760 [0,1,0,0,0,0|2,0,0]=3 2206 B14R1.3152 Cc1cc(cc(c1OCC(C)C)I)Cl 34a_100012343667_100000210624 [0,1,0,0,0,0|2,0,0]=3 2207 B14R1.3152 Cc1cc(cc(c1OCC(C)C)I)Cl 7a_100012343667_100000210760 [0,1,0,0,0,0|2,0,0]=3 2208 B14R1.3152 Cc1cc(cc(c1OCC(C)C)N)Br 34a_100011825904_100000210624 [0,1,0,0,0,0|2,0,0]=3 2209 B14R1.3152 Cc1cc(cc(c1OCC(C)C)N)Br 7a_100011825904_100000210760 [0,1,0,0,0,0|2,0,0]=3 2210 B14R1.3152 Cc1cc(cc(c1OCC(C)C)N)F 34a_100000130126_100000210624 [0,1,0,0,0,0|2,0,0]=3 2211 B14R1.3152 Cc1cc(cc(c1OCC(C)C)N)F 7a_100000130126_100000210760 [0,1,0,0,0,0|2,0,0]=3 2212 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)Br 34a_100000186369_100011218427 [0,1,0,0,0,0|2,0,0]=3 2213 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)Br 7a_100000186369_100011218427 [0,1,0,0,0,0|2,0,0]=3 2214 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)Cl 34a_100012337756_100011218427 [0,1,0,0,0,0|2,0,0]=3 2215 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)Cl 7a_100012337756_100011218427 [0,1,0,0,0,0|2,0,0]=3 2216 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)I 34a_100010982682_100011218427 [0,1,0,0,0,0|2,0,0]=3 2217 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)I 7a_100010982682_100011218427 [0,1,0,0,0,0|2,0,0]=3 2218 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)N 34a_100010064301_100011218427 [0,1,0,0,0,0|2,0,0]=3 2219 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Br)N 7a_100010064301_100011218427 [0,1,0,0,0,0|2,0,0]=3 2220 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)Br 34a_100000187306_100011218427 [0,1,0,0,0,0|1,0,0]=2 2221 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)Br 7a_100000187306_100011218427 [0,1,0,0,0,0|1,0,0]=2 2222 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)Cl 34a_100000211519_100011218427 [0,1,0,0,0,0|1,0,0]=2 2223 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)Cl 7a_100000211519_100011218427 [0,1,0,0,0,0|1,0,0]=2 2224 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)F 34a_100000081862_100011218427 [0,1,0,0,0,0|1,0,0]=2 2225 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)F 7a_100000081862_100011218427 [0,1,0,0,0,0|1,0,0]=2 2226 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)I 34a_100011216129_100011218427 [0,1,0,0,0,0|1,0,0]=2 2227 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)I 7a_100011216129_100011218427 [0,1,0,0,0,0|1,0,0]=2 2228 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)N 34a_100000703291_100011218427 [0,1,0,0,0,0|1,0,0]=2 2229 B14R1.3152 Cc1cc(cc(c1OCC(C)O)C)N 7a_100000703291_100011218427 [0,1,0,0,0,0|1,0,0]=2 2230 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Cl)Br 34a_100000211485_100011218427 [0,1,0,0,0,0|2,0,0]=3 2231 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Cl)Br 7a_100000211485_100011218427 [0,1,0,0,0,0|2,0,0]=3 2232 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Cl)Cl 34a_100011218458_100011218427 [0,1,0,0,0,0|2,0,0]=3 2233 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Cl)Cl 7a_100011218458_100011218427 [0,1,0,0,0,0|2,0,0]=3 2234 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Cl)I 34a_200015900153_100011218427 [0,1,0,0,0,0|2,0,0]=3 2235 B14R1.3152 Cc1cc(cc(c1OCC(C)O)Cl)I 7a_200015900153_100011218427 [0,1,0,0,0,0|2,0,0]=3 2236 B14R1.3152 Cc1cc(cc(c1OCC(C)O)I)Cl 34a_100012343667_100011218427 [0,1,0,0,0,0|2,0,0]=3 2237 B14R1.3152 Cc1cc(cc(c1OCC(C)O)I)Cl 7a_100012343667_100011218427 [0,1,0,0,0,0|2,0,0]=3 2238 B14R1.3152 Cc1cc(cc(c1OCC(C)O)N)Br 34a_100011825904_100011218427 [0,1,0,0,0,0|2,0,0]=3 2239 B14R1.3152 Cc1cc(cc(c1OCC(C)O)N)Br 7a_100011825904_100011218427 [0,1,0,0,0,0|2,0,0]=3 2240 B14R1.3152 Cc1cc(cc(c1OCC(C)O)N)F 34a_100000130126_100011218427 [0,1,0,0,0,0|2,0,0]=3 2241 B14R1.3152 Cc1cc(cc(c1OCC(C)O)N)F 7a_100000130126_100011218427 [0,1,0,0,0,0|2,0,0]=3 2242 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)Br 34a_100000186369_100011934356 [0,1,0,0,0,0|3,0,0]=4 2243 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)Br 7a_100000186369_100011934356 [0,1,0,0,0,0|3,0,0]=4 2244 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)Cl 34a_100012337756_100011934356 [0,1,0,0,0,0|3,0,0]=4 2245 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)Cl 7a_100012337756_100011934356 [0,1,0,0,0,0|3,0,0]=4 2246 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)I 34a_100010982682_100011934356 [0,1,0,0,0,0|3,0,0]=4 2247 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)I 7a_100010982682_100011934356 [0,1,0,0,0,0|3,0,0]=4 2248 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)N 34a_100010064301_100011934356 [0,1,0,0,0,0|3,0,0]=4 2249 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Br)N 7a_100010064301_100011934356 [0,1,0,0,0,0|3,0,0]=4 2250 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)Br 34a_100000187306_100011934356 [0,1,0,0,0,0|2,0,0]=3 2251 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)Br 7a_100000187306_100011934356 [0,1,0,0,0,0|2,0,0]=3 2252 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)Cl 34a_100000211519_100011934356 [0,1,0,0,0,0|2,0,0]=3 2253 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)Cl 7a_100000211519_100011934356 [0,1,0,0,0,0|2,0,0]=3 2254 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)F 34a_100000081862_100011934356 [0,1,0,0,0,0|2,0,0]=3 2255 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)F 7a_100000081862_100011934356 [0,1,0,0,0,0|2,0,0]=3 2256 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)I 34a_100011216129_100011934356 [0,1,0,0,0,0|2,0,0]=3 2257 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)I 7a_100011216129_100011934356 [0,1,0,0,0,0|2,0,0]=3 2258 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)N 34a_100000703291_100011934356 [0,1,0,0,0,0|2,0,0]=3 2259 B14R1.3152 Cc1cc(cc(c1OCC(F)F)C)N 7a_100000703291_100011934356 [0,1,0,0,0,0|2,0,0]=3 2260 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Cl)Br 34a_100000211485_100011934356 [0,1,0,0,0,0|3,0,0]=4 2261 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Cl)Br 7a_100000211485_100011934356 [0,1,0,0,0,0|3,0,0]=4 2262 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Cl)Cl 34a_100011218458_100011934356 [0,1,0,0,0,0|3,0,0]=4 2263 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Cl)Cl 7a_100011218458_100011934356 [0,1,0,0,0,0|3,0,0]=4 2264 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Cl)I 34a_200015900153_100011934356 [0,1,0,0,0,0|3,0,0]=4 2265 B14R1.3152 Cc1cc(cc(c1OCC(F)F)Cl)I 7a_200015900153_100011934356 [0,1,0,0,0,0|3,0,0]=4 2266 B14R1.3152 Cc1cc(cc(c1OCC(F)F)I)Cl 34a_100012343667_100011934356 [0,1,0,0,0,0|3,0,0]=4 2267 B14R1.3152 Cc1cc(cc(c1OCC(F)F)I)Cl 7a_100012343667_100011934356 [0,1,0,0,0,0|3,0,0]=4 2268 B14R1.3152 Cc1cc(cc(c1OCC(F)F)N)Br 34a_100011825904_100011934356 [0,1,0,0,0,0|3,0,0]=4 2269 B14R1.3152 Cc1cc(cc(c1OCC(F)F)N)Br 7a_100011825904_100011934356 [0,1,0,0,0,0|3,0,0]=4 2270 B14R1.3152 Cc1cc(cc(c1OCC(F)F)N)F 34a_100000130126_100011934356 [0,1,0,0,0,0|3,0,0]=4 2271 B14R1.3152 Cc1cc(cc(c1OCC(F)F)N)F 7a_100000130126_100011934356 [0,1,0,0,0,0|3,0,0]=4 2272 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)Br 34a_100000186369_100009817552 [0,1,0,0,0,0|2,0,0]=3 2273 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)Br 7a_100000186369_100009817552 [0,1,0,0,0,0|2,0,0]=3 2274 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)Cl 34a_100012337756_100009817552 [0,1,0,0,0,0|2,0,0]=3 2275 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)Cl 7a_100012337756_100009817552 [0,1,0,0,0,0|2,0,0]=3 2276 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)I 34a_100010982682_100009817552 [0,1,0,0,0,0|2,0,0]=3 2277 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)I 7a_100010982682_100009817552 [0,1,0,0,0,0|2,0,0]=3 2278 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)N 34a_100010064301_100009817552 [0,1,0,0,0,0|2,0,0]=3 2279 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Br)N 7a_100010064301_100009817552 [0,1,0,0,0,0|2,0,0]=3 2280 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)Br 34a_100000187306_100009817552 [0,1,0,0,0,0|1,0,0]=2 2281 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)Br 7a_100000187306_100009817552 [0,1,0,0,0,0|1,0,0]=2 2282 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)Cl 34a_100000211519_100009817552 [0,1,0,0,0,0|1,0,0]=2 2283 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)Cl 7a_100000211519_100009817552 [0,1,0,0,0,0|1,0,0]=2 2284 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)F 34a_100000081862_100009817552 [0,1,0,0,0,0|1,0,0]=2 2285 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)F 7a_100000081862_100009817552 [0,1,0,0,0,0|1,0,0]=2 2286 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)I 34a_100011216129_100009817552 [0,1,0,0,0,0|1,0,0]=2 2287 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)I 7a_100011216129_100009817552 [0,1,0,0,0,0|1,0,0]=2 2288 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)N 34a_100000703291_100009817552 [0,1,0,0,0,0|1,0,0]=2 2289 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)C)N 7a_100000703291_100009817552 [0,1,0,0,0,0|1,0,0]=2 2290 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Cl)Br 34a_100000211485_100009817552 [0,1,0,0,0,0|2,0,0]=3 2291 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Cl)Br 7a_100000211485_100009817552 [0,1,0,0,0,0|2,0,0]=3 2292 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Cl)Cl 34a_100011218458_100009817552 [0,1,0,0,0,0|2,0,0]=3 2293 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Cl)Cl 7a_100011218458_100009817552 [0,1,0,0,0,0|2,0,0]=3 2294 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Cl)I 34a_200015900153_100009817552 [0,1,0,0,0,0|2,0,0]=3 2295 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)Cl)I 7a_200015900153_100009817552 [0,1,0,0,0,0|2,0,0]=3 2296 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)I)Cl 34a_100012343667_100009817552 [0,1,0,0,0,0|2,0,0]=3 2297 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)I)Cl 7a_100012343667_100009817552 [0,1,0,0,0,0|2,0,0]=3 2298 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)N)Br 34a_100011825904_100009817552 [0,1,0,0,0,0|2,0,0]=3 2299 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)N)Br 7a_100011825904_100009817552 [0,1,0,0,0,0|2,0,0]=3 2300 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)N)F 34a_100000130126_100009817552 [0,1,0,0,0,0|2,0,0]=3 2301 B14R1.3152 Cc1cc(cc(c1OC[C@@H](C)O)N)F 7a_100000130126_100009817552 [0,1,0,0,0,0|2,0,0]=3 2302 B14R1.3152 Cc1cc(cc(c1OC[N+](=O)[O-])C)Br 34a_100000187306_100000761209 [0,1,0,0,0,0|3,0,0]=4 2303 B14R1.3152 Cc1cc(cc(c1OC[N+](=O)[O-])C)Cl 34a_100000211519_100000761209 [0,1,0,0,0,0|3,0,0]=4 2304 B14R1.3152 Cc1cc(cc(c1OC[N+](=O)[O-])C)F 34a_100000081862_100000761209 [0,1,0,0,0,0|3,0,0]=4 2305 B14R1.3152 Cc1cc(cc(c1OC[N+](=O)[O-])C)I 34a_100011216129_100000761209 [0,1,0,0,0,0|3,0,0]=4 2306 B14R1.3152 Cc1cc(cc(c1OC[N+](=O)[O-])C)N 34a_100000703291_100000761209 [0,1,0,0,0,0|3,0,0]=4 2307 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)Br 62a_100000747473_100009814048 [0,1,0,0,0,0|1,1,1]=4 2308 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)Br 62a_100009814048_100000747473 [0,1,0,0,0,0|1,1,1]=4 2309 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)Cl 62a_100000747473_100010244930 [0,1,0,0,0,0|1,1,1]=4 2310 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)Cl 62a_100010244930_100000747473 [0,1,0,0,0,0|1,1,1]=4 2311 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)F 62a_100000747473_100012356666 [0,1,0,0,0,0|1,1,1]=4 2312 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)F 62a_100012356666_100000747473 [0,1,0,0,0,0|1,1,1]=4 2313 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)N 62a_100000215964_100000747473 [0,1,0,0,0,0|1,1,1]=4 2314 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)N 62a_100000747473_100000215964 [0,1,0,0,0,0|1,1,1]=4 2315 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)O 62a_100000243743_100000747473 [0,1,0,0,0,0|1,1,1]=4 2316 B14R1.3152 Cc1cc(cc(c1SCC(=O)N)C)O 62a_100000747473_100000243743 [0,1,0,0,0,0|1,1,1]=4 2317 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Br)Br 62a_100000210624_200010208242 [0,1,0,0,0,0|2,1,0]=4 2318 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Br)Br 62a_200010208242_100000210760 [0,1,0,0,0,0|2,1,0]=4 2319 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Br)F 62a_100000210624_100010208209 [0,1,0,0,0,0|2,1,0]=4 2320 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Br)F 62a_100010208209_100000210760 [0,1,0,0,0,0|2,1,0]=4 2321 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)Br 62a_100000210624_100009814048 [0,1,0,0,0,0|1,1,0]=3 2322 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)Br 62a_100009814048_100000210760 [0,1,0,0,0,0|1,1,0]=3 2323 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)Cl 62a_100000210624_100010244930 [0,1,0,0,0,0|1,1,0]=3 2324 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)Cl 62a_100010244930_100000210760 [0,1,0,0,0,0|1,1,0]=3 2325 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)F 62a_100000210624_100012356666 [0,1,0,0,0,0|1,1,0]=3 2326 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)F 62a_100012356666_100000210760 [0,1,0,0,0,0|1,1,0]=3 2327 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)N 62a_100000210624_100000215964 [0,1,0,0,0,0|1,1,0]=3 2328 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)N 62a_100000215964_100000210760 [0,1,0,0,0,0|1,1,0]=3 2329 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)O 62a_100000210624_100000243743 [0,1,0,0,0,0|1,1,0]=3 2330 B14R1.3152 Cc1cc(cc(c1SCC(C)C)C)O 62a_100000243743_100000210760 [0,1,0,0,0,0|1,1,0]=3 2331 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Cl)Cl 62a_100000210624_200000035511 [0,1,0,0,0,0|2,1,0]=4 2332 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Cl)Cl 62a_200000035511_100000210760 [0,1,0,0,0,0|2,1,0]=4 2333 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Cl)F 62a_100000210624_100010079234 [0,1,0,0,0,0|2,1,0]=4 2334 B14R1.3152 Cc1cc(cc(c1SCC(C)C)Cl)F 62a_100010079234_100000210760 [0,1,0,0,0,0|2,1,0]=4 2335 B14R1.3152 Cc1cc(cc(c1SCC(C)C)F)F 62a_100000210624_100015332101 [0,1,0,0,0,0|2,1,0]=4 2336 B14R1.3152 Cc1cc(cc(c1SCC(C)C)F)F 62a_100015332101_100000210760 [0,1,0,0,0,0|2,1,0]=4 2337 B14R1.3152 Cc1cc(cc(c1SCC(C)C)F)N 62a_100000210624_100010115923 [0,1,0,0,0,0|2,1,0]=4 2338 B14R1.3152 Cc1cc(cc(c1SCC(C)C)F)N 62a_100010115923_100000210760 [0,1,0,0,0,0|2,1,0]=4 2339 B14R1.3152 Cc1cc(cc(c1SCC(C)C)N)Cl 62a_100000210624_100000698757 [0,1,0,0,0,0|2,1,0]=4 2340 B14R1.3152 Cc1cc(cc(c1SCC(C)C)N)Cl 62a_100000698757_100000210760 [0,1,0,0,0,0|2,1,0]=4 2341 B14R1.3152 Cc1cc(cc(c1SCC(C)C)O)Cl 62a_100000210624_100010254216 [0,1,0,0,0,0|2,1,0]=4 2342 B14R1.3152 Cc1cc(cc(c1SCC(C)C)O)Cl 62a_100010254216_100000210760 [0,1,0,0,0,0|2,1,0]=4 2343 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Br)Br 62a_100011218427_200010208242 [0,1,0,0,0,0|2,1,0]=4 2344 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Br)Br 62a_200010208242_100011218427 [0,1,0,0,0,0|2,1,0]=4 2345 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Br)F 62a_100010208209_100011218427 [0,1,0,0,0,0|2,1,0]=4 2346 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Br)F 62a_100011218427_100010208209 [0,1,0,0,0,0|2,1,0]=4 2347 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)Br 62a_100009814048_100011218427 [0,1,0,0,0,0|1,1,0]=3 2348 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)Br 62a_100011218427_100009814048 [0,1,0,0,0,0|1,1,0]=3 2349 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)Cl 62a_100010244930_100011218427 [0,1,0,0,0,0|1,1,0]=3 2350 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)Cl 62a_100011218427_100010244930 [0,1,0,0,0,0|1,1,0]=3 2351 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)F 62a_100011218427_100012356666 [0,1,0,0,0,0|1,1,0]=3 2352 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)F 62a_100012356666_100011218427 [0,1,0,0,0,0|1,1,0]=3 2353 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)N 62a_100000215964_100011218427 [0,1,0,0,0,0|1,1,0]=3 2354 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)N 62a_100011218427_100000215964 [0,1,0,0,0,0|1,1,0]=3 2355 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)O 62a_100000243743_100011218427 [0,1,0,0,0,0|1,1,0]=3 2356 B14R1.3152 Cc1cc(cc(c1SCC(C)O)C)O 62a_100011218427_100000243743 [0,1,0,0,0,0|1,1,0]=3 2357 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Cl)Cl 62a_100011218427_200000035511 [0,1,0,0,0,0|2,1,0]=4 2358 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Cl)Cl 62a_200000035511_100011218427 [0,1,0,0,0,0|2,1,0]=4 2359 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Cl)F 62a_100010079234_100011218427 [0,1,0,0,0,0|2,1,0]=4 2360 B14R1.3152 Cc1cc(cc(c1SCC(C)O)Cl)F 62a_100011218427_100010079234 [0,1,0,0,0,0|2,1,0]=4 2361 B14R1.3152 Cc1cc(cc(c1SCC(C)O)F)F 62a_100011218427_100015332101 [0,1,0,0,0,0|2,1,0]=4 2362 B14R1.3152 Cc1cc(cc(c1SCC(C)O)F)F 62a_100015332101_100011218427 [0,1,0,0,0,0|2,1,0]=4 2363 B14R1.3152 Cc1cc(cc(c1SCC(C)O)F)N 62a_100010115923_100011218427 [0,1,0,0,0,0|2,1,0]=4 2364 B14R1.3152 Cc1cc(cc(c1SCC(C)O)F)N 62a_100011218427_100010115923 [0,1,0,0,0,0|2,1,0]=4 2365 B14R1.3152 Cc1cc(cc(c1SCC(C)O)N)Cl 62a_100000698757_100011218427 [0,1,0,0,0,0|2,1,0]=4 2366 B14R1.3152 Cc1cc(cc(c1SCC(C)O)N)Cl 62a_100011218427_100000698757 [0,1,0,0,0,0|2,1,0]=4 2367 B14R1.3152 Cc1cc(cc(c1SCC(C)O)O)Cl 62a_100010254216_100011218427 [0,1,0,0,0,0|2,1,0]=4 2368 B14R1.3152 Cc1cc(cc(c1SCC(C)O)O)Cl 62a_100011218427_100010254216 [0,1,0,0,0,0|2,1,0]=4 2369 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)Br 62a_100009814048_100011934356 [0,1,0,0,0,0|2,1,0]=4 2370 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)Br 62a_100011934356_100009814048 [0,1,0,0,0,0|2,1,0]=4 2371 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)Cl 62a_100010244930_100011934356 [0,1,0,0,0,0|2,1,0]=4 2372 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)Cl 62a_100011934356_100010244930 [0,1,0,0,0,0|2,1,0]=4 2373 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)F 62a_100011934356_100012356666 [0,1,0,0,0,0|2,1,0]=4 2374 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)F 62a_100012356666_100011934356 [0,1,0,0,0,0|2,1,0]=4 2375 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)N 62a_100000215964_100011934356 [0,1,0,0,0,0|2,1,0]=4 2376 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)N 62a_100011934356_100000215964 [0,1,0,0,0,0|2,1,0]=4 2377 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)O 62a_100000243743_100011934356 [0,1,0,0,0,0|2,1,0]=4 2378 B14R1.3152 Cc1cc(cc(c1SCC(F)F)C)O 62a_100011934356_100000243743 [0,1,0,0,0,0|2,1,0]=4 2379 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Br)Br 62a_100009817552_200010208242 [0,1,0,0,0,0|2,1,0]=4 2380 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Br)Br 62a_200010208242_100009817552 [0,1,0,0,0,0|2,1,0]=4 2381 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Br)F 62a_100009817552_100010208209 [0,1,0,0,0,0|2,1,0]=4 2382 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Br)F 62a_100010208209_100009817552 [0,1,0,0,0,0|2,1,0]=4 2383 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)Br 62a_100009814048_100009817552 [0,1,0,0,0,0|1,1,0]=3 2384 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)Br 62a_100009817552_100009814048 [0,1,0,0,0,0|1,1,0]=3 2385 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)Cl 62a_100009817552_100010244930 [0,1,0,0,0,0|1,1,0]=3 2386 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)Cl 62a_100010244930_100009817552 [0,1,0,0,0,0|1,1,0]=3 2387 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)F 62a_100009817552_100012356666 [0,1,0,0,0,0|1,1,0]=3 2388 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)F 62a_100012356666_100009817552 [0,1,0,0,0,0|1,1,0]=3 2389 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)N 62a_100000215964_100009817552 [0,1,0,0,0,0|1,1,0]=3 2390 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)N 62a_100009817552_100000215964 [0,1,0,0,0,0|1,1,0]=3 2391 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)O 62a_100000243743_100009817552 [0,1,0,0,0,0|1,1,0]=3 2392 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)C)O 62a_100009817552_100000243743 [0,1,0,0,0,0|1,1,0]=3 2393 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Cl)Cl 62a_100009817552_200000035511 [0,1,0,0,0,0|2,1,0]=4 2394 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Cl)Cl 62a_200000035511_100009817552 [0,1,0,0,0,0|2,1,0]=4 2395 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Cl)F 62a_100009817552_100010079234 [0,1,0,0,0,0|2,1,0]=4 2396 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)Cl)F 62a_100010079234_100009817552 [0,1,0,0,0,0|2,1,0]=4 2397 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)F)F 62a_100009817552_100015332101 [0,1,0,0,0,0|2,1,0]=4 2398 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)F)F 62a_100015332101_100009817552 [0,1,0,0,0,0|2,1,0]=4 2399 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)F)N 62a_100009817552_100010115923 [0,1,0,0,0,0|2,1,0]=4 2400 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)F)N 62a_100010115923_100009817552 [0,1,0,0,0,0|2,1,0]=4 2401 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)N)Cl 62a_100000698757_100009817552 [0,1,0,0,0,0|2,1,0]=4 2402 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)N)Cl 62a_100009817552_100000698757 [0,1,0,0,0,0|2,1,0]=4 2403 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)O)Cl 62a_100009817552_100010254216 [0,1,0,0,0,0|2,1,0]=4 2404 B14R1.3152 Cc1cc(cc(c1SC[C@@H](C)O)O)Cl 62a_100010254216_100009817552 [0,1,0,0,0,0|2,1,0]=4 2405 B14R1.3152 Cc1cc(nc(c1SCC(C)C)C)N 62a_100000210624_100000699364 [0,1,0,0,0,0|2,1,0]=4 2406 B14R1.3152 Cc1cc(nc(c1SCC(C)C)C)N 62a_100000699364_100000210760 [0,1,0,0,0,0|2,1,0]=4 2407 B14R1.3152 Cc1cc(nc(c1SCC(C)O)C)N 62a_100000699364_100011218427 [0,1,0,0,0,0|2,1,0]=4 2408 B14R1.3152 Cc1cc(nc(c1SCC(C)O)C)N 62a_100011218427_100000699364 [0,1,0,0,0,0|2,1,0]=4 2409 B14R1.3152 Cc1cc(nc(c1SC[C@@H](C)O)C)N 62a_100000699364_100009817552 [0,1,0,0,0,0|2,1,0]=4 2410 B14R1.3152 Cc1cc(nc(c1SC[C@@H](C)O)C)N 62a_100009817552_100000699364 [0,1,0,0,0,0|2,1,0]=4 2411 B14R1.3152 Cc1nc(cc(c1OCC(C)C)Br)Br 34a_200010233669_100000210624 [0,1,0,0,0,0|3,0,0]=4 2412 B14R1.3152 Cc1nc(cc(c1OCC(C)C)Br)Br 7a_200010233669_100000210760 [0,1,0,0,0,0|3,0,0]=4 2413 B14R1.3152 Cc1nc(cc(c1OCC(C)O)Br)Br 34a_200010233669_100011218427 [0,1,0,0,0,0|3,0,0]=4 2414 B14R1.3152 Cc1nc(cc(c1OCC(C)O)Br)Br 7a_200010233669_100011218427 [0,1,0,0,0,0|3,0,0]=4 2415 B14R1.3152 Cc1nc(cc(c1OC[C@@H](C)O)Br)Br 34a_200010233669_100009817552 [0,1,0,0,0,0|3,0,0]=4 2416 B14R1.3152 Cc1nc(cc(c1OC[C@@H](C)O)Br)Br 7a_200010233669_100009817552 [0,1,0,0,0,0|3,0,0]=4 2417 B14R1.4921 CC(C)(C)COc1c(cccc1Br)Br 34a_100000736428_100011219605 [0,1,0,0,0,0|3,0,0]=4 2418 B14R1.4921 CC(C)(C)COc1c(cccc1Br)Cl 34a_100010214474_100011219605 [0,1,0,0,0,0|3,0,0]=4 2419 B14R1.4921 CC(C)(C)COc1c(cccc1Br)F 34a_100009813666_100011219605 [0,1,0,0,0,0|3,0,0]=4 2420 B14R1.4921 CC(C)(C)COc1c(cccc1Br)N 34a_100011934915_100011219605 [0,1,0,0,0,0|3,0,0]=4 2421 B14R1.4921 CC(C)(C)COc1c(cccc1Cl)Cl 34a_100000211709_100011219605 [0,1,0,0,0,0|3,0,0]=4 2422 B14R1.4921 CC(C)(C)COc1c(cccc1Cl)F 34a_100000694953_100011219605 [0,1,0,0,0,0|3,0,0]=4 2423 B14R1.4921 CC(C)(C)COc1c(cccc1Cl)N 34a_100000754742_100011219605 [0,1,0,0,0,0|3,0,0]=4 2424 B14R1.4921 CC(C)(C)COc1c(cccc1F)F 34a_100000230165_100011219605 [0,1,0,0,0,0|3,0,0]=4 2425 B14R1.4921 CC(C)(C)COc1c(cccc1F)N 34a_100011934987_100011219605 [0,1,0,0,0,0|3,0,0]=4 2426 B14R1.4921 CC(C)(C)COc1c(cccc1I)Br 34a_100010084509_100011219605 [0,1,0,0,0,0|3,0,0]=4 2427 B14R1.4921 CC(C)(C)COc1c(cccc1I)Cl 34a_100010202889_100011219605 [0,1,0,0,0,0|3,0,0]=4 2428 B14R1.4921 CC(C)(C)COc1c(cccc1I)F 34a_100010186298_100011219605 [0,1,0,0,0,0|3,0,0]=4 2429 B14R1.4921 CC(C)(C)COc1c(cccc1I)N 34a_100010084371_100011219605 [0,1,0,0,0,0|3,0,0]=4 2430 B14R1.4921 CC(C)(C)COc1c(cccc1N)N 34a_200016994477_100011219605 [0,1,0,0,0,0|3,0,0]=4 2431 B14R1.4921 CC(C)(F)COc1c(cccc1Br)Br 34a_100000736428_100011997219 [0,1,0,0,0,0|3,0,0]=4 2432 B14R1.4921 CC(C)(F)COc1c(cccc1Br)Cl 34a_100010214474_100011997219 [0,1,0,0,0,0|3,0,0]=4 2433 B14R1.4921 CC(C)(F)COc1c(cccc1Br)F 34a_100009813666_100011997219 [0,1,0,0,0,0|3,0,0]=4 2434 B14R1.4921 CC(C)(F)COc1c(cccc1Br)N 34a_100011934915_100011997219 [0,1,0,0,0,0|3,0,0]=4 2435 B14R1.4921 CC(C)(F)COc1c(cccc1Cl)Cl 34a_100000211709_100011997219 [0,1,0,0,0,0|3,0,0]=4 2436 B14R1.4921 CC(C)(F)COc1c(cccc1Cl)F 34a_100000694953_100011997219 [0,1,0,0,0,0|3,0,0]=4 2437 B14R1.4921 CC(C)(F)COc1c(cccc1Cl)N 34a_100000754742_100011997219 [0,1,0,0,0,0|3,0,0]=4 2438 B14R1.4921 CC(C)(F)COc1c(cccc1F)F 34a_100000230165_100011997219 [0,1,0,0,0,0|3,0,0]=4 2439 B14R1.4921 CC(C)(F)COc1c(cccc1F)N 34a_100011934987_100011997219 [0,1,0,0,0,0|3,0,0]=4 2440 B14R1.4921 CC(C)(F)COc1c(cccc1I)Br 34a_100010084509_100011997219 [0,1,0,0,0,0|3,0,0]=4 2441 B14R1.4921 CC(C)(F)COc1c(cccc1I)Cl 34a_100010202889_100011997219 [0,1,0,0,0,0|3,0,0]=4 2442 B14R1.4921 CC(C)(F)COc1c(cccc1I)F 34a_100010186298_100011997219 [0,1,0,0,0,0|3,0,0]=4 2443 B14R1.4921 CC(C)(F)COc1c(cccc1I)N 34a_100010084371_100011997219 [0,1,0,0,0,0|3,0,0]=4 2444 B14R1.4921 CC(C)(F)COc1c(cccc1N)N 34a_200016994477_100011997219 [0,1,0,0,0,0|3,0,0]=4 2445 B14R1.4921 CC(C)(O)COc1c(cccc1Br)Br 34a_100000736428_100000764493 [0,1,0,0,0,0|3,0,0]=4 2446 B14R1.4921 CC(C)(O)COc1c(cccc1Br)Br 7a_100000736428_100000764493 [0,1,0,0,0,0|3,0,0]=4 2447 B14R1.4921 CC(C)(O)COc1c(cccc1Br)Cl 34a_100010214474_100000764493 [0,1,0,0,0,0|3,0,0]=4 2448 B14R1.4921 CC(C)(O)COc1c(cccc1Br)Cl 7a_100010214474_100000764493 [0,1,0,0,0,0|3,0,0]=4 2449 B14R1.4921 CC(C)(O)COc1c(cccc1Br)F 34a_100009813666_100000764493 [0,1,0,0,0,0|3,0,0]=4 2450 B14R1.4921 CC(C)(O)COc1c(cccc1Br)F 7a_100009813666_100000764493 [0,1,0,0,0,0|3,0,0]=4 2451 B14R1.4921 CC(C)(O)COc1c(cccc1Br)N 34a_100011934915_100000764493 [0,1,0,0,0,0|3,0,0]=4 2452 B14R1.4921 CC(C)(O)COc1c(cccc1Cl)Cl 34a_100000211709_100000764493 [0,1,0,0,0,0|3,0,0]=4 2453 B14R1.4921 CC(C)(O)COc1c(cccc1Cl)Cl 7a_100000211709_100000764493 [0,1,0,0,0,0|3,0,0]=4 2454 B14R1.4921 CC(C)(O)COc1c(cccc1Cl)F 34a_100000694953_100000764493 [0,1,0,0,0,0|3,0,0]=4 2455 B14R1.4921 CC(C)(O)COc1c(cccc1Cl)F 7a_100000694953_100000764493 [0,1,0,0,0,0|3,0,0]=4 2456 B14R1.4921 CC(C)(O)COc1c(cccc1Cl)N 34a_100000754742_100000764493 [0,1,0,0,0,0|3,0,0]=4 2457 B14R1.4921 CC(C)(O)COc1c(cccc1F)F 34a_100000230165_100000764493 [0,1,0,0,0,0|3,0,0]=4 2458 B14R1.4921 CC(C)(O)COc1c(cccc1F)F 7a_100000230165_100000764493 [0,1,0,0,0,0|3,0,0]=4 2459 B14R1.4921 CC(C)(O)COc1c(cccc1F)N 34a_100011934987_100000764493 [0,1,0,0,0,0|3,0,0]=4 2460 B14R1.4921 CC(C)(O)COc1c(cccc1I)Br 34a_100010084509_100000764493 [0,1,0,0,0,0|3,0,0]=4 2461 B14R1.4921 CC(C)(O)COc1c(cccc1I)Br 7a_100010084509_100000764493 [0,1,0,0,0,0|3,0,0]=4 2462 B14R1.4921 CC(C)(O)COc1c(cccc1I)Cl 34a_100010202889_100000764493 [0,1,0,0,0,0|3,0,0]=4 2463 B14R1.4921 CC(C)(O)COc1c(cccc1I)Cl 7a_100010202889_100000764493 [0,1,0,0,0,0|3,0,0]=4 2464 B14R1.4921 CC(C)(O)COc1c(cccc1I)F 34a_100010186298_100000764493 [0,1,0,0,0,0|3,0,0]=4 2465 B14R1.4921 CC(C)(O)COc1c(cccc1I)F 7a_100010186298_100000764493 [0,1,0,0,0,0|3,0,0]=4 2466 B14R1.4921 CC(C)(O)COc1c(cccc1I)N 34a_100010084371_100000764493 [0,1,0,0,0,0|3,0,0]=4 2467 B14R1.4921 CC(C)(O)COc1c(cccc1N)N 34a_200016994477_100000764493 [0,1,0,0,0,0|3,0,0]=4 2468 B14R1.4921 Cc1cccc(c1C=CC(C)(C)C)C 271570a_100102527731_100000033847 [0,1,0,0,0,0|2,0,1]=4 2469 B14R1.4921 Cc1cccc(c1C=CC(C)(C)O)C 271570a_200016258132_100000033847 [0,1,0,0,0,0|2,0,1]=4 2470 B14R1.4921 Cc1cccc(c1CNC(C)(C)C)C 207a_100000715429_100000758299 [0,1,0,0,0,0|3,0,0]=4 2471 B14R1.4921 Cc1cccc(c1CNC(C)(C)C)C 2230a_100000715429_100000758300 [0,1,0,0,0,0|3,0,0]=4 2472 B14R1.4921 Cc1cccc(c1CNC(C)(C)C)C 34a_100000689800_100000210625 [0,1,0,0,0,0|3,0,0]=4 2473 B14R1.4921 Cc1cccc(c1COC(C)(C)C)C 34a_100011933981_100000210625 [0,1,0,0,0,0|3,0,0]=4 2474 B14R1.4921 Cc1cccc(c1COC(C)(C)C)C 34a_100015890283_100000758300 [0,1,0,0,0,0|3,0,0]=4 2475 B14R1.4921 Cc1cccc(c1COC(C)(C)C)C 7a_100015890283_100000758300 [0,1,0,0,0,0|3,0,0]=4 2476 B14R1.4921 Cc1cccc(c1CSC(C)(C)C)C 62a_100000211941_100000758300 [0,1,0,0,0,0|3,0,0]=4 2477 B14R1.4921 Cc1cccc(c1CSC(C)(C)C)C 62a_100000758300_100000211941 [0,1,0,0,0,0|3,0,0]=4 2478 B14R1.4921 Cc1cccc(c1NCC(C)(C)C)Br 34a_100011834072_100011219605 [0,1,0,0,0,0|3,0,0]=4 2479 B14R1.4921 Cc1cccc(c1NCC(C)(C)C)C 34a_100000185769_100011219605 [0,1,0,0,0,0|2,0,0]=3 2480 B14R1.4921 Cc1cccc(c1NCC(C)(C)C)Cl 34a_100000756524_100011219605 [0,1,0,0,0,0|3,0,0]=4 2481 B14R1.4921 Cc1cccc(c1NCC(C)(C)C)F 34a_100000766463_100011219605 [0,1,0,0,0,0|3,0,0]=4 2482 B14R1.4921 Cc1cccc(c1NCC(C)(C)C)O 34a_100000743429_100011219605 [0,1,0,0,0,0|3,0,0]=4 2483 B14R1.4921 Cc1cccc(c1NCC(C)(C)F)Br 34a_100011834072_100011997219 [0,1,0,0,0,0|3,0,0]=4 2484 B14R1.4921 Cc1cccc(c1NCC(C)(C)F)C 34a_100000185769_100011997219 [0,1,0,0,0,0|2,0,0]=3 2485 B14R1.4921 Cc1cccc(c1NCC(C)(C)F)Cl 34a_100000756524_100011997219 [0,1,0,0,0,0|3,0,0]=4 2486 B14R1.4921 Cc1cccc(c1NCC(C)(C)F)F 34a_100000766463_100011997219 [0,1,0,0,0,0|3,0,0]=4 2487 B14R1.4921 Cc1cccc(c1NCC(C)(C)F)O 34a_100000743429_100011997219 [0,1,0,0,0,0|3,0,0]=4 2488 B14R1.4921 Cc1cccc(c1NCC(C)(C)O)Br 34a_100011834072_100000764493 [0,1,0,0,0,0|3,0,0]=4 2489 B14R1.4921 Cc1cccc(c1NCC(C)(C)O)C 34a_100000185769_100000764493 [0,1,0,0,0,0|2,0,0]=3 2490 B14R1.4921 Cc1cccc(c1NCC(C)(C)O)Cl 34a_100000756524_100000764493 [0,1,0,0,0,0|3,0,0]=4 2491 B14R1.4921 Cc1cccc(c1NCC(C)(C)O)F 34a_100000766463_100000764493 [0,1,0,0,0,0|3,0,0]=4 2492 B14R1.4921 Cc1cccc(c1NCC(C)(C)O)O 34a_100000743429_100000764493 [0,1,0,0,0,0|3,0,0]=4 2493 B14R1.4921 Cc1cccc(c1OCC(C)(C)C)Br 34a_100009817157_100011219605 [0,1,0,0,0,0|2,0,0]=3 2494 B14R1.4921 Cc1cccc(c1OCC(C)(C)C)C 34a_100000210341_100011219605 [0,1,0,0,0,0|1,0,0]=2 2495 B14R1.4921 Cc1cccc(c1OCC(C)(C)C)Cl 34a_100000033731_100011219605 [0,1,0,0,0,0|2,0,0]=3 2496 B14R1.4921 Cc1cccc(c1OCC(C)(C)C)F 34a_100011659162_100011219605 [0,1,0,0,0,0|2,0,0]=3 2497 B14R1.4921 Cc1cccc(c1OCC(C)(C)C)N 34a_100000756359_100011219605 [0,1,0,0,0,0|2,0,0]=3 2498 B14R1.4921 Cc1cccc(c1OCC(C)(C)F)Br 34a_100009817157_100011997219 [0,1,0,0,0,0|2,0,0]=3 2499 B14R1.4921 Cc1cccc(c1OCC(C)(C)F)C 34a_100000210341_100011997219 [0,1,0,0,0,0|1,0,0]=2 2500 B14R1.4921 Cc1cccc(c1OCC(C)(C)F)Cl 34a_100000033731_100011997219 [0,1,0,0,0,0|2,0,0]=3 2501 B14R1.4921 Cc1cccc(c1OCC(C)(C)F)F 34a_100011659162_100011997219 [0,1,0,0,0,0|2,0,0]=3 2502 B14R1.4921 Cc1cccc(c1OCC(C)(C)F)N 34a_100000756359_100011997219 [0,1,0,0,0,0|2,0,0]=3 2503 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)Br 34a_100009817157_100000764493 [0,1,0,0,0,0|2,0,0]=3 2504 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)Br 7a_100009817157_100000764493 [0,1,0,0,0,0|2,0,0]=3 2505 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)C 34a_100000210341_100000764493 [0,1,0,0,0,0|1,0,0]=2 2506 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)C 7a_100000210341_100000764493 [0,1,0,0,0,0|1,0,0]=2 2507 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)Cl 34a_100000033731_100000764493 [0,1,0,0,0,0|2,0,0]=3 2508 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)Cl 7a_100000033731_100000764493 [0,1,0,0,0,0|2,0,0]=3 2509 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)F 34a_100011659162_100000764493 [0,1,0,0,0,0|2,0,0]=3 2510 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)F 7a_100011659162_100000764493 [0,1,0,0,0,0|2,0,0]=3 2511 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)N 34a_100000756359_100000764493 [0,1,0,0,0,0|2,0,0]=3 2512 B14R1.4921 Cc1cccc(c1OCC(C)(C)O)N 7a_100000756359_100000764493 [0,1,0,0,0,0|2,0,0]=3 2513 B14R1.4921 Cc1cccc(c1OCS(=O)(=O)[O-])C 34a_100000210341_100009817235 [0,1,0,0,0,0|3,0,0]=4 2514 B14R1.4921 Cc1cccc(c1OC[Si](C)(C)C)Br 7a_100009817157_100000233785 [0,1,0,0,0,0|2,1,0]=4 2515 B14R1.4921 Cc1cccc(c1OC[Si](C)(C)C)C 7a_100000210341_100000233785 [0,1,0,0,0,0|1,1,0]=3 2516 B14R1.4921 Cc1cccc(c1OC[Si](C)(C)C)Cl 7a_100000033731_100000233785 [0,1,0,0,0,0|2,1,0]=4 2517 B14R1.4921 Cc1cccc(c1OC[Si](C)(C)C)F 7a_100011659162_100000233785 [0,1,0,0,0,0|2,1,0]=4 2518 B14R1.4921 Cc1cccc(c1OC[Si](C)(C)C)N 7a_100000756359_100000233785 [0,1,0,0,0,0|2,1,0]=4 2519 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)Br 62a_100010141302_100011219605 [0,1,0,0,0,0|2,1,0]=4 2520 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)Br 62a_100011219605_100010141302 [0,1,0,0,0,0|2,1,0]=4 2521 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)C 62a_100000033847_100011219605 [0,1,0,0,0,0|1,1,0]=3 2522 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)C 62a_100011219605_100000033847 [0,1,0,0,0,0|1,1,0]=3 2523 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)Cl 62a_100000043165_100011219605 [0,1,0,0,0,0|2,1,0]=4 2524 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)Cl 62a_100011219605_100000043165 [0,1,0,0,0,0|2,1,0]=4 2525 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)F 62a_100011218421_100011219605 [0,1,0,0,0,0|2,1,0]=4 2526 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)F 62a_100011219605_100011218421 [0,1,0,0,0,0|2,1,0]=4 2527 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)N 62a_100000684715_100011219605 [0,1,0,0,0,0|2,1,0]=4 2528 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)N 62a_100011219605_100000684715 [0,1,0,0,0,0|2,1,0]=4 2529 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)O 62a_100000686692_100011219605 [0,1,0,0,0,0|2,1,0]=4 2530 B14R1.4921 Cc1cccc(c1SCC(C)(C)C)O 62a_100011219605_100000686692 [0,1,0,0,0,0|2,1,0]=4 2531 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)Br 62a_100010141302_100011997219 [0,1,0,0,0,0|2,1,0]=4 2532 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)Br 62a_100011997219_100010141302 [0,1,0,0,0,0|2,1,0]=4 2533 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)C 62a_100000033847_100011997219 [0,1,0,0,0,0|1,1,0]=3 2534 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)C 62a_100011997219_100000033847 [0,1,0,0,0,0|1,1,0]=3 2535 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)Cl 62a_100000043165_100011997219 [0,1,0,0,0,0|2,1,0]=4 2536 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)Cl 62a_100011997219_100000043165 [0,1,0,0,0,0|2,1,0]=4 2537 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)F 62a_100011218421_100011997219 [0,1,0,0,0,0|2,1,0]=4 2538 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)F 62a_100011997219_100011218421 [0,1,0,0,0,0|2,1,0]=4 2539 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)N 62a_100000684715_100011997219 [0,1,0,0,0,0|2,1,0]=4 2540 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)N 62a_100011997219_100000684715 [0,1,0,0,0,0|2,1,0]=4 2541 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)O 62a_100000686692_100011997219 [0,1,0,0,0,0|2,1,0]=4 2542 B14R1.4921 Cc1cccc(c1SCC(C)(C)F)O 62a_100011997219_100000686692 [0,1,0,0,0,0|2,1,0]=4 2543 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)Br 62a_100000764493_100010141302 [0,1,0,0,0,0|2,1,0]=4 2544 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)Br 62a_100010141302_100000764493 [0,1,0,0,0,0|2,1,0]=4 2545 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)C 62a_100000033847_100000764493 [0,1,0,0,0,0|1,1,0]=3 2546 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)C 62a_100000764493_100000033847 [0,1,0,0,0,0|1,1,0]=3 2547 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)Cl 62a_100000043165_100000764493 [0,1,0,0,0,0|2,1,0]=4 2548 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)Cl 62a_100000764493_100000043165 [0,1,0,0,0,0|2,1,0]=4 2549 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)F 62a_100000764493_100011218421 [0,1,0,0,0,0|2,1,0]=4 2550 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)F 62a_100011218421_100000764493 [0,1,0,0,0,0|2,1,0]=4 2551 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)N 62a_100000684715_100000764493 [0,1,0,0,0,0|2,1,0]=4 2552 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)N 62a_100000764493_100000684715 [0,1,0,0,0,0|2,1,0]=4 2553 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)O 62a_100000686692_100000764493 [0,1,0,0,0,0|2,1,0]=4 2554 B14R1.4921 Cc1cccc(c1SCC(C)(C)O)O 62a_100000764493_100000686692 [0,1,0,0,0,0|2,1,0]=4 2555 B14R1.4921 Cc1cccc(c1SCC(F)(F)F)C 62a_100000033847_100000763148 [0,1,0,0,0,0|2,1,0]=4 2556 B14R1.4921 Cc1cccc(c1SCC(F)(F)F)C 62a_100000763148_100000033847 [0,1,0,0,0,0|2,1,0]=4 2557 B14R1.4921 Cc1cccc(c1SCS(=O)(=O)N)C 62a_100000033847_100000741382 [0,1,0,0,0,0|2,1,0]=4 2558 B14R1.4921 Cc1cccc(c1SCS(=O)(=O)N)C 62a_100000741382_100000033847 [0,1,0,0,0,0|2,1,0]=4 2559 B14R1.4921 Cc1cccc(c1SC[N+](C)(C)C)C 62a_100000033847_200000036245 [0,1,0,0,0,0|2,1,0]=4 2560 B14R1.4921 Cc1cccc(c1SC[N+](C)(C)C)C 62a_200000036245_100000033847 [0,1,0,0,0,0|2,1,0]=4 2561 B14R1.4921 Cc1cccc(c1SC[Si](C)(C)C)C 62a_100000033847_100000037933 [0,1,0,0,0,0|1,2,0]=4 2562 B14R1.4921 Cc1cccc(c1SC[Si](C)(C)C)C 62a_100000037933_100000033847 [0,1,0,0,0,0|1,2,0]=4 2563 B14R1.4921 Cc1ccnc(c1OCC(C)(C)C)C 34a_100011934651_100011219605 [0,1,0,0,0,0|2,0,0]=3 2564 B14R1.4921 Cc1ccnc(c1OCC(C)(C)C)Cl 34a_100000696282_100011219605 [0,1,0,0,0,0|3,0,0]=4 2565 B14R1.4921 Cc1ccnc(c1OCC(C)(C)F)C 34a_100011934651_100011997219 [0,1,0,0,0,0|2,0,0]=3 2566 B14R1.4921 Cc1ccnc(c1OCC(C)(C)F)Cl 34a_100000696282_100011997219 [0,1,0,0,0,0|3,0,0]=4 2567 B14R1.4921 Cc1ccnc(c1OCC(C)(C)O)C 34a_100011934651_100000764493 [0,1,0,0,0,0|2,0,0]=3 2568 B14R1.4921 Cc1ccnc(c1OCC(C)(C)O)C 7a_100011934651_100000764493 [0,1,0,0,0,0|2,0,0]=3 2569 B14R1.4921 Cc1ccnc(c1OCC(C)(C)O)Cl 34a_100000696282_100000764493 [0,1,0,0,0,0|3,0,0]=4 2570 B14R1.4921 Cc1ccnc(c1OCC(C)(C)O)Cl 7a_100000696282_100000764493 [0,1,0,0,0,0|3,0,0]=4 2571 B14R1.4921 Cc1ccnc(c1OC[Si](C)(C)C)C 7a_100011934651_100000233785 [0,1,0,0,0,0|2,1,0]=4 2572 B14R1.4921 Cc1ccnc(c1SCC(C)(C)C)C 62a_100011219605_100012000501 [0,1,0,0,0,0|2,1,0]=4 2573 B14R1.4921 Cc1ccnc(c1SCC(C)(C)C)C 62a_100012000501_100011219605 [0,1,0,0,0,0|2,1,0]=4 2574 B14R1.4921 Cc1ccnc(c1SCC(C)(C)F)C 62a_100011997219_100012000501 [0,1,0,0,0,0|2,1,0]=4 2575 B14R1.4921 Cc1ccnc(c1SCC(C)(C)F)C 62a_100012000501_100011997219 [0,1,0,0,0,0|2,1,0]=4 2576 B14R1.4921 Cc1ccnc(c1SCC(C)(C)O)C 62a_100000764493_100012000501 [0,1,0,0,0,0|2,1,0]=4 2577 B14R1.4921 Cc1ccnc(c1SCC(C)(C)O)C 62a_100012000501_100000764493 [0,1,0,0,0,0|2,1,0]=4 2578 B14R1.4921 Cc1cncc(c1SCC(C)(C)C)C 62a_100009817138_100011219605 [0,1,0,0,0,0|2,1,0]=4 2579 B14R1.4921 Cc1cncc(c1SCC(C)(C)C)C 62a_100011219605_100009817138 [0,1,0,0,0,0|2,1,0]=4 2580 B14R1.4921 Cc1cncc(c1SCC(C)(C)F)C 62a_100009817138_100011997219 [0,1,0,0,0,0|2,1,0]=4 2581 B14R1.4921 Cc1cncc(c1SCC(C)(C)F)C 62a_100011997219_100009817138 [0,1,0,0,0,0|2,1,0]=4 2582 B14R1.4921 Cc1cncc(c1SCC(C)(C)O)C 62a_100000764493_100009817138 [0,1,0,0,0,0|2,1,0]=4 2583 B14R1.4921 Cc1cncc(c1SCC(C)(C)O)C 62a_100009817138_100000764493 [0,1,0,0,0,0|2,1,0]=4 2584 B14R1.4921 Cc1ncnc(c1OCC(C)(C)C)C 34a_100009878406_100011219605 [0,1,0,0,0,0|3,0,0]=4 2585 B14R1.4921 Cc1ncnc(c1OCC(C)(C)F)C 34a_100009878406_100011997219 [0,1,0,0,0,0|3,0,0]=4 2586 B14R1.4921 Cc1ncnc(c1OCC(C)(C)O)C 34a_100009878406_100000764493 [0,1,0,0,0,0|3,0,0]=4 2587 B14R1.4921 Cc1ncnc(c1OCC(C)(C)O)C 7a_100009878406_100000764493 [0,1,0,0,0,0|3,0,0]=4 2588 B14R1.4921 Cc1occc(=O)c1OCC(C)(C)C 34a_100000031901_100011219605 [0,1,0,0,0,0|3,0,0]=4 2589 B14R1.4921 Cc1occc(=O)c1OCC(C)(C)F 34a_100000031901_100011997219 [0,1,0,0,0,0|3,0,0]=4 2590 B14R1.4921 Cc1occc(=O)c1OCC(C)(C)O 34a_100000031901_100000764493 [0,1,0,0,0,0|3,0,0]=4 2591 B14R1.5958 C=C(C)CC(=O)c1c(cccc1C)C 1458a_100000758298_100000748629 [0,1,0,0,0,0|2,0,1]=4 2592 B14R1.5958 C=C(C)CN(C)c1c(cccc1C)C 2230a_100011645471_100000748629 [0,1,0,0,0,0|2,0,1]=4 2593 B14R1.5958 C=C(C)CN(C)c1c(cccc1C)C 269982a_100011645471_100000748629 [0,1,0,0,0,0|2,0,1]=4 2594 B14R1.5958 C=C(C)CN(C)c1c(cccc1C)C 34a_100011645471_100000748629 [0,1,0,0,0,0|2,0,1]=4 2595 B14R1.5958 Cc1cccc(c1C(=O)CC(=O)N)C 1458a_100000758298_100000187820 [0,1,0,0,0,0|2,0,1]=4 2596 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)Br 1458a_100000701904_100000210624 [0,1,0,0,0,0|3,0,0]=4 2597 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)C 1458a_100000758298_100000210624 [0,1,0,0,0,0|2,0,0]=3 2598 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)Cl 1458a_100000692601_100000210624 [0,1,0,0,0,0|3,0,0]=4 2599 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)F 1458a_100000762013_100000210624 [0,1,0,0,0,0|3,0,0]=4 2600 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)I 1458a_100000688020_100000210624 [0,1,0,0,0,0|3,0,0]=4 2601 B14R1.5958 Cc1cccc(c1C(=O)CC(C)C)O 1458a_100011934116_100000210624 [0,1,0,0,0,0|3,0,0]=4 2602 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)Br 1458a_100000701904_100011218427 [0,1,0,0,0,0|3,0,0]=4 2603 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)C 1458a_100000758298_100011218427 [0,1,0,0,0,0|2,0,0]=3 2604 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)Cl 1458a_100000692601_100011218427 [0,1,0,0,0,0|3,0,0]=4 2605 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)F 1458a_100000762013_100011218427 [0,1,0,0,0,0|3,0,0]=4 2606 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)I 1458a_100000688020_100011218427 [0,1,0,0,0,0|3,0,0]=4 2607 B14R1.5958 Cc1cccc(c1C(=O)CC(C)O)O 1458a_100011934116_100011218427 [0,1,0,0,0,0|3,0,0]=4 2608 B14R1.5958 Cc1cccc(c1C(=O)CC(F)F)C 1458a_100000758298_100011934356 [0,1,0,0,0,0|3,0,0]=4 2609 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)C 11a_100138425928_100000758298 [0,1,0,0,0,0|3,0,0]=4 2610 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)C 1626a_100138425928_100000758298 [0,1,0,0,0,0|3,0,0]=4 2611 B14R1.5958 Cc1cccc(c1C(=O)NC(C)C)C 240690a_100138425928_100000758298 [0,1,0,0,0,0|3,0,0]=4 2612 B14R1.5958 Cc1cccc(c1C(C)OC(C)C)C 34a_200000695261_100000210206 [0,1,0,0,0,0|3,0,0]=4 2613 B14R1.5958 Cc1cccc(c1C(C)OC(C)C)C 7a_200000695261_100000210206 [0,1,0,0,0,0|3,0,0]=4 2614 B14R1.5958 Cc1cccc(c1N(C)CC(=O)N)C 2230a_100011645471_100000747473 [0,1,0,0,0,0|2,0,1]=4 2615 B14R1.5958 Cc1cccc(c1N(C)CC(=O)N)C 269982a_100011645471_100000187820 [0,1,0,0,0,0|2,0,1]=4 2616 B14R1.5958 Cc1cccc(c1N(C)CC(=O)N)C 34a_100011645471_100000187820 [0,1,0,0,0,0|2,0,1]=4 2617 B14R1.5958 Cc1cccc(c1N(C)CC(C)C)C 2230a_100011645471_100000210760 [0,1,0,0,0,0|2,0,0]=3 2618 B14R1.5958 Cc1cccc(c1N(C)CC(C)C)C 269982a_100011645471_100000210624 [0,1,0,0,0,0|2,0,0]=3 2619 B14R1.5958 Cc1cccc(c1N(C)CC(C)C)C 34a_100011645471_100000210624 [0,1,0,0,0,0|2,0,0]=3 2620 B14R1.5958 Cc1cccc(c1N(C)CC(C)O)C 2230a_100011645471_100011218427 [0,1,0,0,0,0|2,0,0]=3 2621 B14R1.5958 Cc1cccc(c1N(C)CC(C)O)C 269982a_100011645471_100011218427 [0,1,0,0,0,0|2,0,0]=3 2622 B14R1.5958 Cc1cccc(c1N(C)CC(C)O)C 34a_100011645471_100011218427 [0,1,0,0,0,0|2,0,0]=3 2623 B14R1.5958 Cc1cccc(c1N(C)CC(F)F)C 2230a_100011645471_100011934356 [0,1,0,0,0,0|3,0,0]=4 2624 B14R1.5958 Cc1cccc(c1N(C)CC(F)F)C 269982a_100011645471_100011934356 [0,1,0,0,0,0|3,0,0]=4 2625 B14R1.5958 Cc1cccc(c1N(C)CC(F)F)C 34a_100011645471_100011934356 [0,1,0,0,0,0|3,0,0]=4 2626 B14R1.5958 Cc1cccc(c1N(C)C[C@@H](C)O)C 2230a_100011645471_100009817552 [0,1,0,0,0,0|2,0,0]=3 2627 B14R1.5958 Cc1cccc(c1N(C)C[C@@H](C)O)C 269982a_100011645471_100009817552 [0,1,0,0,0,0|2,0,0]=3 2628 B14R1.5958 Cc1cccc(c1N(C)C[C@@H](C)O)C 34a_100011645471_100009817552 [0,1,0,0,0,0|2,0,0]=3 2629 B14R1.5958 Cc1cccc(c1[C@@H](N)CC(C)C)C 271570a_100015190218_100000033847 [0,1,0,0,0,0|2,0,0]=3 2630 B14R1.5958 Cc1cccc(c1[C@@H](N)CC(C)C)Cl 271570a_100015190218_100000043165 [0,1,0,0,0,0|3,0,0]=4 2631 B14R1.5958 Cc1cccc(c1[C@@H](N)CC(C)C)F 271570a_100015190218_100012349962 [0,1,0,0,0,0|3,0,0]=4 2632 B14R1.5958 Cc1cccc(c1[C@@H](N)CC(C)C)N 271570a_100015190218_100000684715 [0,1,0,0,0,0|3,0,0]=4 2633 B14R1.5958 Cc1cccc(c1[C@@H](N)CC(C)C)O 271570a_100015190218_100000686692 [0,1,0,0,0,0|3,0,0]=4 2634 B14R1.5958 Cc1cccc(c1[C@H](C)NC(C)C)C 2230a_100016987977_100000210206 [0,1,0,0,0,0|3,0,0]=4 2635 B14R1.5958 Cc1cccc(c1[C@H](C)NC(C)C)C 34a_100016987977_100000210206 [0,1,0,0,0,0|3,0,0]=4 2636 B14R1.5958 Cc1ccnc(c1[C@@H](N)CC(C)C)C 271570a_100015190218_100012000501 [0,1,0,0,0,0|3,0,0]=4 2637 B14R1.5958 Cc1cncc(c1[C@@H](N)CC(C)C)C 271570a_100015190218_100009817138 [0,1,0,0,0,0|3,0,0]=4 2638 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Br)C 7a_100009817157_100000179758 [0,1,0,0,0,0|2,0,1]=4 2639 B14R1.5971 CC(=O)C(C)Oc1c(cccc1C)C 7a_100000210341_100000179758 [0,1,0,0,0,0|1,0,1]=3 2640 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Cl)C 7a_100000033731_100000179758 [0,1,0,0,0,0|2,0,1]=4 2641 B14R1.5971 CC(=O)C(C)Oc1c(cccc1F)C 7a_100011659162_100000179758 [0,1,0,0,0,0|2,0,1]=4 2642 B14R1.5971 CC(=O)C(C)Oc1c(cccc1N)C 7a_100000756359_100000179758 [0,1,0,0,0,0|2,0,1]=4 2643 B14R1.5971 CC(=O)C(C)Oc1c(ccnc1C)C 7a_100011934651_100000179758 [0,1,0,0,0,0|2,0,1]=4 2644 B14R1.5971 CC(=O)C(C)Sc1c(cccc1C)C 62a_100000033847_100009814033 [0,1,0,0,0,0|1,1,1]=4 2645 B14R1.5971 CC(=O)C(C)Sc1c(cccc1C)C 62a_100009814033_100000033847 [0,1,0,0,0,0|1,1,1]=4 2646 B14R1.5971 Cc1cccc(c1CC(=O)C(C)C)C 1458a_100000210198_100000758300 [0,1,0,0,0,0|2,0,1]=4 2647 B14R1.5971 Cc1cccc(c1CC(=O)C(C)C)C 1458a_100000689862_100000210206 [0,1,0,0,0,0|2,0,1]=4 2648 B14R1.5971 Cc1cccc(c1CC(=O)C(C)F)C 1458a_100000062450_100000758300 [0,1,0,0,0,0|2,0,1]=4 2649 B14R1.5971 Cc1cccc(c1CC(=O)[C@@H](C)O)C 1458a_100000717761_100000758300 [0,1,0,0,0,0|2,0,1]=4 2650 B14R1.5971 Cc1cccc(c1CC(=O)[C@H](C)O)C 1458a_217856618621_100000758300 [0,1,0,0,0,0|2,0,1]=4 2651 B14R1.5971 Cc1cccc(c1CN(C)C(C)C)C 269982a_200000211004_100000758300 [0,1,0,0,0,0|3,0,0]=4 2652 B14R1.5971 Cc1cccc(c1CN(C)C(C)C)C 270004a_200000211004_100000758299 [0,1,0,0,0,0|3,0,0]=4 2653 B14R1.5971 Cc1cccc(c1NC(=O)C(C)C)C 11a_100000185769_100000210198 [0,1,0,0,0,0|2,0,1]=4 2654 B14R1.5971 Cc1cccc(c1NC(=O)C(C)C)C 1626a_100000185769_100000210198 [0,1,0,0,0,0|2,0,1]=4 2655 B14R1.5971 Cc1cccc(c1NC(=O)C(C)C)C 22a_100000185769_100000210198 [0,1,0,0,0,0|2,0,1]=4 2656 B14R1.5971 Cc1cccc(c1NC(=O)C(C)F)C 11a_100000185769_100000062450 [0,1,0,0,0,0|2,0,1]=4 2657 B14R1.5971 Cc1cccc(c1NC(=O)C(C)F)C 1626a_100000185769_100000062450 [0,1,0,0,0,0|2,0,1]=4 2658 B14R1.5971 Cc1cccc(c1NC(=O)C(C)F)C 22a_100000185769_100000062450 [0,1,0,0,0,0|2,0,1]=4 2659 B14R1.5971 Cc1cccc(c1NC(=O)[C@@H](C)O)C 22a_100000185769_100000717761 [0,1,0,0,0,0|2,0,1]=4 2660 B14R1.5971 Cc1cccc(c1NC(=O)[C@H](C)O)C 1626a_100000185769_217856618621 [0,1,0,0,0,0|2,0,1]=4 2661 B14R1.5971 Cc1cccc(c1NC(=O)[C@H](C)O)C 22a_100000185769_217856618621 [0,1,0,0,0,0|2,0,1]=4 2662 B14R1.5971 Cc1cccc(c1NC(C)C(=O)N)C 34a_100000185769_100000702099 [0,1,0,0,0,0|2,0,1]=4 2663 B14R1.5971 Cc1cccc(c1NC(F)C(=O)N)C 34a_100000185769_100009813875 [0,1,0,0,0,0|2,0,1]=4 2664 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)Br 34a_100009817157_100000702099 [0,1,0,0,0,0|2,0,1]=4 2665 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)Br 7a_100009817157_100000702099 [0,1,0,0,0,0|2,0,1]=4 2666 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)C 34a_100000210341_100000702099 [0,1,0,0,0,0|1,0,1]=3 2667 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)C 7a_100000210341_100000702099 [0,1,0,0,0,0|1,0,1]=3 2668 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)Cl 34a_100000033731_100000702099 [0,1,0,0,0,0|2,0,1]=4 2669 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)Cl 7a_100000033731_100000702099 [0,1,0,0,0,0|2,0,1]=4 2670 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)F 34a_100011659162_100000702099 [0,1,0,0,0,0|2,0,1]=4 2671 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)F 7a_100011659162_100000702099 [0,1,0,0,0,0|2,0,1]=4 2672 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)N 34a_100000756359_100000702099 [0,1,0,0,0,0|2,0,1]=4 2673 B14R1.5971 Cc1cccc(c1OC(C)C(=O)N)N 7a_100000756359_100000702099 [0,1,0,0,0,0|2,0,1]=4 2674 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)Br 34a_100009817157_100009813875 [0,1,0,0,0,0|2,0,1]=4 2675 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)Br 7a_100009817157_100009813875 [0,1,0,0,0,0|2,0,1]=4 2676 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)C 34a_100000210341_100009813875 [0,1,0,0,0,0|1,0,1]=3 2677 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)C 7a_100000210341_100009813875 [0,1,0,0,0,0|1,0,1]=3 2678 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)Cl 34a_100000033731_100009813875 [0,1,0,0,0,0|2,0,1]=4 2679 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)Cl 7a_100000033731_100009813875 [0,1,0,0,0,0|2,0,1]=4 2680 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)F 34a_100011659162_100009813875 [0,1,0,0,0,0|2,0,1]=4 2681 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)F 7a_100011659162_100009813875 [0,1,0,0,0,0|2,0,1]=4 2682 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)N 34a_100000756359_100009813875 [0,1,0,0,0,0|2,0,1]=4 2683 B14R1.5971 Cc1cccc(c1OC(F)C(=O)N)N 7a_100000756359_100009813875 [0,1,0,0,0,0|2,0,1]=4 2684 B14R1.5971 Cc1cccc(c1OC(F)C(=O)[O-])C 34a_100000210341_100020610796 [0,1,0,0,0,0|2,0,1]=4 2685 B14R1.5971 Cc1cccc(c1SC(C)C(=O)N)C 62a_100000033847_100000702099 [0,1,0,0,0,0|1,1,1]=4 2686 B14R1.5971 Cc1cccc(c1SC(C)C(=O)N)C 62a_100000702099_100000033847 [0,1,0,0,0,0|1,1,1]=4 2687 B14R1.5971 Cc1cccc(c1SC(F)C(=O)N)C 62a_100000033847_100009813875 [0,1,0,0,0,0|1,1,1]=4 2688 B14R1.5971 Cc1cccc(c1SC(F)C(=O)N)C 62a_100009813875_100000033847 [0,1,0,0,0,0|1,1,1]=4 2689 B14R1.5971 Cc1ccnc(c1OC(C)C(=O)N)C 34a_100011934651_100000702099 [0,1,0,0,0,0|2,0,1]=4 2690 B14R1.5971 Cc1ccnc(c1OC(C)C(=O)N)C 7a_100011934651_100000702099 [0,1,0,0,0,0|2,0,1]=4 2691 B14R1.5971 Cc1ccnc(c1OC(F)C(=O)N)C 34a_100011934651_100009813875 [0,1,0,0,0,0|2,0,1]=4 2692 B14R1.5971 Cc1ccnc(c1OC(F)C(=O)N)C 7a_100011934651_100009813875 [0,1,0,0,0,0|2,0,1]=4 2693 B14R1.6054 C=C(C)CNc1c(ccc(c1C)Br)C 34a_200010074581_100000748629 [0,1,0,0,0,0|2,0,1]=4 2694 B14R1.6054 C=C(C)CNc1c(ccc(c1C)C)C 2230a_100000117417_100000748629 [0,1,0,0,0,0|2,0,1]=4 2695 B14R1.6054 C=C(C)CNc1c(ccc(c1C)C)C 34a_100000117417_100000748629 [0,1,0,0,0,0|2,0,1]=4 2696 B14R1.6054 C=C(C)CNc1c(ccc(c1C)C)C 7a_100000117417_100000748629 [0,1,0,0,0,0|2,0,1]=4 2697 B14R1.6054 C=C(C)CNc1c(ccc(c1C)Cl)C 2230a_200020642106_100000748629 [0,1,0,0,0,0|2,0,1]=4 2698 B14R1.6054 C=C(C)CNc1c(ccc(c1C)Cl)C 34a_200020642106_100000748629 [0,1,0,0,0,0|2,0,1]=4 2699 B14R1.6054 C=C(C)CNc1c(ccc(c1C)I)C 34a_200010115591_100000748629 [0,1,0,0,0,0|2,0,1]=4 2700 B14R1.6054 C=C(C)COc1c(ccc(c1C)C)C 34a_100000211305_100000748629 [0,1,0,0,0,0|1,0,1]=3 2701 B14R1.6054 C=C(C)COc1c(ccc(c1C)C)C 7a_100000211305_100000748629 [0,1,0,0,0,0|1,0,1]=3 2702 B14R1.6054 C=C(C)COc1c(ccc(c1C)Cl)Br 34a_200010391122_100000748629 [0,1,0,0,0,0|2,0,1]=4 2703 B14R1.6054 C=C(C)COc1c(ccc(c1C)Cl)Br 7a_200010391122_100000748629 [0,1,0,0,0,0|2,0,1]=4 2704 B14R1.6054 C=C(C)COc1c(ccc(c1C)F)Br 34a_200010391124_100000748629 [0,1,0,0,0,0|2,0,1]=4 2705 B14R1.6054 C=C(C)COc1c(ccc(c1C)F)Br 7a_200010391124_100000748629 [0,1,0,0,0,0|2,0,1]=4 2706 B14R1.6054 C=C(C)COc1c(ccc(c1Cl)N)C 34a_100000036876_100000748629 [0,1,0,0,0,0|2,0,1]=4 2707 B14R1.6054 C=C(C)COc1c(ccc(c1Cl)N)C 7a_100000036876_100000748629 [0,1,0,0,0,0|2,0,1]=4 2708 B14R1.6054 C=C(C)CSc1c(ccc(c1C)F)C 62a_100000748629_100011068659 [0,1,0,0,0,0|1,1,1]=4 2709 B14R1.6054 C=C(C)CSc1c(ccc(c1C)F)C 62a_100011068659_100000211660 [0,1,0,0,0,0|1,1,1]=4 2710 B14R1.6054 C=C(C)CSc1c(ccc(c1C)N)C 62a_100000748629_106354213274 [0,1,0,0,0,0|1,1,1]=4 2711 B14R1.6054 C=C(C)CSc1c(ccc(c1C)N)C 62a_106354213274_100000211660 [0,1,0,0,0,0|1,1,1]=4 2712 B14R1.6054 C=C(C)CSc1c(ccc(c1C)O)C 62a_100000748629_100010659238 [0,1,0,0,0,0|1,1,1]=4 2713 B14R1.6054 C=C(C)CSc1c(ccc(c1C)O)C 62a_100010659238_100000211660 [0,1,0,0,0,0|1,1,1]=4 2714 B14R1.6054 C=C(F)COc1c(ccc(c1C)C)C 34a_100000211305_100009893438 [0,1,0,0,0,0|1,0,2]=4 2715 B14R1.6054 C=C(F)COc1c(ccc(c1C)C)C 7a_100000211305_100000042424 [0,1,0,0,0,0|1,0,2]=4 2716 B14R1.6054 CC(C)COc1c(ccc(c1Br)F)F 34a_100010170822_100000210624 [0,1,0,0,0,0|3,0,0]=4 2717 B14R1.6054 CC(C)COc1c(ccc(c1Br)F)F 7a_100010170822_100000210760 [0,1,0,0,0,0|3,0,0]=4 2718 B14R1.6054 CC(C)COc1c(ccc(c1Br)F)N 34a_100010128263_100000210624 [0,1,0,0,0,0|3,0,0]=4 2719 B14R1.6054 CC(C)COc1c(ccc(c1Br)F)N 7a_100010128263_100000210760 [0,1,0,0,0,0|3,0,0]=4 2720 B14R1.6054 CC(C)COc1c(ccc(c1Cl)Br)Cl 34a_100010089855_100000210624 [0,1,0,0,0,0|3,0,0]=4 2721 B14R1.6054 CC(C)COc1c(ccc(c1Cl)Br)Cl 7a_100010089855_100000210760 [0,1,0,0,0,0|3,0,0]=4 2722 B14R1.6054 CC(C)COc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_100000210624 [0,1,0,0,0,0|3,0,0]=4 2723 B14R1.6054 CC(C)COc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_100000210760 [0,1,0,0,0,0|3,0,0]=4 2724 B14R1.6054 CC(C)COc1c(ccc(c1Cl)Cl)F 34a_100000062035_100000210624 [0,1,0,0,0,0|3,0,0]=4 2725 B14R1.6054 CC(C)COc1c(ccc(c1Cl)Cl)F 7a_100000062035_100000210760 [0,1,0,0,0,0|3,0,0]=4 2726 B14R1.6054 CC(C)COc1c(ccc(c1Cl)F)Br 34a_100014979575_100000210624 [0,1,0,0,0,0|3,0,0]=4 2727 B14R1.6054 CC(C)COc1c(ccc(c1Cl)F)Br 7a_100014979575_100000210760 [0,1,0,0,0,0|3,0,0]=4 2728 B14R1.6054 CC(C)COc1c(ccc(c1Cl)F)F 34a_100000038336_100000210624 [0,1,0,0,0,0|3,0,0]=4 2729 B14R1.6054 CC(C)COc1c(ccc(c1Cl)F)F 7a_100000038336_100000210760 [0,1,0,0,0,0|3,0,0]=4 2730 B14R1.6054 CC(C)COc1c(ccc(c1F)Br)Cl 34a_100010240321_100000210624 [0,1,0,0,0,0|3,0,0]=4 2731 B14R1.6054 CC(C)COc1c(ccc(c1F)Br)Cl 7a_100010240321_100000210760 [0,1,0,0,0,0|3,0,0]=4 2732 B14R1.6054 CC(C)COc1c(ccc(c1F)Br)F 34a_100010167067_100000210624 [0,1,0,0,0,0|3,0,0]=4 2733 B14R1.6054 CC(C)COc1c(ccc(c1F)Br)F 7a_100010167067_100000210760 [0,1,0,0,0,0|3,0,0]=4 2734 B14R1.6054 CC(C)COc1c(ccc(c1F)Cl)Br 34a_100010081130_100000210624 [0,1,0,0,0,0|3,0,0]=4 2735 B14R1.6054 CC(C)COc1c(ccc(c1F)Cl)Br 7a_100010081130_100000210760 [0,1,0,0,0,0|3,0,0]=4 2736 B14R1.6054 CC(C)COc1c(ccc(c1F)Cl)F 34a_100000034634_100000210624 [0,1,0,0,0,0|3,0,0]=4 2737 B14R1.6054 CC(C)COc1c(ccc(c1F)Cl)F 7a_100000034634_100000210760 [0,1,0,0,0,0|3,0,0]=4 2738 B14R1.6054 CC(C)COc1c(ccc(c1F)F)Br 34a_100010243909_100000210624 [0,1,0,0,0,0|3,0,0]=4 2739 B14R1.6054 CC(C)COc1c(ccc(c1F)F)Br 7a_100010243909_100000210760 [0,1,0,0,0,0|3,0,0]=4 2740 B14R1.6054 CC(C)COc1c(ccc(c1F)F)F 34a_100000031686_100000210624 [0,1,0,0,0,0|3,0,0]=4 2741 B14R1.6054 CC(C)COc1c(ccc(c1F)F)F 7a_100000031686_100000210760 [0,1,0,0,0,0|3,0,0]=4 2742 B14R1.6054 CC(C)COc1c(ccc(c1F)F)N 34a_100015205010_100000210624 [0,1,0,0,0,0|3,0,0]=4 2743 B14R1.6054 CC(C)COc1c(ccc(c1F)F)N 7a_100015205010_100000210760 [0,1,0,0,0,0|3,0,0]=4 2744 B14R1.6054 CC(C)COc1c(ccc(c1F)I)Br 34a_200010782288_100000210624 [0,1,0,0,0,0|3,0,0]=4 2745 B14R1.6054 CC(C)COc1c(ccc(c1F)I)Br 7a_200010782288_100000210760 [0,1,0,0,0,0|3,0,0]=4 2746 B14R1.6054 CC(O)COc1c(ccc(c1Br)F)F 34a_100010170822_100011218427 [0,1,0,0,0,0|3,0,0]=4 2747 B14R1.6054 CC(O)COc1c(ccc(c1Br)F)F 7a_100010170822_100011218427 [0,1,0,0,0,0|3,0,0]=4 2748 B14R1.6054 CC(O)COc1c(ccc(c1Br)F)N 34a_100010128263_100011218427 [0,1,0,0,0,0|3,0,0]=4 2749 B14R1.6054 CC(O)COc1c(ccc(c1Br)F)N 7a_100010128263_100011218427 [0,1,0,0,0,0|3,0,0]=4 2750 B14R1.6054 CC(O)COc1c(ccc(c1Cl)Br)Cl 34a_100010089855_100011218427 [0,1,0,0,0,0|3,0,0]=4 2751 B14R1.6054 CC(O)COc1c(ccc(c1Cl)Br)Cl 7a_100010089855_100011218427 [0,1,0,0,0,0|3,0,0]=4 2752 B14R1.6054 CC(O)COc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_100011218427 [0,1,0,0,0,0|3,0,0]=4 2753 B14R1.6054 CC(O)COc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_100011218427 [0,1,0,0,0,0|3,0,0]=4 2754 B14R1.6054 CC(O)COc1c(ccc(c1Cl)Cl)F 34a_100000062035_100011218427 [0,1,0,0,0,0|3,0,0]=4 2755 B14R1.6054 CC(O)COc1c(ccc(c1Cl)Cl)F 7a_100000062035_100011218427 [0,1,0,0,0,0|3,0,0]=4 2756 B14R1.6054 CC(O)COc1c(ccc(c1Cl)F)Br 34a_100014979575_100011218427 [0,1,0,0,0,0|3,0,0]=4 2757 B14R1.6054 CC(O)COc1c(ccc(c1Cl)F)Br 7a_100014979575_100011218427 [0,1,0,0,0,0|3,0,0]=4 2758 B14R1.6054 CC(O)COc1c(ccc(c1Cl)F)F 34a_100000038336_100011218427 [0,1,0,0,0,0|3,0,0]=4 2759 B14R1.6054 CC(O)COc1c(ccc(c1Cl)F)F 7a_100000038336_100011218427 [0,1,0,0,0,0|3,0,0]=4 2760 B14R1.6054 CC(O)COc1c(ccc(c1F)Br)Cl 34a_100010240321_100011218427 [0,1,0,0,0,0|3,0,0]=4 2761 B14R1.6054 CC(O)COc1c(ccc(c1F)Br)Cl 7a_100010240321_100011218427 [0,1,0,0,0,0|3,0,0]=4 2762 B14R1.6054 CC(O)COc1c(ccc(c1F)Br)F 34a_100010167067_100011218427 [0,1,0,0,0,0|3,0,0]=4 2763 B14R1.6054 CC(O)COc1c(ccc(c1F)Br)F 7a_100010167067_100011218427 [0,1,0,0,0,0|3,0,0]=4 2764 B14R1.6054 CC(O)COc1c(ccc(c1F)Cl)Br 34a_100010081130_100011218427 [0,1,0,0,0,0|3,0,0]=4 2765 B14R1.6054 CC(O)COc1c(ccc(c1F)Cl)Br 7a_100010081130_100011218427 [0,1,0,0,0,0|3,0,0]=4 2766 B14R1.6054 CC(O)COc1c(ccc(c1F)Cl)F 34a_100000034634_100011218427 [0,1,0,0,0,0|3,0,0]=4 2767 B14R1.6054 CC(O)COc1c(ccc(c1F)Cl)F 7a_100000034634_100011218427 [0,1,0,0,0,0|3,0,0]=4 2768 B14R1.6054 CC(O)COc1c(ccc(c1F)F)Br 34a_100010243909_100011218427 [0,1,0,0,0,0|3,0,0]=4 2769 B14R1.6054 CC(O)COc1c(ccc(c1F)F)Br 7a_100010243909_100011218427 [0,1,0,0,0,0|3,0,0]=4 2770 B14R1.6054 CC(O)COc1c(ccc(c1F)F)F 34a_100000031686_100011218427 [0,1,0,0,0,0|3,0,0]=4 2771 B14R1.6054 CC(O)COc1c(ccc(c1F)F)F 7a_100000031686_100011218427 [0,1,0,0,0,0|3,0,0]=4 2772 B14R1.6054 CC(O)COc1c(ccc(c1F)F)N 34a_100015205010_100011218427 [0,1,0,0,0,0|3,0,0]=4 2773 B14R1.6054 CC(O)COc1c(ccc(c1F)F)N 7a_100015205010_100011218427 [0,1,0,0,0,0|3,0,0]=4 2774 B14R1.6054 CC(O)COc1c(ccc(c1F)I)Br 34a_200010782288_100011218427 [0,1,0,0,0,0|3,0,0]=4 2775 B14R1.6054 CC(O)COc1c(ccc(c1F)I)Br 7a_200010782288_100011218427 [0,1,0,0,0,0|3,0,0]=4 2776 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Br)F)F 34a_100010170822_100009817552 [0,1,0,0,0,0|3,0,0]=4 2777 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Br)F)F 7a_100010170822_100009817552 [0,1,0,0,0,0|3,0,0]=4 2778 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Br)F)N 34a_100010128263_100009817552 [0,1,0,0,0,0|3,0,0]=4 2779 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Br)F)N 7a_100010128263_100009817552 [0,1,0,0,0,0|3,0,0]=4 2780 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)Br)Cl 34a_100010089855_100009817552 [0,1,0,0,0,0|3,0,0]=4 2781 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)Br)Cl 7a_100010089855_100009817552 [0,1,0,0,0,0|3,0,0]=4 2782 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_100009817552 [0,1,0,0,0,0|3,0,0]=4 2783 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_100009817552 [0,1,0,0,0,0|3,0,0]=4 2784 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)Cl)F 34a_100000062035_100009817552 [0,1,0,0,0,0|3,0,0]=4 2785 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)Cl)F 7a_100000062035_100009817552 [0,1,0,0,0,0|3,0,0]=4 2786 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)F)Br 34a_100014979575_100009817552 [0,1,0,0,0,0|3,0,0]=4 2787 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)F)Br 7a_100014979575_100009817552 [0,1,0,0,0,0|3,0,0]=4 2788 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)F)F 34a_100000038336_100009817552 [0,1,0,0,0,0|3,0,0]=4 2789 B14R1.6054 C[C@@H](O)COc1c(ccc(c1Cl)F)F 7a_100000038336_100009817552 [0,1,0,0,0,0|3,0,0]=4 2790 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Br)Cl 34a_100010240321_100009817552 [0,1,0,0,0,0|3,0,0]=4 2791 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Br)Cl 7a_100010240321_100009817552 [0,1,0,0,0,0|3,0,0]=4 2792 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Br)F 34a_100010167067_100009817552 [0,1,0,0,0,0|3,0,0]=4 2793 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Br)F 7a_100010167067_100009817552 [0,1,0,0,0,0|3,0,0]=4 2794 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Cl)Br 34a_100010081130_100009817552 [0,1,0,0,0,0|3,0,0]=4 2795 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Cl)Br 7a_100010081130_100009817552 [0,1,0,0,0,0|3,0,0]=4 2796 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Cl)F 34a_100000034634_100009817552 [0,1,0,0,0,0|3,0,0]=4 2797 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)Cl)F 7a_100000034634_100009817552 [0,1,0,0,0,0|3,0,0]=4 2798 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)F)Br 34a_100010243909_100009817552 [0,1,0,0,0,0|3,0,0]=4 2799 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)F)Br 7a_100010243909_100009817552 [0,1,0,0,0,0|3,0,0]=4 2800 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)F)F 34a_100000031686_100009817552 [0,1,0,0,0,0|3,0,0]=4 2801 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)F)F 7a_100000031686_100009817552 [0,1,0,0,0,0|3,0,0]=4 2802 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)F)N 34a_100015205010_100009817552 [0,1,0,0,0,0|3,0,0]=4 2803 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)F)N 7a_100015205010_100009817552 [0,1,0,0,0,0|3,0,0]=4 2804 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)I)Br 34a_200010782288_100009817552 [0,1,0,0,0,0|3,0,0]=4 2805 B14R1.6054 C[C@@H](O)COc1c(ccc(c1F)I)Br 7a_200010782288_100009817552 [0,1,0,0,0,0|3,0,0]=4 2806 B14R1.6054 Cc1c(c(=O)ccn1C)OCC(C)C 34a_100000032683_100000210624 [0,1,0,0,0,0|3,0,0]=4 2807 B14R1.6054 Cc1c(c(=O)ccn1C)OCC(C)C 7a_100000032683_100000210760 [0,1,0,0,0,0|3,0,0]=4 2808 B14R1.6054 Cc1c(c(=O)ccn1C)OCC(C)O 34a_100000032683_100011218427 [0,1,0,0,0,0|3,0,0]=4 2809 B14R1.6054 Cc1c(c(=O)ccn1C)OCC(C)O 7a_100000032683_100011218427 [0,1,0,0,0,0|3,0,0]=4 2810 B14R1.6054 Cc1c(c(=O)ccn1C)OC[C@@H](C)O 34a_100000032683_100009817552 [0,1,0,0,0,0|3,0,0]=4 2811 B14R1.6054 Cc1c(c(=O)ccn1C)OC[C@@H](C)O 7a_100000032683_100009817552 [0,1,0,0,0,0|3,0,0]=4 2812 B14R1.6054 Cc1c(ccc(c1NCC(C)C)Br)F 34a_100011009917_100000210624 [0,1,0,0,0,0|3,0,0]=4 2813 B14R1.6054 Cc1c(ccc(c1NCC(C)C)Cl)Cl 34a_100009961198_100000210624 [0,1,0,0,0,0|3,0,0]=4 2814 B14R1.6054 Cc1c(ccc(c1NCC(C)C)F)Br 2230a_100010588651_100000210760 [0,1,0,0,0,0|3,0,0]=4 2815 B14R1.6054 Cc1c(ccc(c1NCC(C)C)F)Br 34a_100010588651_100000210624 [0,1,0,0,0,0|3,0,0]=4 2816 B14R1.6054 Cc1c(ccc(c1NCC(C)C)O)Br 34a_100013039247_100000210624 [0,1,0,0,0,0|3,0,0]=4 2817 B14R1.6054 Cc1c(ccc(c1NCC(C)O)Br)F 34a_100011009917_100011218427 [0,1,0,0,0,0|3,0,0]=4 2818 B14R1.6054 Cc1c(ccc(c1NCC(C)O)Cl)Cl 34a_100009961198_100011218427 [0,1,0,0,0,0|3,0,0]=4 2819 B14R1.6054 Cc1c(ccc(c1NCC(C)O)F)Br 2230a_100010588651_100011218427 [0,1,0,0,0,0|3,0,0]=4 2820 B14R1.6054 Cc1c(ccc(c1NCC(C)O)F)Br 34a_100010588651_100011218427 [0,1,0,0,0,0|3,0,0]=4 2821 B14R1.6054 Cc1c(ccc(c1NCC(C)O)O)Br 34a_100013039247_100011218427 [0,1,0,0,0,0|3,0,0]=4 2822 B14R1.6054 Cc1c(ccc(c1NC[C@@H](C)O)Br)F 34a_100011009917_100009817552 [0,1,0,0,0,0|3,0,0]=4 2823 B14R1.6054 Cc1c(ccc(c1NC[C@@H](C)O)Cl)Cl 34a_100009961198_100009817552 [0,1,0,0,0,0|3,0,0]=4 2824 B14R1.6054 Cc1c(ccc(c1NC[C@@H](C)O)F)Br 2230a_100010588651_100009817552 [0,1,0,0,0,0|3,0,0]=4 2825 B14R1.6054 Cc1c(ccc(c1NC[C@@H](C)O)F)Br 34a_100010588651_100009817552 [0,1,0,0,0,0|3,0,0]=4 2826 B14R1.6054 Cc1c(ccc(c1NC[C@@H](C)O)O)Br 34a_100013039247_100009817552 [0,1,0,0,0,0|3,0,0]=4 2827 B14R1.6054 Cc1c(ccc(c1OCC(=O)N)Br)Cl 34a_200010391122_100000187820 [0,1,0,0,0,0|2,0,1]=4 2828 B14R1.6054 Cc1c(ccc(c1OCC(=O)N)Br)Cl 7a_200010391122_100000187820 [0,1,0,0,0,0|2,0,1]=4 2829 B14R1.6054 Cc1c(ccc(c1OCC(=O)N)Br)F 34a_200010391124_100000187820 [0,1,0,0,0,0|2,0,1]=4 2830 B14R1.6054 Cc1c(ccc(c1OCC(=O)N)Br)F 7a_200010391124_100000187820 [0,1,0,0,0,0|2,0,1]=4 2831 B14R1.6054 Cc1c(ccc(c1OCC(C)C)Br)Cl 34a_200010391122_100000210624 [0,1,0,0,0,0|2,0,0]=3 2832 B14R1.6054 Cc1c(ccc(c1OCC(C)C)Br)Cl 7a_200010391122_100000210760 [0,1,0,0,0,0|2,0,0]=3 2833 B14R1.6054 Cc1c(ccc(c1OCC(C)C)Br)F 34a_200010391124_100000210624 [0,1,0,0,0,0|2,0,0]=3 2834 B14R1.6054 Cc1c(ccc(c1OCC(C)C)Br)F 7a_200010391124_100000210760 [0,1,0,0,0,0|2,0,0]=3 2835 B14R1.6054 Cc1c(ccc(c1OCC(C)O)Br)Cl 34a_200010391122_100011218427 [0,1,0,0,0,0|2,0,0]=3 2836 B14R1.6054 Cc1c(ccc(c1OCC(C)O)Br)Cl 7a_200010391122_100011218427 [0,1,0,0,0,0|2,0,0]=3 2837 B14R1.6054 Cc1c(ccc(c1OCC(C)O)Br)F 34a_200010391124_100011218427 [0,1,0,0,0,0|2,0,0]=3 2838 B14R1.6054 Cc1c(ccc(c1OCC(C)O)Br)F 7a_200010391124_100011218427 [0,1,0,0,0,0|2,0,0]=3 2839 B14R1.6054 Cc1c(ccc(c1OCC(F)F)Br)Cl 34a_200010391122_100011934356 [0,1,0,0,0,0|3,0,0]=4 2840 B14R1.6054 Cc1c(ccc(c1OCC(F)F)Br)Cl 7a_200010391122_100011934356 [0,1,0,0,0,0|3,0,0]=4 2841 B14R1.6054 Cc1c(ccc(c1OCC(F)F)Br)F 34a_200010391124_100011934356 [0,1,0,0,0,0|3,0,0]=4 2842 B14R1.6054 Cc1c(ccc(c1OCC(F)F)Br)F 7a_200010391124_100011934356 [0,1,0,0,0,0|3,0,0]=4 2843 B14R1.6054 Cc1c(ccc(c1OC[C@@H](C)O)Br)Cl 34a_200010391122_100009817552 [0,1,0,0,0,0|2,0,0]=3 2844 B14R1.6054 Cc1c(ccc(c1OC[C@@H](C)O)Br)Cl 7a_200010391122_100009817552 [0,1,0,0,0,0|2,0,0]=3 2845 B14R1.6054 Cc1c(ccc(c1OC[C@@H](C)O)Br)F 34a_200010391124_100009817552 [0,1,0,0,0,0|2,0,0]=3 2846 B14R1.6054 Cc1c(ccc(c1OC[C@@H](C)O)Br)F 7a_200010391124_100009817552 [0,1,0,0,0,0|2,0,0]=3 2847 B14R1.6054 Cc1c(ccc(c1SCC(C)C)F)F 62a_100000210624_100010167959 [0,1,0,0,0,0|2,1,0]=4 2848 B14R1.6054 Cc1c(ccc(c1SCC(C)C)F)F 62a_100010167959_100000210760 [0,1,0,0,0,0|2,1,0]=4 2849 B14R1.6054 Cc1c(ccc(c1SCC(C)O)F)F 62a_100010167959_100011218427 [0,1,0,0,0,0|2,1,0]=4 2850 B14R1.6054 Cc1c(ccc(c1SCC(C)O)F)F 62a_100011218427_100010167959 [0,1,0,0,0,0|2,1,0]=4 2851 B14R1.6054 Cc1c(ccc(c1SC[C@@H](C)O)F)F 62a_100009817552_100010167959 [0,1,0,0,0,0|2,1,0]=4 2852 B14R1.6054 Cc1c(ccc(c1SC[C@@H](C)O)F)F 62a_100010167959_100009817552 [0,1,0,0,0,0|2,1,0]=4 2853 B14R1.6054 Cc1ccc(c(c1Br)OCC(C)C)F 34a_200010223207_100000210624 [0,1,0,0,0,0|3,0,0]=4 2854 B14R1.6054 Cc1ccc(c(c1Br)OCC(C)C)F 7a_200010223207_100000210760 [0,1,0,0,0,0|3,0,0]=4 2855 B14R1.6054 Cc1ccc(c(c1Br)OCC(C)O)F 34a_200010223207_100011218427 [0,1,0,0,0,0|3,0,0]=4 2856 B14R1.6054 Cc1ccc(c(c1Br)OCC(C)O)F 7a_200010223207_100011218427 [0,1,0,0,0,0|3,0,0]=4 2857 B14R1.6054 Cc1ccc(c(c1Br)OC[C@@H](C)O)F 34a_200010223207_100009817552 [0,1,0,0,0,0|3,0,0]=4 2858 B14R1.6054 Cc1ccc(c(c1Br)OC[C@@H](C)O)F 7a_200010223207_100009817552 [0,1,0,0,0,0|3,0,0]=4 2859 B14R1.6054 Cc1ccc(c(c1C)NCC(=O)N)C 2230a_100000117417_100000747473 [0,1,0,0,0,0|2,0,1]=4 2860 B14R1.6054 Cc1ccc(c(c1C)NCC(=O)N)C 34a_100000117417_100000187820 [0,1,0,0,0,0|2,0,1]=4 2861 B14R1.6054 Cc1ccc(c(c1C)NCC(=O)N)C 7a_100000117417_100000187820 [0,1,0,0,0,0|2,0,1]=4 2862 B14R1.6054 Cc1ccc(c(c1C)NCC(C)C)C 2230a_100000117417_100000210760 [0,1,0,0,0,0|2,0,0]=3 2863 B14R1.6054 Cc1ccc(c(c1C)NCC(C)C)C 34a_100000117417_100000210624 [0,1,0,0,0,0|2,0,0]=3 2864 B14R1.6054 Cc1ccc(c(c1C)NCC(C)C)C 7a_100000117417_100000210760 [0,1,0,0,0,0|2,0,0]=3 2865 B14R1.6054 Cc1ccc(c(c1C)NCC(C)O)C 2230a_100000117417_100011218427 [0,1,0,0,0,0|2,0,0]=3 2866 B14R1.6054 Cc1ccc(c(c1C)NCC(C)O)C 34a_100000117417_100011218427 [0,1,0,0,0,0|2,0,0]=3 2867 B14R1.6054 Cc1ccc(c(c1C)NCC(C)O)C 7a_100000117417_100011218427 [0,1,0,0,0,0|2,0,0]=3 2868 B14R1.6054 Cc1ccc(c(c1C)NCC(F)F)C 2230a_100000117417_100011934356 [0,1,0,0,0,0|3,0,0]=4 2869 B14R1.6054 Cc1ccc(c(c1C)NCC(F)F)C 34a_100000117417_100011934356 [0,1,0,0,0,0|3,0,0]=4 2870 B14R1.6054 Cc1ccc(c(c1C)NCC(F)F)C 7a_100000117417_100011934356 [0,1,0,0,0,0|3,0,0]=4 2871 B14R1.6054 Cc1ccc(c(c1C)NC[C@@H](C)O)C 2230a_100000117417_100009817552 [0,1,0,0,0,0|2,0,0]=3 2872 B14R1.6054 Cc1ccc(c(c1C)NC[C@@H](C)O)C 34a_100000117417_100009817552 [0,1,0,0,0,0|2,0,0]=3 2873 B14R1.6054 Cc1ccc(c(c1C)NC[C@@H](C)O)C 7a_100000117417_100009817552 [0,1,0,0,0,0|2,0,0]=3 2874 B14R1.6054 Cc1ccc(c(c1C)OCC(=O)N)C 34a_100000211305_100000187820 [0,1,0,0,0,0|1,0,1]=3 2875 B14R1.6054 Cc1ccc(c(c1C)OCC(=O)N)C 7a_100000211305_100000187820 [0,1,0,0,0,0|1,0,1]=3 2876 B14R1.6054 Cc1ccc(c(c1C)OCC(=O)[O-])C 34a_100000211305_100020667443 [0,1,0,0,0,0|2,0,1]=4 2877 B14R1.6054 Cc1ccc(c(c1C)OCC(C)C)C 34a_100000211305_100000210624 [0,1,0,0,0,0|1,0,0]=2 2878 B14R1.6054 Cc1ccc(c(c1C)OCC(C)C)C 7a_100000211305_100000210760 [0,1,0,0,0,0|1,0,0]=2 2879 B14R1.6054 Cc1ccc(c(c1C)OCC(C)O)C 34a_100000211305_100011218427 [0,1,0,0,0,0|1,0,0]=2 2880 B14R1.6054 Cc1ccc(c(c1C)OCC(C)O)C 7a_100000211305_100011218427 [0,1,0,0,0,0|1,0,0]=2 2881 B14R1.6054 Cc1ccc(c(c1C)OCC(F)F)C 34a_100000211305_100011934356 [0,1,0,0,0,0|2,0,0]=3 2882 B14R1.6054 Cc1ccc(c(c1C)OCC(F)F)C 7a_100000211305_100011934356 [0,1,0,0,0,0|2,0,0]=3 2883 B14R1.6054 Cc1ccc(c(c1C)OC[C@@H](C)O)C 34a_100000211305_100009817552 [0,1,0,0,0,0|1,0,0]=2 2884 B14R1.6054 Cc1ccc(c(c1C)OC[C@@H](C)O)C 7a_100000211305_100009817552 [0,1,0,0,0,0|1,0,0]=2 2885 B14R1.6054 Cc1ccc(c(c1C)OC[N+](=O)[O-])C 34a_100000211305_100000761209 [0,1,0,0,0,0|3,0,0]=4 2886 B14R1.6054 Cc1ccc(c(c1C=CC(C)C)C)F 271570a_100016257149_100011068659 [0,1,0,0,0,0|2,0,1]=4 2887 B14R1.6054 Cc1ccc(c(c1C=CC(C)C)C)N 271570a_100016257149_106354213274 [0,1,0,0,0,0|2,0,1]=4 2888 B14R1.6054 Cc1ccc(c(c1C=CC(C)C)C)O 271570a_100016257149_100010659238 [0,1,0,0,0,0|2,0,1]=4 2889 B14R1.6054 Cc1ccc(c(c1C=CC(C)O)C)F 271570a_200011019289_100011068659 [0,1,0,0,0,0|2,0,1]=4 2890 B14R1.6054 Cc1ccc(c(c1C=CC(C)O)C)N 271570a_200011019289_106354213274 [0,1,0,0,0,0|2,0,1]=4 2891 B14R1.6054 Cc1ccc(c(c1C=CC(C)O)C)O 271570a_200011019289_100010659238 [0,1,0,0,0,0|2,0,1]=4 2892 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)C)Cl 34a_200000087117_100000210624 [0,1,0,0,0,0|3,0,0]=4 2893 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)C)Cl 7a_200000087117_100000210760 [0,1,0,0,0,0|3,0,0]=4 2894 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)C)F 34a_100000035349_100000210624 [0,1,0,0,0,0|3,0,0]=4 2895 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)C)F 7a_100000035349_100000210760 [0,1,0,0,0,0|3,0,0]=4 2896 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)O)Cl 34a_200000087117_100011218427 [0,1,0,0,0,0|3,0,0]=4 2897 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)O)Cl 7a_200000087117_100011218427 [0,1,0,0,0,0|3,0,0]=4 2898 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)O)F 34a_100000035349_100011218427 [0,1,0,0,0,0|3,0,0]=4 2899 B14R1.6054 Cc1ccc(c(c1Cl)OCC(C)O)F 7a_100000035349_100011218427 [0,1,0,0,0,0|3,0,0]=4 2900 B14R1.6054 Cc1ccc(c(c1Cl)OC[C@@H](C)O)Cl 34a_200000087117_100009817552 [0,1,0,0,0,0|3,0,0]=4 2901 B14R1.6054 Cc1ccc(c(c1Cl)OC[C@@H](C)O)Cl 7a_200000087117_100009817552 [0,1,0,0,0,0|3,0,0]=4 2902 B14R1.6054 Cc1ccc(c(c1Cl)OC[C@@H](C)O)F 34a_100000035349_100009817552 [0,1,0,0,0,0|3,0,0]=4 2903 B14R1.6054 Cc1ccc(c(c1Cl)OC[C@@H](C)O)F 7a_100000035349_100009817552 [0,1,0,0,0,0|3,0,0]=4 2904 B14R1.6054 Cc1ccc(c(c1F)OCC(C)C)Br 34a_100000722096_100000210624 [0,1,0,0,0,0|3,0,0]=4 2905 B14R1.6054 Cc1ccc(c(c1F)OCC(C)C)Br 7a_100000722096_100000210760 [0,1,0,0,0,0|3,0,0]=4 2906 B14R1.6054 Cc1ccc(c(c1F)OCC(C)C)Cl 34a_200000034537_100000210624 [0,1,0,0,0,0|3,0,0]=4 2907 B14R1.6054 Cc1ccc(c(c1F)OCC(C)C)Cl 7a_200000034537_100000210760 [0,1,0,0,0,0|3,0,0]=4 2908 B14R1.6054 Cc1ccc(c(c1F)OCC(C)C)F 34a_100011216644_100000210624 [0,1,0,0,0,0|3,0,0]=4 2909 B14R1.6054 Cc1ccc(c(c1F)OCC(C)C)F 7a_100011216644_100000210760 [0,1,0,0,0,0|3,0,0]=4 2910 B14R1.6054 Cc1ccc(c(c1F)OCC(C)O)Br 34a_100000722096_100011218427 [0,1,0,0,0,0|3,0,0]=4 2911 B14R1.6054 Cc1ccc(c(c1F)OCC(C)O)Br 7a_100000722096_100011218427 [0,1,0,0,0,0|3,0,0]=4 2912 B14R1.6054 Cc1ccc(c(c1F)OCC(C)O)Cl 34a_200000034537_100011218427 [0,1,0,0,0,0|3,0,0]=4 2913 B14R1.6054 Cc1ccc(c(c1F)OCC(C)O)Cl 7a_200000034537_100011218427 [0,1,0,0,0,0|3,0,0]=4 2914 B14R1.6054 Cc1ccc(c(c1F)OCC(C)O)F 34a_100011216644_100011218427 [0,1,0,0,0,0|3,0,0]=4 2915 B14R1.6054 Cc1ccc(c(c1F)OCC(C)O)F 7a_100011216644_100011218427 [0,1,0,0,0,0|3,0,0]=4 2916 B14R1.6054 Cc1ccc(c(c1F)OC[C@@H](C)O)Br 34a_100000722096_100009817552 [0,1,0,0,0,0|3,0,0]=4 2917 B14R1.6054 Cc1ccc(c(c1F)OC[C@@H](C)O)Br 7a_100000722096_100009817552 [0,1,0,0,0,0|3,0,0]=4 2918 B14R1.6054 Cc1ccc(c(c1F)OC[C@@H](C)O)Cl 34a_200000034537_100009817552 [0,1,0,0,0,0|3,0,0]=4 2919 B14R1.6054 Cc1ccc(c(c1F)OC[C@@H](C)O)Cl 7a_200000034537_100009817552 [0,1,0,0,0,0|3,0,0]=4 2920 B14R1.6054 Cc1ccc(c(c1F)OC[C@@H](C)O)F 34a_100011216644_100009817552 [0,1,0,0,0,0|3,0,0]=4 2921 B14R1.6054 Cc1ccc(c(c1F)OC[C@@H](C)O)F 7a_100011216644_100009817552 [0,1,0,0,0,0|3,0,0]=4 2922 B14R1.6054 Cc1ccc(c(c1NCC(=O)N)C)Br 34a_200010074581_100000187820 [0,1,0,0,0,0|2,0,1]=4 2923 B14R1.6054 Cc1ccc(c(c1NCC(=O)N)C)Cl 2230a_200020642106_100000747473 [0,1,0,0,0,0|2,0,1]=4 2924 B14R1.6054 Cc1ccc(c(c1NCC(=O)N)C)Cl 34a_200020642106_100000187820 [0,1,0,0,0,0|2,0,1]=4 2925 B14R1.6054 Cc1ccc(c(c1NCC(=O)N)C)I 34a_200010115591_100000187820 [0,1,0,0,0,0|2,0,1]=4 2926 B14R1.6054 Cc1ccc(c(c1NCC(C)C)C)Br 34a_200010074581_100000210624 [0,1,0,0,0,0|2,0,0]=3 2927 B14R1.6054 Cc1ccc(c(c1NCC(C)C)C)Cl 2230a_200020642106_100000210760 [0,1,0,0,0,0|2,0,0]=3 2928 B14R1.6054 Cc1ccc(c(c1NCC(C)C)C)Cl 34a_200020642106_100000210624 [0,1,0,0,0,0|2,0,0]=3 2929 B14R1.6054 Cc1ccc(c(c1NCC(C)C)C)I 34a_200010115591_100000210624 [0,1,0,0,0,0|2,0,0]=3 2930 B14R1.6054 Cc1ccc(c(c1NCC(C)O)C)Br 34a_200010074581_100011218427 [0,1,0,0,0,0|2,0,0]=3 2931 B14R1.6054 Cc1ccc(c(c1NCC(C)O)C)Cl 2230a_200020642106_100011218427 [0,1,0,0,0,0|2,0,0]=3 2932 B14R1.6054 Cc1ccc(c(c1NCC(C)O)C)Cl 34a_200020642106_100011218427 [0,1,0,0,0,0|2,0,0]=3 2933 B14R1.6054 Cc1ccc(c(c1NCC(C)O)C)I 34a_200010115591_100011218427 [0,1,0,0,0,0|2,0,0]=3 2934 B14R1.6054 Cc1ccc(c(c1NCC(F)F)C)Br 34a_200010074581_100011934356 [0,1,0,0,0,0|3,0,0]=4 2935 B14R1.6054 Cc1ccc(c(c1NCC(F)F)C)Cl 2230a_200020642106_100011934356 [0,1,0,0,0,0|3,0,0]=4 2936 B14R1.6054 Cc1ccc(c(c1NCC(F)F)C)Cl 34a_200020642106_100011934356 [0,1,0,0,0,0|3,0,0]=4 2937 B14R1.6054 Cc1ccc(c(c1NCC(F)F)C)I 34a_200010115591_100011934356 [0,1,0,0,0,0|3,0,0]=4 2938 B14R1.6054 Cc1ccc(c(c1NC[C@@H](C)O)C)Br 34a_200010074581_100009817552 [0,1,0,0,0,0|2,0,0]=3 2939 B14R1.6054 Cc1ccc(c(c1NC[C@@H](C)O)C)Cl 2230a_200020642106_100009817552 [0,1,0,0,0,0|2,0,0]=3 2940 B14R1.6054 Cc1ccc(c(c1NC[C@@H](C)O)C)Cl 34a_200020642106_100009817552 [0,1,0,0,0,0|2,0,0]=3 2941 B14R1.6054 Cc1ccc(c(c1NC[C@@H](C)O)C)I 34a_200010115591_100009817552 [0,1,0,0,0,0|2,0,0]=3 2942 B14R1.6054 Cc1ccc(c(c1OCC(=O)N)Cl)N 34a_100000036876_100000187820 [0,1,0,0,0,0|2,0,1]=4 2943 B14R1.6054 Cc1ccc(c(c1OCC(=O)N)Cl)N 7a_100000036876_100000187820 [0,1,0,0,0,0|2,0,1]=4 2944 B14R1.6054 Cc1ccc(c(c1OCC(C)C)Cl)N 34a_100000036876_100000210624 [0,1,0,0,0,0|2,0,0]=3 2945 B14R1.6054 Cc1ccc(c(c1OCC(C)C)Cl)N 7a_100000036876_100000210760 [0,1,0,0,0,0|2,0,0]=3 2946 B14R1.6054 Cc1ccc(c(c1OCC(C)O)Cl)N 34a_100000036876_100011218427 [0,1,0,0,0,0|2,0,0]=3 2947 B14R1.6054 Cc1ccc(c(c1OCC(C)O)Cl)N 7a_100000036876_100011218427 [0,1,0,0,0,0|2,0,0]=3 2948 B14R1.6054 Cc1ccc(c(c1OCC(F)F)Cl)N 34a_100000036876_100011934356 [0,1,0,0,0,0|3,0,0]=4 2949 B14R1.6054 Cc1ccc(c(c1OCC(F)F)Cl)N 7a_100000036876_100011934356 [0,1,0,0,0,0|3,0,0]=4 2950 B14R1.6054 Cc1ccc(c(c1OC[C@@H](C)O)Cl)N 34a_100000036876_100009817552 [0,1,0,0,0,0|2,0,0]=3 2951 B14R1.6054 Cc1ccc(c(c1OC[C@@H](C)O)Cl)N 7a_100000036876_100009817552 [0,1,0,0,0,0|2,0,0]=3 2952 B14R1.6054 Cc1ccc(c(c1SCC(=O)N)C)F 62a_100000747473_100011068659 [0,1,0,0,0,0|1,1,1]=4 2953 B14R1.6054 Cc1ccc(c(c1SCC(=O)N)C)F 62a_100011068659_100000747473 [0,1,0,0,0,0|1,1,1]=4 2954 B14R1.6054 Cc1ccc(c(c1SCC(=O)N)C)N 62a_100000747473_106354213274 [0,1,0,0,0,0|1,1,1]=4 2955 B14R1.6054 Cc1ccc(c(c1SCC(=O)N)C)N 62a_106354213274_100000747473 [0,1,0,0,0,0|1,1,1]=4 2956 B14R1.6054 Cc1ccc(c(c1SCC(=O)N)C)O 62a_100000747473_100010659238 [0,1,0,0,0,0|1,1,1]=4 2957 B14R1.6054 Cc1ccc(c(c1SCC(=O)N)C)O 62a_100010659238_100000747473 [0,1,0,0,0,0|1,1,1]=4 2958 B14R1.6054 Cc1ccc(c(c1SCC(C)C)C)F 62a_100000210624_100011068659 [0,1,0,0,0,0|1,1,0]=3 2959 B14R1.6054 Cc1ccc(c(c1SCC(C)C)C)F 62a_100011068659_100000210760 [0,1,0,0,0,0|1,1,0]=3 2960 B14R1.6054 Cc1ccc(c(c1SCC(C)C)C)N 62a_100000210624_106354213274 [0,1,0,0,0,0|1,1,0]=3 2961 B14R1.6054 Cc1ccc(c(c1SCC(C)C)C)N 62a_106354213274_100000210760 [0,1,0,0,0,0|1,1,0]=3 2962 B14R1.6054 Cc1ccc(c(c1SCC(C)C)C)O 62a_100000210624_100010659238 [0,1,0,0,0,0|1,1,0]=3 2963 B14R1.6054 Cc1ccc(c(c1SCC(C)C)C)O 62a_100010659238_100000210760 [0,1,0,0,0,0|1,1,0]=3 2964 B14R1.6054 Cc1ccc(c(c1SCC(C)C)O)F 62a_100000210624_200010223207 [0,1,0,0,0,0|2,1,0]=4 2965 B14R1.6054 Cc1ccc(c(c1SCC(C)C)O)F 62a_200010223207_100000210760 [0,1,0,0,0,0|2,1,0]=4 2966 B14R1.6054 Cc1ccc(c(c1SCC(C)O)C)F 62a_100011068659_100011218427 [0,1,0,0,0,0|1,1,0]=3 2967 B14R1.6054 Cc1ccc(c(c1SCC(C)O)C)F 62a_100011218427_100011068659 [0,1,0,0,0,0|1,1,0]=3 2968 B14R1.6054 Cc1ccc(c(c1SCC(C)O)C)N 62a_100011218427_106354213274 [0,1,0,0,0,0|1,1,0]=3 2969 B14R1.6054 Cc1ccc(c(c1SCC(C)O)C)N 62a_106354213274_100011218427 [0,1,0,0,0,0|1,1,0]=3 2970 B14R1.6054 Cc1ccc(c(c1SCC(C)O)C)O 62a_100010659238_100011218427 [0,1,0,0,0,0|1,1,0]=3 2971 B14R1.6054 Cc1ccc(c(c1SCC(C)O)C)O 62a_100011218427_100010659238 [0,1,0,0,0,0|1,1,0]=3 2972 B14R1.6054 Cc1ccc(c(c1SCC(C)O)O)F 62a_100011218427_200010223207 [0,1,0,0,0,0|2,1,0]=4 2973 B14R1.6054 Cc1ccc(c(c1SCC(C)O)O)F 62a_200010223207_100011218427 [0,1,0,0,0,0|2,1,0]=4 2974 B14R1.6054 Cc1ccc(c(c1SCC(F)F)C)F 62a_100011068659_100011934356 [0,1,0,0,0,0|2,1,0]=4 2975 B14R1.6054 Cc1ccc(c(c1SCC(F)F)C)F 62a_100011934356_100011068659 [0,1,0,0,0,0|2,1,0]=4 2976 B14R1.6054 Cc1ccc(c(c1SCC(F)F)C)N 62a_100011934356_106354213274 [0,1,0,0,0,0|2,1,0]=4 2977 B14R1.6054 Cc1ccc(c(c1SCC(F)F)C)N 62a_106354213274_100011934356 [0,1,0,0,0,0|2,1,0]=4 2978 B14R1.6054 Cc1ccc(c(c1SCC(F)F)C)O 62a_100010659238_100011934356 [0,1,0,0,0,0|2,1,0]=4 2979 B14R1.6054 Cc1ccc(c(c1SCC(F)F)C)O 62a_100011934356_100010659238 [0,1,0,0,0,0|2,1,0]=4 2980 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)C)F 62a_100009817552_100011068659 [0,1,0,0,0,0|1,1,0]=3 2981 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)C)F 62a_100011068659_100009817552 [0,1,0,0,0,0|1,1,0]=3 2982 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)C)N 62a_100009817552_106354213274 [0,1,0,0,0,0|1,1,0]=3 2983 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)C)N 62a_106354213274_100009817552 [0,1,0,0,0,0|1,1,0]=3 2984 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)C)O 62a_100009817552_100010659238 [0,1,0,0,0,0|1,1,0]=3 2985 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)C)O 62a_100010659238_100009817552 [0,1,0,0,0,0|1,1,0]=3 2986 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)O)F 62a_100009817552_200010223207 [0,1,0,0,0,0|2,1,0]=4 2987 B14R1.6054 Cc1ccc(c(c1SC[C@@H](C)O)O)F 62a_200010223207_100009817552 [0,1,0,0,0,0|2,1,0]=4 2988 B14R1.6054 Cc1cnc(c(c1SCC(C)C)C)F 62a_100000210624_100011016222 [0,1,0,0,0,0|2,1,0]=4 2989 B14R1.6054 Cc1cnc(c(c1SCC(C)C)C)F 62a_100011016222_100000210760 [0,1,0,0,0,0|2,1,0]=4 2990 B14R1.6054 Cc1cnc(c(c1SCC(C)O)C)F 62a_100011016222_100011218427 [0,1,0,0,0,0|2,1,0]=4 2991 B14R1.6054 Cc1cnc(c(c1SCC(C)O)C)F 62a_100011218427_100011016222 [0,1,0,0,0,0|2,1,0]=4 2992 B14R1.6054 Cc1cnc(c(c1SC[C@@H](C)O)C)F 62a_100009817552_100011016222 [0,1,0,0,0,0|2,1,0]=4 2993 B14R1.6054 Cc1cnc(c(c1SC[C@@H](C)O)C)F 62a_100011016222_100009817552 [0,1,0,0,0,0|2,1,0]=4 2994 B14R1.6054 Cc1ncc(c(c1SCC(C)C)C)N 62a_100000210624_100012352430 [0,1,0,0,0,0|2,1,0]=4 2995 B14R1.6054 Cc1ncc(c(c1SCC(C)C)C)N 62a_100012352430_100000210760 [0,1,0,0,0,0|2,1,0]=4 2996 B14R1.6054 Cc1ncc(c(c1SCC(C)O)C)N 62a_100011218427_100012352430 [0,1,0,0,0,0|2,1,0]=4 2997 B14R1.6054 Cc1ncc(c(c1SCC(C)O)C)N 62a_100012352430_100011218427 [0,1,0,0,0,0|2,1,0]=4 2998 B14R1.6054 Cc1ncc(c(c1SC[C@@H](C)O)C)N 62a_100009817552_100012352430 [0,1,0,0,0,0|2,1,0]=4 2999 B14R1.6054 Cc1ncc(c(c1SC[C@@H](C)O)C)N 62a_100012352430_100009817552 [0,1,0,0,0,0|2,1,0]=4 3000 B14R1.19598 C#CC(C)NCc1c(cccc1C)C 2230a_100000707721_100000758300 [0,1,0,0,0,0|3,0,0]=4 3001 B14R1.19598 C#CC(C)NCc1c(cccc1C)C 270004a_100000707721_100000758299 [0,1,0,0,0,0|3,0,0]=4 3002 B14R1.19598 C#CC(C)NCc1c(cccc1C)C 34a_100000689800_200000035995 [0,1,0,0,0,0|3,0,0]=4 3003 B14R1.19598 C#CC(C)NCc1c(cccc1C)C 34a_100000707721_100000758300 [0,1,0,0,0,0|3,0,0]=4 3004 B14R1.19598 C#CC(C)OCc1c(cccc1C)C 34a_100011933981_200000035995 [0,1,0,0,0,0|3,0,0]=4 3005 B14R1.19598 C#CC(C)SCc1c(cccc1C)C 62a_200000035995_100000758300 [0,1,0,0,0,0|3,0,0]=4 3006 B14R1.19598 C#C[C@@H](C)OCc1c(cccc1C)C 34a_100009815206_100000758300 [0,1,0,0,0,0|3,0,0]=4 3007 B14R1.19598 C#C[C@@H](C)OCc1c(cccc1C)C 7a_100009815206_100000758300 [0,1,0,0,0,0|3,0,0]=4 3008 B14R1.19598 C=C(C#N)COc1c(cccc1C)C 34a_100000210341_100000694840 [0,1,0,0,0,0|0,0,3]=4 3009 B14R1.19598 C=CC(C)OCc1c(cccc1C)C 34a_100000695699_100000758300 [0,1,0,0,0,0|3,0,0]=4 3010 B14R1.19598 C=CC(C)SCc1c(cccc1C)C 62a_100011215867_100000758300 [0,1,0,0,0,0|3,0,0]=4 3011 B14R1.19598 C=CC(O)CNc1c(cccc1C)C 34a_100000185769_100000730141 [0,1,0,0,0,0|2,0,1]=4 3012 B14R1.19598 C=CC(O)COc1c(cccc1Br)C 34a_100009817157_100000730141 [0,1,0,0,0,0|2,0,1]=4 3013 B14R1.19598 C=CC(O)COc1c(cccc1Br)C 7a_100009817157_100000730141 [0,1,0,0,0,0|2,0,1]=4 3014 B14R1.19598 C=CC(O)COc1c(cccc1C)C 34a_100000210341_100000730141 [0,1,0,0,0,0|1,0,1]=3 3015 B14R1.19598 C=CC(O)COc1c(cccc1C)C 7a_100000210341_100000730141 [0,1,0,0,0,0|1,0,1]=3 3016 B14R1.19598 C=CC(O)COc1c(cccc1Cl)C 34a_100000033731_100000730141 [0,1,0,0,0,0|2,0,1]=4 3017 B14R1.19598 C=CC(O)COc1c(cccc1Cl)C 7a_100000033731_100000730141 [0,1,0,0,0,0|2,0,1]=4 3018 B14R1.19598 C=CC(O)COc1c(cccc1F)C 34a_100011659162_100000730141 [0,1,0,0,0,0|2,0,1]=4 3019 B14R1.19598 C=CC(O)COc1c(cccc1F)C 7a_100011659162_100000730141 [0,1,0,0,0,0|2,0,1]=4 3020 B14R1.19598 C=CC(O)COc1c(cccc1N)C 34a_100000756359_100000730141 [0,1,0,0,0,0|2,0,1]=4 3021 B14R1.19598 C=CC(O)COc1c(cccc1N)C 7a_100000756359_100000730141 [0,1,0,0,0,0|2,0,1]=4 3022 B14R1.19598 C=CC(O)COc1c(ccnc1C)C 34a_100011934651_100000730141 [0,1,0,0,0,0|2,0,1]=4 3023 B14R1.19598 C=CC(O)COc1c(ccnc1C)C 7a_100011934651_100000730141 [0,1,0,0,0,0|2,0,1]=4 3024 B14R1.19598 C=CC(O)CSc1c(cccc1C)C 62a_100000033847_100000730141 [0,1,0,0,0,0|1,1,1]=4 3025 B14R1.19598 C=CC(O)CSc1c(cccc1C)C 62a_100000730141_100000033847 [0,1,0,0,0,0|1,1,1]=4 3026 B14R1.19598 CCC(=O)CCc1c(cccc1C)C 1458a_200011998103_100000210202 [0,1,0,0,0,0|2,0,1]=4 3027 B14R1.19598 CCC(=O)COc1c(cccc1Br)C 7a_100009817157_100000747405 [0,1,0,0,0,0|2,0,1]=4 3028 B14R1.19598 CCC(=O)COc1c(cccc1C)C 1458a_100000184085_100000210202 [0,1,0,0,0,0|1,0,1]=3 3029 B14R1.19598 CCC(=O)COc1c(cccc1C)C 7a_100000210341_100000747405 [0,1,0,0,0,0|1,0,1]=3 3030 B14R1.19598 CCC(=O)COc1c(cccc1Cl)C 7a_100000033731_100000747405 [0,1,0,0,0,0|2,0,1]=4 3031 B14R1.19598 CCC(=O)COc1c(cccc1F)C 7a_100011659162_100000747405 [0,1,0,0,0,0|2,0,1]=4 3032 B14R1.19598 CCC(=O)COc1c(cccc1N)C 7a_100000756359_100000747405 [0,1,0,0,0,0|2,0,1]=4 3033 B14R1.19598 CCC(=O)COc1c(ccnc1C)C 7a_100011934651_100000747405 [0,1,0,0,0,0|2,0,1]=4 3034 B14R1.19598 CCC(=O)CSc1c(cccc1C)C 62a_100000033847_100000747405 [0,1,0,0,0,0|1,1,1]=4 3035 B14R1.19598 CCC(=O)CSc1c(cccc1C)C 62a_100000747405_100000033847 [0,1,0,0,0,0|1,1,1]=4 3036 B14R1.19598 CCC(C)CNc1c(cccc1Br)C 34a_100011834072_100000748023 [0,1,0,0,0,0|3,0,0]=4 3037 B14R1.19598 CCC(C)CNc1c(cccc1C)C 34a_100000185769_100000748023 [0,1,0,0,0,0|2,0,0]=3 3038 B14R1.19598 CCC(C)CNc1c(cccc1Cl)C 34a_100000756524_100000748023 [0,1,0,0,0,0|3,0,0]=4 3039 B14R1.19598 CCC(C)CNc1c(cccc1F)C 34a_100000766463_100000748023 [0,1,0,0,0,0|3,0,0]=4 3040 B14R1.19598 CCC(C)CNc1c(cccc1O)C 34a_100000743429_100000748023 [0,1,0,0,0,0|3,0,0]=4 3041 B14R1.19598 CCC(C)COc1c(cccc1Br)Br 34a_100000736428_100000748023 [0,1,0,0,0,0|3,0,0]=4 3042 B14R1.19598 CCC(C)COc1c(cccc1Br)Br 7a_100000736428_100000748023 [0,1,0,0,0,0|3,0,0]=4 3043 B14R1.19598 CCC(C)COc1c(cccc1Br)C 34a_100009817157_100000748023 [0,1,0,0,0,0|2,0,0]=3 3044 B14R1.19598 CCC(C)COc1c(cccc1Br)C 7a_100009817157_100000748023 [0,1,0,0,0,0|2,0,0]=3 3045 B14R1.19598 CCC(C)COc1c(cccc1Br)Cl 34a_100010214474_100000748023 [0,1,0,0,0,0|3,0,0]=4 3046 B14R1.19598 CCC(C)COc1c(cccc1Br)Cl 7a_100010214474_100000748023 [0,1,0,0,0,0|3,0,0]=4 3047 B14R1.19598 CCC(C)COc1c(cccc1Br)F 34a_100009813666_100000748023 [0,1,0,0,0,0|3,0,0]=4 3048 B14R1.19598 CCC(C)COc1c(cccc1Br)F 7a_100009813666_100000748023 [0,1,0,0,0,0|3,0,0]=4 3049 B14R1.19598 CCC(C)COc1c(cccc1Br)N 34a_100011934915_100000748023 [0,1,0,0,0,0|3,0,0]=4 3050 B14R1.19598 CCC(C)COc1c(cccc1C)C 34a_100000210341_100000748023 [0,1,0,0,0,0|1,0,0]=2 3051 B14R1.19598 CCC(C)COc1c(cccc1C)C 7a_100000210341_100000748023 [0,1,0,0,0,0|1,0,0]=2 3052 B14R1.19598 CCC(C)COc1c(cccc1Cl)C 34a_100000033731_100000748023 [0,1,0,0,0,0|2,0,0]=3 3053 B14R1.19598 CCC(C)COc1c(cccc1Cl)C 7a_100000033731_100000748023 [0,1,0,0,0,0|2,0,0]=3 3054 B14R1.19598 CCC(C)COc1c(cccc1Cl)Cl 34a_100000211709_100000748023 [0,1,0,0,0,0|3,0,0]=4 3055 B14R1.19598 CCC(C)COc1c(cccc1Cl)Cl 7a_100000211709_100000748023 [0,1,0,0,0,0|3,0,0]=4 3056 B14R1.19598 CCC(C)COc1c(cccc1Cl)F 34a_100000694953_100000748023 [0,1,0,0,0,0|3,0,0]=4 3057 B14R1.19598 CCC(C)COc1c(cccc1Cl)F 7a_100000694953_100000748023 [0,1,0,0,0,0|3,0,0]=4 3058 B14R1.19598 CCC(C)COc1c(cccc1Cl)N 34a_100000754742_100000748023 [0,1,0,0,0,0|3,0,0]=4 3059 B14R1.19598 CCC(C)COc1c(cccc1F)C 34a_100011659162_100000748023 [0,1,0,0,0,0|2,0,0]=3 3060 B14R1.19598 CCC(C)COc1c(cccc1F)C 7a_100011659162_100000748023 [0,1,0,0,0,0|2,0,0]=3 3061 B14R1.19598 CCC(C)COc1c(cccc1F)F 34a_100000230165_100000748023 [0,1,0,0,0,0|3,0,0]=4 3062 B14R1.19598 CCC(C)COc1c(cccc1F)F 7a_100000230165_100000748023 [0,1,0,0,0,0|3,0,0]=4 3063 B14R1.19598 CCC(C)COc1c(cccc1F)N 34a_100011934987_100000748023 [0,1,0,0,0,0|3,0,0]=4 3064 B14R1.19598 CCC(C)COc1c(cccc1I)Br 34a_100010084509_100000748023 [0,1,0,0,0,0|3,0,0]=4 3065 B14R1.19598 CCC(C)COc1c(cccc1I)Br 7a_100010084509_100000748023 [0,1,0,0,0,0|3,0,0]=4 3066 B14R1.19598 CCC(C)COc1c(cccc1I)Cl 34a_100010202889_100000748023 [0,1,0,0,0,0|3,0,0]=4 3067 B14R1.19598 CCC(C)COc1c(cccc1I)Cl 7a_100010202889_100000748023 [0,1,0,0,0,0|3,0,0]=4 3068 B14R1.19598 CCC(C)COc1c(cccc1I)F 34a_100010186298_100000748023 [0,1,0,0,0,0|3,0,0]=4 3069 B14R1.19598 CCC(C)COc1c(cccc1I)F 7a_100010186298_100000748023 [0,1,0,0,0,0|3,0,0]=4 3070 B14R1.19598 CCC(C)COc1c(cccc1I)N 34a_100010084371_100000748023 [0,1,0,0,0,0|3,0,0]=4 3071 B14R1.19598 CCC(C)COc1c(cccc1N)C 34a_100000756359_100000748023 [0,1,0,0,0,0|2,0,0]=3 3072 B14R1.19598 CCC(C)COc1c(cccc1N)C 7a_100000756359_100000748023 [0,1,0,0,0,0|2,0,0]=3 3073 B14R1.19598 CCC(C)COc1c(cccc1N)N 34a_200016994477_100000748023 [0,1,0,0,0,0|3,0,0]=4 3074 B14R1.19598 CCC(C)COc1c(ccnc1C)C 34a_100011934651_100000748023 [0,1,0,0,0,0|2,0,0]=3 3075 B14R1.19598 CCC(C)COc1c(ccnc1C)C 7a_100011934651_100000748023 [0,1,0,0,0,0|2,0,0]=3 3076 B14R1.19598 CCC(C)COc1c(ccnc1Cl)C 34a_100000696282_100000748023 [0,1,0,0,0,0|3,0,0]=4 3077 B14R1.19598 CCC(C)COc1c(ccnc1Cl)C 7a_100000696282_100000748023 [0,1,0,0,0,0|3,0,0]=4 3078 B14R1.19598 CCC(C)COc1c(ncnc1C)C 34a_100009878406_100000748023 [0,1,0,0,0,0|3,0,0]=4 3079 B14R1.19598 CCC(C)COc1c(ncnc1C)C 7a_100009878406_100000748023 [0,1,0,0,0,0|3,0,0]=4 3080 B14R1.19598 CCC(C)COc1c(occc1=O)C 34a_100000031901_100000748023 [0,1,0,0,0,0|3,0,0]=4 3081 B14R1.19598 CCC(C)CSc1c(cccc1Br)C 62a_100000748023_100010141302 [0,1,0,0,0,0|2,1,0]=4 3082 B14R1.19598 CCC(C)CSc1c(cccc1Br)C 62a_100010141302_100000748023 [0,1,0,0,0,0|2,1,0]=4 3083 B14R1.19598 CCC(C)CSc1c(cccc1C)C 62a_100000033847_100000748023 [0,1,0,0,0,0|1,1,0]=3 3084 B14R1.19598 CCC(C)CSc1c(cccc1C)C 62a_100000748023_100000033847 [0,1,0,0,0,0|1,1,0]=3 3085 B14R1.19598 CCC(C)CSc1c(cccc1Cl)C 62a_100000043165_100000748023 [0,1,0,0,0,0|2,1,0]=4 3086 B14R1.19598 CCC(C)CSc1c(cccc1Cl)C 62a_100000748023_100000043165 [0,1,0,0,0,0|2,1,0]=4 3087 B14R1.19598 CCC(C)CSc1c(cccc1F)C 62a_100000748023_100011218421 [0,1,0,0,0,0|2,1,0]=4 3088 B14R1.19598 CCC(C)CSc1c(cccc1F)C 62a_100011218421_100000748023 [0,1,0,0,0,0|2,1,0]=4 3089 B14R1.19598 CCC(C)CSc1c(cccc1N)C 62a_100000684715_100000748023 [0,1,0,0,0,0|2,1,0]=4 3090 B14R1.19598 CCC(C)CSc1c(cccc1N)C 62a_100000748023_100000684715 [0,1,0,0,0,0|2,1,0]=4 3091 B14R1.19598 CCC(C)CSc1c(cccc1O)C 62a_100000686692_100000748023 [0,1,0,0,0,0|2,1,0]=4 3092 B14R1.19598 CCC(C)CSc1c(cccc1O)C 62a_100000748023_100000686692 [0,1,0,0,0,0|2,1,0]=4 3093 B14R1.19598 CCC(C)CSc1c(ccnc1C)C 62a_100000748023_100012000501 [0,1,0,0,0,0|2,1,0]=4 3094 B14R1.19598 CCC(C)CSc1c(ccnc1C)C 62a_100012000501_100000748023 [0,1,0,0,0,0|2,1,0]=4 3095 B14R1.19598 CCC(C)CSc1c(cncc1C)C 62a_100000748023_100009817138 [0,1,0,0,0,0|2,1,0]=4 3096 B14R1.19598 CCC(C)CSc1c(cncc1C)C 62a_100009817138_100000748023 [0,1,0,0,0,0|2,1,0]=4 3097 B14R1.19598 CCC(C)NCc1c(cccc1C)C 207a_100000209981_100000758299 [0,1,0,0,0,0|3,0,0]=4 3098 B14R1.19598 CCC(C)NCc1c(cccc1C)C 2230a_100000209981_100000758300 [0,1,0,0,0,0|3,0,0]=4 3099 B14R1.19598 CCC(C)NCc1c(cccc1C)C 270004a_100000209981_100000758299 [0,1,0,0,0,0|3,0,0]=4 3100 B14R1.19598 CCC(C)NCc1c(cccc1C)C 34a_100000689800_100011215416 [0,1,0,0,0,0|3,0,0]=4 3101 B14R1.19598 CCC(C)OCc1c(cccc1C)C 34a_100011933981_100011215416 [0,1,0,0,0,0|3,0,0]=4 3102 B14R1.19598 CCC(C)OCc1c(cccc1C)C 7a_100000210228_100000758300 [0,1,0,0,0,0|3,0,0]=4 3103 B14R1.19598 CCC(C)OCc1c(cccc1C)C 7a_100011933981_100000758301 [0,1,0,0,0,0|3,0,0]=4 3104 B14R1.19598 CCC(C)SCc1c(cccc1C)C 62a_100000758300_100000758301 [0,1,0,0,0,0|3,0,0]=4 3105 B14R1.19598 CCC(C)SCc1c(cccc1C)C 62a_100000758301_100000758300 [0,1,0,0,0,0|3,0,0]=4 3106 B14R1.19598 CCC(O)CNc1c(cccc1Br)C 34a_100011834072_100011218378 [0,1,0,0,0,0|3,0,0]=4 3107 B14R1.19598 CCC(O)CNc1c(cccc1C)C 34a_100000185769_100011218378 [0,1,0,0,0,0|2,0,0]=3 3108 B14R1.19598 CCC(O)CNc1c(cccc1Cl)C 34a_100000756524_100011218378 [0,1,0,0,0,0|3,0,0]=4 3109 B14R1.19598 CCC(O)CNc1c(cccc1F)C 34a_100000766463_100011218378 [0,1,0,0,0,0|3,0,0]=4 3110 B14R1.19598 CCC(O)CNc1c(cccc1O)C 34a_100000743429_100011218378 [0,1,0,0,0,0|3,0,0]=4 3111 B14R1.19598 CCC(O)COc1c(cccc1Br)Br 34a_100000736428_100011218378 [0,1,0,0,0,0|3,0,0]=4 3112 B14R1.19598 CCC(O)COc1c(cccc1Br)Br 7a_100000736428_100011218378 [0,1,0,0,0,0|3,0,0]=4 3113 B14R1.19598 CCC(O)COc1c(cccc1Br)C 34a_100009817157_100011218378 [0,1,0,0,0,0|2,0,0]=3 3114 B14R1.19598 CCC(O)COc1c(cccc1Br)C 7a_100009817157_100011218378 [0,1,0,0,0,0|2,0,0]=3 3115 B14R1.19598 CCC(O)COc1c(cccc1Br)Cl 34a_100010214474_100011218378 [0,1,0,0,0,0|3,0,0]=4 3116 B14R1.19598 CCC(O)COc1c(cccc1Br)Cl 7a_100010214474_100011218378 [0,1,0,0,0,0|3,0,0]=4 3117 B14R1.19598 CCC(O)COc1c(cccc1Br)F 34a_100009813666_100011218378 [0,1,0,0,0,0|3,0,0]=4 3118 B14R1.19598 CCC(O)COc1c(cccc1Br)F 7a_100009813666_100011218378 [0,1,0,0,0,0|3,0,0]=4 3119 B14R1.19598 CCC(O)COc1c(cccc1Br)N 34a_100011934915_100011218378 [0,1,0,0,0,0|3,0,0]=4 3120 B14R1.19598 CCC(O)COc1c(cccc1C)C 34a_100000210341_100011218378 [0,1,0,0,0,0|1,0,0]=2 3121 B14R1.19598 CCC(O)COc1c(cccc1C)C 7a_100000210341_100011218378 [0,1,0,0,0,0|1,0,0]=2 3122 B14R1.19598 CCC(O)COc1c(cccc1Cl)C 34a_100000033731_100011218378 [0,1,0,0,0,0|2,0,0]=3 3123 B14R1.19598 CCC(O)COc1c(cccc1Cl)C 7a_100000033731_100011218378 [0,1,0,0,0,0|2,0,0]=3 3124 B14R1.19598 CCC(O)COc1c(cccc1Cl)Cl 34a_100000211709_100011218378 [0,1,0,0,0,0|3,0,0]=4 3125 B14R1.19598 CCC(O)COc1c(cccc1Cl)Cl 7a_100000211709_100011218378 [0,1,0,0,0,0|3,0,0]=4 3126 B14R1.19598 CCC(O)COc1c(cccc1Cl)F 34a_100000694953_100011218378 [0,1,0,0,0,0|3,0,0]=4 3127 B14R1.19598 CCC(O)COc1c(cccc1Cl)F 7a_100000694953_100011218378 [0,1,0,0,0,0|3,0,0]=4 3128 B14R1.19598 CCC(O)COc1c(cccc1Cl)N 34a_100000754742_100011218378 [0,1,0,0,0,0|3,0,0]=4 3129 B14R1.19598 CCC(O)COc1c(cccc1F)C 34a_100011659162_100011218378 [0,1,0,0,0,0|2,0,0]=3 3130 B14R1.19598 CCC(O)COc1c(cccc1F)C 7a_100011659162_100011218378 [0,1,0,0,0,0|2,0,0]=3 3131 B14R1.19598 CCC(O)COc1c(cccc1F)F 34a_100000230165_100011218378 [0,1,0,0,0,0|3,0,0]=4 3132 B14R1.19598 CCC(O)COc1c(cccc1F)F 7a_100000230165_100011218378 [0,1,0,0,0,0|3,0,0]=4 3133 B14R1.19598 CCC(O)COc1c(cccc1F)N 34a_100011934987_100011218378 [0,1,0,0,0,0|3,0,0]=4 3134 B14R1.19598 CCC(O)COc1c(cccc1I)Br 34a_100010084509_100011218378 [0,1,0,0,0,0|3,0,0]=4 3135 B14R1.19598 CCC(O)COc1c(cccc1I)Br 7a_100010084509_100011218378 [0,1,0,0,0,0|3,0,0]=4 3136 B14R1.19598 CCC(O)COc1c(cccc1I)Cl 34a_100010202889_100011218378 [0,1,0,0,0,0|3,0,0]=4 3137 B14R1.19598 CCC(O)COc1c(cccc1I)Cl 7a_100010202889_100011218378 [0,1,0,0,0,0|3,0,0]=4 3138 B14R1.19598 CCC(O)COc1c(cccc1I)F 34a_100010186298_100011218378 [0,1,0,0,0,0|3,0,0]=4 3139 B14R1.19598 CCC(O)COc1c(cccc1I)F 7a_100010186298_100011218378 [0,1,0,0,0,0|3,0,0]=4 3140 B14R1.19598 CCC(O)COc1c(cccc1I)N 34a_100010084371_100011218378 [0,1,0,0,0,0|3,0,0]=4 3141 B14R1.19598 CCC(O)COc1c(cccc1N)C 34a_100000756359_100011218378 [0,1,0,0,0,0|2,0,0]=3 3142 B14R1.19598 CCC(O)COc1c(cccc1N)C 7a_100000756359_100011218378 [0,1,0,0,0,0|2,0,0]=3 3143 B14R1.19598 CCC(O)COc1c(cccc1N)N 34a_200016994477_100011218378 [0,1,0,0,0,0|3,0,0]=4 3144 B14R1.19598 CCC(O)COc1c(ccnc1C)C 34a_100011934651_100011218378 [0,1,0,0,0,0|2,0,0]=3 3145 B14R1.19598 CCC(O)COc1c(ccnc1C)C 7a_100011934651_100011218378 [0,1,0,0,0,0|2,0,0]=3 3146 B14R1.19598 CCC(O)COc1c(ccnc1Cl)C 34a_100000696282_100011218378 [0,1,0,0,0,0|3,0,0]=4 3147 B14R1.19598 CCC(O)COc1c(ccnc1Cl)C 7a_100000696282_100011218378 [0,1,0,0,0,0|3,0,0]=4 3148 B14R1.19598 CCC(O)COc1c(ncnc1C)C 34a_100009878406_100011218378 [0,1,0,0,0,0|3,0,0]=4 3149 B14R1.19598 CCC(O)COc1c(ncnc1C)C 7a_100009878406_100011218378 [0,1,0,0,0,0|3,0,0]=4 3150 B14R1.19598 CCC(O)COc1c(occc1=O)C 34a_100000031901_100011218378 [0,1,0,0,0,0|3,0,0]=4 3151 B14R1.19598 CCC(O)CSc1c(cccc1Br)C 62a_100010141302_100011218378 [0,1,0,0,0,0|2,1,0]=4 3152 B14R1.19598 CCC(O)CSc1c(cccc1Br)C 62a_100011218378_100010141302 [0,1,0,0,0,0|2,1,0]=4 3153 B14R1.19598 CCC(O)CSc1c(cccc1C)C 62a_100000033847_100011218378 [0,1,0,0,0,0|1,1,0]=3 3154 B14R1.19598 CCC(O)CSc1c(cccc1C)C 62a_100011218378_100000033847 [0,1,0,0,0,0|1,1,0]=3 3155 B14R1.19598 CCC(O)CSc1c(cccc1Cl)C 62a_100000043165_100011218378 [0,1,0,0,0,0|2,1,0]=4 3156 B14R1.19598 CCC(O)CSc1c(cccc1Cl)C 62a_100011218378_100000043165 [0,1,0,0,0,0|2,1,0]=4 3157 B14R1.19598 CCC(O)CSc1c(cccc1F)C 62a_100011218378_100011218421 [0,1,0,0,0,0|2,1,0]=4 3158 B14R1.19598 CCC(O)CSc1c(cccc1F)C 62a_100011218421_100011218378 [0,1,0,0,0,0|2,1,0]=4 3159 B14R1.19598 CCC(O)CSc1c(cccc1N)C 62a_100000684715_100011218378 [0,1,0,0,0,0|2,1,0]=4 3160 B14R1.19598 CCC(O)CSc1c(cccc1N)C 62a_100011218378_100000684715 [0,1,0,0,0,0|2,1,0]=4 3161 B14R1.19598 CCC(O)CSc1c(cccc1O)C 62a_100000686692_100011218378 [0,1,0,0,0,0|2,1,0]=4 3162 B14R1.19598 CCC(O)CSc1c(cccc1O)C 62a_100011218378_100000686692 [0,1,0,0,0,0|2,1,0]=4 3163 B14R1.19598 CCC(O)CSc1c(ccnc1C)C 62a_100011218378_100012000501 [0,1,0,0,0,0|2,1,0]=4 3164 B14R1.19598 CCC(O)CSc1c(ccnc1C)C 62a_100012000501_100011218378 [0,1,0,0,0,0|2,1,0]=4 3165 B14R1.19598 CCC(O)CSc1c(cncc1C)C 62a_100009817138_100011218378 [0,1,0,0,0,0|2,1,0]=4 3166 B14R1.19598 CCC(O)CSc1c(cncc1C)C 62a_100011218378_100009817138 [0,1,0,0,0,0|2,1,0]=4 3167 B14R1.19598 CC[C@H](C)CNc1c(cccc1Br)C 34a_100011834072_100009816398 [0,1,0,0,0,0|3,0,0]=4 3168 B14R1.19598 CC[C@H](C)CNc1c(cccc1C)C 34a_100000185769_100009816398 [0,1,0,0,0,0|2,0,0]=3 3169 B14R1.19598 CC[C@H](C)CNc1c(cccc1Cl)C 34a_100000756524_100009816398 [0,1,0,0,0,0|3,0,0]=4 3170 B14R1.19598 CC[C@H](C)CNc1c(cccc1F)C 34a_100000766463_100009816398 [0,1,0,0,0,0|3,0,0]=4 3171 B14R1.19598 CC[C@H](C)CNc1c(cccc1O)C 34a_100000743429_100009816398 [0,1,0,0,0,0|3,0,0]=4 3172 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)Br 34a_100000736428_100009816398 [0,1,0,0,0,0|3,0,0]=4 3173 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)Br 7a_100000736428_100009816398 [0,1,0,0,0,0|3,0,0]=4 3174 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)C 34a_100009817157_100009816398 [0,1,0,0,0,0|2,0,0]=3 3175 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)C 7a_100009817157_100009816398 [0,1,0,0,0,0|2,0,0]=3 3176 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)Cl 34a_100010214474_100009816398 [0,1,0,0,0,0|3,0,0]=4 3177 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)Cl 7a_100010214474_100009816398 [0,1,0,0,0,0|3,0,0]=4 3178 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)F 34a_100009813666_100009816398 [0,1,0,0,0,0|3,0,0]=4 3179 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)F 7a_100009813666_100009816398 [0,1,0,0,0,0|3,0,0]=4 3180 B14R1.19598 CC[C@H](C)COc1c(cccc1Br)N 34a_100011934915_100009816398 [0,1,0,0,0,0|3,0,0]=4 3181 B14R1.19598 CC[C@H](C)COc1c(cccc1C)C 34a_100000210341_100009816398 [0,1,0,0,0,0|1,0,0]=2 3182 B14R1.19598 CC[C@H](C)COc1c(cccc1C)C 7a_100000210341_100009816398 [0,1,0,0,0,0|1,0,0]=2 3183 B14R1.19598 CC[C@H](C)COc1c(cccc1Cl)C 34a_100000033731_100009816398 [0,1,0,0,0,0|2,0,0]=3 3184 B14R1.19598 CC[C@H](C)COc1c(cccc1Cl)C 7a_100000033731_100009816398 [0,1,0,0,0,0|2,0,0]=3 3185 B14R1.19598 CC[C@H](C)COc1c(cccc1Cl)Cl 34a_100000211709_100009816398 [0,1,0,0,0,0|3,0,0]=4 3186 B14R1.19598 CC[C@H](C)COc1c(cccc1Cl)Cl 7a_100000211709_100009816398 [0,1,0,0,0,0|3,0,0]=4 3187 B14R1.19598 CC[C@H](C)COc1c(cccc1Cl)F 34a_100000694953_100009816398 [0,1,0,0,0,0|3,0,0]=4 3188 B14R1.19598 CC[C@H](C)COc1c(cccc1Cl)F 7a_100000694953_100009816398 [0,1,0,0,0,0|3,0,0]=4 3189 B14R1.19598 CC[C@H](C)COc1c(cccc1Cl)N 34a_100000754742_100009816398 [0,1,0,0,0,0|3,0,0]=4 3190 B14R1.19598 CC[C@H](C)COc1c(cccc1F)C 34a_100011659162_100009816398 [0,1,0,0,0,0|2,0,0]=3 3191 B14R1.19598 CC[C@H](C)COc1c(cccc1F)C 7a_100011659162_100009816398 [0,1,0,0,0,0|2,0,0]=3 3192 B14R1.19598 CC[C@H](C)COc1c(cccc1F)F 34a_100000230165_100009816398 [0,1,0,0,0,0|3,0,0]=4 3193 B14R1.19598 CC[C@H](C)COc1c(cccc1F)F 7a_100000230165_100009816398 [0,1,0,0,0,0|3,0,0]=4 3194 B14R1.19598 CC[C@H](C)COc1c(cccc1F)N 34a_100011934987_100009816398 [0,1,0,0,0,0|3,0,0]=4 3195 B14R1.19598 CC[C@H](C)COc1c(cccc1I)Br 34a_100010084509_100009816398 [0,1,0,0,0,0|3,0,0]=4 3196 B14R1.19598 CC[C@H](C)COc1c(cccc1I)Br 7a_100010084509_100009816398 [0,1,0,0,0,0|3,0,0]=4 3197 B14R1.19598 CC[C@H](C)COc1c(cccc1I)Cl 34a_100010202889_100009816398 [0,1,0,0,0,0|3,0,0]=4 3198 B14R1.19598 CC[C@H](C)COc1c(cccc1I)Cl 7a_100010202889_100009816398 [0,1,0,0,0,0|3,0,0]=4 3199 B14R1.19598 CC[C@H](C)COc1c(cccc1I)F 34a_100010186298_100009816398 [0,1,0,0,0,0|3,0,0]=4 3200 B14R1.19598 CC[C@H](C)COc1c(cccc1I)F 7a_100010186298_100009816398 [0,1,0,0,0,0|3,0,0]=4 3201 B14R1.19598 CC[C@H](C)COc1c(cccc1I)N 34a_100010084371_100009816398 [0,1,0,0,0,0|3,0,0]=4 3202 B14R1.19598 CC[C@H](C)COc1c(cccc1N)C 34a_100000756359_100009816398 [0,1,0,0,0,0|2,0,0]=3 3203 B14R1.19598 CC[C@H](C)COc1c(cccc1N)C 7a_100000756359_100009816398 [0,1,0,0,0,0|2,0,0]=3 3204 B14R1.19598 CC[C@H](C)COc1c(cccc1N)N 34a_200016994477_100009816398 [0,1,0,0,0,0|3,0,0]=4 3205 B14R1.19598 CC[C@H](C)COc1c(ccnc1C)C 34a_100011934651_100009816398 [0,1,0,0,0,0|2,0,0]=3 3206 B14R1.19598 CC[C@H](C)COc1c(ccnc1C)C 7a_100011934651_100009816398 [0,1,0,0,0,0|2,0,0]=3 3207 B14R1.19598 CC[C@H](C)COc1c(ccnc1Cl)C 34a_100000696282_100009816398 [0,1,0,0,0,0|3,0,0]=4 3208 B14R1.19598 CC[C@H](C)COc1c(ccnc1Cl)C 7a_100000696282_100009816398 [0,1,0,0,0,0|3,0,0]=4 3209 B14R1.19598 CC[C@H](C)COc1c(ncnc1C)C 34a_100009878406_100009816398 [0,1,0,0,0,0|3,0,0]=4 3210 B14R1.19598 CC[C@H](C)COc1c(ncnc1C)C 7a_100009878406_100009816398 [0,1,0,0,0,0|3,0,0]=4 3211 B14R1.19598 CC[C@H](C)COc1c(occc1=O)C 34a_100000031901_100009816398 [0,1,0,0,0,0|3,0,0]=4 3212 B14R1.19598 CC[C@H](C)CSc1c(cccc1Br)C 62a_100009816398_100010141302 [0,1,0,0,0,0|2,1,0]=4 3213 B14R1.19598 CC[C@H](C)CSc1c(cccc1Br)C 62a_100010141302_100009816398 [0,1,0,0,0,0|2,1,0]=4 3214 B14R1.19598 CC[C@H](C)CSc1c(cccc1C)C 62a_100000033847_100009816398 [0,1,0,0,0,0|1,1,0]=3 3215 B14R1.19598 CC[C@H](C)CSc1c(cccc1C)C 62a_100009816398_100000033847 [0,1,0,0,0,0|1,1,0]=3 3216 B14R1.19598 CC[C@H](C)CSc1c(cccc1Cl)C 62a_100000043165_100009816398 [0,1,0,0,0,0|2,1,0]=4 3217 B14R1.19598 CC[C@H](C)CSc1c(cccc1Cl)C 62a_100009816398_100000043165 [0,1,0,0,0,0|2,1,0]=4 3218 B14R1.19598 CC[C@H](C)CSc1c(cccc1F)C 62a_100009816398_100011218421 [0,1,0,0,0,0|2,1,0]=4 3219 B14R1.19598 CC[C@H](C)CSc1c(cccc1F)C 62a_100011218421_100009816398 [0,1,0,0,0,0|2,1,0]=4 3220 B14R1.19598 CC[C@H](C)CSc1c(cccc1N)C 62a_100000684715_100009816398 [0,1,0,0,0,0|2,1,0]=4 3221 B14R1.19598 CC[C@H](C)CSc1c(cccc1N)C 62a_100009816398_100000684715 [0,1,0,0,0,0|2,1,0]=4 3222 B14R1.19598 CC[C@H](C)CSc1c(cccc1O)C 62a_100000686692_100009816398 [0,1,0,0,0,0|2,1,0]=4 3223 B14R1.19598 CC[C@H](C)CSc1c(cccc1O)C 62a_100009816398_100000686692 [0,1,0,0,0,0|2,1,0]=4 3224 B14R1.19598 CC[C@H](C)CSc1c(ccnc1C)C 62a_100009816398_100012000501 [0,1,0,0,0,0|2,1,0]=4 3225 B14R1.19598 CC[C@H](C)CSc1c(ccnc1C)C 62a_100012000501_100009816398 [0,1,0,0,0,0|2,1,0]=4 3226 B14R1.19598 CC[C@H](C)CSc1c(cncc1C)C 62a_100009816398_100009817138 [0,1,0,0,0,0|2,1,0]=4 3227 B14R1.19598 CC[C@H](C)CSc1c(cncc1C)C 62a_100009817138_100009816398 [0,1,0,0,0,0|2,1,0]=4 3228 B14R1.19598 CNC(=O)CCc1c(cccc1C)C 11a_106832991635_200011998103 [0,1,0,0,0,0|2,0,1]=4 3229 B14R1.19598 CNC(=O)CCc1c(cccc1C)C 1626a_100102657272_200011998103 [0,1,0,0,0,0|2,0,1]=4 3230 B14R1.19598 CNC(=O)CCc1c(cccc1C)C 240690a_100102657272_200011998103 [0,1,0,0,0,0|2,0,1]=4 3231 B14R1.19598 CNC(=O)CCc1c(cccc1C)C 527a_100102657272_200011998103 [0,1,0,0,0,0|2,0,1]=4 3232 B14R1.19598 CNC(=O)CNc1c(cccc1C)C 34a_100000185769_100000183359 [0,1,0,0,0,0|2,0,1]=4 3233 B14R1.19598 CNC(=O)COc1c(cccc1Br)C 34a_100009817157_100000183359 [0,1,0,0,0,0|2,0,1]=4 3234 B14R1.19598 CNC(=O)COc1c(cccc1Br)C 7a_100009817157_100000183359 [0,1,0,0,0,0|2,0,1]=4 3235 B14R1.19598 CNC(=O)COc1c(cccc1C)C 11a_106832991635_100000184085 [0,1,0,0,0,0|1,0,1]=3 3236 B14R1.19598 CNC(=O)COc1c(cccc1C)C 1626a_100102657272_100000184085 [0,1,0,0,0,0|1,0,1]=3 3237 B14R1.19598 CNC(=O)COc1c(cccc1C)C 240690a_100102657272_100000184085 [0,1,0,0,0,0|1,0,1]=3 3238 B14R1.19598 CNC(=O)COc1c(cccc1C)C 34a_100000210341_100000183359 [0,1,0,0,0,0|1,0,1]=3 3239 B14R1.19598 CNC(=O)COc1c(cccc1C)C 527a_100102657272_100000184085 [0,1,0,0,0,0|1,0,1]=3 3240 B14R1.19598 CNC(=O)COc1c(cccc1C)C 7a_100000210341_100000183359 [0,1,0,0,0,0|1,0,1]=3 3241 B14R1.19598 CNC(=O)COc1c(cccc1Cl)C 34a_100000033731_100000183359 [0,1,0,0,0,0|2,0,1]=4 3242 B14R1.19598 CNC(=O)COc1c(cccc1Cl)C 7a_100000033731_100000183359 [0,1,0,0,0,0|2,0,1]=4 3243 B14R1.19598 CNC(=O)COc1c(cccc1F)C 34a_100011659162_100000183359 [0,1,0,0,0,0|2,0,1]=4 3244 B14R1.19598 CNC(=O)COc1c(cccc1F)C 7a_100011659162_100000183359 [0,1,0,0,0,0|2,0,1]=4 3245 B14R1.19598 CNC(=O)COc1c(cccc1N)C 34a_100000756359_100000183359 [0,1,0,0,0,0|2,0,1]=4 3246 B14R1.19598 CNC(=O)COc1c(cccc1N)C 7a_100000756359_100000183359 [0,1,0,0,0,0|2,0,1]=4 3247 B14R1.19598 CNC(=O)COc1c(ccnc1C)C 34a_100011934651_100000183359 [0,1,0,0,0,0|2,0,1]=4 3248 B14R1.19598 CNC(=O)COc1c(ccnc1C)C 7a_100011934651_100000183359 [0,1,0,0,0,0|2,0,1]=4 3249 B14R1.19598 CNC(=O)CSc1c(cccc1C)C 62a_100000033847_100000183359 [0,1,0,0,0,0|1,1,1]=4 3250 B14R1.19598 CNC(=O)CSc1c(cccc1C)C 62a_100000183359_100000033847 [0,1,0,0,0,0|1,1,1]=4 3251 B14R1.19598 CNC(C)COc1c(cccc1C)C 2230a_100000744845_200000210301 [0,1,0,0,0,0|0,0,0]=1 3252 B14R1.19598 CNC(C)COc1c(cccc1C)C 270004a_106832991635_100011343208 [0,1,0,0,0,0|0,0,0]=1 3253 B14R1.19598 CNC(C)COc1c(cccc1C)C 34a_100000744845_200000210301 [0,1,0,0,0,0|0,0,0]=1 3254 B14R1.19598 COC(=O)CNc1c(cccc1C)C 34a_100000185769_100000747449 [0,1,0,0,0,0|2,0,1]=4 3255 B14R1.19598 COC(=O)COc1c(cccc1Br)C 34a_100009817157_100000747449 [0,1,0,0,0,0|2,0,1]=4 3256 B14R1.19598 COC(=O)COc1c(cccc1Br)C 7a_100009817157_100000747449 [0,1,0,0,0,0|2,0,1]=4 3257 B14R1.19598 COC(=O)COc1c(cccc1C)C 34a_100000210341_100000747449 [0,1,0,0,0,0|1,0,1]=3 3258 B14R1.19598 COC(=O)COc1c(cccc1C)C 7a_100000210341_100000747449 [0,1,0,0,0,0|1,0,1]=3 3259 B14R1.19598 COC(=O)COc1c(cccc1Cl)C 34a_100000033731_100000747449 [0,1,0,0,0,0|2,0,1]=4 3260 B14R1.19598 COC(=O)COc1c(cccc1Cl)C 7a_100000033731_100000747449 [0,1,0,0,0,0|2,0,1]=4 3261 B14R1.19598 COC(=O)COc1c(cccc1F)C 34a_100011659162_100000747449 [0,1,0,0,0,0|2,0,1]=4 3262 B14R1.19598 COC(=O)COc1c(cccc1F)C 7a_100011659162_100000747449 [0,1,0,0,0,0|2,0,1]=4 3263 B14R1.19598 COC(=O)COc1c(cccc1N)C 34a_100000756359_100000747449 [0,1,0,0,0,0|2,0,1]=4 3264 B14R1.19598 COC(=O)COc1c(cccc1N)C 7a_100000756359_100000747449 [0,1,0,0,0,0|2,0,1]=4 3265 B14R1.19598 COC(=O)COc1c(ccnc1C)C 34a_100011934651_100000747449 [0,1,0,0,0,0|2,0,1]=4 3266 B14R1.19598 COC(=O)COc1c(ccnc1C)C 7a_100011934651_100000747449 [0,1,0,0,0,0|2,0,1]=4 3267 B14R1.19598 COC(=O)CSc1c(cccc1C)C 62a_100000033847_100000747449 [0,1,0,0,0,0|1,1,1]=4 3268 B14R1.19598 COC(=O)CSc1c(cccc1C)C 62a_100000747449_100000033847 [0,1,0,0,0,0|1,1,1]=4 3269 B14R1.19598 COC(C)SCc1c(cccc1C)C 62a_100000758300_100009879195 [0,1,0,0,0,0|3,0,0]=4 3270 B14R1.19598 COC(C)SCc1c(cccc1C)C 62a_100009879195_100000758300 [0,1,0,0,0,0|3,0,0]=4 3271 B14R1.19598 C[C@@H](CO)COc1c(cccc1Br)Br 34a_100000736428_100000059175 [0,1,0,0,0,0|3,0,0]=4 3272 B14R1.19598 C[C@@H](CO)COc1c(cccc1Br)Br 7a_100000736428_100000059175 [0,1,0,0,0,0|3,0,0]=4 3273 B14R1.19598 C[C@@H](CO)COc1c(cccc1Br)Cl 34a_100010214474_100000059175 [0,1,0,0,0,0|3,0,0]=4 3274 B14R1.19598 C[C@@H](CO)COc1c(cccc1Br)Cl 7a_100010214474_100000059175 [0,1,0,0,0,0|3,0,0]=4 3275 B14R1.19598 C[C@@H](CO)COc1c(cccc1Br)F 34a_100009813666_100000059175 [0,1,0,0,0,0|3,0,0]=4 3276 B14R1.19598 C[C@@H](CO)COc1c(cccc1Br)F 7a_100009813666_100000059175 [0,1,0,0,0,0|3,0,0]=4 3277 B14R1.19598 C[C@@H](CO)COc1c(cccc1Br)N 34a_100011934915_100000059175 [0,1,0,0,0,0|3,0,0]=4 3278 B14R1.19598 C[C@@H](CO)COc1c(cccc1Cl)Cl 34a_100000211709_100000059175 [0,1,0,0,0,0|3,0,0]=4 3279 B14R1.19598 C[C@@H](CO)COc1c(cccc1Cl)Cl 7a_100000211709_100000059175 [0,1,0,0,0,0|3,0,0]=4 3280 B14R1.19598 C[C@@H](CO)COc1c(cccc1Cl)F 34a_100000694953_100000059175 [0,1,0,0,0,0|3,0,0]=4 3281 B14R1.19598 C[C@@H](CO)COc1c(cccc1Cl)F 7a_100000694953_100000059175 [0,1,0,0,0,0|3,0,0]=4 3282 B14R1.19598 C[C@@H](CO)COc1c(cccc1Cl)N 34a_100000754742_100000059175 [0,1,0,0,0,0|3,0,0]=4 3283 B14R1.19598 C[C@@H](CO)COc1c(cccc1F)F 34a_100000230165_100000059175 [0,1,0,0,0,0|3,0,0]=4 3284 B14R1.19598 C[C@@H](CO)COc1c(cccc1F)F 7a_100000230165_100000059175 [0,1,0,0,0,0|3,0,0]=4 3285 B14R1.19598 C[C@@H](CO)COc1c(cccc1F)N 34a_100011934987_100000059175 [0,1,0,0,0,0|3,0,0]=4 3286 B14R1.19598 C[C@@H](CO)COc1c(cccc1I)Br 34a_100010084509_100000059175 [0,1,0,0,0,0|3,0,0]=4 3287 B14R1.19598 C[C@@H](CO)COc1c(cccc1I)Br 7a_100010084509_100000059175 [0,1,0,0,0,0|3,0,0]=4 3288 B14R1.19598 C[C@@H](CO)COc1c(cccc1I)Cl 34a_100010202889_100000059175 [0,1,0,0,0,0|3,0,0]=4 3289 B14R1.19598 C[C@@H](CO)COc1c(cccc1I)Cl 7a_100010202889_100000059175 [0,1,0,0,0,0|3,0,0]=4 3290 B14R1.19598 C[C@@H](CO)COc1c(cccc1I)F 34a_100010186298_100000059175 [0,1,0,0,0,0|3,0,0]=4 3291 B14R1.19598 C[C@@H](CO)COc1c(cccc1I)F 7a_100010186298_100000059175 [0,1,0,0,0,0|3,0,0]=4 3292 B14R1.19598 C[C@@H](CO)COc1c(cccc1I)N 34a_100010084371_100000059175 [0,1,0,0,0,0|3,0,0]=4 3293 B14R1.19598 C[C@@H](CO)COc1c(cccc1N)N 34a_200016994477_100000059175 [0,1,0,0,0,0|3,0,0]=4 3294 B14R1.19598 Cc1cccc(c1CCC(=O)CF)C 1458a_200011998103_100015361967 [0,1,0,0,0,0|2,0,1]=4 3295 B14R1.19598 Cc1cccc(c1CNC(C)C#N)C 2230a_100000737613_100000758300 [0,1,0,0,0,0|2,0,1]=4 3296 B14R1.19598 Cc1cccc(c1CNC(C)CO)C 34a_100000689800_100012180447 [0,1,0,0,0,0|3,0,0]=4 3297 B14R1.19598 Cc1cccc(c1CN[C@H](C)CF)C 207a_100102880703_100000758299 [0,1,0,0,0,0|3,0,0]=4 3298 B14R1.19598 Cc1cccc(c1CN[C@H](C)CF)C 270004a_100102880703_100000758299 [0,1,0,0,0,0|3,0,0]=4 3299 B14R1.19598 Cc1cccc(c1CN[C@H](C)CO)C 207a_100000737577_100000758299 [0,1,0,0,0,0|3,0,0]=4 3300 B14R1.19598 Cc1cccc(c1CN[C@H](C)CO)C 2230a_100000737577_100000758300 [0,1,0,0,0,0|3,0,0]=4 3301 B14R1.19598 Cc1cccc(c1CN[C@H](C)CO)C 270004a_100000737577_100000758299 [0,1,0,0,0,0|3,0,0]=4 3302 B14R1.19598 Cc1cccc(c1COC(C)C#N)C 34a_100011218135_100000758300 [0,1,0,0,0,0|2,0,1]=4 3303 B14R1.19598 Cc1cccc(c1COC(C)C#N)C 7a_100011933981_100000703298 [0,1,0,0,0,0|2,0,1]=4 3304 B14R1.19598 Cc1cccc(c1COC(C)CF)C 34a_100016041109_100000758300 [0,1,0,0,0,0|3,0,0]=4 3305 B14R1.19598 Cc1cccc(c1COC(C)CF)C 7a_100016041109_100000758300 [0,1,0,0,0,0|3,0,0]=4 3306 B14R1.19598 Cc1cccc(c1COC(C)CN)Br 34a_100000210904_100010146847 [0,1,0,0,0,0|3,0,0]=4 3307 B14R1.19598 Cc1cccc(c1COC(C)CN)C 34a_100000210904_100000758300 [0,1,0,0,0,0|2,0,0]=3 3308 B14R1.19598 Cc1cccc(c1COC(C)CN)F 34a_100000210904_100009814554 [0,1,0,0,0,0|3,0,0]=4 3309 B14R1.19598 Cc1cccc(c1COC(C)CN)I 34a_100000210904_100010150146 [0,1,0,0,0,0|3,0,0]=4 3310 B14R1.19598 Cc1cccc(c1COC(C)CO)C 34a_100011933981_100012180447 [0,1,0,0,0,0|3,0,0]=4 3311 B14R1.19598 Cc1cccc(c1COC(C)CO)C 7a_100011933981_100012180447 [0,1,0,0,0,0|3,0,0]=4 3312 B14R1.19598 Cc1cccc(c1CSC(C)C#N)C 62a_100000703298_100000758300 [0,1,0,0,0,0|2,0,1]=4 3313 B14R1.19598 Cc1cccc(c1CSC(C)C#N)C 62a_100000758300_100000703298 [0,1,0,0,0,0|2,0,1]=4 3314 B14R1.19598 Cc1cccc(c1CSC(C)CO)C 62a_100012180447_100000758300 [0,1,0,0,0,0|3,0,0]=4 3315 B14R1.19598 Cc1cccc(c1CS[C@H](C)CO)C 62a_100000758300_100016084084 [0,1,0,0,0,0|3,0,0]=4 3316 B14R1.19598 Cc1cccc(c1CS[C@H](C)CO)C 62a_100016084084_100000758300 [0,1,0,0,0,0|3,0,0]=4 3317 B14R1.19598 Cc1cccc(c1NCC(O)CO)Br 34a_100011834072_100011219619 [0,1,0,0,0,0|3,0,0]=4 3318 B14R1.19598 Cc1cccc(c1NCC(O)CO)C 34a_100000185769_100011219619 [0,1,0,0,0,0|2,0,0]=3 3319 B14R1.19598 Cc1cccc(c1NCC(O)CO)Cl 34a_100000756524_100011219619 [0,1,0,0,0,0|3,0,0]=4 3320 B14R1.19598 Cc1cccc(c1NCC(O)CO)F 34a_100000766463_100011219619 [0,1,0,0,0,0|3,0,0]=4 3321 B14R1.19598 Cc1cccc(c1NCC(O)CO)O 34a_100000743429_100011219619 [0,1,0,0,0,0|3,0,0]=4 3322 B14R1.19598 Cc1cccc(c1NC[C@@H](C)CO)Br 34a_100011834072_100000059175 [0,1,0,0,0,0|3,0,0]=4 3323 B14R1.19598 Cc1cccc(c1NC[C@@H](C)CO)C 34a_100000185769_100000059175 [0,1,0,0,0,0|2,0,0]=3 3324 B14R1.19598 Cc1cccc(c1NC[C@@H](C)CO)Cl 34a_100000756524_100000059175 [0,1,0,0,0,0|3,0,0]=4 3325 B14R1.19598 Cc1cccc(c1NC[C@@H](C)CO)F 34a_100000766463_100000059175 [0,1,0,0,0,0|3,0,0]=4 3326 B14R1.19598 Cc1cccc(c1NC[C@@H](C)CO)O 34a_100000743429_100000059175 [0,1,0,0,0,0|3,0,0]=4 3327 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CF)Br 34a_100011834072_100015614560 [0,1,0,0,0,0|3,0,0]=4 3328 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CF)C 34a_100000185769_100015614560 [0,1,0,0,0,0|2,0,0]=3 3329 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CF)Cl 34a_100000756524_100015614560 [0,1,0,0,0,0|3,0,0]=4 3330 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CF)F 34a_100000766463_100015614560 [0,1,0,0,0,0|3,0,0]=4 3331 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CF)O 34a_100000743429_100015614560 [0,1,0,0,0,0|3,0,0]=4 3332 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CO)Br 34a_100011834072_100009815848 [0,1,0,0,0,0|3,0,0]=4 3333 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CO)C 34a_100000185769_100009815848 [0,1,0,0,0,0|2,0,0]=3 3334 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CO)Cl 34a_100000756524_100009815848 [0,1,0,0,0,0|3,0,0]=4 3335 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CO)F 34a_100000766463_100009815848 [0,1,0,0,0,0|3,0,0]=4 3336 B14R1.19598 Cc1cccc(c1NC[C@@H](O)CO)O 34a_100000743429_100009815848 [0,1,0,0,0,0|3,0,0]=4 3337 B14R1.19598 Cc1cccc(c1OCC(=O)CF)C 1458a_100000184085_100015361967 [0,1,0,0,0,0|1,0,1]=3 3338 B14R1.19598 Cc1cccc(c1OCC(C)N[13CH3])C 2230a_100000744845_200025704644 [0,1,0,0,0,0|0,0,0]=1 3339 B14R1.19598 Cc1cccc(c1OCC(C)N[13CH3])C 34a_100000744845_200025704644 [0,1,0,0,0,0|0,0,0]=1 3340 B14R1.19598 Cc1cccc(c1OCC(O)CO)Br 34a_100009817157_100011219619 [0,1,0,0,0,0|2,0,0]=3 3341 B14R1.19598 Cc1cccc(c1OCC(O)CO)Br 7a_100009817157_100011219619 [0,1,0,0,0,0|2,0,0]=3 3342 B14R1.19598 Cc1cccc(c1OCC(O)CO)C 34a_100000210341_100011219619 [0,1,0,0,0,0|1,0,0]=2 3343 B14R1.19598 Cc1cccc(c1OCC(O)CO)C 7a_100000210341_100011219619 [0,1,0,0,0,0|1,0,0]=2 3344 B14R1.19598 Cc1cccc(c1OCC(O)CO)Cl 34a_100000033731_100011219619 [0,1,0,0,0,0|2,0,0]=3 3345 B14R1.19598 Cc1cccc(c1OCC(O)CO)Cl 7a_100000033731_100011219619 [0,1,0,0,0,0|2,0,0]=3 3346 B14R1.19598 Cc1cccc(c1OCC(O)CO)F 34a_100011659162_100011219619 [0,1,0,0,0,0|2,0,0]=3 3347 B14R1.19598 Cc1cccc(c1OCC(O)CO)F 7a_100011659162_100011219619 [0,1,0,0,0,0|2,0,0]=3 3348 B14R1.19598 Cc1cccc(c1OCC(O)CO)N 34a_100000756359_100011219619 [0,1,0,0,0,0|2,0,0]=3 3349 B14R1.19598 Cc1cccc(c1OCC(O)CO)N 7a_100000756359_100011219619 [0,1,0,0,0,0|2,0,0]=3 3350 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)Br 34a_100009817157_100000059175 [0,1,0,0,0,0|2,0,0]=3 3351 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)Br 7a_100009817157_100000059175 [0,1,0,0,0,0|2,0,0]=3 3352 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)C 34a_100000210341_100000059175 [0,1,0,0,0,0|1,0,0]=2 3353 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)C 7a_100000210341_100000059175 [0,1,0,0,0,0|1,0,0]=2 3354 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)Cl 34a_100000033731_100000059175 [0,1,0,0,0,0|2,0,0]=3 3355 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)Cl 7a_100000033731_100000059175 [0,1,0,0,0,0|2,0,0]=3 3356 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)F 34a_100011659162_100000059175 [0,1,0,0,0,0|2,0,0]=3 3357 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)F 7a_100011659162_100000059175 [0,1,0,0,0,0|2,0,0]=3 3358 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)N 34a_100000756359_100000059175 [0,1,0,0,0,0|2,0,0]=3 3359 B14R1.19598 Cc1cccc(c1OC[C@@H](C)CO)N 7a_100000756359_100000059175 [0,1,0,0,0,0|2,0,0]=3 3360 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)Br 34a_100009817157_100015614560 [0,1,0,0,0,0|2,0,0]=3 3361 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)Br 7a_100009817157_100015614560 [0,1,0,0,0,0|2,0,0]=3 3362 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)C 34a_100000210341_100015614560 [0,1,0,0,0,0|1,0,0]=2 3363 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)C 7a_100000210341_100015614560 [0,1,0,0,0,0|1,0,0]=2 3364 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)Cl 34a_100000033731_100015614560 [0,1,0,0,0,0|2,0,0]=3 3365 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)Cl 7a_100000033731_100015614560 [0,1,0,0,0,0|2,0,0]=3 3366 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)F 34a_100011659162_100015614560 [0,1,0,0,0,0|2,0,0]=3 3367 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)F 7a_100011659162_100015614560 [0,1,0,0,0,0|2,0,0]=3 3368 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)N 34a_100000756359_100015614560 [0,1,0,0,0,0|2,0,0]=3 3369 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CF)N 7a_100000756359_100015614560 [0,1,0,0,0,0|2,0,0]=3 3370 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)Br 34a_100009817157_100009815848 [0,1,0,0,0,0|2,0,0]=3 3371 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)Br 7a_100009817157_100009815848 [0,1,0,0,0,0|2,0,0]=3 3372 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)C 34a_100000210341_100009815848 [0,1,0,0,0,0|1,0,0]=2 3373 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)C 7a_100000210341_100009815848 [0,1,0,0,0,0|1,0,0]=2 3374 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)Cl 34a_100000033731_100009815848 [0,1,0,0,0,0|2,0,0]=3 3375 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)Cl 7a_100000033731_100009815848 [0,1,0,0,0,0|2,0,0]=3 3376 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)F 34a_100011659162_100009815848 [0,1,0,0,0,0|2,0,0]=3 3377 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)F 7a_100011659162_100009815848 [0,1,0,0,0,0|2,0,0]=3 3378 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)N 34a_100000756359_100009815848 [0,1,0,0,0,0|2,0,0]=3 3379 B14R1.19598 Cc1cccc(c1OC[C@@H](O)CO)N 7a_100000756359_100009815848 [0,1,0,0,0,0|2,0,0]=3 3380 B14R1.19598 Cc1cccc(c1SCC(O)CO)Br 62a_100010141302_100011219619 [0,1,0,0,0,0|2,1,0]=4 3381 B14R1.19598 Cc1cccc(c1SCC(O)CO)Br 62a_100011219619_100010141302 [0,1,0,0,0,0|2,1,0]=4 3382 B14R1.19598 Cc1cccc(c1SCC(O)CO)C 62a_100000033847_100011219619 [0,1,0,0,0,0|1,1,0]=3 3383 B14R1.19598 Cc1cccc(c1SCC(O)CO)C 62a_100011219619_100000033847 [0,1,0,0,0,0|1,1,0]=3 3384 B14R1.19598 Cc1cccc(c1SCC(O)CO)Cl 62a_100000043165_100011219619 [0,1,0,0,0,0|2,1,0]=4 3385 B14R1.19598 Cc1cccc(c1SCC(O)CO)Cl 62a_100011219619_100000043165 [0,1,0,0,0,0|2,1,0]=4 3386 B14R1.19598 Cc1cccc(c1SCC(O)CO)F 62a_100011218421_100011219619 [0,1,0,0,0,0|2,1,0]=4 3387 B14R1.19598 Cc1cccc(c1SCC(O)CO)F 62a_100011219619_100011218421 [0,1,0,0,0,0|2,1,0]=4 3388 B14R1.19598 Cc1cccc(c1SCC(O)CO)N 62a_100000684715_100011219619 [0,1,0,0,0,0|2,1,0]=4 3389 B14R1.19598 Cc1cccc(c1SCC(O)CO)N 62a_100011219619_100000684715 [0,1,0,0,0,0|2,1,0]=4 3390 B14R1.19598 Cc1cccc(c1SCC(O)CO)O 62a_100000686692_100011219619 [0,1,0,0,0,0|2,1,0]=4 3391 B14R1.19598 Cc1cccc(c1SCC(O)CO)O 62a_100011219619_100000686692 [0,1,0,0,0,0|2,1,0]=4 3392 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)Br 62a_100000059175_100010141302 [0,1,0,0,0,0|2,1,0]=4 3393 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)Br 62a_100010141302_100000059175 [0,1,0,0,0,0|2,1,0]=4 3394 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)C 62a_100000033847_100000059175 [0,1,0,0,0,0|1,1,0]=3 3395 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)C 62a_100000059175_100000033847 [0,1,0,0,0,0|1,1,0]=3 3396 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)Cl 62a_100000043165_100000059175 [0,1,0,0,0,0|2,1,0]=4 3397 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)Cl 62a_100000059175_100000043165 [0,1,0,0,0,0|2,1,0]=4 3398 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)F 62a_100000059175_100011218421 [0,1,0,0,0,0|2,1,0]=4 3399 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)F 62a_100011218421_100000059175 [0,1,0,0,0,0|2,1,0]=4 3400 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)N 62a_100000059175_100000684715 [0,1,0,0,0,0|2,1,0]=4 3401 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)N 62a_100000684715_100000059175 [0,1,0,0,0,0|2,1,0]=4 3402 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)O 62a_100000059175_100000686692 [0,1,0,0,0,0|2,1,0]=4 3403 B14R1.19598 Cc1cccc(c1SC[C@@H](C)CO)O 62a_100000686692_100000059175 [0,1,0,0,0,0|2,1,0]=4 3404 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)Br 62a_100010141302_100015614560 [0,1,0,0,0,0|2,1,0]=4 3405 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)Br 62a_100015614560_100010141302 [0,1,0,0,0,0|2,1,0]=4 3406 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)C 62a_100000033847_100015614560 [0,1,0,0,0,0|1,1,0]=3 3407 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)C 62a_100015614560_100000033847 [0,1,0,0,0,0|1,1,0]=3 3408 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)Cl 62a_100000043165_100015614560 [0,1,0,0,0,0|2,1,0]=4 3409 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)Cl 62a_100015614560_100000043165 [0,1,0,0,0,0|2,1,0]=4 3410 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)F 62a_100011218421_100015614560 [0,1,0,0,0,0|2,1,0]=4 3411 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)F 62a_100015614560_100011218421 [0,1,0,0,0,0|2,1,0]=4 3412 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)N 62a_100000684715_100015614560 [0,1,0,0,0,0|2,1,0]=4 3413 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)N 62a_100015614560_100000684715 [0,1,0,0,0,0|2,1,0]=4 3414 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)O 62a_100000686692_100015614560 [0,1,0,0,0,0|2,1,0]=4 3415 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CF)O 62a_100015614560_100000686692 [0,1,0,0,0,0|2,1,0]=4 3416 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)Br 62a_100009815848_100010141302 [0,1,0,0,0,0|2,1,0]=4 3417 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)Br 62a_100010141302_100009815848 [0,1,0,0,0,0|2,1,0]=4 3418 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)C 62a_100000033847_100009815848 [0,1,0,0,0,0|1,1,0]=3 3419 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)C 62a_100009815848_100000033847 [0,1,0,0,0,0|1,1,0]=3 3420 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)Cl 62a_100000043165_100009815848 [0,1,0,0,0,0|2,1,0]=4 3421 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)Cl 62a_100009815848_100000043165 [0,1,0,0,0,0|2,1,0]=4 3422 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)F 62a_100009815848_100011218421 [0,1,0,0,0,0|2,1,0]=4 3423 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)F 62a_100011218421_100009815848 [0,1,0,0,0,0|2,1,0]=4 3424 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)N 62a_100000684715_100009815848 [0,1,0,0,0,0|2,1,0]=4 3425 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)N 62a_100009815848_100000684715 [0,1,0,0,0,0|2,1,0]=4 3426 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)O 62a_100000686692_100009815848 [0,1,0,0,0,0|2,1,0]=4 3427 B14R1.19598 Cc1cccc(c1SC[C@@H](O)CO)O 62a_100009815848_100000686692 [0,1,0,0,0,0|2,1,0]=4 3428 B14R1.19598 Cc1ccnc(c1OCC(O)CO)C 34a_100011934651_100011219619 [0,1,0,0,0,0|2,0,0]=3 3429 B14R1.19598 Cc1ccnc(c1OCC(O)CO)C 7a_100011934651_100011219619 [0,1,0,0,0,0|2,0,0]=3 3430 B14R1.19598 Cc1ccnc(c1OCC(O)CO)Cl 34a_100000696282_100011219619 [0,1,0,0,0,0|3,0,0]=4 3431 B14R1.19598 Cc1ccnc(c1OCC(O)CO)Cl 7a_100000696282_100011219619 [0,1,0,0,0,0|3,0,0]=4 3432 B14R1.19598 Cc1ccnc(c1OC[C@@H](C)CO)C 34a_100011934651_100000059175 [0,1,0,0,0,0|2,0,0]=3 3433 B14R1.19598 Cc1ccnc(c1OC[C@@H](C)CO)C 7a_100011934651_100000059175 [0,1,0,0,0,0|2,0,0]=3 3434 B14R1.19598 Cc1ccnc(c1OC[C@@H](C)CO)Cl 34a_100000696282_100000059175 [0,1,0,0,0,0|3,0,0]=4 3435 B14R1.19598 Cc1ccnc(c1OC[C@@H](C)CO)Cl 7a_100000696282_100000059175 [0,1,0,0,0,0|3,0,0]=4 3436 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CF)C 34a_100011934651_100015614560 [0,1,0,0,0,0|2,0,0]=3 3437 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CF)C 7a_100011934651_100015614560 [0,1,0,0,0,0|2,0,0]=3 3438 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CF)Cl 34a_100000696282_100015614560 [0,1,0,0,0,0|3,0,0]=4 3439 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CF)Cl 7a_100000696282_100015614560 [0,1,0,0,0,0|3,0,0]=4 3440 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CO)C 34a_100011934651_100009815848 [0,1,0,0,0,0|2,0,0]=3 3441 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CO)C 7a_100011934651_100009815848 [0,1,0,0,0,0|2,0,0]=3 3442 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CO)Cl 34a_100000696282_100009815848 [0,1,0,0,0,0|3,0,0]=4 3443 B14R1.19598 Cc1ccnc(c1OC[C@@H](O)CO)Cl 7a_100000696282_100009815848 [0,1,0,0,0,0|3,0,0]=4 3444 B14R1.19598 Cc1ccnc(c1SCC(O)CO)C 62a_100011219619_100012000501 [0,1,0,0,0,0|2,1,0]=4 3445 B14R1.19598 Cc1ccnc(c1SCC(O)CO)C 62a_100012000501_100011219619 [0,1,0,0,0,0|2,1,0]=4 3446 B14R1.19598 Cc1ccnc(c1SC[C@@H](C)CO)C 62a_100000059175_100012000501 [0,1,0,0,0,0|2,1,0]=4 3447 B14R1.19598 Cc1ccnc(c1SC[C@@H](C)CO)C 62a_100012000501_100000059175 [0,1,0,0,0,0|2,1,0]=4 3448 B14R1.19598 Cc1ccnc(c1SC[C@@H](O)CF)C 62a_100012000501_100015614560 [0,1,0,0,0,0|2,1,0]=4 3449 B14R1.19598 Cc1ccnc(c1SC[C@@H](O)CF)C 62a_100015614560_100012000501 [0,1,0,0,0,0|2,1,0]=4 3450 B14R1.19598 Cc1ccnc(c1SC[C@@H](O)CO)C 62a_100009815848_100012000501 [0,1,0,0,0,0|2,1,0]=4 3451 B14R1.19598 Cc1ccnc(c1SC[C@@H](O)CO)C 62a_100012000501_100009815848 [0,1,0,0,0,0|2,1,0]=4 3452 B14R1.19598 Cc1cncc(c1SCC(O)CO)C 62a_100009817138_100011219619 [0,1,0,0,0,0|2,1,0]=4 3453 B14R1.19598 Cc1cncc(c1SCC(O)CO)C 62a_100011219619_100009817138 [0,1,0,0,0,0|2,1,0]=4 3454 B14R1.19598 Cc1cncc(c1SC[C@@H](C)CO)C 62a_100000059175_100009817138 [0,1,0,0,0,0|2,1,0]=4 3455 B14R1.19598 Cc1cncc(c1SC[C@@H](C)CO)C 62a_100009817138_100000059175 [0,1,0,0,0,0|2,1,0]=4 3456 B14R1.19598 Cc1cncc(c1SC[C@@H](O)CF)C 62a_100009817138_100015614560 [0,1,0,0,0,0|2,1,0]=4 3457 B14R1.19598 Cc1cncc(c1SC[C@@H](O)CF)C 62a_100015614560_100009817138 [0,1,0,0,0,0|2,1,0]=4 3458 B14R1.19598 Cc1cncc(c1SC[C@@H](O)CO)C 62a_100009815848_100009817138 [0,1,0,0,0,0|2,1,0]=4 3459 B14R1.19598 Cc1cncc(c1SC[C@@H](O)CO)C 62a_100009817138_100009815848 [0,1,0,0,0,0|2,1,0]=4 3460 B14R1.19598 Cc1ncnc(c1OCC(O)CO)C 34a_100009878406_100011219619 [0,1,0,0,0,0|3,0,0]=4 3461 B14R1.19598 Cc1ncnc(c1OCC(O)CO)C 7a_100009878406_100011219619 [0,1,0,0,0,0|3,0,0]=4 3462 B14R1.19598 Cc1ncnc(c1OC[C@@H](C)CO)C 34a_100009878406_100000059175 [0,1,0,0,0,0|3,0,0]=4 3463 B14R1.19598 Cc1ncnc(c1OC[C@@H](C)CO)C 7a_100009878406_100000059175 [0,1,0,0,0,0|3,0,0]=4 3464 B14R1.19598 Cc1ncnc(c1OC[C@@H](O)CF)C 34a_100009878406_100015614560 [0,1,0,0,0,0|3,0,0]=4 3465 B14R1.19598 Cc1ncnc(c1OC[C@@H](O)CF)C 7a_100009878406_100015614560 [0,1,0,0,0,0|3,0,0]=4 3466 B14R1.19598 Cc1ncnc(c1OC[C@@H](O)CO)C 34a_100009878406_100009815848 [0,1,0,0,0,0|3,0,0]=4 3467 B14R1.19598 Cc1ncnc(c1OC[C@@H](O)CO)C 7a_100009878406_100009815848 [0,1,0,0,0,0|3,0,0]=4 3468 B14R1.19598 Cc1occc(=O)c1OCC(O)CO 34a_100000031901_100011219619 [0,1,0,0,0,0|3,0,0]=4 3469 B14R1.19598 Cc1occc(=O)c1OC[C@@H](C)CO 34a_100000031901_100000059175 [0,1,0,0,0,0|3,0,0]=4 3470 B14R1.19598 Cc1occc(=O)c1OC[C@@H](O)CF 34a_100000031901_100015614560 [0,1,0,0,0,0|3,0,0]=4 3471 B14R1.19598 Cc1occc(=O)c1OC[C@@H](O)CO 34a_100000031901_100009815848 [0,1,0,0,0,0|3,0,0]=4 3472 B14R1.19598 Nc1cccc(c1OCC(O)CO)Br 34a_100011934915_100011219619 [0,1,0,0,0,0|3,0,0]=4 3473 B14R1.19598 Nc1cccc(c1OCC(O)CO)Cl 34a_100000754742_100011219619 [0,1,0,0,0,0|3,0,0]=4 3474 B14R1.19598 Nc1cccc(c1OCC(O)CO)F 34a_100011934987_100011219619 [0,1,0,0,0,0|3,0,0]=4 3475 B14R1.19598 Nc1cccc(c1OCC(O)CO)I 34a_100010084371_100011219619 [0,1,0,0,0,0|3,0,0]=4 3476 B14R1.19598 Nc1cccc(c1OCC(O)CO)N 34a_200016994477_100011219619 [0,1,0,0,0,0|3,0,0]=4 3477 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CF)Br 34a_100011934915_100015614560 [0,1,0,0,0,0|3,0,0]=4 3478 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CF)Cl 34a_100000754742_100015614560 [0,1,0,0,0,0|3,0,0]=4 3479 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CF)F 34a_100011934987_100015614560 [0,1,0,0,0,0|3,0,0]=4 3480 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CF)I 34a_100010084371_100015614560 [0,1,0,0,0,0|3,0,0]=4 3481 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CF)N 34a_200016994477_100015614560 [0,1,0,0,0,0|3,0,0]=4 3482 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CO)Br 34a_100011934915_100009815848 [0,1,0,0,0,0|3,0,0]=4 3483 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CO)Cl 34a_100000754742_100009815848 [0,1,0,0,0,0|3,0,0]=4 3484 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CO)F 34a_100011934987_100009815848 [0,1,0,0,0,0|3,0,0]=4 3485 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CO)I 34a_100010084371_100009815848 [0,1,0,0,0,0|3,0,0]=4 3486 B14R1.19598 Nc1cccc(c1OC[C@@H](O)CO)N 34a_200016994477_100009815848 [0,1,0,0,0,0|3,0,0]=4 3487 B14R1.19598 OCC(O)COc1c(cccc1Br)Br 34a_100000736428_100011219619 [0,1,0,0,0,0|3,0,0]=4 3488 B14R1.19598 OCC(O)COc1c(cccc1Br)Br 7a_100000736428_100011219619 [0,1,0,0,0,0|3,0,0]=4 3489 B14R1.19598 OCC(O)COc1c(cccc1Br)Cl 34a_100010214474_100011219619 [0,1,0,0,0,0|3,0,0]=4 3490 B14R1.19598 OCC(O)COc1c(cccc1Br)Cl 7a_100010214474_100011219619 [0,1,0,0,0,0|3,0,0]=4 3491 B14R1.19598 OCC(O)COc1c(cccc1Br)F 34a_100009813666_100011219619 [0,1,0,0,0,0|3,0,0]=4 3492 B14R1.19598 OCC(O)COc1c(cccc1Br)F 7a_100009813666_100011219619 [0,1,0,0,0,0|3,0,0]=4 3493 B14R1.19598 OCC(O)COc1c(cccc1Cl)Cl 34a_100000211709_100011219619 [0,1,0,0,0,0|3,0,0]=4 3494 B14R1.19598 OCC(O)COc1c(cccc1Cl)Cl 7a_100000211709_100011219619 [0,1,0,0,0,0|3,0,0]=4 3495 B14R1.19598 OCC(O)COc1c(cccc1Cl)F 34a_100000694953_100011219619 [0,1,0,0,0,0|3,0,0]=4 3496 B14R1.19598 OCC(O)COc1c(cccc1Cl)F 7a_100000694953_100011219619 [0,1,0,0,0,0|3,0,0]=4 3497 B14R1.19598 OCC(O)COc1c(cccc1F)F 34a_100000230165_100011219619 [0,1,0,0,0,0|3,0,0]=4 3498 B14R1.19598 OCC(O)COc1c(cccc1F)F 7a_100000230165_100011219619 [0,1,0,0,0,0|3,0,0]=4 3499 B14R1.19598 OCC(O)COc1c(cccc1I)Br 34a_100010084509_100011219619 [0,1,0,0,0,0|3,0,0]=4 3500 B14R1.19598 OCC(O)COc1c(cccc1I)Br 7a_100010084509_100011219619 [0,1,0,0,0,0|3,0,0]=4 3501 B14R1.19598 OCC(O)COc1c(cccc1I)Cl 34a_100010202889_100011219619 [0,1,0,0,0,0|3,0,0]=4 3502 B14R1.19598 OCC(O)COc1c(cccc1I)Cl 7a_100010202889_100011219619 [0,1,0,0,0,0|3,0,0]=4 3503 B14R1.19598 OCC(O)COc1c(cccc1I)F 34a_100010186298_100011219619 [0,1,0,0,0,0|3,0,0]=4 3504 B14R1.19598 OCC(O)COc1c(cccc1I)F 7a_100010186298_100011219619 [0,1,0,0,0,0|3,0,0]=4 3505 B14R1.19598 OC[C@H](O)COc1c(cccc1Br)Br 34a_100000736428_100009815848 [0,1,0,0,0,0|3,0,0]=4 3506 B14R1.19598 OC[C@H](O)COc1c(cccc1Br)Br 7a_100000736428_100009815848 [0,1,0,0,0,0|3,0,0]=4 3507 B14R1.19598 OC[C@H](O)COc1c(cccc1Br)Cl 34a_100010214474_100009815848 [0,1,0,0,0,0|3,0,0]=4 3508 B14R1.19598 OC[C@H](O)COc1c(cccc1Br)Cl 7a_100010214474_100009815848 [0,1,0,0,0,0|3,0,0]=4 3509 B14R1.19598 OC[C@H](O)COc1c(cccc1Br)F 34a_100009813666_100009815848 [0,1,0,0,0,0|3,0,0]=4 3510 B14R1.19598 OC[C@H](O)COc1c(cccc1Br)F 7a_100009813666_100009815848 [0,1,0,0,0,0|3,0,0]=4 3511 B14R1.19598 OC[C@H](O)COc1c(cccc1Cl)Cl 34a_100000211709_100009815848 [0,1,0,0,0,0|3,0,0]=4 3512 B14R1.19598 OC[C@H](O)COc1c(cccc1Cl)Cl 7a_100000211709_100009815848 [0,1,0,0,0,0|3,0,0]=4 3513 B14R1.19598 OC[C@H](O)COc1c(cccc1Cl)F 34a_100000694953_100009815848 [0,1,0,0,0,0|3,0,0]=4 3514 B14R1.19598 OC[C@H](O)COc1c(cccc1Cl)F 7a_100000694953_100009815848 [0,1,0,0,0,0|3,0,0]=4 3515 B14R1.19598 OC[C@H](O)COc1c(cccc1F)F 34a_100000230165_100009815848 [0,1,0,0,0,0|3,0,0]=4 3516 B14R1.19598 OC[C@H](O)COc1c(cccc1F)F 7a_100000230165_100009815848 [0,1,0,0,0,0|3,0,0]=4 3517 B14R1.19598 OC[C@H](O)COc1c(cccc1I)Br 34a_100010084509_100009815848 [0,1,0,0,0,0|3,0,0]=4 3518 B14R1.19598 OC[C@H](O)COc1c(cccc1I)Br 7a_100010084509_100009815848 [0,1,0,0,0,0|3,0,0]=4 3519 B14R1.19598 OC[C@H](O)COc1c(cccc1I)Cl 34a_100010202889_100009815848 [0,1,0,0,0,0|3,0,0]=4 3520 B14R1.19598 OC[C@H](O)COc1c(cccc1I)Cl 7a_100010202889_100009815848 [0,1,0,0,0,0|3,0,0]=4 3521 B14R1.19598 OC[C@H](O)COc1c(cccc1I)F 34a_100010186298_100009815848 [0,1,0,0,0,0|3,0,0]=4 3522 B14R1.19598 OC[C@H](O)COc1c(cccc1I)F 7a_100010186298_100009815848 [0,1,0,0,0,0|3,0,0]=4 3523 B14R1.19598 O[C@@H](CF)COc1c(cccc1Br)Br 34a_100000736428_100015614560 [0,1,0,0,0,0|3,0,0]=4 3524 B14R1.19598 O[C@@H](CF)COc1c(cccc1Br)Br 7a_100000736428_100015614560 [0,1,0,0,0,0|3,0,0]=4 3525 B14R1.19598 O[C@@H](CF)COc1c(cccc1Br)Cl 34a_100010214474_100015614560 [0,1,0,0,0,0|3,0,0]=4 3526 B14R1.19598 O[C@@H](CF)COc1c(cccc1Br)Cl 7a_100010214474_100015614560 [0,1,0,0,0,0|3,0,0]=4 3527 B14R1.19598 O[C@@H](CF)COc1c(cccc1Br)F 34a_100009813666_100015614560 [0,1,0,0,0,0|3,0,0]=4 3528 B14R1.19598 O[C@@H](CF)COc1c(cccc1Br)F 7a_100009813666_100015614560 [0,1,0,0,0,0|3,0,0]=4 3529 B14R1.19598 O[C@@H](CF)COc1c(cccc1Cl)Cl 34a_100000211709_100015614560 [0,1,0,0,0,0|3,0,0]=4 3530 B14R1.19598 O[C@@H](CF)COc1c(cccc1Cl)Cl 7a_100000211709_100015614560 [0,1,0,0,0,0|3,0,0]=4 3531 B14R1.19598 O[C@@H](CF)COc1c(cccc1Cl)F 34a_100000694953_100015614560 [0,1,0,0,0,0|3,0,0]=4 3532 B14R1.19598 O[C@@H](CF)COc1c(cccc1Cl)F 7a_100000694953_100015614560 [0,1,0,0,0,0|3,0,0]=4 3533 B14R1.19598 O[C@@H](CF)COc1c(cccc1F)F 34a_100000230165_100015614560 [0,1,0,0,0,0|3,0,0]=4 3534 B14R1.19598 O[C@@H](CF)COc1c(cccc1F)F 7a_100000230165_100015614560 [0,1,0,0,0,0|3,0,0]=4 3535 B14R1.19598 O[C@@H](CF)COc1c(cccc1I)Br 34a_100010084509_100015614560 [0,1,0,0,0,0|3,0,0]=4 3536 B14R1.19598 O[C@@H](CF)COc1c(cccc1I)Br 7a_100010084509_100015614560 [0,1,0,0,0,0|3,0,0]=4 3537 B14R1.19598 O[C@@H](CF)COc1c(cccc1I)Cl 34a_100010202889_100015614560 [0,1,0,0,0,0|3,0,0]=4 3538 B14R1.19598 O[C@@H](CF)COc1c(cccc1I)Cl 7a_100010202889_100015614560 [0,1,0,0,0,0|3,0,0]=4 3539 B14R1.19598 O[C@@H](CF)COc1c(cccc1I)F 34a_100010186298_100015614560 [0,1,0,0,0,0|3,0,0]=4 3540 B14R1.19598 O[C@@H](CF)COc1c(cccc1I)F 7a_100010186298_100015614560 [0,1,0,0,0,0|3,0,0]=4 3541 B12R0.233 C/C=C/C=CC(=NNCC(C)O)C 4a_200000730056_100016268696 [0,0,1,0,0,0|3,0,0]=4 3542 B14R2.717 Brc1cccc(c1OCC2CC2)Br 34a_100000736428_100000742324 [0,0,0,1,0,0|3,0,0]=4 3543 B14R2.717 Brc1cccc(c1OCC2CC2)Br 7a_100000736428_100000742324 [0,0,0,1,0,0|3,0,0]=4 3544 B14R2.717 Brc1cccc(c1OCC2CC2)I 34a_100010084509_100000742324 [0,0,0,1,0,0|3,0,0]=4 3545 B14R2.717 Brc1cccc(c1OCC2CC2)I 7a_100010084509_100000742324 [0,0,0,1,0,0|3,0,0]=4 3546 B14R2.717 Brc1cccc(c1OCC2CO2)Br 34a_100000736428_102125554688 [0,0,0,1,0,0|3,0,0]=4 3547 B14R2.717 Brc1cccc(c1OCC2CO2)Br 7a_100000736428_102125554688 [0,0,0,1,0,0|3,0,0]=4 3548 B14R2.717 Brc1cccc(c1OCC2CO2)I 34a_100010084509_102125554688 [0,0,0,1,0,0|3,0,0]=4 3549 B14R2.717 Brc1cccc(c1OCC2CO2)I 7a_100010084509_102125554688 [0,0,0,1,0,0|3,0,0]=4 3550 B14R2.717 Brc1cccc(c1OCC2CS2)Br 7a_100000736428_100000031435 [0,0,0,1,0,0|3,0,0]=4 3551 B14R2.717 Brc1cccc(c1OCC2CS2)I 7a_100010084509_100000031435 [0,0,0,1,0,0|3,0,0]=4 3552 B14R2.717 Brc1cccc(c1OC[C@@H]2CO2)Br 7a_100000736428_100000745022 [0,0,0,1,0,0|3,0,0]=4 3553 B14R2.717 Brc1cccc(c1OC[C@@H]2CO2)I 7a_100010084509_100000745022 [0,0,0,1,0,0|3,0,0]=4 3554 B14R2.717 Cc1cccc(c1C#CC2CC2)C 271570a_200009880635_100000033847 [0,0,0,1,0,0|2,0,1]=4 3555 B14R2.717 Cc1cccc(c1C=CC2CC2)C 271570a_100102526188_100000033847 [0,0,0,1,0,0|2,0,1]=4 3556 B14R2.717 Cc1cccc(c1CNC2CC2)C 34a_100000212008_100000758300 [0,0,0,1,0,0|3,0,0]=4 3557 B14R2.717 Cc1cccc(c1CNC2CC2)C 34a_100000689800_100000211595 [0,0,0,1,0,0|3,0,0]=4 3558 B14R2.717 Cc1cccc(c1COC2CC2)C 34a_100011933981_100000211595 [0,0,0,1,0,0|3,0,0]=4 3559 B14R2.717 Cc1cccc(c1CSC2CC2)C 62a_100000758300_100000211595 [0,0,0,1,0,0|3,0,0]=4 3560 B14R2.717 Cc1cccc(c1NCC2CC2)Br 34a_100011834072_100000742324 [0,0,0,1,0,0|3,0,0]=4 3561 B14R2.717 Cc1cccc(c1NCC2CC2)C 34a_100000185769_100000742324 [0,0,0,1,0,0|2,0,0]=3 3562 B14R2.717 Cc1cccc(c1NCC2CC2)Cl 34a_100000756524_100000742324 [0,0,0,1,0,0|3,0,0]=4 3563 B14R2.717 Cc1cccc(c1NCC2CC2)F 34a_100000766463_100000742324 [0,0,0,1,0,0|3,0,0]=4 3564 B14R2.717 Cc1cccc(c1NCC2CC2)O 34a_100000743429_100000742324 [0,0,0,1,0,0|3,0,0]=4 3565 B14R2.717 Cc1cccc(c1NCC2CO2)Br 34a_100011834072_102125554688 [0,0,0,1,0,0|3,0,0]=4 3566 B14R2.717 Cc1cccc(c1NCC2CO2)C 34a_100000185769_102125554688 [0,0,0,1,0,0|2,0,0]=3 3567 B14R2.717 Cc1cccc(c1NCC2CO2)Cl 34a_100000756524_102125554688 [0,0,0,1,0,0|3,0,0]=4 3568 B14R2.717 Cc1cccc(c1NCC2CO2)F 34a_100000766463_102125554688 [0,0,0,1,0,0|3,0,0]=4 3569 B14R2.717 Cc1cccc(c1NCC2CO2)O 34a_100000743429_102125554688 [0,0,0,1,0,0|3,0,0]=4 3570 B14R2.717 Cc1cccc(c1OCC2CC2)Br 34a_100009817157_100000742324 [0,0,0,1,0,0|2,0,0]=3 3571 B14R2.717 Cc1cccc(c1OCC2CC2)Br 7a_100009817157_100000742324 [0,0,0,1,0,0|2,0,0]=3 3572 B14R2.717 Cc1cccc(c1OCC2CC2)C 34a_100000210341_100000742324 [0,0,0,1,0,0|1,0,0]=2 3573 B14R2.717 Cc1cccc(c1OCC2CC2)C 7a_100000210341_100000742324 [0,0,0,1,0,0|1,0,0]=2 3574 B14R2.717 Cc1cccc(c1OCC2CC2)Cl 34a_100000033731_100000742324 [0,0,0,1,0,0|2,0,0]=3 3575 B14R2.717 Cc1cccc(c1OCC2CC2)Cl 7a_100000033731_100000742324 [0,0,0,1,0,0|2,0,0]=3 3576 B14R2.717 Cc1cccc(c1OCC2CC2)F 34a_100011659162_100000742324 [0,0,0,1,0,0|2,0,0]=3 3577 B14R2.717 Cc1cccc(c1OCC2CC2)F 7a_100011659162_100000742324 [0,0,0,1,0,0|2,0,0]=3 3578 B14R2.717 Cc1cccc(c1OCC2CC2)N 34a_100000756359_100000742324 [0,0,0,1,0,0|2,0,0]=3 3579 B14R2.717 Cc1cccc(c1OCC2CC2)N 7a_100000756359_100000742324 [0,0,0,1,0,0|2,0,0]=3 3580 B14R2.717 Cc1cccc(c1OCC2CO2)Br 34a_100009817157_102125554688 [0,0,0,1,0,0|2,0,0]=3 3581 B14R2.717 Cc1cccc(c1OCC2CO2)Br 7a_100009817157_102125554688 [0,0,0,1,0,0|2,0,0]=3 3582 B14R2.717 Cc1cccc(c1OCC2CO2)C 34a_100000210341_102125554688 [0,0,0,1,0,0|1,0,0]=2 3583 B14R2.717 Cc1cccc(c1OCC2CO2)C 7a_100000210341_102125554688 [0,0,0,1,0,0|1,0,0]=2 3584 B14R2.717 Cc1cccc(c1OCC2CO2)Cl 34a_100000033731_102125554688 [0,0,0,1,0,0|2,0,0]=3 3585 B14R2.717 Cc1cccc(c1OCC2CO2)Cl 7a_100000033731_102125554688 [0,0,0,1,0,0|2,0,0]=3 3586 B14R2.717 Cc1cccc(c1OCC2CO2)F 34a_100011659162_102125554688 [0,0,0,1,0,0|2,0,0]=3 3587 B14R2.717 Cc1cccc(c1OCC2CO2)F 7a_100011659162_102125554688 [0,0,0,1,0,0|2,0,0]=3 3588 B14R2.717 Cc1cccc(c1OCC2CO2)N 34a_100000756359_102125554688 [0,0,0,1,0,0|2,0,0]=3 3589 B14R2.717 Cc1cccc(c1OCC2CO2)N 7a_100000756359_102125554688 [0,0,0,1,0,0|2,0,0]=3 3590 B14R2.717 Cc1cccc(c1OCC2CS2)Br 7a_100009817157_100000031435 [0,0,0,1,0,0|2,0,0]=3 3591 B14R2.717 Cc1cccc(c1OCC2CS2)C 7a_100000210341_100000031435 [0,0,0,1,0,0|1,0,0]=2 3592 B14R2.717 Cc1cccc(c1OCC2CS2)Cl 7a_100000033731_100000031435 [0,0,0,1,0,0|2,0,0]=3 3593 B14R2.717 Cc1cccc(c1OCC2CS2)F 7a_100011659162_100000031435 [0,0,0,1,0,0|2,0,0]=3 3594 B14R2.717 Cc1cccc(c1OCC2CS2)N 7a_100000756359_100000031435 [0,0,0,1,0,0|2,0,0]=3 3595 B14R2.717 Cc1cccc(c1OC[C@@H]2CO2)Br 7a_100009817157_100000745022 [0,0,0,1,0,0|2,0,0]=3 3596 B14R2.717 Cc1cccc(c1OC[C@@H]2CO2)C 7a_100000210341_100000745022 [0,0,0,1,0,0|1,0,0]=2 3597 B14R2.717 Cc1cccc(c1OC[C@@H]2CO2)Cl 7a_100000033731_100000745022 [0,0,0,1,0,0|2,0,0]=3 3598 B14R2.717 Cc1cccc(c1OC[C@@H]2CO2)F 7a_100011659162_100000745022 [0,0,0,1,0,0|2,0,0]=3 3599 B14R2.717 Cc1cccc(c1OC[C@@H]2CO2)N 7a_100000756359_100000745022 [0,0,0,1,0,0|2,0,0]=3 3600 B14R2.717 Cc1cccc(c1SCC2CC2)Br 62a_100000756562_100010141302 [0,0,0,1,0,0|2,1,0]=4 3601 B14R2.717 Cc1cccc(c1SCC2CC2)Br 62a_100010141302_100000742324 [0,0,0,1,0,0|2,1,0]=4 3602 B14R2.717 Cc1cccc(c1SCC2CC2)C 62a_100000033847_100000742324 [0,0,0,1,0,0|1,1,0]=3 3603 B14R2.717 Cc1cccc(c1SCC2CC2)C 62a_100000756562_100000033847 [0,0,0,1,0,0|1,1,0]=3 3604 B14R2.717 Cc1cccc(c1SCC2CC2)Cl 62a_100000043165_100000742324 [0,0,0,1,0,0|2,1,0]=4 3605 B14R2.717 Cc1cccc(c1SCC2CC2)Cl 62a_100000756562_100000043165 [0,0,0,1,0,0|2,1,0]=4 3606 B14R2.717 Cc1cccc(c1SCC2CC2)F 62a_100000756562_100011218421 [0,0,0,1,0,0|2,1,0]=4 3607 B14R2.717 Cc1cccc(c1SCC2CC2)F 62a_100011218421_100000742324 [0,0,0,1,0,0|2,1,0]=4 3608 B14R2.717 Cc1cccc(c1SCC2CC2)N 62a_100000684715_100000742324 [0,0,0,1,0,0|2,1,0]=4 3609 B14R2.717 Cc1cccc(c1SCC2CC2)N 62a_100000756562_100000684715 [0,0,0,1,0,0|2,1,0]=4 3610 B14R2.717 Cc1cccc(c1SCC2CC2)O 62a_100000686692_100000742324 [0,0,0,1,0,0|2,1,0]=4 3611 B14R2.717 Cc1cccc(c1SCC2CC2)O 62a_100000756562_100000686692 [0,0,0,1,0,0|2,1,0]=4 3612 B14R2.717 Cc1cccc(c1SCC2CO2)Br 62a_100010141302_102125554688 [0,0,0,1,0,0|2,1,0]=4 3613 B14R2.717 Cc1cccc(c1SCC2CO2)Br 62a_102125554688_100010141302 [0,0,0,1,0,0|2,1,0]=4 3614 B14R2.717 Cc1cccc(c1SCC2CO2)C 62a_100000033847_102125554688 [0,0,0,1,0,0|1,1,0]=3 3615 B14R2.717 Cc1cccc(c1SCC2CO2)C 62a_102125554688_100000033847 [0,0,0,1,0,0|1,1,0]=3 3616 B14R2.717 Cc1cccc(c1SCC2CO2)Cl 62a_100000043165_102125554688 [0,0,0,1,0,0|2,1,0]=4 3617 B14R2.717 Cc1cccc(c1SCC2CO2)Cl 62a_102125554688_100000043165 [0,0,0,1,0,0|2,1,0]=4 3618 B14R2.717 Cc1cccc(c1SCC2CO2)F 62a_100011218421_102125554688 [0,0,0,1,0,0|2,1,0]=4 3619 B14R2.717 Cc1cccc(c1SCC2CO2)F 62a_102125554688_100011218421 [0,0,0,1,0,0|2,1,0]=4 3620 B14R2.717 Cc1cccc(c1SCC2CO2)N 62a_100000684715_102125554688 [0,0,0,1,0,0|2,1,0]=4 3621 B14R2.717 Cc1cccc(c1SCC2CO2)N 62a_102125554688_100000684715 [0,0,0,1,0,0|2,1,0]=4 3622 B14R2.717 Cc1cccc(c1SCC2CO2)O 62a_100000686692_102125554688 [0,0,0,1,0,0|2,1,0]=4 3623 B14R2.717 Cc1cccc(c1SCC2CO2)O 62a_102125554688_100000686692 [0,0,0,1,0,0|2,1,0]=4 3624 B14R2.717 Cc1cccc(c1SCC2CS2)Br 62a_100000031435_100010141302 [0,0,0,1,0,0|2,1,0]=4 3625 B14R2.717 Cc1cccc(c1SCC2CS2)Br 62a_100010141302_100000031435 [0,0,0,1,0,0|2,1,0]=4 3626 B14R2.717 Cc1cccc(c1SCC2CS2)C 62a_100000031435_100000033847 [0,0,0,1,0,0|1,1,0]=3 3627 B14R2.717 Cc1cccc(c1SCC2CS2)C 62a_100000033847_100000031435 [0,0,0,1,0,0|1,1,0]=3 3628 B14R2.717 Cc1cccc(c1SCC2CS2)Cl 62a_100000031435_100000043165 [0,0,0,1,0,0|2,1,0]=4 3629 B14R2.717 Cc1cccc(c1SCC2CS2)Cl 62a_100000043165_100000031435 [0,0,0,1,0,0|2,1,0]=4 3630 B14R2.717 Cc1cccc(c1SCC2CS2)F 62a_100000031435_100011218421 [0,0,0,1,0,0|2,1,0]=4 3631 B14R2.717 Cc1cccc(c1SCC2CS2)F 62a_100011218421_100000031435 [0,0,0,1,0,0|2,1,0]=4 3632 B14R2.717 Cc1cccc(c1SCC2CS2)N 62a_100000031435_100000684715 [0,0,0,1,0,0|2,1,0]=4 3633 B14R2.717 Cc1cccc(c1SCC2CS2)N 62a_100000684715_100000031435 [0,0,0,1,0,0|2,1,0]=4 3634 B14R2.717 Cc1cccc(c1SCC2CS2)O 62a_100000031435_100000686692 [0,0,0,1,0,0|2,1,0]=4 3635 B14R2.717 Cc1cccc(c1SCC2CS2)O 62a_100000686692_100000031435 [0,0,0,1,0,0|2,1,0]=4 3636 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)Br 62a_100000745022_100010141302 [0,0,0,1,0,0|2,1,0]=4 3637 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)Br 62a_100010141302_100000745022 [0,0,0,1,0,0|2,1,0]=4 3638 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)C 62a_100000033847_100000745022 [0,0,0,1,0,0|1,1,0]=3 3639 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)C 62a_100000745022_100000033847 [0,0,0,1,0,0|1,1,0]=3 3640 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)Cl 62a_100000043165_100000745022 [0,0,0,1,0,0|2,1,0]=4 3641 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)Cl 62a_100000745022_100000043165 [0,0,0,1,0,0|2,1,0]=4 3642 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)F 62a_100000745022_100011218421 [0,0,0,1,0,0|2,1,0]=4 3643 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)F 62a_100011218421_100000745022 [0,0,0,1,0,0|2,1,0]=4 3644 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)N 62a_100000684715_100000745022 [0,0,0,1,0,0|2,1,0]=4 3645 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)N 62a_100000745022_100000684715 [0,0,0,1,0,0|2,1,0]=4 3646 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)O 62a_100000686692_100000745022 [0,0,0,1,0,0|2,1,0]=4 3647 B14R2.717 Cc1cccc(c1SC[C@@H]2CO2)O 62a_100000745022_100000686692 [0,0,0,1,0,0|2,1,0]=4 3648 B14R2.717 Cc1ccnc(c1OCC2CC2)C 34a_100011934651_100000742324 [0,0,0,1,0,0|2,0,0]=3 3649 B14R2.717 Cc1ccnc(c1OCC2CC2)C 7a_100011934651_100000742324 [0,0,0,1,0,0|2,0,0]=3 3650 B14R2.717 Cc1ccnc(c1OCC2CC2)Cl 34a_100000696282_100000742324 [0,0,0,1,0,0|3,0,0]=4 3651 B14R2.717 Cc1ccnc(c1OCC2CC2)Cl 7a_100000696282_100000742324 [0,0,0,1,0,0|3,0,0]=4 3652 B14R2.717 Cc1ccnc(c1OCC2CO2)C 34a_100011934651_102125554688 [0,0,0,1,0,0|2,0,0]=3 3653 B14R2.717 Cc1ccnc(c1OCC2CO2)C 7a_100011934651_102125554688 [0,0,0,1,0,0|2,0,0]=3 3654 B14R2.717 Cc1ccnc(c1OCC2CO2)Cl 34a_100000696282_102125554688 [0,0,0,1,0,0|3,0,0]=4 3655 B14R2.717 Cc1ccnc(c1OCC2CO2)Cl 7a_100000696282_102125554688 [0,0,0,1,0,0|3,0,0]=4 3656 B14R2.717 Cc1ccnc(c1OCC2CS2)C 7a_100011934651_100000031435 [0,0,0,1,0,0|2,0,0]=3 3657 B14R2.717 Cc1ccnc(c1OCC2CS2)Cl 7a_100000696282_100000031435 [0,0,0,1,0,0|3,0,0]=4 3658 B14R2.717 Cc1ccnc(c1OC[C@@H]2CO2)C 7a_100011934651_100000745022 [0,0,0,1,0,0|2,0,0]=3 3659 B14R2.717 Cc1ccnc(c1OC[C@@H]2CO2)Cl 7a_100000696282_100000745022 [0,0,0,1,0,0|3,0,0]=4 3660 B14R2.717 Cc1ccnc(c1SCC2CC2)C 62a_100000756562_100012000501 [0,0,0,1,0,0|2,1,0]=4 3661 B14R2.717 Cc1ccnc(c1SCC2CC2)C 62a_100012000501_100000742324 [0,0,0,1,0,0|2,1,0]=4 3662 B14R2.717 Cc1ccnc(c1SCC2CO2)C 62a_100012000501_102125554688 [0,0,0,1,0,0|2,1,0]=4 3663 B14R2.717 Cc1ccnc(c1SCC2CO2)C 62a_102125554688_100012000501 [0,0,0,1,0,0|2,1,0]=4 3664 B14R2.717 Cc1ccnc(c1SCC2CS2)C 62a_100000031435_100012000501 [0,0,0,1,0,0|2,1,0]=4 3665 B14R2.717 Cc1ccnc(c1SCC2CS2)C 62a_100012000501_100000031435 [0,0,0,1,0,0|2,1,0]=4 3666 B14R2.717 Cc1ccnc(c1SC[C@@H]2CO2)C 62a_100000745022_100012000501 [0,0,0,1,0,0|2,1,0]=4 3667 B14R2.717 Cc1ccnc(c1SC[C@@H]2CO2)C 62a_100012000501_100000745022 [0,0,0,1,0,0|2,1,0]=4 3668 B14R2.717 Cc1cncc(c1SCC2CC2)C 62a_100000756562_100009817138 [0,0,0,1,0,0|2,1,0]=4 3669 B14R2.717 Cc1cncc(c1SCC2CC2)C 62a_100009817138_100000742324 [0,0,0,1,0,0|2,1,0]=4 3670 B14R2.717 Cc1cncc(c1SCC2CO2)C 62a_100009817138_102125554688 [0,0,0,1,0,0|2,1,0]=4 3671 B14R2.717 Cc1cncc(c1SCC2CO2)C 62a_102125554688_100009817138 [0,0,0,1,0,0|2,1,0]=4 3672 B14R2.717 Cc1cncc(c1SCC2CS2)C 62a_100000031435_100009817138 [0,0,0,1,0,0|2,1,0]=4 3673 B14R2.717 Cc1cncc(c1SCC2CS2)C 62a_100009817138_100000031435 [0,0,0,1,0,0|2,1,0]=4 3674 B14R2.717 Cc1cncc(c1SC[C@@H]2CO2)C 62a_100000745022_100009817138 [0,0,0,1,0,0|2,1,0]=4 3675 B14R2.717 Cc1cncc(c1SC[C@@H]2CO2)C 62a_100009817138_100000745022 [0,0,0,1,0,0|2,1,0]=4 3676 B14R2.717 Cc1ncnc(c1OCC2CC2)C 34a_100009878406_100000742324 [0,0,0,1,0,0|3,0,0]=4 3677 B14R2.717 Cc1ncnc(c1OCC2CC2)C 7a_100009878406_100000742324 [0,0,0,1,0,0|3,0,0]=4 3678 B14R2.717 Cc1ncnc(c1OCC2CO2)C 34a_100009878406_102125554688 [0,0,0,1,0,0|3,0,0]=4 3679 B14R2.717 Cc1ncnc(c1OCC2CO2)C 7a_100009878406_102125554688 [0,0,0,1,0,0|3,0,0]=4 3680 B14R2.717 Cc1ncnc(c1OCC2CS2)C 7a_100009878406_100000031435 [0,0,0,1,0,0|3,0,0]=4 3681 B14R2.717 Cc1ncnc(c1OC[C@@H]2CO2)C 7a_100009878406_100000745022 [0,0,0,1,0,0|3,0,0]=4 3682 B14R2.717 Cc1occc(=O)c1OCC2CC2 34a_100000031901_100000742324 [0,0,0,1,0,0|3,0,0]=4 3683 B14R2.717 Cc1occc(=O)c1OCC2CO2 34a_100000031901_102125554688 [0,0,0,1,0,0|3,0,0]=4 3684 B14R2.717 Clc1cccc(c1OCC2CC2)Br 34a_100010214474_100000742324 [0,0,0,1,0,0|3,0,0]=4 3685 B14R2.717 Clc1cccc(c1OCC2CC2)Br 7a_100010214474_100000742324 [0,0,0,1,0,0|3,0,0]=4 3686 B14R2.717 Clc1cccc(c1OCC2CC2)Cl 34a_100000211709_100000742324 [0,0,0,1,0,0|3,0,0]=4 3687 B14R2.717 Clc1cccc(c1OCC2CC2)Cl 7a_100000211709_100000742324 [0,0,0,1,0,0|3,0,0]=4 3688 B14R2.717 Clc1cccc(c1OCC2CC2)I 34a_100010202889_100000742324 [0,0,0,1,0,0|3,0,0]=4 3689 B14R2.717 Clc1cccc(c1OCC2CC2)I 7a_100010202889_100000742324 [0,0,0,1,0,0|3,0,0]=4 3690 B14R2.717 Clc1cccc(c1OCC2CO2)Br 34a_100010214474_102125554688 [0,0,0,1,0,0|3,0,0]=4 3691 B14R2.717 Clc1cccc(c1OCC2CO2)Br 7a_100010214474_102125554688 [0,0,0,1,0,0|3,0,0]=4 3692 B14R2.717 Clc1cccc(c1OCC2CO2)Cl 34a_100000211709_102125554688 [0,0,0,1,0,0|3,0,0]=4 3693 B14R2.717 Clc1cccc(c1OCC2CO2)Cl 7a_100000211709_102125554688 [0,0,0,1,0,0|3,0,0]=4 3694 B14R2.717 Clc1cccc(c1OCC2CO2)I 34a_100010202889_102125554688 [0,0,0,1,0,0|3,0,0]=4 3695 B14R2.717 Clc1cccc(c1OCC2CO2)I 7a_100010202889_102125554688 [0,0,0,1,0,0|3,0,0]=4 3696 B14R2.717 Clc1cccc(c1OCC2CS2)Br 7a_100010214474_100000031435 [0,0,0,1,0,0|3,0,0]=4 3697 B14R2.717 Clc1cccc(c1OCC2CS2)Cl 7a_100000211709_100000031435 [0,0,0,1,0,0|3,0,0]=4 3698 B14R2.717 Clc1cccc(c1OCC2CS2)I 7a_100010202889_100000031435 [0,0,0,1,0,0|3,0,0]=4 3699 B14R2.717 Clc1cccc(c1OC[C@@H]2CO2)Br 7a_100010214474_100000745022 [0,0,0,1,0,0|3,0,0]=4 3700 B14R2.717 Clc1cccc(c1OC[C@@H]2CO2)Cl 7a_100000211709_100000745022 [0,0,0,1,0,0|3,0,0]=4 3701 B14R2.717 Clc1cccc(c1OC[C@@H]2CO2)I 7a_100010202889_100000745022 [0,0,0,1,0,0|3,0,0]=4 3702 B14R2.717 Fc1cccc(c1OCC2CC2)Br 34a_100009813666_100000742324 [0,0,0,1,0,0|3,0,0]=4 3703 B14R2.717 Fc1cccc(c1OCC2CC2)Br 7a_100009813666_100000742324 [0,0,0,1,0,0|3,0,0]=4 3704 B14R2.717 Fc1cccc(c1OCC2CC2)Cl 34a_100000694953_100000742324 [0,0,0,1,0,0|3,0,0]=4 3705 B14R2.717 Fc1cccc(c1OCC2CC2)Cl 7a_100000694953_100000742324 [0,0,0,1,0,0|3,0,0]=4 3706 B14R2.717 Fc1cccc(c1OCC2CC2)F 34a_100000230165_100000742324 [0,0,0,1,0,0|3,0,0]=4 3707 B14R2.717 Fc1cccc(c1OCC2CC2)F 7a_100000230165_100000742324 [0,0,0,1,0,0|3,0,0]=4 3708 B14R2.717 Fc1cccc(c1OCC2CC2)I 34a_100010186298_100000742324 [0,0,0,1,0,0|3,0,0]=4 3709 B14R2.717 Fc1cccc(c1OCC2CC2)I 7a_100010186298_100000742324 [0,0,0,1,0,0|3,0,0]=4 3710 B14R2.717 Fc1cccc(c1OCC2CO2)Br 34a_100009813666_102125554688 [0,0,0,1,0,0|3,0,0]=4 3711 B14R2.717 Fc1cccc(c1OCC2CO2)Br 7a_100009813666_102125554688 [0,0,0,1,0,0|3,0,0]=4 3712 B14R2.717 Fc1cccc(c1OCC2CO2)Cl 34a_100000694953_102125554688 [0,0,0,1,0,0|3,0,0]=4 3713 B14R2.717 Fc1cccc(c1OCC2CO2)Cl 7a_100000694953_102125554688 [0,0,0,1,0,0|3,0,0]=4 3714 B14R2.717 Fc1cccc(c1OCC2CO2)F 34a_100000230165_102125554688 [0,0,0,1,0,0|3,0,0]=4 3715 B14R2.717 Fc1cccc(c1OCC2CO2)F 7a_100000230165_102125554688 [0,0,0,1,0,0|3,0,0]=4 3716 B14R2.717 Fc1cccc(c1OCC2CO2)I 34a_100010186298_102125554688 [0,0,0,1,0,0|3,0,0]=4 3717 B14R2.717 Fc1cccc(c1OCC2CO2)I 7a_100010186298_102125554688 [0,0,0,1,0,0|3,0,0]=4 3718 B14R2.717 Fc1cccc(c1OCC2CS2)Br 7a_100009813666_100000031435 [0,0,0,1,0,0|3,0,0]=4 3719 B14R2.717 Fc1cccc(c1OCC2CS2)Cl 7a_100000694953_100000031435 [0,0,0,1,0,0|3,0,0]=4 3720 B14R2.717 Fc1cccc(c1OCC2CS2)F 7a_100000230165_100000031435 [0,0,0,1,0,0|3,0,0]=4 3721 B14R2.717 Fc1cccc(c1OCC2CS2)I 7a_100010186298_100000031435 [0,0,0,1,0,0|3,0,0]=4 3722 B14R2.717 Fc1cccc(c1OC[C@@H]2CO2)Br 7a_100009813666_100000745022 [0,0,0,1,0,0|3,0,0]=4 3723 B14R2.717 Fc1cccc(c1OC[C@@H]2CO2)Cl 7a_100000694953_100000745022 [0,0,0,1,0,0|3,0,0]=4 3724 B14R2.717 Fc1cccc(c1OC[C@@H]2CO2)F 7a_100000230165_100000745022 [0,0,0,1,0,0|3,0,0]=4 3725 B14R2.717 Fc1cccc(c1OC[C@@H]2CO2)I 7a_100010186298_100000745022 [0,0,0,1,0,0|3,0,0]=4 3726 B14R2.717 Nc1cccc(c1OCC2CC2)Br 34a_100011934915_100000742324 [0,0,0,1,0,0|3,0,0]=4 3727 B14R2.717 Nc1cccc(c1OCC2CC2)Cl 34a_100000754742_100000742324 [0,0,0,1,0,0|3,0,0]=4 3728 B14R2.717 Nc1cccc(c1OCC2CC2)F 34a_100011934987_100000742324 [0,0,0,1,0,0|3,0,0]=4 3729 B14R2.717 Nc1cccc(c1OCC2CC2)I 34a_100010084371_100000742324 [0,0,0,1,0,0|3,0,0]=4 3730 B14R2.717 Nc1cccc(c1OCC2CC2)N 34a_200016994477_100000742324 [0,0,0,1,0,0|3,0,0]=4 3731 B14R2.717 Nc1cccc(c1OCC2CO2)Br 34a_100011934915_102125554688 [0,0,0,1,0,0|3,0,0]=4 3732 B14R2.717 Nc1cccc(c1OCC2CO2)Cl 34a_100000754742_102125554688 [0,0,0,1,0,0|3,0,0]=4 3733 B14R2.717 Nc1cccc(c1OCC2CO2)F 34a_100011934987_102125554688 [0,0,0,1,0,0|3,0,0]=4 3734 B14R2.717 Nc1cccc(c1OCC2CO2)I 34a_100010084371_102125554688 [0,0,0,1,0,0|3,0,0]=4 3735 B14R2.717 Nc1cccc(c1OCC2CO2)N 34a_200016994477_102125554688 [0,0,0,1,0,0|3,0,0]=4 3736 B14R2.7969 Cc1cccc2c1CC(C2)N(C)C 270004a_100102631434_100010637320 [0,0,0,1,0,0|3,0,0]=4 3737 B14R2.7969 Cc1cccc2c1CN(C2)C(C)C 2230a_100020635169_100000210206 [0,0,0,1,0,0|3,0,0]=4 3738 B14R2.7969 Cc1cccc2c1CN(C2)C(C)C 269982a_100020635169_100000210206 [0,0,0,1,0,0|3,0,0]=4 3739 B14R2.7969 Cc1cccc2c1CN(C2)C(C)C 34a_100020635169_100000210206 [0,0,0,1,0,0|3,0,0]=4 3740 B12R1.895 Cc1n[nH]c(c1OCC(C)C)C 34a_100012186652_100000210624 [0,0,0,0,1,0|3,0,0]=4 3741 B12R1.895 Cc1n[nH]c(c1OCC(C)O)C 34a_100012186652_100011218427 [0,0,0,0,1,0|3,0,0]=4 3742 B12R1.895 Cc1n[nH]c(c1OC[C@@H](C)O)C 34a_100012186652_100009817552 [0,0,0,0,1,0|3,0,0]=4 3743 B12R1.1009 CC(=Cc1c(cccc1C)C)C 271570a_100102525489_100000033847 [0,0,0,0,1,0|1,0,2]=4 3744 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100000070787_100010146847 [0,0,0,0,1,0|2,0,1]=4 3745 B12R1.1009 CC(=O)Cc1c(cccc1Br)C 1458a_100010147022_200000210301 [0,0,0,0,1,0|2,0,1]=4 3746 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000070787_100000758300 [0,0,0,0,1,0|1,0,1]=3 3747 B12R1.1009 CC(=O)Cc1c(cccc1C)C 1458a_100000689862_200000210301 [0,0,0,0,1,0|1,0,1]=3 3748 B12R1.1009 CC(=O)Cc1c(cccc1F)C 1458a_100000070787_100009814554 [0,0,0,0,1,0|2,0,1]=4 3749 B12R1.1009 CC(=O)Cc1c(cccc1I)C 1458a_100000070787_100010150146 [0,0,0,0,1,0|2,0,1]=4 3750 B12R1.1009 CC(=O)Nc1c(cccc1C)C 11a_100000185769_100015343762 [0,0,0,0,1,0|2,0,1]=4 3751 B12R1.1009 CC(=O)Nc1c(cccc1C)C 1626a_100000185769_100015343762 [0,0,0,0,1,0|2,0,1]=4 3752 B12R1.1009 CC(=O)Nc1c(cccc1C)C 22a_100000185769_100000070787 [0,0,0,0,1,0|2,0,1]=4 3753 B12R1.1009 CC(C)Oc1c(cccc1Br)Br 34a_100000736428_100000210206 [0,0,0,0,1,0|3,0,0]=4 3754 B12R1.1009 CC(C)Oc1c(cccc1Br)Br 7a_100000736428_100000210206 [0,0,0,0,1,0|3,0,0]=4 3755 B12R1.1009 CC(C)Oc1c(cccc1Br)Cl 34a_100010214474_100000210206 [0,0,0,0,1,0|3,0,0]=4 3756 B12R1.1009 CC(C)Oc1c(cccc1Br)Cl 7a_100010214474_100000210206 [0,0,0,0,1,0|3,0,0]=4 3757 B12R1.1009 CC(C)Oc1c(cccc1Br)F 34a_100009813666_100000210206 [0,0,0,0,1,0|3,0,0]=4 3758 B12R1.1009 CC(C)Oc1c(cccc1Br)F 7a_100009813666_100000210206 [0,0,0,0,1,0|3,0,0]=4 3759 B12R1.1009 CC(C)Oc1c(cccc1Br)N 34a_100011934915_100000210206 [0,0,0,0,1,0|3,0,0]=4 3760 B12R1.1009 CC(C)Oc1c(cccc1Cl)Cl 34a_100000211709_100000210206 [0,0,0,0,1,0|3,0,0]=4 3761 B12R1.1009 CC(C)Oc1c(cccc1Cl)Cl 7a_100000211709_100000210206 [0,0,0,0,1,0|3,0,0]=4 3762 B12R1.1009 CC(C)Oc1c(cccc1Cl)F 34a_100000694953_100000210206 [0,0,0,0,1,0|3,0,0]=4 3763 B12R1.1009 CC(C)Oc1c(cccc1Cl)F 7a_100000694953_100000210206 [0,0,0,0,1,0|3,0,0]=4 3764 B12R1.1009 CC(C)Oc1c(cccc1Cl)N 34a_100000754742_100000210206 [0,0,0,0,1,0|3,0,0]=4 3765 B12R1.1009 CC(C)Oc1c(cccc1F)F 34a_100000230165_100000210206 [0,0,0,0,1,0|3,0,0]=4 3766 B12R1.1009 CC(C)Oc1c(cccc1F)F 7a_100000230165_100000210206 [0,0,0,0,1,0|3,0,0]=4 3767 B12R1.1009 CC(C)Oc1c(cccc1F)N 34a_100011934987_100000210206 [0,0,0,0,1,0|3,0,0]=4 3768 B12R1.1009 CC(C)Oc1c(cccc1F)O 271570a_203496583355_200010078528 [0,0,0,0,1,0|3,0,0]=4 3769 B12R1.1009 CC(C)Oc1c(cccc1I)Br 34a_100010084509_100000210206 [0,0,0,0,1,0|3,0,0]=4 3770 B12R1.1009 CC(C)Oc1c(cccc1I)Br 7a_100010084509_100000210206 [0,0,0,0,1,0|3,0,0]=4 3771 B12R1.1009 CC(C)Oc1c(cccc1I)Cl 34a_100010202889_100000210206 [0,0,0,0,1,0|3,0,0]=4 3772 B12R1.1009 CC(C)Oc1c(cccc1I)Cl 7a_100010202889_100000210206 [0,0,0,0,1,0|3,0,0]=4 3773 B12R1.1009 CC(C)Oc1c(cccc1I)F 34a_100010186298_100000210206 [0,0,0,0,1,0|3,0,0]=4 3774 B12R1.1009 CC(C)Oc1c(cccc1I)F 7a_100010186298_100000210206 [0,0,0,0,1,0|3,0,0]=4 3775 B12R1.1009 CC(C)Oc1c(cccc1I)N 34a_100010084371_100000210206 [0,0,0,0,1,0|3,0,0]=4 3776 B12R1.1009 CC(C)Oc1c(cccc1N)N 34a_200016994477_100000210206 [0,0,0,0,1,0|3,0,0]=4 3777 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])Br 1458a_100010147022_200025704644 [0,0,0,0,1,0|2,0,1]=4 3778 B12R1.1009 Cc1cccc(c1CC(=O)[13CH3])C 1458a_100000689862_200025704644 [0,0,0,0,1,0|1,0,1]=3 3779 B12R1.1009 Cc1cccc(c1CN(C)C)Br 2230a_100102631434_100010146847 [0,0,0,0,1,0|3,0,0]=4 3780 B12R1.1009 Cc1cccc(c1CN(C)C)Br 269982a_100102631434_100010146847 [0,0,0,0,1,0|3,0,0]=4 3781 B12R1.1009 Cc1cccc(c1CN(C)C)Br 270004a_100102631434_100009881667 [0,0,0,0,1,0|3,0,0]=4 3782 B12R1.1009 Cc1cccc(c1CN(C)C)C 2230a_100102631434_100000758300 [0,0,0,0,1,0|2,0,0]=3 3783 B12R1.1009 Cc1cccc(c1CN(C)C)C 269982a_100102631434_100000758300 [0,0,0,0,1,0|2,0,0]=3 3784 B12R1.1009 Cc1cccc(c1CN(C)C)C 270004a_100102631434_100000758299 [0,0,0,0,1,0|2,0,0]=3 3785 B12R1.1009 Cc1cccc(c1CN(C)C)Cl 270004a_100102631434_100000041122 [0,0,0,0,1,0|3,0,0]=4 3786 B12R1.1009 Cc1cccc(c1CN(C)C)F 2230a_100102631434_100009814554 [0,0,0,0,1,0|3,0,0]=4 3787 B12R1.1009 Cc1cccc(c1CN(C)C)F 269982a_100102631434_100009814554 [0,0,0,0,1,0|3,0,0]=4 3788 B12R1.1009 Cc1cccc(c1CN(C)C)F 270004a_100102631434_100000069827 [0,0,0,0,1,0|3,0,0]=4 3789 B12R1.1009 Cc1cccc(c1CN(C)C)I 2230a_100102631434_100010150146 [0,0,0,0,1,0|3,0,0]=4 3790 B12R1.1009 Cc1cccc(c1CN(C)C)I 269982a_100102631434_100010150146 [0,0,0,0,1,0|3,0,0]=4 3791 B12R1.1009 Cc1cccc(c1NC(C)C)Br 34a_100011834072_100000210206 [0,0,0,0,1,0|3,0,0]=4 3792 B12R1.1009 Cc1cccc(c1NC(C)C)C 34a_100000185769_100000210206 [0,0,0,0,1,0|2,0,0]=3 3793 B12R1.1009 Cc1cccc(c1NC(C)C)Cl 34a_100000756524_100000210206 [0,0,0,0,1,0|3,0,0]=4 3794 B12R1.1009 Cc1cccc(c1NC(C)C)F 34a_100000766463_100000210206 [0,0,0,0,1,0|3,0,0]=4 3795 B12R1.1009 Cc1cccc(c1NC(C)C)O 34a_100000743429_100000210206 [0,0,0,0,1,0|3,0,0]=4 3796 B12R1.1009 Cc1cccc(c1OC(C)C)Br 34a_100009817157_100000210206 [0,0,0,0,1,0|2,0,0]=3 3797 B12R1.1009 Cc1cccc(c1OC(C)C)Br 7a_100009817157_100000210206 [0,0,0,0,1,0|2,0,0]=3 3798 B12R1.1009 Cc1cccc(c1OC(C)C)C 34a_100000210341_100000210206 [0,0,0,0,1,0|1,0,0]=2 3799 B12R1.1009 Cc1cccc(c1OC(C)C)C 7a_100000210341_100000210206 [0,0,0,0,1,0|1,0,0]=2 3800 B12R1.1009 Cc1cccc(c1OC(C)C)Cl 34a_100000033731_100000210206 [0,0,0,0,1,0|2,0,0]=3 3801 B12R1.1009 Cc1cccc(c1OC(C)C)Cl 7a_100000033731_100000210206 [0,0,0,0,1,0|2,0,0]=3 3802 B12R1.1009 Cc1cccc(c1OC(C)C)F 34a_100011659162_100000210206 [0,0,0,0,1,0|2,0,0]=3 3803 B12R1.1009 Cc1cccc(c1OC(C)C)F 7a_100011659162_100000210206 [0,0,0,0,1,0|2,0,0]=3 3804 B12R1.1009 Cc1cccc(c1OC(C)C)N 34a_100000756359_100000210206 [0,0,0,0,1,0|2,0,0]=3 3805 B12R1.1009 Cc1cccc(c1OC(C)C)N 7a_100000756359_100000210206 [0,0,0,0,1,0|2,0,0]=3 3806 B12R1.1009 Cc1cccc(c1OC(F)F)O 271570a_203496583355_100010232499 [0,0,0,0,1,0|3,0,0]=4 3807 B12R1.1009 Cc1cccc(c1SC(C)C)Br 62a_100000210206_100010141302 [0,0,0,0,1,0|2,1,0]=4 3808 B12R1.1009 Cc1cccc(c1SC(C)C)Br 62a_100010141302_100000210206 [0,0,0,0,1,0|2,1,0]=4 3809 B12R1.1009 Cc1cccc(c1SC(C)C)C 62a_100000033847_100000210206 [0,0,0,0,1,0|1,1,0]=3 3810 B12R1.1009 Cc1cccc(c1SC(C)C)C 62a_100000210206_100000033847 [0,0,0,0,1,0|1,1,0]=3 3811 B12R1.1009 Cc1cccc(c1SC(C)C)Cl 62a_100000043165_100000210206 [0,0,0,0,1,0|2,1,0]=4 3812 B12R1.1009 Cc1cccc(c1SC(C)C)Cl 62a_100000210206_100000043165 [0,0,0,0,1,0|2,1,0]=4 3813 B12R1.1009 Cc1cccc(c1SC(C)C)F 62a_100000210206_100011218421 [0,0,0,0,1,0|2,1,0]=4 3814 B12R1.1009 Cc1cccc(c1SC(C)C)F 62a_100011218421_100000210206 [0,0,0,0,1,0|2,1,0]=4 3815 B12R1.1009 Cc1cccc(c1SC(C)C)N 62a_100000210206_100000684715 [0,0,0,0,1,0|2,1,0]=4 3816 B12R1.1009 Cc1cccc(c1SC(C)C)N 62a_100000684715_100000210206 [0,0,0,0,1,0|2,1,0]=4 3817 B12R1.1009 Cc1cccc(c1SC(C)C)O 62a_100000210206_100000686692 [0,0,0,0,1,0|2,1,0]=4 3818 B12R1.1009 Cc1cccc(c1SC(C)C)O 62a_100000686692_100000210206 [0,0,0,0,1,0|2,1,0]=4 3819 B12R1.1009 Cc1ccnc(c1OC(C)C)C 34a_100011934651_100000210206 [0,0,0,0,1,0|2,0,0]=3 3820 B12R1.1009 Cc1ccnc(c1OC(C)C)C 7a_100011934651_100000210206 [0,0,0,0,1,0|2,0,0]=3 3821 B12R1.1009 Cc1ccnc(c1OC(C)C)Cl 34a_100000696282_100000210206 [0,0,0,0,1,0|3,0,0]=4 3822 B12R1.1009 Cc1ccnc(c1OC(C)C)Cl 7a_100000696282_100000210206 [0,0,0,0,1,0|3,0,0]=4 3823 B12R1.1009 Cc1ccnc(c1SC(C)C)C 62a_100000210206_100012000501 [0,0,0,0,1,0|2,1,0]=4 3824 B12R1.1009 Cc1ccnc(c1SC(C)C)C 62a_100012000501_100000210206 [0,0,0,0,1,0|2,1,0]=4 3825 B12R1.1009 Cc1cncc(c1SC(C)C)C 62a_100000210206_100009817138 [0,0,0,0,1,0|2,1,0]=4 3826 B12R1.1009 Cc1cncc(c1SC(C)C)C 62a_100009817138_100000210206 [0,0,0,0,1,0|2,1,0]=4 3827 B12R1.1009 Cc1ncnc(c1OC(C)C)C 34a_100009878406_100000210206 [0,0,0,0,1,0|3,0,0]=4 3828 B12R1.1009 Cc1ncnc(c1OC(C)C)C 7a_100009878406_100000210206 [0,0,0,0,1,0|3,0,0]=4 3829 B12R1.1009 Cc1occc(=O)c1OC(C)C 34a_100000031901_100000210206 [0,0,0,0,1,0|3,0,0]=4 3830 B14R1.4920 C=C(C)CCNc1c(cccc1C)C 34a_100000185769_100000730704 [0,0,0,0,0,1|2,0,1]=4 3831 B14R1.4920 C=C(C)CCOc1c(cccc1Br)C 34a_100009817157_100000730704 [0,0,0,0,0,1|2,0,1]=4 3832 B14R1.4920 C=C(C)CCOc1c(cccc1Br)C 7a_100009817157_100000730704 [0,0,0,0,0,1|2,0,1]=4 3833 B14R1.4920 C=C(C)CCOc1c(cccc1C)C 34a_100000210341_100000730704 [0,0,0,0,0,1|1,0,1]=3 3834 B14R1.4920 C=C(C)CCOc1c(cccc1C)C 7a_100000210341_100000730704 [0,0,0,0,0,1|1,0,1]=3 3835 B14R1.4920 C=C(C)CCOc1c(cccc1Cl)C 34a_100000033731_100000730704 [0,0,0,0,0,1|2,0,1]=4 3836 B14R1.4920 C=C(C)CCOc1c(cccc1Cl)C 7a_100000033731_100000730704 [0,0,0,0,0,1|2,0,1]=4 3837 B14R1.4920 C=C(C)CCOc1c(cccc1F)C 34a_100011659162_100000730704 [0,0,0,0,0,1|2,0,1]=4 3838 B14R1.4920 C=C(C)CCOc1c(cccc1F)C 7a_100011659162_100000730704 [0,0,0,0,0,1|2,0,1]=4 3839 B14R1.4920 C=C(C)CCOc1c(cccc1N)C 34a_100000756359_100000730704 [0,0,0,0,0,1|2,0,1]=4 3840 B14R1.4920 C=C(C)CCOc1c(cccc1N)C 7a_100000756359_100000730704 [0,0,0,0,0,1|2,0,1]=4 3841 B14R1.4920 C=C(C)CCOc1c(ccnc1C)C 34a_100011934651_100000730704 [0,0,0,0,0,1|2,0,1]=4 3842 B14R1.4920 C=C(C)CCOc1c(ccnc1C)C 7a_100011934651_100000730704 [0,0,0,0,0,1|2,0,1]=4 3843 B14R1.4920 C=C(C)CCSc1c(cccc1C)C 62a_100000033847_100000730704 [0,0,0,0,0,1|1,1,1]=4 3844 B14R1.4920 C=C(C)CCSc1c(cccc1C)C 62a_100000730704_100000033847 [0,0,0,0,0,1|1,1,1]=4 3845 B14R1.4920 C=C(C)CNCc1c(cccc1C)C 34a_100000689800_100000748629 [0,0,0,0,0,1|2,0,1]=4 3846 B14R1.4920 C=C(C)COCc1c(cccc1Br)C 34a_100000210245_100010146847 [0,0,0,0,0,1|2,0,1]=4 3847 B14R1.4920 C=C(C)COCc1c(cccc1C)C 34a_100000210245_100000758300 [0,0,0,0,0,1|1,0,1]=3 3848 B14R1.4920 C=C(C)COCc1c(cccc1C)C 34a_100011933981_100000748629 [0,0,0,0,0,1|1,0,1]=3 3849 B14R1.4920 C=C(C)COCc1c(cccc1C)C 7a_100011933981_100000748629 [0,0,0,0,0,1|1,0,1]=3 3850 B14R1.4920 C=C(C)COCc1c(cccc1Cl)C 34a_100000082531_100000748629 [0,0,0,0,0,1|2,0,1]=4 3851 B14R1.4920 C=C(C)COCc1c(cccc1Cl)C 7a_100000082531_100000748629 [0,0,0,0,0,1|2,0,1]=4 3852 B14R1.4920 C=C(C)COCc1c(cccc1F)C 34a_100000057874_100000748629 [0,0,0,0,0,1|2,0,1]=4 3853 B14R1.4920 C=C(C)COCc1c(cccc1F)C 34a_100000210245_100009814554 [0,0,0,0,0,1|2,0,1]=4 3854 B14R1.4920 C=C(C)COCc1c(cccc1F)C 7a_100000057874_100000748629 [0,0,0,0,0,1|2,0,1]=4 3855 B14R1.4920 C=C(C)COCc1c(cccc1I)C 34a_100000210245_100010150146 [0,0,0,0,0,1|2,0,1]=4 3856 B14R1.4920 C=C(C)CSCc1c(cccc1C)C 62a_100000748629_100000758300 [0,0,0,0,0,1|1,1,1]=4 3857 B14R1.4920 C=C(C)CSCc1c(cccc1C)C 62a_100000758300_100000211660 [0,0,0,0,0,1|1,1,1]=4 3858 B14R1.4920 C=C(F)COCc1c(cccc1C)C 34a_100011933981_100009893438 [0,0,0,0,0,1|1,0,2]=4 3859 B14R1.4920 C=C(F)COCc1c(cccc1C)C 34a_200010262243_100000758300 [0,0,0,0,0,1|1,0,2]=4 3860 B14R1.4920 C=C(F)COCc1c(cccc1C)C 7a_100011933981_100000042424 [0,0,0,0,0,1|1,0,2]=4 3861 B14R1.4920 CC(=CCNc1c(cccc1C)C)C 34a_100000185769_100000761012 [0,0,0,0,0,1|2,0,1]=4 3862 B14R1.4920 CC(=CCOc1c(cccc1Br)C)C 34a_100009817157_100000761012 [0,0,0,0,0,1|2,0,1]=4 3863 B14R1.4920 CC(=CCOc1c(cccc1Br)C)C 7a_100009817157_100000761012 [0,0,0,0,0,1|2,0,1]=4 3864 B14R1.4920 CC(=CCOc1c(cccc1C)C)C 34a_100000210341_100000761012 [0,0,0,0,0,1|1,0,1]=3 3865 B14R1.4920 CC(=CCOc1c(cccc1C)C)C 7a_100000210341_100000761012 [0,0,0,0,0,1|1,0,1]=3 3866 B14R1.4920 CC(=CCOc1c(cccc1Cl)C)C 34a_100000033731_100000761012 [0,0,0,0,0,1|2,0,1]=4 3867 B14R1.4920 CC(=CCOc1c(cccc1Cl)C)C 7a_100000033731_100000761012 [0,0,0,0,0,1|2,0,1]=4 3868 B14R1.4920 CC(=CCOc1c(cccc1F)C)C 34a_100011659162_100000761012 [0,0,0,0,0,1|2,0,1]=4 3869 B14R1.4920 CC(=CCOc1c(cccc1F)C)C 7a_100011659162_100000761012 [0,0,0,0,0,1|2,0,1]=4 3870 B14R1.4920 CC(=CCOc1c(cccc1N)C)C 34a_100000756359_100000761012 [0,0,0,0,0,1|2,0,1]=4 3871 B14R1.4920 CC(=CCOc1c(cccc1N)C)C 7a_100000756359_100000761012 [0,0,0,0,0,1|2,0,1]=4 3872 B14R1.4920 CC(=CCOc1c(ccnc1C)C)C 34a_100011934651_100000761012 [0,0,0,0,0,1|2,0,1]=4 3873 B14R1.4920 CC(=CCOc1c(ccnc1C)C)C 7a_100011934651_100000761012 [0,0,0,0,0,1|2,0,1]=4 3874 B14R1.4920 CC(=CCSc1c(cccc1C)C)C 62a_100000033847_100000761012 [0,0,0,0,0,1|1,1,1]=4 3875 B14R1.4920 CC(=CCSc1c(cccc1C)C)C 62a_100000761012_100000033847 [0,0,0,0,0,1|1,1,1]=4 3876 B14R1.4920 CC(=O)CCOc1c(cccc1Br)C 7a_100009817157_100000053229 [0,0,0,0,0,1|2,0,1]=4 3877 B14R1.4920 CC(=O)CCOc1c(cccc1C)C 1458a_100000070787_100000184555 [0,0,0,0,0,1|1,0,1]=3 3878 B14R1.4920 CC(=O)CCOc1c(cccc1C)C 1458a_200000738035_200000210301 [0,0,0,0,0,1|1,0,1]=3 3879 B14R1.4920 CC(=O)CCOc1c(cccc1C)C 7a_100000210341_100000053229 [0,0,0,0,0,1|1,0,1]=3 3880 B14R1.4920 CC(=O)CCOc1c(cccc1Cl)C 7a_100000033731_100000053229 [0,0,0,0,0,1|2,0,1]=4 3881 B14R1.4920 CC(=O)CCOc1c(cccc1F)C 7a_100011659162_100000053229 [0,0,0,0,0,1|2,0,1]=4 3882 B14R1.4920 CC(=O)CCOc1c(cccc1N)C 7a_100000756359_100000053229 [0,0,0,0,0,1|2,0,1]=4 3883 B14R1.4920 CC(=O)CCOc1c(ccnc1C)C 7a_100011934651_100000053229 [0,0,0,0,0,1|2,0,1]=4 3884 B14R1.4920 CC(=O)CCSc1c(cccc1C)C 62a_100000033847_100000053229 [0,0,0,0,0,1|1,1,1]=4 3885 B14R1.4920 CC(=O)CCSc1c(cccc1C)C 62a_100000053229_100000033847 [0,0,0,0,0,1|1,1,1]=4 3886 B14R1.4920 CC(=O)COCc1c(cccc1Br)C 34a_100000211253_100010146847 [0,0,0,0,0,1|2,0,1]=4 3887 B14R1.4920 CC(=O)COCc1c(cccc1C)C 34a_100000211253_100000758300 [0,0,0,0,0,1|1,0,1]=3 3888 B14R1.4920 CC(=O)COCc1c(cccc1F)C 34a_100000211253_100009814554 [0,0,0,0,0,1|2,0,1]=4 3889 B14R1.4920 CC(=O)COCc1c(cccc1I)C 34a_100000211253_100010150146 [0,0,0,0,0,1|2,0,1]=4 3890 B14R1.4920 CC(=O)OCNc1c(cccc1C)C 34a_100000185769_100009813279 [0,0,0,0,0,1|2,0,1]=4 3891 B14R1.4920 CC(=O)OCOc1c(cccc1Br)C 34a_100009817157_100009813279 [0,0,0,0,0,1|2,0,1]=4 3892 B14R1.4920 CC(=O)OCOc1c(cccc1C)C 34a_100000210341_100009813279 [0,0,0,0,0,1|1,0,1]=3 3893 B14R1.4920 CC(=O)OCOc1c(cccc1Cl)C 34a_100000033731_100009813279 [0,0,0,0,0,1|2,0,1]=4 3894 B14R1.4920 CC(=O)OCOc1c(cccc1F)C 34a_100011659162_100009813279 [0,0,0,0,0,1|2,0,1]=4 3895 B14R1.4920 CC(=O)OCOc1c(cccc1N)C 34a_100000756359_100009813279 [0,0,0,0,0,1|2,0,1]=4 3896 B14R1.4920 CC(=O)OCOc1c(ccnc1C)C 34a_100011934651_100009813279 [0,0,0,0,0,1|2,0,1]=4 3897 B14R1.4920 CC(=O)OCSc1c(cccc1C)C 62a_100000033847_100000076356 [0,0,0,0,0,1|1,1,1]=4 3898 B14R1.4920 CC(=O)OCSc1c(cccc1C)C 62a_100000076356_100000033847 [0,0,0,0,0,1|1,1,1]=4 3899 B14R1.4920 CC(Br)COCc1c(cccc1Br)Cl 34a_100012180447_100010138402 [0,0,0,0,0,1|3,0,0]=4 3900 B14R1.4920 CC(Br)COCc1c(cccc1Br)F 34a_100012180447_100012145669 [0,0,0,0,0,1|3,0,0]=4 3901 B14R1.4920 CC(Br)COCc1c(cccc1Cl)Cl 34a_100012180447_100000187851 [0,0,0,0,0,1|3,0,0]=4 3902 B14R1.4920 CC(Br)COCc1c(cccc1Cl)F 34a_100012180447_100000187852 [0,0,0,0,0,1|3,0,0]=4 3903 B14R1.4920 CC(Br)COCc1c(cccc1F)F 34a_100012180447_100000698325 [0,0,0,0,0,1|3,0,0]=4 3904 B14R1.4920 CC(Br)COCc1c(cccc1I)Br 34a_100012180447_100010146611 [0,0,0,0,0,1|3,0,0]=4 3905 B14R1.4920 CC(Br)COCc1c(cccc1I)F 34a_100012180447_100010149602 [0,0,0,0,0,1|3,0,0]=4 3906 B14R1.4920 CC(C)CCOc1c(cccc1Br)Br 34a_100000736428_100000210312 [0,0,0,0,0,1|3,0,0]=4 3907 B14R1.4920 CC(C)CCOc1c(cccc1Br)Br 7a_100000736428_100000210626 [0,0,0,0,0,1|3,0,0]=4 3908 B14R1.4920 CC(C)CCOc1c(cccc1Br)Cl 34a_100010214474_100000210312 [0,0,0,0,0,1|3,0,0]=4 3909 B14R1.4920 CC(C)CCOc1c(cccc1Br)Cl 7a_100010214474_100000210626 [0,0,0,0,0,1|3,0,0]=4 3910 B14R1.4920 CC(C)CCOc1c(cccc1Br)F 34a_100009813666_100000210312 [0,0,0,0,0,1|3,0,0]=4 3911 B14R1.4920 CC(C)CCOc1c(cccc1Br)F 7a_100009813666_100000210626 [0,0,0,0,0,1|3,0,0]=4 3912 B14R1.4920 CC(C)CCOc1c(cccc1Br)N 34a_100011934915_100000210312 [0,0,0,0,0,1|3,0,0]=4 3913 B14R1.4920 CC(C)CCOc1c(cccc1Cl)Cl 34a_100000211709_100000210312 [0,0,0,0,0,1|3,0,0]=4 3914 B14R1.4920 CC(C)CCOc1c(cccc1Cl)Cl 7a_100000211709_100000210626 [0,0,0,0,0,1|3,0,0]=4 3915 B14R1.4920 CC(C)CCOc1c(cccc1Cl)F 34a_100000694953_100000210312 [0,0,0,0,0,1|3,0,0]=4 3916 B14R1.4920 CC(C)CCOc1c(cccc1Cl)F 7a_100000694953_100000210626 [0,0,0,0,0,1|3,0,0]=4 3917 B14R1.4920 CC(C)CCOc1c(cccc1Cl)N 34a_100000754742_100000210312 [0,0,0,0,0,1|3,0,0]=4 3918 B14R1.4920 CC(C)CCOc1c(cccc1F)F 34a_100000230165_100000210312 [0,0,0,0,0,1|3,0,0]=4 3919 B14R1.4920 CC(C)CCOc1c(cccc1F)F 7a_100000230165_100000210626 [0,0,0,0,0,1|3,0,0]=4 3920 B14R1.4920 CC(C)CCOc1c(cccc1F)N 34a_100011934987_100000210312 [0,0,0,0,0,1|3,0,0]=4 3921 B14R1.4920 CC(C)CCOc1c(cccc1I)Br 34a_100010084509_100000210312 [0,0,0,0,0,1|3,0,0]=4 3922 B14R1.4920 CC(C)CCOc1c(cccc1I)Br 7a_100010084509_100000210626 [0,0,0,0,0,1|3,0,0]=4 3923 B14R1.4920 CC(C)CCOc1c(cccc1I)Cl 34a_100010202889_100000210312 [0,0,0,0,0,1|3,0,0]=4 3924 B14R1.4920 CC(C)CCOc1c(cccc1I)Cl 7a_100010202889_100000210626 [0,0,0,0,0,1|3,0,0]=4 3925 B14R1.4920 CC(C)CCOc1c(cccc1I)F 34a_100010186298_100000210312 [0,0,0,0,0,1|3,0,0]=4 3926 B14R1.4920 CC(C)CCOc1c(cccc1I)F 7a_100010186298_100000210626 [0,0,0,0,0,1|3,0,0]=4 3927 B14R1.4920 CC(C)CCOc1c(cccc1I)N 34a_100010084371_100000210312 [0,0,0,0,0,1|3,0,0]=4 3928 B14R1.4920 CC(C)CCOc1c(cccc1N)N 34a_200016994477_100000210312 [0,0,0,0,0,1|3,0,0]=4 3929 B14R1.4920 CC(C)COCc1c(cccc1Br)Br 34a_100010172814_100000210624 [0,0,0,0,0,1|3,0,0]=4 3930 B14R1.4920 CC(C)COCc1c(cccc1Br)Br 7a_100010172814_100000210760 [0,0,0,0,0,1|3,0,0]=4 3931 B14R1.4920 CC(C)COCc1c(cccc1Br)Cl 34a_100000210257_100010138402 [0,0,0,0,0,1|3,0,0]=4 3932 B14R1.4920 CC(C)COCc1c(cccc1Br)F 34a_100000210257_100012145669 [0,0,0,0,0,1|3,0,0]=4 3933 B14R1.4920 CC(C)COCc1c(cccc1Br)F 34a_100012355691_100000210624 [0,0,0,0,0,1|3,0,0]=4 3934 B14R1.4920 CC(C)COCc1c(cccc1Br)F 7a_100012355691_100000210760 [0,0,0,0,0,1|3,0,0]=4 3935 B14R1.4920 CC(C)COCc1c(cccc1Br)N 34a_100000747656_100000210624 [0,0,0,0,0,1|3,0,0]=4 3936 B14R1.4920 CC(C)COCc1c(cccc1Cl)Cl 34a_100000210257_100000187851 [0,0,0,0,0,1|3,0,0]=4 3937 B14R1.4920 CC(C)COCc1c(cccc1Cl)Cl 34a_100000215722_100000210624 [0,0,0,0,0,1|3,0,0]=4 3938 B14R1.4920 CC(C)COCc1c(cccc1Cl)Cl 7a_100000215722_100000210760 [0,0,0,0,0,1|3,0,0]=4 3939 B14R1.4920 CC(C)COCc1c(cccc1Cl)F 34a_100000210257_100000187852 [0,0,0,0,0,1|3,0,0]=4 3940 B14R1.4920 CC(C)COCc1c(cccc1Cl)F 34a_100000215723_100000210624 [0,0,0,0,0,1|3,0,0]=4 3941 B14R1.4920 CC(C)COCc1c(cccc1Cl)F 7a_100000215723_100000210760 [0,0,0,0,0,1|3,0,0]=4 3942 B14R1.4920 CC(C)COCc1c(cccc1Cl)N 34a_100011916388_100000210624 [0,0,0,0,0,1|3,0,0]=4 3943 B14R1.4920 CC(C)COCc1c(cccc1F)F 34a_100000210257_100000698325 [0,0,0,0,0,1|3,0,0]=4 3944 B14R1.4920 CC(C)COCc1c(cccc1F)F 34a_100000698215_100000210624 [0,0,0,0,0,1|3,0,0]=4 3945 B14R1.4920 CC(C)COCc1c(cccc1F)F 7a_100000698215_100000210760 [0,0,0,0,0,1|3,0,0]=4 3946 B14R1.4920 CC(C)COCc1c(cccc1F)N 34a_100011846719_100000210624 [0,0,0,0,0,1|3,0,0]=4 3947 B14R1.4920 CC(C)COCc1c(cccc1I)Br 34a_100000210257_100010146611 [0,0,0,0,0,1|3,0,0]=4 3948 B14R1.4920 CC(C)COCc1c(cccc1I)F 34a_100000210257_100010149602 [0,0,0,0,0,1|3,0,0]=4 3949 B14R1.4920 CC(C)COCc1c(cccc1I)F 34a_100010214973_100000210624 [0,0,0,0,0,1|3,0,0]=4 3950 B14R1.4920 CC(C)COCc1c(cccc1I)F 7a_100010214973_100000210760 [0,0,0,0,0,1|3,0,0]=4 3951 B14R1.4920 CC(C)OCOc1c(cccc1Br)Br 34a_100000736428_100000709892 [0,0,0,0,0,1|3,0,0]=4 3952 B14R1.4920 CC(C)OCOc1c(cccc1Br)Cl 34a_100010214474_100000709892 [0,0,0,0,0,1|3,0,0]=4 3953 B14R1.4920 CC(C)OCOc1c(cccc1Br)F 34a_100009813666_100000709892 [0,0,0,0,0,1|3,0,0]=4 3954 B14R1.4920 CC(C)OCOc1c(cccc1Br)N 34a_100011934915_100000709892 [0,0,0,0,0,1|3,0,0]=4 3955 B14R1.4920 CC(C)OCOc1c(cccc1Cl)Cl 34a_100000211709_100000709892 [0,0,0,0,0,1|3,0,0]=4 3956 B14R1.4920 CC(C)OCOc1c(cccc1Cl)F 34a_100000694953_100000709892 [0,0,0,0,0,1|3,0,0]=4 3957 B14R1.4920 CC(C)OCOc1c(cccc1Cl)N 34a_100000754742_100000709892 [0,0,0,0,0,1|3,0,0]=4 3958 B14R1.4920 CC(C)OCOc1c(cccc1F)F 34a_100000230165_100000709892 [0,0,0,0,0,1|3,0,0]=4 3959 B14R1.4920 CC(C)OCOc1c(cccc1F)N 34a_100011934987_100000709892 [0,0,0,0,0,1|3,0,0]=4 3960 B14R1.4920 CC(C)OCOc1c(cccc1I)Br 34a_100010084509_100000709892 [0,0,0,0,0,1|3,0,0]=4 3961 B14R1.4920 CC(C)OCOc1c(cccc1I)Cl 34a_100010202889_100000709892 [0,0,0,0,0,1|3,0,0]=4 3962 B14R1.4920 CC(C)OCOc1c(cccc1I)F 34a_100010186298_100000709892 [0,0,0,0,0,1|3,0,0]=4 3963 B14R1.4920 CC(C)OCOc1c(cccc1I)N 34a_100010084371_100000709892 [0,0,0,0,0,1|3,0,0]=4 3964 B14R1.4920 CC(C)OCOc1c(cccc1N)N 34a_200016994477_100000709892 [0,0,0,0,0,1|3,0,0]=4 3965 B14R1.4920 CC(F)COCc1c(cccc1Br)Cl 34a_100015925927_100010138402 [0,0,0,0,0,1|3,0,0]=4 3966 B14R1.4920 CC(F)COCc1c(cccc1Br)F 34a_100015925927_100012145669 [0,0,0,0,0,1|3,0,0]=4 3967 B14R1.4920 CC(F)COCc1c(cccc1Cl)Cl 34a_100015925927_100000187851 [0,0,0,0,0,1|3,0,0]=4 3968 B14R1.4920 CC(F)COCc1c(cccc1Cl)F 34a_100015925927_100000187852 [0,0,0,0,0,1|3,0,0]=4 3969 B14R1.4920 CC(F)COCc1c(cccc1F)F 34a_100015925927_100000698325 [0,0,0,0,0,1|3,0,0]=4 3970 B14R1.4920 CC(F)COCc1c(cccc1I)Br 34a_100015925927_100010146611 [0,0,0,0,0,1|3,0,0]=4 3971 B14R1.4920 CC(F)COCc1c(cccc1I)F 34a_100015925927_100010149602 [0,0,0,0,0,1|3,0,0]=4 3972 B14R1.4920 CC(O)CCOc1c(cccc1Br)Br 34a_100000736428_100012276601 [0,0,0,0,0,1|3,0,0]=4 3973 B14R1.4920 CC(O)CCOc1c(cccc1Br)Br 7a_100000736428_100012276601 [0,0,0,0,0,1|3,0,0]=4 3974 B14R1.4920 CC(O)CCOc1c(cccc1Br)Cl 34a_100010214474_100012276601 [0,0,0,0,0,1|3,0,0]=4 3975 B14R1.4920 CC(O)CCOc1c(cccc1Br)Cl 7a_100010214474_100012276601 [0,0,0,0,0,1|3,0,0]=4 3976 B14R1.4920 CC(O)CCOc1c(cccc1Br)F 34a_100009813666_100012276601 [0,0,0,0,0,1|3,0,0]=4 3977 B14R1.4920 CC(O)CCOc1c(cccc1Br)F 7a_100009813666_100012276601 [0,0,0,0,0,1|3,0,0]=4 3978 B14R1.4920 CC(O)CCOc1c(cccc1Br)N 34a_100011934915_100012276601 [0,0,0,0,0,1|3,0,0]=4 3979 B14R1.4920 CC(O)CCOc1c(cccc1Cl)Cl 34a_100000211709_100012276601 [0,0,0,0,0,1|3,0,0]=4 3980 B14R1.4920 CC(O)CCOc1c(cccc1Cl)Cl 7a_100000211709_100012276601 [0,0,0,0,0,1|3,0,0]=4 3981 B14R1.4920 CC(O)CCOc1c(cccc1Cl)F 34a_100000694953_100012276601 [0,0,0,0,0,1|3,0,0]=4 3982 B14R1.4920 CC(O)CCOc1c(cccc1Cl)F 7a_100000694953_100012276601 [0,0,0,0,0,1|3,0,0]=4 3983 B14R1.4920 CC(O)CCOc1c(cccc1Cl)N 34a_100000754742_100012276601 [0,0,0,0,0,1|3,0,0]=4 3984 B14R1.4920 CC(O)CCOc1c(cccc1F)F 34a_100000230165_100012276601 [0,0,0,0,0,1|3,0,0]=4 3985 B14R1.4920 CC(O)CCOc1c(cccc1F)F 7a_100000230165_100012276601 [0,0,0,0,0,1|3,0,0]=4 3986 B14R1.4920 CC(O)CCOc1c(cccc1F)N 34a_100011934987_100012276601 [0,0,0,0,0,1|3,0,0]=4 3987 B14R1.4920 CC(O)CCOc1c(cccc1I)Br 34a_100010084509_100012276601 [0,0,0,0,0,1|3,0,0]=4 3988 B14R1.4920 CC(O)CCOc1c(cccc1I)Br 7a_100010084509_100012276601 [0,0,0,0,0,1|3,0,0]=4 3989 B14R1.4920 CC(O)CCOc1c(cccc1I)Cl 34a_100010202889_100012276601 [0,0,0,0,0,1|3,0,0]=4 3990 B14R1.4920 CC(O)CCOc1c(cccc1I)Cl 7a_100010202889_100012276601 [0,0,0,0,0,1|3,0,0]=4 3991 B14R1.4920 CC(O)CCOc1c(cccc1I)F 34a_100010186298_100012276601 [0,0,0,0,0,1|3,0,0]=4 3992 B14R1.4920 CC(O)CCOc1c(cccc1I)F 7a_100010186298_100012276601 [0,0,0,0,0,1|3,0,0]=4 3993 B14R1.4920 CC(O)CCOc1c(cccc1I)N 34a_100010084371_100012276601 [0,0,0,0,0,1|3,0,0]=4 3994 B14R1.4920 CC(O)CCOc1c(cccc1N)N 34a_200016994477_100012276601 [0,0,0,0,0,1|3,0,0]=4 3995 B14R1.4920 CC(O)COCc1c(cccc1Br)Br 34a_100010172814_100011218427 [0,0,0,0,0,1|3,0,0]=4 3996 B14R1.4920 CC(O)COCc1c(cccc1Br)Br 7a_100010172814_100011218427 [0,0,0,0,0,1|3,0,0]=4 3997 B14R1.4920 CC(O)COCc1c(cccc1Br)F 34a_100012355691_100011218427 [0,0,0,0,0,1|3,0,0]=4 3998 B14R1.4920 CC(O)COCc1c(cccc1Br)F 7a_100012355691_100011218427 [0,0,0,0,0,1|3,0,0]=4 3999 B14R1.4920 CC(O)COCc1c(cccc1Br)N 34a_100000747656_100011218427 [0,0,0,0,0,1|3,0,0]=4 4000 B14R1.4920 CC(O)COCc1c(cccc1Cl)Cl 34a_100000215722_100011218427 [0,0,0,0,0,1|3,0,0]=4 4001 B14R1.4920 CC(O)COCc1c(cccc1Cl)Cl 7a_100000215722_100011218427 [0,0,0,0,0,1|3,0,0]=4 4002 B14R1.4920 CC(O)COCc1c(cccc1Cl)F 34a_100000215723_100011218427 [0,0,0,0,0,1|3,0,0]=4 4003 B14R1.4920 CC(O)COCc1c(cccc1Cl)F 7a_100000215723_100011218427 [0,0,0,0,0,1|3,0,0]=4 4004 B14R1.4920 CC(O)COCc1c(cccc1Cl)N 34a_100011916388_100011218427 [0,0,0,0,0,1|3,0,0]=4 4005 B14R1.4920 CC(O)COCc1c(cccc1F)F 34a_100000698215_100011218427 [0,0,0,0,0,1|3,0,0]=4 4006 B14R1.4920 CC(O)COCc1c(cccc1F)F 7a_100000698215_100011218427 [0,0,0,0,0,1|3,0,0]=4 4007 B14R1.4920 CC(O)COCc1c(cccc1F)N 34a_100011846719_100011218427 [0,0,0,0,0,1|3,0,0]=4 4008 B14R1.4920 CC(O)COCc1c(cccc1I)F 34a_100010214973_100011218427 [0,0,0,0,0,1|3,0,0]=4 4009 B14R1.4920 CC(O)COCc1c(cccc1I)F 7a_100010214973_100011218427 [0,0,0,0,0,1|3,0,0]=4 4010 B14R1.4920 C[C@@H](Cl)COCc1c(cccc1Br)Cl 34a_100016084084_100010138402 [0,0,0,0,0,1|3,0,0]=4 4011 B14R1.4920 C[C@@H](Cl)COCc1c(cccc1Br)F 34a_100016084084_100012145669 [0,0,0,0,0,1|3,0,0]=4 4012 B14R1.4920 C[C@@H](Cl)COCc1c(cccc1Cl)Cl 34a_100016084084_100000187851 [0,0,0,0,0,1|3,0,0]=4 4013 B14R1.4920 C[C@@H](Cl)COCc1c(cccc1Cl)F 34a_100016084084_100000187852 [0,0,0,0,0,1|3,0,0]=4 4014 B14R1.4920 C[C@@H](Cl)COCc1c(cccc1F)F 34a_100016084084_100000698325 [0,0,0,0,0,1|3,0,0]=4 4015 B14R1.4920 C[C@@H](Cl)COCc1c(cccc1I)Br 34a_100016084084_100010146611 [0,0,0,0,0,1|3,0,0]=4 4016 B14R1.4920 C[C@@H](Cl)COCc1c(cccc1I)F 34a_100016084084_100010149602 [0,0,0,0,0,1|3,0,0]=4 4017 B14R1.4920 C[C@@H](N)COCc1c(cccc1Br)Cl 34a_100000737577_100010138402 [0,0,0,0,0,1|2,0,0]=3 4018 B14R1.4920 C[C@@H](N)COCc1c(cccc1Br)F 34a_100000737577_100012145669 [0,0,0,0,0,1|2,0,0]=3 4019 B14R1.4920 C[C@@H](N)COCc1c(cccc1Cl)Cl 34a_100000737577_100000187851 [0,0,0,0,0,1|2,0,0]=3 4020 B14R1.4920 C[C@@H](N)COCc1c(cccc1Cl)F 34a_100000737577_100000187852 [0,0,0,0,0,1|2,0,0]=3 4021 B14R1.4920 C[C@@H](N)COCc1c(cccc1F)F 34a_100000737577_100000698325 [0,0,0,0,0,1|2,0,0]=3 4022 B14R1.4920 C[C@@H](N)COCc1c(cccc1I)Br 34a_100000737577_100010146611 [0,0,0,0,0,1|2,0,0]=3 4023 B14R1.4920 C[C@@H](N)COCc1c(cccc1I)F 34a_100000737577_100010149602 [0,0,0,0,0,1|2,0,0]=3 4024 B14R1.4920 C[C@@H](N)COCc1c(cncc1Cl)Cl 34a_100000737577_200009872113 [0,0,0,0,0,1|3,0,0]=4 4025 B14R1.4920 C[C@@H](O)COCc1c(cccc1Br)Br 34a_100010172814_100009817552 [0,0,0,0,0,1|3,0,0]=4 4026 B14R1.4920 C[C@@H](O)COCc1c(cccc1Br)Br 7a_100010172814_100009817552 [0,0,0,0,0,1|3,0,0]=4 4027 B14R1.4920 C[C@@H](O)COCc1c(cccc1Br)F 34a_100012355691_100009817552 [0,0,0,0,0,1|3,0,0]=4 4028 B14R1.4920 C[C@@H](O)COCc1c(cccc1Br)F 7a_100012355691_100009817552 [0,0,0,0,0,1|3,0,0]=4 4029 B14R1.4920 C[C@@H](O)COCc1c(cccc1Br)N 34a_100000747656_100009817552 [0,0,0,0,0,1|3,0,0]=4 4030 B14R1.4920 C[C@@H](O)COCc1c(cccc1Cl)Cl 34a_100000215722_100009817552 [0,0,0,0,0,1|3,0,0]=4 4031 B14R1.4920 C[C@@H](O)COCc1c(cccc1Cl)Cl 7a_100000215722_100009817552 [0,0,0,0,0,1|3,0,0]=4 4032 B14R1.4920 C[C@@H](O)COCc1c(cccc1Cl)F 34a_100000215723_100009817552 [0,0,0,0,0,1|3,0,0]=4 4033 B14R1.4920 C[C@@H](O)COCc1c(cccc1Cl)F 7a_100000215723_100009817552 [0,0,0,0,0,1|3,0,0]=4 4034 B14R1.4920 C[C@@H](O)COCc1c(cccc1Cl)N 34a_100011916388_100009817552 [0,0,0,0,0,1|3,0,0]=4 4035 B14R1.4920 C[C@@H](O)COCc1c(cccc1F)F 34a_100000698215_100009817552 [0,0,0,0,0,1|3,0,0]=4 4036 B14R1.4920 C[C@@H](O)COCc1c(cccc1F)F 7a_100000698215_100009817552 [0,0,0,0,0,1|3,0,0]=4 4037 B14R1.4920 C[C@@H](O)COCc1c(cccc1F)N 34a_100011846719_100009817552 [0,0,0,0,0,1|3,0,0]=4 4038 B14R1.4920 C[C@@H](O)COCc1c(cccc1I)F 34a_100010214973_100009817552 [0,0,0,0,0,1|3,0,0]=4 4039 B14R1.4920 C[C@@H](O)COCc1c(cccc1I)F 7a_100010214973_100009817552 [0,0,0,0,0,1|3,0,0]=4 4040 B14R1.4920 Cc1cccc(c1C=CCC(C)C)C 271570a_100016259101_100000033847 [0,0,0,0,0,1|2,0,0]=3 4041 B14R1.4920 Cc1cccc(c1C=CCC(C)C)Cl 271570a_100016259101_100000043165 [0,0,0,0,0,1|3,0,0]=4 4042 B14R1.4920 Cc1cccc(c1C=CCC(C)C)F 271570a_100016259101_100012349962 [0,0,0,0,0,1|3,0,0]=4 4043 B14R1.4920 Cc1cccc(c1C=CCC(C)C)N 271570a_100016259101_100000684715 [0,0,0,0,0,1|3,0,0]=4 4044 B14R1.4920 Cc1cccc(c1C=CCC(C)C)O 271570a_100016259101_100000686692 [0,0,0,0,0,1|3,0,0]=4 4045 B14R1.4920 Cc1cccc(c1C=NNC(C)C)C 4a_100000741168_100000758299 [0,0,0,0,0,1|3,0,0]=4 4046 B14R1.4920 Cc1cccc(c1CNCC(=O)N)C 2230a_100000711301_100000758300 [0,0,0,0,0,1|2,0,1]=4 4047 B14R1.4920 Cc1cccc(c1CNCC(=O)N)C 34a_100000689800_100000187820 [0,0,0,0,0,1|2,0,1]=4 4048 B14R1.4920 Cc1cccc(c1CNCC(C)C)Br 207a_100000210953_100009881667 [0,0,0,0,0,1|3,0,0]=4 4049 B14R1.4920 Cc1cccc(c1CNCC(C)C)Br 2230a_100000210953_100010146847 [0,0,0,0,0,1|3,0,0]=4 4050 B14R1.4920 Cc1cccc(c1CNCC(C)C)Br 26a_100000210953_100009817157 [0,0,0,0,0,1|3,0,0]=4 4051 B14R1.4920 Cc1cccc(c1CNCC(C)C)Br 270004a_100000210953_100009881667 [0,0,0,0,0,1|3,0,0]=4 4052 B14R1.4920 Cc1cccc(c1CNCC(C)C)Br 34a_100000210953_100010146847 [0,0,0,0,0,1|3,0,0]=4 4053 B14R1.4920 Cc1cccc(c1CNCC(C)C)C 207a_100000210953_100000758299 [0,0,0,0,0,1|2,0,0]=3 4054 B14R1.4920 Cc1cccc(c1CNCC(C)C)C 2230a_100000210953_100000758300 [0,0,0,0,0,1|2,0,0]=3 4055 B14R1.4920 Cc1cccc(c1CNCC(C)C)C 270004a_100000210953_100000758299 [0,0,0,0,0,1|2,0,0]=3 4056 B14R1.4920 Cc1cccc(c1CNCC(C)C)C 270004a_100000689800_100000210432 [0,0,0,0,0,1|2,0,0]=3 4057 B14R1.4920 Cc1cccc(c1CNCC(C)C)C 34a_100000210953_100000758300 [0,0,0,0,0,1|2,0,0]=3 4058 B14R1.4920 Cc1cccc(c1CNCC(C)C)C 34a_100000689800_100000210624 [0,0,0,0,0,1|2,0,0]=3 4059 B14R1.4920 Cc1cccc(c1CNCC(C)C)Cl 207a_100000210953_100000041122 [0,0,0,0,0,1|3,0,0]=4 4060 B14R1.4920 Cc1cccc(c1CNCC(C)C)Cl 270004a_100000210953_100000041122 [0,0,0,0,0,1|3,0,0]=4 4061 B14R1.4920 Cc1cccc(c1CNCC(C)C)F 207a_100000210953_100000069827 [0,0,0,0,0,1|3,0,0]=4 4062 B14R1.4920 Cc1cccc(c1CNCC(C)C)F 2230a_100000210953_100009814554 [0,0,0,0,0,1|3,0,0]=4 4063 B14R1.4920 Cc1cccc(c1CNCC(C)C)F 270004a_100000210953_100000069827 [0,0,0,0,0,1|3,0,0]=4 4064 B14R1.4920 Cc1cccc(c1CNCC(C)C)F 270004a_100000762012_100000210432 [0,0,0,0,0,1|3,0,0]=4 4065 B14R1.4920 Cc1cccc(c1CNCC(C)C)F 34a_100000210953_100009814554 [0,0,0,0,0,1|3,0,0]=4 4066 B14R1.4920 Cc1cccc(c1CNCC(C)C)F 34a_100000762012_100000210624 [0,0,0,0,0,1|3,0,0]=4 4067 B14R1.4920 Cc1cccc(c1CNCC(C)C)I 2230a_100000210953_100010150146 [0,0,0,0,0,1|3,0,0]=4 4068 B14R1.4920 Cc1cccc(c1CNCC(C)C)I 34a_100000210953_100010150146 [0,0,0,0,0,1|3,0,0]=4 4069 B14R1.4920 Cc1cccc(c1CNCC(C)O)Br 207a_100000210904_100009881667 [0,0,0,0,0,1|3,0,0]=4 4070 B14R1.4920 Cc1cccc(c1CNCC(C)O)Br 2230a_100000210904_100010146847 [0,0,0,0,0,1|3,0,0]=4 4071 B14R1.4920 Cc1cccc(c1CNCC(C)O)Br 270004a_100000210904_100009881667 [0,0,0,0,0,1|3,0,0]=4 4072 B14R1.4920 Cc1cccc(c1CNCC(C)O)Br 34a_100000210904_100010146847 [0,0,0,0,0,1|3,0,0]=4 4073 B14R1.4920 Cc1cccc(c1CNCC(C)O)C 207a_100000210904_100000758299 [0,0,0,0,0,1|2,0,0]=3 4074 B14R1.4920 Cc1cccc(c1CNCC(C)O)C 2230a_100000210904_100000758300 [0,0,0,0,0,1|2,0,0]=3 4075 B14R1.4920 Cc1cccc(c1CNCC(C)O)C 270004a_100000210904_100000758299 [0,0,0,0,0,1|2,0,0]=3 4076 B14R1.4920 Cc1cccc(c1CNCC(C)O)C 34a_100000210904_100000758300 [0,0,0,0,0,1|2,0,0]=3 4077 B14R1.4920 Cc1cccc(c1CNCC(C)O)C 34a_100000689800_100011218427 [0,0,0,0,0,1|2,0,0]=3 4078 B14R1.4920 Cc1cccc(c1CNCC(C)O)Cl 207a_100000210904_100000041122 [0,0,0,0,0,1|3,0,0]=4 4079 B14R1.4920 Cc1cccc(c1CNCC(C)O)Cl 270004a_100000210904_100000041122 [0,0,0,0,0,1|3,0,0]=4 4080 B14R1.4920 Cc1cccc(c1CNCC(C)O)F 207a_100000210904_100000069827 [0,0,0,0,0,1|3,0,0]=4 4081 B14R1.4920 Cc1cccc(c1CNCC(C)O)F 2230a_100000210904_100009814554 [0,0,0,0,0,1|3,0,0]=4 4082 B14R1.4920 Cc1cccc(c1CNCC(C)O)F 270004a_100000210904_100000069827 [0,0,0,0,0,1|3,0,0]=4 4083 B14R1.4920 Cc1cccc(c1CNCC(C)O)F 34a_100000210904_100009814554 [0,0,0,0,0,1|3,0,0]=4 4084 B14R1.4920 Cc1cccc(c1CNCC(C)O)F 34a_100000762012_100011218427 [0,0,0,0,0,1|3,0,0]=4 4085 B14R1.4920 Cc1cccc(c1CNCC(C)O)I 2230a_100000210904_100010150146 [0,0,0,0,0,1|3,0,0]=4 4086 B14R1.4920 Cc1cccc(c1CNCC(C)O)I 34a_100000210904_100010150146 [0,0,0,0,0,1|3,0,0]=4 4087 B14R1.4920 Cc1cccc(c1CNCC(F)F)C 207a_100000765723_100000758299 [0,0,0,0,0,1|3,0,0]=4 4088 B14R1.4920 Cc1cccc(c1CNCC(F)F)C 270004a_100000765723_100000758299 [0,0,0,0,0,1|3,0,0]=4 4089 B14R1.4920 Cc1cccc(c1CNCC(F)F)C 34a_100000689800_100011934356 [0,0,0,0,0,1|3,0,0]=4 4090 B14R1.4920 Cc1cccc(c1CNCC(F)F)C 34a_100000765723_100000758300 [0,0,0,0,0,1|3,0,0]=4 4091 B14R1.4920 Cc1cccc(c1CNC[C@@H](C)O)C 34a_100000689800_100009817552 [0,0,0,0,0,1|2,0,0]=3 4092 B14R1.4920 Cc1cccc(c1CNC[C@@H](C)O)F 34a_100000762012_100009817552 [0,0,0,0,0,1|3,0,0]=4 4093 B14R1.4920 Cc1cccc(c1COCC(=O)N)C 34a_100011933981_100000187820 [0,0,0,0,0,1|1,0,1]=3 4094 B14R1.4920 Cc1cccc(c1COCC(=O)N)C 7a_100011933981_100000187820 [0,0,0,0,0,1|1,0,1]=3 4095 B14R1.4920 Cc1cccc(c1COCC(=O)N)Cl 34a_100000082531_100000187820 [0,0,0,0,0,1|2,0,1]=4 4096 B14R1.4920 Cc1cccc(c1COCC(=O)N)Cl 7a_100000082531_100000187820 [0,0,0,0,0,1|2,0,1]=4 4097 B14R1.4920 Cc1cccc(c1COCC(=O)N)F 34a_100000057874_100000187820 [0,0,0,0,0,1|2,0,1]=4 4098 B14R1.4920 Cc1cccc(c1COCC(=O)N)F 7a_100000057874_100000187820 [0,0,0,0,0,1|2,0,1]=4 4099 B14R1.4920 Cc1cccc(c1COCC(=O)[O-])C 34a_100011933981_100020667443 [0,0,0,0,0,1|2,0,1]=4 4100 B14R1.4920 Cc1cccc(c1COCC(C)Br)Br 34a_100012180447_100010146847 [0,0,0,0,0,1|2,0,0]=3 4101 B14R1.4920 Cc1cccc(c1COCC(C)Br)C 34a_100012180447_100000758300 [0,0,0,0,0,1|1,0,0]=2 4102 B14R1.4920 Cc1cccc(c1COCC(C)Br)F 34a_100012180447_100009814554 [0,0,0,0,0,1|2,0,0]=3 4103 B14R1.4920 Cc1cccc(c1COCC(C)Br)I 34a_100012180447_100010150146 [0,0,0,0,0,1|2,0,0]=3 4104 B14R1.4920 Cc1cccc(c1COCC(C)C)Br 34a_100000210257_100010146847 [0,0,0,0,0,1|2,0,0]=3 4105 B14R1.4920 Cc1cccc(c1COCC(C)C)C 34a_100000210257_100000758300 [0,0,0,0,0,1|1,0,0]=2 4106 B14R1.4920 Cc1cccc(c1COCC(C)C)C 34a_100011933981_100000210624 [0,0,0,0,0,1|1,0,0]=2 4107 B14R1.4920 Cc1cccc(c1COCC(C)C)C 7a_100011933981_100000210760 [0,0,0,0,0,1|1,0,0]=2 4108 B14R1.4920 Cc1cccc(c1COCC(C)C)Cl 34a_100000082531_100000210624 [0,0,0,0,0,1|2,0,0]=3 4109 B14R1.4920 Cc1cccc(c1COCC(C)C)Cl 7a_100000082531_100000210760 [0,0,0,0,0,1|2,0,0]=3 4110 B14R1.4920 Cc1cccc(c1COCC(C)C)F 34a_100000057874_100000210624 [0,0,0,0,0,1|2,0,0]=3 4111 B14R1.4920 Cc1cccc(c1COCC(C)C)F 34a_100000210257_100009814554 [0,0,0,0,0,1|2,0,0]=3 4112 B14R1.4920 Cc1cccc(c1COCC(C)C)F 7a_100000057874_100000210760 [0,0,0,0,0,1|2,0,0]=3 4113 B14R1.4920 Cc1cccc(c1COCC(C)C)I 34a_100000210257_100010150146 [0,0,0,0,0,1|2,0,0]=3 4114 B14R1.4920 Cc1cccc(c1COCC(C)F)Br 34a_100015925927_100010146847 [0,0,0,0,0,1|2,0,0]=3 4115 B14R1.4920 Cc1cccc(c1COCC(C)F)C 34a_100015925927_100000758300 [0,0,0,0,0,1|1,0,0]=2 4116 B14R1.4920 Cc1cccc(c1COCC(C)F)F 34a_100015925927_100009814554 [0,0,0,0,0,1|2,0,0]=3 4117 B14R1.4920 Cc1cccc(c1COCC(C)F)I 34a_100015925927_100010150146 [0,0,0,0,0,1|2,0,0]=3 4118 B14R1.4920 Cc1cccc(c1COCC(C)O)C 34a_100011933981_100011218427 [0,0,0,0,0,1|1,0,0]=2 4119 B14R1.4920 Cc1cccc(c1COCC(C)O)C 7a_100011933981_100011218427 [0,0,0,0,0,1|1,0,0]=2 4120 B14R1.4920 Cc1cccc(c1COCC(C)O)Cl 34a_100000082531_100011218427 [0,0,0,0,0,1|2,0,0]=3 4121 B14R1.4920 Cc1cccc(c1COCC(C)O)Cl 7a_100000082531_100011218427 [0,0,0,0,0,1|2,0,0]=3 4122 B14R1.4920 Cc1cccc(c1COCC(C)O)F 34a_100000057874_100011218427 [0,0,0,0,0,1|2,0,0]=3 4123 B14R1.4920 Cc1cccc(c1COCC(C)O)F 7a_100000057874_100011218427 [0,0,0,0,0,1|2,0,0]=3 4124 B14R1.4920 Cc1cccc(c1COCC(F)F)Br 34a_100000743014_100010146847 [0,0,0,0,0,1|3,0,0]=4 4125 B14R1.4920 Cc1cccc(c1COCC(F)F)C 34a_100000743014_100000758300 [0,0,0,0,0,1|2,0,0]=3 4126 B14R1.4920 Cc1cccc(c1COCC(F)F)C 34a_100011933981_100011934356 [0,0,0,0,0,1|2,0,0]=3 4127 B14R1.4920 Cc1cccc(c1COCC(F)F)C 7a_100011933981_100011934356 [0,0,0,0,0,1|2,0,0]=3 4128 B14R1.4920 Cc1cccc(c1COCC(F)F)Cl 34a_100000082531_100011934356 [0,0,0,0,0,1|3,0,0]=4 4129 B14R1.4920 Cc1cccc(c1COCC(F)F)Cl 7a_100000082531_100011934356 [0,0,0,0,0,1|3,0,0]=4 4130 B14R1.4920 Cc1cccc(c1COCC(F)F)F 34a_100000057874_100011934356 [0,0,0,0,0,1|3,0,0]=4 4131 B14R1.4920 Cc1cccc(c1COCC(F)F)F 34a_100000743014_100009814554 [0,0,0,0,0,1|3,0,0]=4 4132 B14R1.4920 Cc1cccc(c1COCC(F)F)F 7a_100000057874_100011934356 [0,0,0,0,0,1|3,0,0]=4 4133 B14R1.4920 Cc1cccc(c1COCC(F)F)I 34a_100000743014_100010150146 [0,0,0,0,0,1|3,0,0]=4 4134 B14R1.4920 Cc1cccc(c1COC[C@@H](C)Cl)Br 34a_100016084084_100010146847 [0,0,0,0,0,1|2,0,0]=3 4135 B14R1.4920 Cc1cccc(c1COC[C@@H](C)Cl)C 34a_100016084084_100000758300 [0,0,0,0,0,1|1,0,0]=2 4136 B14R1.4920 Cc1cccc(c1COC[C@@H](C)Cl)F 34a_100016084084_100009814554 [0,0,0,0,0,1|2,0,0]=3 4137 B14R1.4920 Cc1cccc(c1COC[C@@H](C)Cl)I 34a_100016084084_100010150146 [0,0,0,0,0,1|2,0,0]=3 4138 B14R1.4920 Cc1cccc(c1COC[C@@H](C)N)Br 34a_100000737577_100010146847 [0,0,0,0,0,1|1,0,0]=2 4139 B14R1.4920 Cc1cccc(c1COC[C@@H](C)N)C 34a_100000737577_100000758300 [0,0,0,0,0,1|0,0,0]=1 4140 B14R1.4920 Cc1cccc(c1COC[C@@H](C)N)F 34a_100000737577_100009814554 [0,0,0,0,0,1|1,0,0]=2 4141 B14R1.4920 Cc1cccc(c1COC[C@@H](C)N)I 34a_100000737577_100010150146 [0,0,0,0,0,1|1,0,0]=2 4142 B14R1.4920 Cc1cccc(c1COC[C@@H](C)O)C 34a_100011933981_100009817552 [0,0,0,0,0,1|1,0,0]=2 4143 B14R1.4920 Cc1cccc(c1COC[C@@H](C)O)C 7a_100011933981_100009817552 [0,0,0,0,0,1|1,0,0]=2 4144 B14R1.4920 Cc1cccc(c1COC[C@@H](C)O)Cl 34a_100000082531_100009817552 [0,0,0,0,0,1|2,0,0]=3 4145 B14R1.4920 Cc1cccc(c1COC[C@@H](C)O)Cl 7a_100000082531_100009817552 [0,0,0,0,0,1|2,0,0]=3 4146 B14R1.4920 Cc1cccc(c1COC[C@@H](C)O)F 34a_100000057874_100009817552 [0,0,0,0,0,1|2,0,0]=3 4147 B14R1.4920 Cc1cccc(c1COC[C@@H](C)O)F 7a_100000057874_100009817552 [0,0,0,0,0,1|2,0,0]=3 4148 B14R1.4920 Cc1cccc(c1COC[N+](=O)[O-])C 34a_100011933981_100000761209 [0,0,0,0,0,1|3,0,0]=4 4149 B14R1.4920 Cc1cccc(c1CSCC(=O)N)C 62a_100000747473_100000758300 [0,0,0,0,0,1|1,1,1]=4 4150 B14R1.4920 Cc1cccc(c1CSCC(=O)N)C 62a_100000758300_100000747473 [0,0,0,0,0,1|1,1,1]=4 4151 B14R1.4920 Cc1cccc(c1CSCC(C)C)Br 62a_100000210624_100010146847 [0,0,0,0,0,1|2,1,0]=4 4152 B14R1.4920 Cc1cccc(c1CSCC(C)C)Br 62a_100010146847_100000210760 [0,0,0,0,0,1|2,1,0]=4 4153 B14R1.4920 Cc1cccc(c1CSCC(C)C)C 62a_100000210624_100000758300 [0,0,0,0,0,1|1,1,0]=3 4154 B14R1.4920 Cc1cccc(c1CSCC(C)C)C 62a_100000758300_100000210760 [0,0,0,0,0,1|1,1,0]=3 4155 B14R1.4920 Cc1cccc(c1CSCC(C)C)F 62a_100000210624_100009814554 [0,0,0,0,0,1|2,1,0]=4 4156 B14R1.4920 Cc1cccc(c1CSCC(C)C)F 62a_100009814554_100000210760 [0,0,0,0,0,1|2,1,0]=4 4157 B14R1.4920 Cc1cccc(c1CSCC(C)C)I 62a_100000210624_100010150146 [0,0,0,0,0,1|2,1,0]=4 4158 B14R1.4920 Cc1cccc(c1CSCC(C)C)I 62a_100010150146_100000210760 [0,0,0,0,0,1|2,1,0]=4 4159 B14R1.4920 Cc1cccc(c1CSCC(C)O)Br 62a_100010146847_100011218427 [0,0,0,0,0,1|2,1,0]=4 4160 B14R1.4920 Cc1cccc(c1CSCC(C)O)Br 62a_100011218427_100010146847 [0,0,0,0,0,1|2,1,0]=4 4161 B14R1.4920 Cc1cccc(c1CSCC(C)O)C 62a_100000758300_100011218427 [0,0,0,0,0,1|1,1,0]=3 4162 B14R1.4920 Cc1cccc(c1CSCC(C)O)C 62a_100011218427_100000758300 [0,0,0,0,0,1|1,1,0]=3 4163 B14R1.4920 Cc1cccc(c1CSCC(C)O)F 62a_100009814554_100011218427 [0,0,0,0,0,1|2,1,0]=4 4164 B14R1.4920 Cc1cccc(c1CSCC(C)O)F 62a_100011218427_100009814554 [0,0,0,0,0,1|2,1,0]=4 4165 B14R1.4920 Cc1cccc(c1CSCC(C)O)I 62a_100010150146_100011218427 [0,0,0,0,0,1|2,1,0]=4 4166 B14R1.4920 Cc1cccc(c1CSCC(C)O)I 62a_100011218427_100010150146 [0,0,0,0,0,1|2,1,0]=4 4167 B14R1.4920 Cc1cccc(c1CSCC(F)F)C 62a_100000758300_100011934356 [0,0,0,0,0,1|2,1,0]=4 4168 B14R1.4920 Cc1cccc(c1CSCC(F)F)C 62a_100011934356_100000758300 [0,0,0,0,0,1|2,1,0]=4 4169 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)Br 62a_100009817552_100010146847 [0,0,0,0,0,1|2,1,0]=4 4170 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)Br 62a_100010146847_100009817552 [0,0,0,0,0,1|2,1,0]=4 4171 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)C 62a_100000758300_100009817552 [0,0,0,0,0,1|1,1,0]=3 4172 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)C 62a_100009817552_100000758300 [0,0,0,0,0,1|1,1,0]=3 4173 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)F 62a_100009814554_100009817552 [0,0,0,0,0,1|2,1,0]=4 4174 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)F 62a_100009817552_100009814554 [0,0,0,0,0,1|2,1,0]=4 4175 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)I 62a_100009817552_100010150146 [0,0,0,0,0,1|2,1,0]=4 4176 B14R1.4920 Cc1cccc(c1CSC[C@@H](C)O)I 62a_100010150146_100009817552 [0,0,0,0,0,1|2,1,0]=4 4177 B14R1.4920 Cc1cccc(c1NCCC(=O)N)C 34a_100000185769_100000731001 [0,0,0,0,0,1|2,0,1]=4 4178 B14R1.4920 Cc1cccc(c1NCCC(C)C)Br 34a_100011834072_100000210312 [0,0,0,0,0,1|3,0,0]=4 4179 B14R1.4920 Cc1cccc(c1NCCC(C)C)C 34a_100000185769_100000210312 [0,0,0,0,0,1|2,0,0]=3 4180 B14R1.4920 Cc1cccc(c1NCCC(C)C)Cl 34a_100000756524_100000210312 [0,0,0,0,0,1|3,0,0]=4 4181 B14R1.4920 Cc1cccc(c1NCCC(C)C)F 34a_100000766463_100000210312 [0,0,0,0,0,1|3,0,0]=4 4182 B14R1.4920 Cc1cccc(c1NCCC(C)C)O 34a_100000743429_100000210312 [0,0,0,0,0,1|3,0,0]=4 4183 B14R1.4920 Cc1cccc(c1NCCC(C)O)Br 34a_100011834072_100012276601 [0,0,0,0,0,1|3,0,0]=4 4184 B14R1.4920 Cc1cccc(c1NCCC(C)O)C 34a_100000185769_100012276601 [0,0,0,0,0,1|2,0,0]=3 4185 B14R1.4920 Cc1cccc(c1NCCC(C)O)Cl 34a_100000756524_100012276601 [0,0,0,0,0,1|3,0,0]=4 4186 B14R1.4920 Cc1cccc(c1NCCC(C)O)F 34a_100000766463_100012276601 [0,0,0,0,0,1|3,0,0]=4 4187 B14R1.4920 Cc1cccc(c1NCCC(C)O)O 34a_100000743429_100012276601 [0,0,0,0,0,1|3,0,0]=4 4188 B14R1.4920 Cc1cccc(c1NCOC(C)C)Br 34a_100011834072_100000709892 [0,0,0,0,0,1|3,0,0]=4 4189 B14R1.4920 Cc1cccc(c1NCOC(C)C)C 34a_100000185769_100000709892 [0,0,0,0,0,1|2,0,0]=3 4190 B14R1.4920 Cc1cccc(c1NCOC(C)C)Cl 34a_100000756524_100000709892 [0,0,0,0,0,1|3,0,0]=4 4191 B14R1.4920 Cc1cccc(c1NCOC(C)C)F 34a_100000766463_100000709892 [0,0,0,0,0,1|3,0,0]=4 4192 B14R1.4920 Cc1cccc(c1NCOC(C)C)O 34a_100000743429_100000709892 [0,0,0,0,0,1|3,0,0]=4 4193 B14R1.4920 Cc1cccc(c1NN=CC(C)C)C 4a_100016987787_100000210432 [0,0,0,0,0,1|2,0,1]=4 4194 B14R1.4920 Cc1cccc(c1OCCC(=O)N)Br 34a_100009817157_100000731001 [0,0,0,0,0,1|2,0,1]=4 4195 B14R1.4920 Cc1cccc(c1OCCC(=O)N)Br 7a_100009817157_100000744528 [0,0,0,0,0,1|2,0,1]=4 4196 B14R1.4920 Cc1cccc(c1OCCC(=O)N)C 34a_100000210341_100000731001 [0,0,0,0,0,1|1,0,1]=3 4197 B14R1.4920 Cc1cccc(c1OCCC(=O)N)C 7a_100000210341_100000744528 [0,0,0,0,0,1|1,0,1]=3 4198 B14R1.4920 Cc1cccc(c1OCCC(=O)N)Cl 34a_100000033731_100000731001 [0,0,0,0,0,1|2,0,1]=4 4199 B14R1.4920 Cc1cccc(c1OCCC(=O)N)Cl 7a_100000033731_100000744528 [0,0,0,0,0,1|2,0,1]=4 4200 B14R1.4920 Cc1cccc(c1OCCC(=O)N)F 34a_100011659162_100000731001 [0,0,0,0,0,1|2,0,1]=4 4201 B14R1.4920 Cc1cccc(c1OCCC(=O)N)F 7a_100011659162_100000744528 [0,0,0,0,0,1|2,0,1]=4 4202 B14R1.4920 Cc1cccc(c1OCCC(=O)N)N 34a_100000756359_100000731001 [0,0,0,0,0,1|2,0,1]=4 4203 B14R1.4920 Cc1cccc(c1OCCC(=O)N)N 7a_100000756359_100000744528 [0,0,0,0,0,1|2,0,1]=4 4204 B14R1.4920 Cc1cccc(c1OCCC(=O)[13CH3])C 1458a_200000738035_200025704644 [0,0,0,0,0,1|1,0,1]=3 4205 B14R1.4920 Cc1cccc(c1OCCC(C)C)Br 34a_100009817157_100000210312 [0,0,0,0,0,1|2,0,0]=3 4206 B14R1.4920 Cc1cccc(c1OCCC(C)C)Br 7a_100009817157_100000210626 [0,0,0,0,0,1|2,0,0]=3 4207 B14R1.4920 Cc1cccc(c1OCCC(C)C)C 34a_100000210341_100000210312 [0,0,0,0,0,1|1,0,0]=2 4208 B14R1.4920 Cc1cccc(c1OCCC(C)C)C 7a_100000210341_100000210626 [0,0,0,0,0,1|1,0,0]=2 4209 B14R1.4920 Cc1cccc(c1OCCC(C)C)Cl 34a_100000033731_100000210312 [0,0,0,0,0,1|2,0,0]=3 4210 B14R1.4920 Cc1cccc(c1OCCC(C)C)Cl 7a_100000033731_100000210626 [0,0,0,0,0,1|2,0,0]=3 4211 B14R1.4920 Cc1cccc(c1OCCC(C)C)F 34a_100011659162_100000210312 [0,0,0,0,0,1|2,0,0]=3 4212 B14R1.4920 Cc1cccc(c1OCCC(C)C)F 7a_100011659162_100000210626 [0,0,0,0,0,1|2,0,0]=3 4213 B14R1.4920 Cc1cccc(c1OCCC(C)C)N 34a_100000756359_100000210312 [0,0,0,0,0,1|2,0,0]=3 4214 B14R1.4920 Cc1cccc(c1OCCC(C)C)N 7a_100000756359_100000210626 [0,0,0,0,0,1|2,0,0]=3 4215 B14R1.4920 Cc1cccc(c1OCCC(C)O)Br 34a_100009817157_100012276601 [0,0,0,0,0,1|2,0,0]=3 4216 B14R1.4920 Cc1cccc(c1OCCC(C)O)Br 7a_100009817157_100012276601 [0,0,0,0,0,1|2,0,0]=3 4217 B14R1.4920 Cc1cccc(c1OCCC(C)O)C 34a_100000210341_100012276601 [0,0,0,0,0,1|1,0,0]=2 4218 B14R1.4920 Cc1cccc(c1OCCC(C)O)C 7a_100000210341_100012276601 [0,0,0,0,0,1|1,0,0]=2 4219 B14R1.4920 Cc1cccc(c1OCCC(C)O)Cl 34a_100000033731_100012276601 [0,0,0,0,0,1|2,0,0]=3 4220 B14R1.4920 Cc1cccc(c1OCCC(C)O)Cl 7a_100000033731_100012276601 [0,0,0,0,0,1|2,0,0]=3 4221 B14R1.4920 Cc1cccc(c1OCCC(C)O)F 34a_100011659162_100012276601 [0,0,0,0,0,1|2,0,0]=3 4222 B14R1.4920 Cc1cccc(c1OCCC(C)O)F 7a_100011659162_100012276601 [0,0,0,0,0,1|2,0,0]=3 4223 B14R1.4920 Cc1cccc(c1OCCC(C)O)N 34a_100000756359_100012276601 [0,0,0,0,0,1|2,0,0]=3 4224 B14R1.4920 Cc1cccc(c1OCCC(C)O)N 7a_100000756359_100012276601 [0,0,0,0,0,1|2,0,0]=3 4225 B14R1.4920 Cc1cccc(c1OCCN(C)C)Br 7a_100009817157_100000755713 [0,0,0,0,0,1|3,0,0]=4 4226 B14R1.4920 Cc1cccc(c1OCCN(C)C)C 2230a_100102631434_100000184555 [0,0,0,0,0,1|2,0,0]=3 4227 B14R1.4920 Cc1cccc(c1OCCN(C)C)C 269982a_100102631434_100000184555 [0,0,0,0,0,1|2,0,0]=3 4228 B14R1.4920 Cc1cccc(c1OCCN(C)C)C 7a_100000210341_100000755713 [0,0,0,0,0,1|2,0,0]=3 4229 B14R1.4920 Cc1cccc(c1OCCN(C)C)Cl 7a_100000033731_100000755713 [0,0,0,0,0,1|3,0,0]=4 4230 B14R1.4920 Cc1cccc(c1OCCN(C)C)F 7a_100011659162_100000755713 [0,0,0,0,0,1|3,0,0]=4 4231 B14R1.4920 Cc1cccc(c1OCCN(C)C)N 7a_100000756359_100000755713 [0,0,0,0,0,1|3,0,0]=4 4232 B14R1.4920 Cc1cccc(c1OCOC(C)C)Br 34a_100009817157_100000709892 [0,0,0,0,0,1|2,0,0]=3 4233 B14R1.4920 Cc1cccc(c1OCOC(C)C)C 34a_100000210341_100000709892 [0,0,0,0,0,1|1,0,0]=2 4234 B14R1.4920 Cc1cccc(c1OCOC(C)C)Cl 34a_100000033731_100000709892 [0,0,0,0,0,1|2,0,0]=3 4235 B14R1.4920 Cc1cccc(c1OCOC(C)C)F 34a_100011659162_100000709892 [0,0,0,0,0,1|2,0,0]=3 4236 B14R1.4920 Cc1cccc(c1OCOC(C)C)N 34a_100000756359_100000709892 [0,0,0,0,0,1|2,0,0]=3 4237 B14R1.4920 Cc1cccc(c1SCCC(=O)N)C 62a_100000033847_100000744528 [0,0,0,0,0,1|1,1,1]=4 4238 B14R1.4920 Cc1cccc(c1SCCC(=O)N)C 62a_100000744528_100000033847 [0,0,0,0,0,1|1,1,1]=4 4239 B14R1.4920 Cc1cccc(c1SCCC(C)C)Br 62a_100000210312_100010141302 [0,0,0,0,0,1|2,1,0]=4 4240 B14R1.4920 Cc1cccc(c1SCCC(C)C)Br 62a_100010141302_100000210312 [0,0,0,0,0,1|2,1,0]=4 4241 B14R1.4920 Cc1cccc(c1SCCC(C)C)C 62a_100000033847_100000210312 [0,0,0,0,0,1|1,1,0]=3 4242 B14R1.4920 Cc1cccc(c1SCCC(C)C)C 62a_100000210312_100000033847 [0,0,0,0,0,1|1,1,0]=3 4243 B14R1.4920 Cc1cccc(c1SCCC(C)C)Cl 62a_100000043165_100000210312 [0,0,0,0,0,1|2,1,0]=4 4244 B14R1.4920 Cc1cccc(c1SCCC(C)C)Cl 62a_100000210312_100000043165 [0,0,0,0,0,1|2,1,0]=4 4245 B14R1.4920 Cc1cccc(c1SCCC(C)C)F 62a_100000210312_100011218421 [0,0,0,0,0,1|2,1,0]=4 4246 B14R1.4920 Cc1cccc(c1SCCC(C)C)F 62a_100011218421_100000210312 [0,0,0,0,0,1|2,1,0]=4 4247 B14R1.4920 Cc1cccc(c1SCCC(C)C)N 62a_100000210312_100000684715 [0,0,0,0,0,1|2,1,0]=4 4248 B14R1.4920 Cc1cccc(c1SCCC(C)C)N 62a_100000684715_100000210312 [0,0,0,0,0,1|2,1,0]=4 4249 B14R1.4920 Cc1cccc(c1SCCC(C)C)O 62a_100000210312_100000686692 [0,0,0,0,0,1|2,1,0]=4 4250 B14R1.4920 Cc1cccc(c1SCCC(C)C)O 62a_100000686692_100000210312 [0,0,0,0,0,1|2,1,0]=4 4251 B14R1.4920 Cc1cccc(c1SCCC(C)O)Br 62a_100010141302_100012276601 [0,0,0,0,0,1|2,1,0]=4 4252 B14R1.4920 Cc1cccc(c1SCCC(C)O)Br 62a_100012276601_100010141302 [0,0,0,0,0,1|2,1,0]=4 4253 B14R1.4920 Cc1cccc(c1SCCC(C)O)C 62a_100000033847_100012276601 [0,0,0,0,0,1|1,1,0]=3 4254 B14R1.4920 Cc1cccc(c1SCCC(C)O)C 62a_100012276601_100000033847 [0,0,0,0,0,1|1,1,0]=3 4255 B14R1.4920 Cc1cccc(c1SCCC(C)O)Cl 62a_100000043165_100012276601 [0,0,0,0,0,1|2,1,0]=4 4256 B14R1.4920 Cc1cccc(c1SCCC(C)O)Cl 62a_100012276601_100000043165 [0,0,0,0,0,1|2,1,0]=4 4257 B14R1.4920 Cc1cccc(c1SCCC(C)O)F 62a_100011218421_100012276601 [0,0,0,0,0,1|2,1,0]=4 4258 B14R1.4920 Cc1cccc(c1SCCC(C)O)F 62a_100012276601_100011218421 [0,0,0,0,0,1|2,1,0]=4 4259 B14R1.4920 Cc1cccc(c1SCCC(C)O)N 62a_100000684715_100012276601 [0,0,0,0,0,1|2,1,0]=4 4260 B14R1.4920 Cc1cccc(c1SCCC(C)O)N 62a_100012276601_100000684715 [0,0,0,0,0,1|2,1,0]=4 4261 B14R1.4920 Cc1cccc(c1SCCC(C)O)O 62a_100000686692_100012276601 [0,0,0,0,0,1|2,1,0]=4 4262 B14R1.4920 Cc1cccc(c1SCCC(C)O)O 62a_100012276601_100000686692 [0,0,0,0,0,1|2,1,0]=4 4263 B14R1.4920 Cc1cccc(c1SCCN(C)C)C 62a_100000033847_100000755713 [0,0,0,0,0,1|2,1,0]=4 4264 B14R1.4920 Cc1cccc(c1SCOC(C)C)Br 62a_100000709892_100010141302 [0,0,0,0,0,1|2,1,0]=4 4265 B14R1.4920 Cc1cccc(c1SCOC(C)C)Br 62a_100010141302_100000709892 [0,0,0,0,0,1|2,1,0]=4 4266 B14R1.4920 Cc1cccc(c1SCOC(C)C)C 62a_100000033847_100000709892 [0,0,0,0,0,1|1,1,0]=3 4267 B14R1.4920 Cc1cccc(c1SCOC(C)C)C 62a_100000709892_100000033847 [0,0,0,0,0,1|1,1,0]=3 4268 B14R1.4920 Cc1cccc(c1SCOC(C)C)Cl 62a_100000043165_100000709892 [0,0,0,0,0,1|2,1,0]=4 4269 B14R1.4920 Cc1cccc(c1SCOC(C)C)Cl 62a_100000709892_100000043165 [0,0,0,0,0,1|2,1,0]=4 4270 B14R1.4920 Cc1cccc(c1SCOC(C)C)F 62a_100000709892_100011218421 [0,0,0,0,0,1|2,1,0]=4 4271 B14R1.4920 Cc1cccc(c1SCOC(C)C)F 62a_100011218421_100000709892 [0,0,0,0,0,1|2,1,0]=4 4272 B14R1.4920 Cc1cccc(c1SCOC(C)C)N 62a_100000684715_100000709892 [0,0,0,0,0,1|2,1,0]=4 4273 B14R1.4920 Cc1cccc(c1SCOC(C)C)N 62a_100000709892_100000684715 [0,0,0,0,0,1|2,1,0]=4 4274 B14R1.4920 Cc1cccc(c1SCOC(C)C)O 62a_100000686692_100000709892 [0,0,0,0,0,1|2,1,0]=4 4275 B14R1.4920 Cc1cccc(c1SCOC(C)C)O 62a_100000709892_100000686692 [0,0,0,0,0,1|2,1,0]=4 4276 B14R1.4920 Cc1ccnc(c1C=CCC(C)C)C 271570a_100016259101_100012000501 [0,0,0,0,0,1|3,0,0]=4 4277 B14R1.4920 Cc1ccnc(c1OCCC(=O)N)C 34a_100011934651_100000731001 [0,0,0,0,0,1|2,0,1]=4 4278 B14R1.4920 Cc1ccnc(c1OCCC(=O)N)C 7a_100011934651_100000744528 [0,0,0,0,0,1|2,0,1]=4 4279 B14R1.4920 Cc1ccnc(c1OCCC(C)C)C 34a_100011934651_100000210312 [0,0,0,0,0,1|2,0,0]=3 4280 B14R1.4920 Cc1ccnc(c1OCCC(C)C)C 7a_100011934651_100000210626 [0,0,0,0,0,1|2,0,0]=3 4281 B14R1.4920 Cc1ccnc(c1OCCC(C)C)Cl 34a_100000696282_100000210312 [0,0,0,0,0,1|3,0,0]=4 4282 B14R1.4920 Cc1ccnc(c1OCCC(C)C)Cl 7a_100000696282_100000210626 [0,0,0,0,0,1|3,0,0]=4 4283 B14R1.4920 Cc1ccnc(c1OCCC(C)O)C 34a_100011934651_100012276601 [0,0,0,0,0,1|2,0,0]=3 4284 B14R1.4920 Cc1ccnc(c1OCCC(C)O)C 7a_100011934651_100012276601 [0,0,0,0,0,1|2,0,0]=3 4285 B14R1.4920 Cc1ccnc(c1OCCC(C)O)Cl 34a_100000696282_100012276601 [0,0,0,0,0,1|3,0,0]=4 4286 B14R1.4920 Cc1ccnc(c1OCCC(C)O)Cl 7a_100000696282_100012276601 [0,0,0,0,0,1|3,0,0]=4 4287 B14R1.4920 Cc1ccnc(c1OCCN(C)C)C 7a_100011934651_100000755713 [0,0,0,0,0,1|3,0,0]=4 4288 B14R1.4920 Cc1ccnc(c1OCOC(C)C)C 34a_100011934651_100000709892 [0,0,0,0,0,1|2,0,0]=3 4289 B14R1.4920 Cc1ccnc(c1OCOC(C)C)Cl 34a_100000696282_100000709892 [0,0,0,0,0,1|3,0,0]=4 4290 B14R1.4920 Cc1ccnc(c1SCCC(C)C)C 62a_100000210312_100012000501 [0,0,0,0,0,1|2,1,0]=4 4291 B14R1.4920 Cc1ccnc(c1SCCC(C)C)C 62a_100012000501_100000210312 [0,0,0,0,0,1|2,1,0]=4 4292 B14R1.4920 Cc1ccnc(c1SCCC(C)O)C 62a_100012000501_100012276601 [0,0,0,0,0,1|2,1,0]=4 4293 B14R1.4920 Cc1ccnc(c1SCCC(C)O)C 62a_100012276601_100012000501 [0,0,0,0,0,1|2,1,0]=4 4294 B14R1.4920 Cc1ccnc(c1SCOC(C)C)C 62a_100000709892_100012000501 [0,0,0,0,0,1|2,1,0]=4 4295 B14R1.4920 Cc1ccnc(c1SCOC(C)C)C 62a_100012000501_100000709892 [0,0,0,0,0,1|2,1,0]=4 4296 B14R1.4920 Cc1cncc(c1C=CCC(C)C)C 271570a_100016259101_100009817138 [0,0,0,0,0,1|3,0,0]=4 4297 B14R1.4920 Cc1cncc(c1SCCC(C)C)C 62a_100000210312_100009817138 [0,0,0,0,0,1|2,1,0]=4 4298 B14R1.4920 Cc1cncc(c1SCCC(C)C)C 62a_100009817138_100000210312 [0,0,0,0,0,1|2,1,0]=4 4299 B14R1.4920 Cc1cncc(c1SCCC(C)O)C 62a_100009817138_100012276601 [0,0,0,0,0,1|2,1,0]=4 4300 B14R1.4920 Cc1cncc(c1SCCC(C)O)C 62a_100012276601_100009817138 [0,0,0,0,0,1|2,1,0]=4 4301 B14R1.4920 Cc1cncc(c1SCOC(C)C)C 62a_100000709892_100009817138 [0,0,0,0,0,1|2,1,0]=4 4302 B14R1.4920 Cc1cncc(c1SCOC(C)C)C 62a_100009817138_100000709892 [0,0,0,0,0,1|2,1,0]=4 4303 B14R1.4920 Cc1ncnc(c1OCCC(C)C)C 34a_100009878406_100000210312 [0,0,0,0,0,1|3,0,0]=4 4304 B14R1.4920 Cc1ncnc(c1OCCC(C)C)C 7a_100009878406_100000210626 [0,0,0,0,0,1|3,0,0]=4 4305 B14R1.4920 Cc1ncnc(c1OCCC(C)O)C 34a_100009878406_100012276601 [0,0,0,0,0,1|3,0,0]=4 4306 B14R1.4920 Cc1ncnc(c1OCCC(C)O)C 7a_100009878406_100012276601 [0,0,0,0,0,1|3,0,0]=4 4307 B14R1.4920 Cc1ncnc(c1OCOC(C)C)C 34a_100009878406_100000709892 [0,0,0,0,0,1|3,0,0]=4 4308 B14R1.4920 Cc1occc(=O)c1OCCC(C)C 34a_100000031901_100000210312 [0,0,0,0,0,1|3,0,0]=4 4309 B14R1.4920 Cc1occc(=O)c1OCCC(C)O 34a_100000031901_100012276601 [0,0,0,0,0,1|3,0,0]=4 4310 B14R1.4920 Cc1occc(=O)c1OCOC(C)C 34a_100000031901_100000709892 [0,0,0,0,0,1|3,0,0]=4 4311 B11R0.140 C/C=C/C=CC(=NNCCC)C 4a_100000740057_100016268696 [1,0,1,0,0,0|2,0,0]=4 4312 B11R1.17 C#CCOc1ccccc1C 34a_100000210338_100000184674 [2,0,0,0,0,0|0,0,2]=4 4313 B11R1.17 C#CCOc1ccccc1C 7a_100000210338_100000038162 [2,0,0,0,0,0|0,0,2]=4 4314 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [2,0,0,0,0,0|0,0,2]=4 4315 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [2,0,0,0,0,0|0,0,2]=4 4316 B11R1.17 CCCCc1cccc[n+]1C 271570a_100020621405_100000212160 [2,0,0,0,0,0|2,0,0]=4 4317 B11R1.17 CCCCc1ccccc1Br 271570a_100020621405_100000695589 [2,0,0,0,0,0|2,0,0]=4 4318 B11R1.17 CCCCc1ccccc1C 271570a_100020621405_100000210755 [2,0,0,0,0,0|1,0,0]=3 4319 B11R1.17 CCCCc1ccccc1Cl 271570a_100020621405_100000764095 [2,0,0,0,0,0|2,0,0]=4 4320 B11R1.17 CCCCc1ccccc1F 271570a_100020621405_100011215700 [2,0,0,0,0,0|2,0,0]=4 4321 B11R1.17 CCCCc1ccccc1N 271570a_100020621405_100000210017 [2,0,0,0,0,0|2,0,0]=4 4322 B11R1.17 CCCCc1ccccc1O 271570a_100020621405_100000739446 [2,0,0,0,0,0|2,0,0]=4 4323 B11R1.17 CCCCc1cccnc1C 271570a_100020621405_100000751574 [2,0,0,0,0,0|2,0,0]=4 4324 B11R1.17 CCCCc1ccncc1C 271570a_100020621405_100015191297 [2,0,0,0,0,0|2,0,0]=4 4325 B11R1.17 CCCCc1cnccc1C 271570a_100020621405_100000761580 [2,0,0,0,0,0|2,0,0]=4 4326 B11R1.17 CCCCc1ncccc1C 271570a_100020621405_100000751373 [2,0,0,0,0,0|2,0,0]=4 4327 B11R1.17 CCCNc1ccccc1Br 34a_100000210017_100000210303 [2,0,0,0,0,0|2,0,0]=4 4328 B11R1.17 CCCNc1ccccc1C 34a_100015192222_100000210303 [2,0,0,0,0,0|1,0,0]=3 4329 B11R1.17 CCCNc1ccccc1Cl 34a_100000185783_100000210303 [2,0,0,0,0,0|2,0,0]=4 4330 B11R1.17 CCCNc1ccccc1F 34a_100000210422_100000210303 [2,0,0,0,0,0|2,0,0]=4 4331 B11R1.17 CCCNc1ccccc1I 34a_100000210053_100000210303 [2,0,0,0,0,0|2,0,0]=4 4332 B11R1.17 CCCNc1ccccc1O 34a_100000185747_100000210303 [2,0,0,0,0,0|2,0,0]=4 4333 B11R1.17 CCCOc1cccc[n+]1[O-] 7a_100000211761_100000210303 [2,0,0,0,0,0|2,0,0]=4 4334 B11R1.17 CCCOc1ccccc1Br 34a_100000181306_100000210303 [2,0,0,0,0,0|1,0,0]=3 4335 B11R1.17 CCCOc1ccccc1Br 7a_100000181306_100000210303 [2,0,0,0,0,0|1,0,0]=3 4336 B11R1.17 CCCOc1ccccc1C 34a_100000210338_100000210303 [2,0,0,0,0,0|0,0,0]=2 4337 B11R1.17 CCCOc1ccccc1C 7a_100000210338_100000210303 [2,0,0,0,0,0|0,0,0]=2 4338 B11R1.17 CCCOc1ccccc1Cl 34a_100000210172_100000210303 [2,0,0,0,0,0|1,0,0]=3 4339 B11R1.17 CCCOc1ccccc1Cl 7a_100000210172_100000210303 [2,0,0,0,0,0|1,0,0]=3 4340 B11R1.17 CCCOc1ccccc1F 34a_100000210171_100000210303 [2,0,0,0,0,0|1,0,0]=3 4341 B11R1.17 CCCOc1ccccc1F 7a_100000210171_100000210303 [2,0,0,0,0,0|1,0,0]=3 4342 B11R1.17 CCCOc1ccccc1I 34a_100000739446_100000210303 [2,0,0,0,0,0|1,0,0]=3 4343 B11R1.17 CCCOc1ccccc1I 7a_100000739446_100000210303 [2,0,0,0,0,0|1,0,0]=3 4344 B11R1.17 CCCOc1ccccc1N 34a_100000185747_100000210303 [2,0,0,0,0,0|1,0,0]=3 4345 B11R1.17 CCCOc1ccccc1N 7a_100000185747_100000210303 [2,0,0,0,0,0|1,0,0]=3 4346 B11R1.17 CCCOc1ccccc1O 271570a_203496583355_100000174042 [2,0,0,0,0,0|1,0,0]=3 4347 B11R1.17 CCCOc1cccnc1Br 34a_100000744436_100000210303 [2,0,0,0,0,0|2,0,0]=4 4348 B11R1.17 CCCOc1cccnc1Br 7a_100000744436_100000210303 [2,0,0,0,0,0|2,0,0]=4 4349 B11R1.17 CCCOc1cccnc1C 34a_100000745507_100000210303 [2,0,0,0,0,0|1,0,0]=3 4350 B11R1.17 CCCOc1cccnc1C 7a_100000745507_100000210303 [2,0,0,0,0,0|1,0,0]=3 4351 B11R1.17 CCCOc1cccnc1Cl 34a_100000757616_100000210303 [2,0,0,0,0,0|2,0,0]=4 4352 B11R1.17 CCCOc1cccnc1Cl 7a_100000757616_100000210303 [2,0,0,0,0,0|2,0,0]=4 4353 B11R1.17 CCCOc1cccnc1F 34a_100000061740_100000210303 [2,0,0,0,0,0|2,0,0]=4 4354 B11R1.17 CCCOc1cccnc1F 7a_100000061740_100000210303 [2,0,0,0,0,0|2,0,0]=4 4355 B11R1.17 CCCOc1cccnc1I 34a_100000034122_100000210303 [2,0,0,0,0,0|2,0,0]=4 4356 B11R1.17 CCCOc1cccnc1I 7a_100000034122_100000210303 [2,0,0,0,0,0|2,0,0]=4 4357 B11R1.17 CCCOc1cccnc1N 34a_100000211975_100000210303 [2,0,0,0,0,0|2,0,0]=4 4358 B11R1.17 CCCOc1cccnc1N 7a_100000211975_100000210303 [2,0,0,0,0,0|2,0,0]=4 4359 B11R1.17 CCCOc1cccoc1=O 34a_100000077404_100000210303 [2,0,0,0,0,0|2,0,0]=4 4360 B11R1.17 CCCOc1cccoc1=O 7a_100000077404_100000210303 [2,0,0,0,0,0|2,0,0]=4 4361 B11R1.17 CCCOc1ccncc1Br 34a_100011996408_100000210303 [2,0,0,0,0,0|2,0,0]=4 4362 B11R1.17 CCCOc1ccncc1C 34a_100000694293_100000210303 [2,0,0,0,0,0|1,0,0]=3 4363 B11R1.17 CCCOc1ccncc1Cl 34a_100011997054_100000210303 [2,0,0,0,0,0|2,0,0]=4 4364 B11R1.17 CCCOc1ccncc1F 34a_200000081243_100000210303 [2,0,0,0,0,0|2,0,0]=4 4365 B11R1.17 CCCOc1cnccc1C 34a_100011997053_100000210303 [2,0,0,0,0,0|1,0,0]=3 4366 B11R1.17 CCCOc1cnccc1C 7a_100011997053_100000210303 [2,0,0,0,0,0|1,0,0]=3 4367 B11R1.17 CCCOc1cnccc1Cl 34a_100011996695_100000210303 [2,0,0,0,0,0|2,0,0]=4 4368 B11R1.17 CCCOc1cnccc1I 34a_100000050107_100000210303 [2,0,0,0,0,0|2,0,0]=4 4369 B11R1.17 CCCOc1cnccc1N 34a_100000753702_100000210303 [2,0,0,0,0,0|2,0,0]=4 4370 B11R1.17 CCCOc1coccc1=O 34a_100000060831_100000210303 [2,0,0,0,0,0|2,0,0]=4 4371 B11R1.17 CCCOc1ncccc1Cl 34a_100011290957_100000210303 [2,0,0,0,0,0|2,0,0]=4 4372 B11R1.17 CCCOc1ncccc1F 34a_100011219419_100000210303 [2,0,0,0,0,0|2,0,0]=4 4373 B11R1.17 CCCOc1ncccc1N 34a_100000746358_100000210303 [2,0,0,0,0,0|2,0,0]=4 4374 B11R1.17 CCCOc1ncccc1O 271570a_203496583355_200011465209 [2,0,0,0,0,0|2,0,0]=4 4375 B11R1.17 CCCOc1nccnc1C 34a_100000766352_100000210303 [2,0,0,0,0,0|2,0,0]=4 4376 B11R1.17 CCCSc1cccc[n+]1C 62a_100000210303_100000212160 [2,0,0,0,0,0|1,1,0]=4 4377 B11R1.17 CCCSc1ccccc1Br 62a_100000210303_100000695589 [2,0,0,0,0,0|1,1,0]=4 4378 B11R1.17 CCCSc1ccccc1Br 62a_100000695589_100000210303 [2,0,0,0,0,0|1,1,0]=4 4379 B11R1.17 CCCSc1ccccc1C 62a_100000210303_100000210755 [2,0,0,0,0,0|0,1,0]=3 4380 B11R1.17 CCCSc1ccccc1C 62a_100000210755_100000210303 [2,0,0,0,0,0|0,1,0]=3 4381 B11R1.17 CCCSc1ccccc1Cl 62a_100000210303_100000764095 [2,0,0,0,0,0|1,1,0]=4 4382 B11R1.17 CCCSc1ccccc1Cl 62a_100000764095_100000210303 [2,0,0,0,0,0|1,1,0]=4 4383 B11R1.17 CCCSc1ccccc1F 62a_100000210303_100011215700 [2,0,0,0,0,0|1,1,0]=4 4384 B11R1.17 CCCSc1ccccc1F 62a_100011215700_100000210303 [2,0,0,0,0,0|1,1,0]=4 4385 B11R1.17 CCCSc1ccccc1N 62a_100000210017_100000210303 [2,0,0,0,0,0|1,1,0]=4 4386 B11R1.17 CCCSc1ccccc1N 62a_100000210303_100000210017 [2,0,0,0,0,0|1,1,0]=4 4387 B11R1.17 CCCSc1ccccc1O 62a_100000210303_100000739446 [2,0,0,0,0,0|1,1,0]=4 4388 B11R1.17 CCCSc1ccccc1O 62a_100000739446_100000210303 [2,0,0,0,0,0|1,1,0]=4 4389 B11R1.17 CCCSc1cccnc1C 62a_100000210303_100000751574 [2,0,0,0,0,0|1,1,0]=4 4390 B11R1.17 CCCSc1cccnc1C 62a_100000751574_100000210303 [2,0,0,0,0,0|1,1,0]=4 4391 B11R1.17 CCCSc1ccncc1C 62a_100000210303_100000765111 [2,0,0,0,0,0|1,1,0]=4 4392 B11R1.17 CCCSc1ccncc1C 62a_100000765111_100000210303 [2,0,0,0,0,0|1,1,0]=4 4393 B11R1.17 CCCSc1cnccc1C 62a_100000210303_100000761580 [2,0,0,0,0,0|1,1,0]=4 4394 B11R1.17 CCCSc1cnccc1C 62a_100000761580_100000210303 [2,0,0,0,0,0|1,1,0]=4 4395 B11R1.17 CCCSc1ncccc1C 62a_100000210303_100000751373 [2,0,0,0,0,0|1,1,0]=4 4396 B11R1.17 CCCSc1ncccc1C 62a_100000751373_100000210303 [2,0,0,0,0,0|1,1,0]=4 4397 B11R1.17 CCNCc1ccccc1C 207a_100015525214_100000211143 [2,0,0,0,0,0|2,0,0]=4 4398 B11R1.17 CCNCc1ccccc1C 2230a_100015525214_100000211839 [2,0,0,0,0,0|2,0,0]=4 4399 B11R1.17 CCNCc1ccccc1C 270004a_100015525214_100000211143 [2,0,0,0,0,0|2,0,0]=4 4400 B11R1.17 CCNCc1ccccc1C 34a_100000174972_100000210202 [2,0,0,0,0,0|2,0,0]=4 4401 B11R1.17 CCOCc1ccccc1C 34a_100000698903_100000210202 [2,0,0,0,0,0|2,0,0]=4 4402 B11R1.17 CCOCc1ccccc1C 34a_100121572206_100000211839 [2,0,0,0,0,0|2,0,0]=4 4403 B11R1.17 CCOCc1ccccc1C 7a_100000698903_100000210202 [2,0,0,0,0,0|2,0,0]=4 4404 B11R1.17 CCSCc1ccccc1C 62a_100000210202_100000211839 [2,0,0,0,0,0|2,0,0]=4 4405 B11R1.17 CCSCc1ccccc1C 62a_100000211839_100000210202 [2,0,0,0,0,0|2,0,0]=4 4406 B11R1.17 CNCCc1ccccc1C 2230a_100000685071_200000210301 [2,0,0,0,0,0|2,0,0]=4 4407 B11R1.17 CNCCc1ccccc1C 2230a_106832991635_100011713688 [2,0,0,0,0,0|2,0,0]=4 4408 B11R1.17 CNCCc1ccccc1C 34a_100000685071_200000210301 [2,0,0,0,0,0|2,0,0]=4 4409 B11R1.17 CNCCc1ccccc1C 34a_100102657272_100011713688 [2,0,0,0,0,0|2,0,0]=4 4410 B11R1.17 CNCCc1ccccc1C 7a_106832991635_100011713688 [2,0,0,0,0,0|2,0,0]=4 4411 B11R1.17 COCCc1ccccc1C 34a_100011220023_200000210301 [2,0,0,0,0,0|2,0,0]=4 4412 B11R1.17 COCCc1ccccc1C 34a_100138415774_100011713688 [2,0,0,0,0,0|2,0,0]=4 4413 B11R1.17 COCCc1ccccc1C 7a_100011220023_200000210301 [2,0,0,0,0,0|2,0,0]=4 4414 B11R1.17 COCOc1ccccc1O 271570a_203496583355_200000230759 [2,0,0,0,0,0|2,0,0]=4 4415 B11R1.17 COCSc1ccccc1C 62a_100000210755_100000766300 [2,0,0,0,0,0|1,1,0]=4 4416 B11R1.17 COCSc1ccccc1C 62a_100000766300_100000210755 [2,0,0,0,0,0|1,1,0]=4 4417 B11R1.17 CSCCc1ccccc1C 62a_100011713688_200000210301 [2,0,0,0,0,0|2,0,0]=4 4418 B11R1.17 CSCCc1ccccc1C 62a_200000210301_100011713688 [2,0,0,0,0,0|2,0,0]=4 4419 B11R1.17 CSCNc1ccccc1C 34a_100015192222_100011218213 [2,0,0,0,0,0|2,0,0]=4 4420 B11R1.17 CSCOc1ccccc1Br 34a_100000181306_100011218213 [2,0,0,0,0,0|2,0,0]=4 4421 B11R1.17 CSCOc1ccccc1C 34a_100000210338_100011218213 [2,0,0,0,0,0|1,0,0]=3 4422 B11R1.17 CSCOc1ccccc1Cl 34a_100000210172_100011218213 [2,0,0,0,0,0|2,0,0]=4 4423 B11R1.17 CSCOc1ccccc1F 34a_100000210171_100011218213 [2,0,0,0,0,0|2,0,0]=4 4424 B11R1.17 CSCOc1ccccc1I 34a_100000739446_100011218213 [2,0,0,0,0,0|2,0,0]=4 4425 B11R1.17 CSCOc1ccccc1N 34a_100000185747_100011218213 [2,0,0,0,0,0|2,0,0]=4 4426 B11R1.17 CSCOc1cccnc1C 34a_100000745507_100011218213 [2,0,0,0,0,0|2,0,0]=4 4427 B11R1.17 CSCOc1ccncc1C 34a_100000694293_100011218213 [2,0,0,0,0,0|2,0,0]=4 4428 B11R1.17 CSCOc1cnccc1C 34a_100011997053_100011218213 [2,0,0,0,0,0|2,0,0]=4 4429 B11R1.17 CSCSc1ccccc1C 62a_100000210755_100011218213 [2,0,0,0,0,0|1,1,0]=4 4430 B11R1.17 CSCSc1ccccc1C 62a_100011218213_100000210755 [2,0,0,0,0,0|1,1,0]=4 4431 B11R1.17 Cc1ccccc1CCN[13CH3] 2230a_100000685071_200025704644 [2,0,0,0,0,0|2,0,0]=4 4432 B11R1.17 Cc1ccccc1CCN[13CH3] 34a_100000685071_200025704644 [2,0,0,0,0,0|2,0,0]=4 4433 B11R1.17 Cc1ccccc1CCO[13CH3] 34a_100011220023_200025704644 [2,0,0,0,0,0|2,0,0]=4 4434 B11R1.17 Cc1ccccc1CCO[13CH3] 7a_100011220023_200025704644 [2,0,0,0,0,0|2,0,0]=4 4435 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_100011713688_200025704644 [2,0,0,0,0,0|2,0,0]=4 4436 B11R1.17 Cc1ccccc1CCS[13CH3] 62a_200025704644_100011713688 [2,0,0,0,0,0|2,0,0]=4 4437 B11R1.17 Cc1ccccc1NCCF 34a_100015192222_100011217306 [2,0,0,0,0,0|2,0,0]=4 4438 B11R1.17 Cc1ccccc1NCCO 34a_100015192222_100000211926 [2,0,0,0,0,0|2,0,0]=4 4439 B11R1.17 Cc1ccccc1OCC#N 7a_100000210338_100011215382 [2,0,0,0,0,0|0,0,2]=4 4440 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [2,0,0,0,0,0|1,0,1]=4 4441 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [2,0,0,0,0,0|1,0,1]=4 4442 B11R1.17 Cc1ccccc1OCCF 34a_100000210338_100011217306 [2,0,0,0,0,0|1,0,0]=3 4443 B11R1.17 Cc1ccccc1OCCF 7a_100000210338_100011217306 [2,0,0,0,0,0|1,0,0]=3 4444 B11R1.17 Cc1ccccc1OCCO 34a_100000210338_100000211926 [2,0,0,0,0,0|1,0,0]=3 4445 B11R1.17 Cc1ccccc1OCCO 7a_100000210338_100000211926 [2,0,0,0,0,0|1,0,0]=3 4446 B11R1.17 Cc1ccccc1SCCF 62a_100000210755_100011217306 [2,0,0,0,0,0|1,1,0]=4 4447 B11R1.17 Cc1ccccc1SCCF 62a_100011217306_100000210755 [2,0,0,0,0,0|1,1,0]=4 4448 B11R1.17 Cc1ccccc1SCCO 62a_100000210755_100000211926 [2,0,0,0,0,0|1,1,0]=4 4449 B11R1.17 Cc1ccccc1SCCO 62a_100000211926_100000210755 [2,0,0,0,0,0|1,1,0]=4 4450 B11R1.17 Cc1ccncc1OCCF 34a_100011997053_100011217306 [2,0,0,0,0,0|2,0,0]=4 4451 B11R1.17 Cc1ccncc1OCCF 7a_100011997053_100011217306 [2,0,0,0,0,0|2,0,0]=4 4452 B11R1.17 Cc1ccncc1OCCO 34a_100011997053_100000211926 [2,0,0,0,0,0|2,0,0]=4 4453 B11R1.17 Cc1ccncc1OCCO 7a_100011997053_100000211926 [2,0,0,0,0,0|2,0,0]=4 4454 B11R1.17 Cc1cnccc1OCCF 34a_100000694293_100011217306 [2,0,0,0,0,0|2,0,0]=4 4455 B11R1.17 Cc1cnccc1OCCO 34a_100000694293_100000211926 [2,0,0,0,0,0|2,0,0]=4 4456 B11R1.17 Cc1ncccc1OCCF 34a_100000745507_100011217306 [2,0,0,0,0,0|2,0,0]=4 4457 B11R1.17 Cc1ncccc1OCCF 7a_100000745507_100011217306 [2,0,0,0,0,0|2,0,0]=4 4458 B11R1.17 Cc1ncccc1OCCO 34a_100000745507_100000211926 [2,0,0,0,0,0|2,0,0]=4 4459 B11R1.17 Cc1ncccc1OCCO 7a_100000745507_100000211926 [2,0,0,0,0,0|2,0,0]=4 4460 B11R1.17 FCCOc1ccccc1Br 34a_100000181306_100011217306 [2,0,0,0,0,0|2,0,0]=4 4461 B11R1.17 FCCOc1ccccc1Br 7a_100000181306_100011217306 [2,0,0,0,0,0|2,0,0]=4 4462 B11R1.17 FCCOc1ccccc1Cl 34a_100000210172_100011217306 [2,0,0,0,0,0|2,0,0]=4 4463 B11R1.17 FCCOc1ccccc1Cl 7a_100000210172_100011217306 [2,0,0,0,0,0|2,0,0]=4 4464 B11R1.17 FCCOc1ccccc1F 34a_100000210171_100011217306 [2,0,0,0,0,0|2,0,0]=4 4465 B11R1.17 FCCOc1ccccc1F 7a_100000210171_100011217306 [2,0,0,0,0,0|2,0,0]=4 4466 B11R1.17 FCCOc1ccccc1I 34a_100000739446_100011217306 [2,0,0,0,0,0|2,0,0]=4 4467 B11R1.17 FCCOc1ccccc1I 7a_100000739446_100011217306 [2,0,0,0,0,0|2,0,0]=4 4468 B11R1.17 NCCOc1ccccc1O 271570a_203496583355_100000744007 [2,0,0,0,0,0|1,0,0]=3 4469 B11R1.17 Nc1ccccc1OCCF 34a_100000185747_100011217306 [2,0,0,0,0,0|2,0,0]=4 4470 B11R1.17 Nc1ccccc1OCCF 7a_100000185747_100011217306 [2,0,0,0,0,0|2,0,0]=4 4471 B11R1.17 Nc1ccccc1OCCO 34a_100000185747_100000211926 [2,0,0,0,0,0|2,0,0]=4 4472 B11R1.17 Nc1ccccc1OCCO 7a_100000185747_100000211926 [2,0,0,0,0,0|2,0,0]=4 4473 B11R1.17 OCCOc1ccccc1Br 34a_100000181306_100000211926 [2,0,0,0,0,0|2,0,0]=4 4474 B11R1.17 OCCOc1ccccc1Br 7a_100000181306_100000211926 [2,0,0,0,0,0|2,0,0]=4 4475 B11R1.17 OCCOc1ccccc1Cl 34a_100000210172_100000211926 [2,0,0,0,0,0|2,0,0]=4 4476 B11R1.17 OCCOc1ccccc1Cl 7a_100000210172_100000211926 [2,0,0,0,0,0|2,0,0]=4 4477 B11R1.17 OCCOc1ccccc1F 34a_100000210171_100000211926 [2,0,0,0,0,0|2,0,0]=4 4478 B11R1.17 OCCOc1ccccc1F 7a_100000210171_100000211926 [2,0,0,0,0,0|2,0,0]=4 4479 B11R1.17 OCCOc1ccccc1I 34a_100000739446_100000211926 [2,0,0,0,0,0|2,0,0]=4 4480 B11R1.17 OCCOc1ccccc1I 7a_100000739446_100000211926 [2,0,0,0,0,0|2,0,0]=4 4481 B11R1.17 OCCOc1ccccc1O 271570a_203496583355_100000230753 [2,0,0,0,0,0|2,0,0]=4 4482 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [2,0,0,0,0,0|1,0,1]=4 4483 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [2,0,0,0,0,0|1,0,1]=4 4484 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [2,0,0,0,0,0|1,0,1]=4 4485 B11R1.91 CC(C)CNc1ccccc1 34a_100000106764_100000210624 [2,0,0,0,0,0|2,0,0]=4 4486 B11R1.91 CC(C)COc1ccccc1 34a_100000210340_100000210624 [2,0,0,0,0,0|1,0,0]=3 4487 B11R1.91 CC(C)COc1ccccc1 7a_100000210340_100000210760 [2,0,0,0,0,0|1,0,0]=3 4488 B11R1.91 CC(C)COc1cccnc1 34a_100000210849_100000210624 [2,0,0,0,0,0|2,0,0]=4 4489 B11R1.91 CC(C)COc1cccnc1 7a_100000210849_100000210760 [2,0,0,0,0,0|2,0,0]=4 4490 B11R1.91 CC(C)COc1ccncc1 34a_100000212176_100000210624 [2,0,0,0,0,0|2,0,0]=4 4491 B11R1.91 CC(C)CSc1ccccc1 62a_100000210624_100000041952 [2,0,0,0,0,0|1,1,0]=4 4492 B11R1.91 CC(C)CSc1ccccc1 62a_100000719477_100000210760 [2,0,0,0,0,0|1,1,0]=4 4493 B11R1.91 CC(O)CNc1ccccc1 34a_100000106764_100011218427 [2,0,0,0,0,0|2,0,0]=4 4494 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [2,0,0,0,0,0|1,0,0]=3 4495 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [2,0,0,0,0,0|1,0,0]=3 4496 B11R1.91 CC(O)COc1cccnc1 34a_100000210849_100011218427 [2,0,0,0,0,0|2,0,0]=4 4497 B11R1.91 CC(O)COc1cccnc1 7a_100000210849_100011218427 [2,0,0,0,0,0|2,0,0]=4 4498 B11R1.91 CC(O)COc1ccncc1 34a_100000212176_100011218427 [2,0,0,0,0,0|2,0,0]=4 4499 B11R1.91 CC(O)CSc1ccccc1 62a_100000719477_100011218427 [2,0,0,0,0,0|1,1,0]=4 4500 B11R1.91 CC(O)CSc1ccccc1 62a_100011218427_100000041952 [2,0,0,0,0,0|1,1,0]=4 4501 B11R1.91 C[C@@H](O)CNc1ccccc1 34a_100000106764_100009817552 [2,0,0,0,0,0|2,0,0]=4 4502 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [2,0,0,0,0,0|1,0,0]=3 4503 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [2,0,0,0,0,0|1,0,0]=3 4504 B11R1.91 C[C@@H](O)COc1cccnc1 34a_100000210849_100009817552 [2,0,0,0,0,0|2,0,0]=4 4505 B11R1.91 C[C@@H](O)COc1cccnc1 7a_100000210849_100009817552 [2,0,0,0,0,0|2,0,0]=4 4506 B11R1.91 C[C@@H](O)COc1ccncc1 34a_100000212176_100009817552 [2,0,0,0,0,0|2,0,0]=4 4507 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100000719477_100009817552 [2,0,0,0,0,0|1,1,0]=4 4508 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100009817552_100000041952 [2,0,0,0,0,0|1,1,0]=4 4509 B11R1.91 FC(F)COc1ccccc1 34a_100000210340_100011934356 [2,0,0,0,0,0|2,0,0]=4 4510 B11R1.91 FC(F)COc1ccccc1 7a_100000210340_100011934356 [2,0,0,0,0,0|2,0,0]=4 4511 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [2,0,0,0,0,0|1,0,1]=4 4512 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [2,0,0,0,0,0|1,0,1]=4 4513 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [2,0,0,0,0,0|1,0,1]=4 4514 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [2,0,0,0,0,0|0,0,2]=4 4515 B11R1.605 CCNc1c(cccc1Br)C 34a_100011834072_100000210202 [2,0,0,0,0,0|2,0,0]=4 4516 B11R1.605 CCNc1c(cccc1C)C 34a_100000185769_100000210202 [2,0,0,0,0,0|1,0,0]=3 4517 B11R1.605 CCNc1c(cccc1Cl)C 34a_100000756524_100000210202 [2,0,0,0,0,0|2,0,0]=4 4518 B11R1.605 CCNc1c(cccc1F)C 34a_100000766463_100000210202 [2,0,0,0,0,0|2,0,0]=4 4519 B11R1.605 CCNc1c(cccc1O)C 34a_100000743429_100000210202 [2,0,0,0,0,0|2,0,0]=4 4520 B11R1.605 CCOc1c(cccc1Br)Br 34a_100000736428_100000210202 [2,0,0,0,0,0|2,0,0]=4 4521 B11R1.605 CCOc1c(cccc1Br)Br 7a_100000736428_100000210202 [2,0,0,0,0,0|2,0,0]=4 4522 B11R1.605 CCOc1c(cccc1Br)C 34a_100009817157_100000210202 [2,0,0,0,0,0|1,0,0]=3 4523 B11R1.605 CCOc1c(cccc1Br)C 7a_100009817157_100000210202 [2,0,0,0,0,0|1,0,0]=3 4524 B11R1.605 CCOc1c(cccc1Br)Cl 34a_100010214474_100000210202 [2,0,0,0,0,0|2,0,0]=4 4525 B11R1.605 CCOc1c(cccc1Br)Cl 7a_100010214474_100000210202 [2,0,0,0,0,0|2,0,0]=4 4526 B11R1.605 CCOc1c(cccc1Br)F 34a_100009813666_100000210202 [2,0,0,0,0,0|2,0,0]=4 4527 B11R1.605 CCOc1c(cccc1Br)F 7a_100009813666_100000210202 [2,0,0,0,0,0|2,0,0]=4 4528 B11R1.605 CCOc1c(cccc1Br)N 34a_100011934915_100000210202 [2,0,0,0,0,0|2,0,0]=4 4529 B11R1.605 CCOc1c(cccc1C)C 34a_100000210341_100000210202 [2,0,0,0,0,0|0,0,0]=2 4530 B11R1.605 CCOc1c(cccc1C)C 7a_100000210341_100000210202 [2,0,0,0,0,0|0,0,0]=2 4531 B11R1.605 CCOc1c(cccc1Cl)C 34a_100000033731_100000210202 [2,0,0,0,0,0|1,0,0]=3 4532 B11R1.605 CCOc1c(cccc1Cl)C 7a_100000033731_100000210202 [2,0,0,0,0,0|1,0,0]=3 4533 B11R1.605 CCOc1c(cccc1Cl)Cl 34a_100000211709_100000210202 [2,0,0,0,0,0|2,0,0]=4 4534 B11R1.605 CCOc1c(cccc1Cl)Cl 7a_100000211709_100000210202 [2,0,0,0,0,0|2,0,0]=4 4535 B11R1.605 CCOc1c(cccc1Cl)F 34a_100000694953_100000210202 [2,0,0,0,0,0|2,0,0]=4 4536 B11R1.605 CCOc1c(cccc1Cl)F 7a_100000694953_100000210202 [2,0,0,0,0,0|2,0,0]=4 4537 B11R1.605 CCOc1c(cccc1Cl)N 34a_100000754742_100000210202 [2,0,0,0,0,0|2,0,0]=4 4538 B11R1.605 CCOc1c(cccc1F)C 34a_100011659162_100000210202 [2,0,0,0,0,0|1,0,0]=3 4539 B11R1.605 CCOc1c(cccc1F)C 7a_100011659162_100000210202 [2,0,0,0,0,0|1,0,0]=3 4540 B11R1.605 CCOc1c(cccc1F)F 34a_100000230165_100000210202 [2,0,0,0,0,0|2,0,0]=4 4541 B11R1.605 CCOc1c(cccc1F)F 7a_100000230165_100000210202 [2,0,0,0,0,0|2,0,0]=4 4542 B11R1.605 CCOc1c(cccc1F)N 34a_100011934987_100000210202 [2,0,0,0,0,0|2,0,0]=4 4543 B11R1.605 CCOc1c(cccc1F)O 271570a_203496583355_100010232518 [2,0,0,0,0,0|2,0,0]=4 4544 B11R1.605 CCOc1c(cccc1I)Br 34a_100010084509_100000210202 [2,0,0,0,0,0|2,0,0]=4 4545 B11R1.605 CCOc1c(cccc1I)Br 7a_100010084509_100000210202 [2,0,0,0,0,0|2,0,0]=4 4546 B11R1.605 CCOc1c(cccc1I)Cl 34a_100010202889_100000210202 [2,0,0,0,0,0|2,0,0]=4 4547 B11R1.605 CCOc1c(cccc1I)Cl 7a_100010202889_100000210202 [2,0,0,0,0,0|2,0,0]=4 4548 B11R1.605 CCOc1c(cccc1I)F 34a_100010186298_100000210202 [2,0,0,0,0,0|2,0,0]=4 4549 B11R1.605 CCOc1c(cccc1I)F 7a_100010186298_100000210202 [2,0,0,0,0,0|2,0,0]=4 4550 B11R1.605 CCOc1c(cccc1I)N 34a_100010084371_100000210202 [2,0,0,0,0,0|2,0,0]=4 4551 B11R1.605 CCOc1c(cccc1N)C 34a_100000756359_100000210202 [2,0,0,0,0,0|1,0,0]=3 4552 B11R1.605 CCOc1c(cccc1N)C 7a_100000756359_100000210202 [2,0,0,0,0,0|1,0,0]=3 4553 B11R1.605 CCOc1c(cccc1N)N 34a_200016994477_100000210202 [2,0,0,0,0,0|2,0,0]=4 4554 B11R1.605 CCOc1c(ccnc1C)C 34a_100011934651_100000210202 [2,0,0,0,0,0|1,0,0]=3 4555 B11R1.605 CCOc1c(ccnc1C)C 7a_100011934651_100000210202 [2,0,0,0,0,0|1,0,0]=3 4556 B11R1.605 CCOc1c(ccnc1Cl)C 34a_100000696282_100000210202 [2,0,0,0,0,0|2,0,0]=4 4557 B11R1.605 CCOc1c(ccnc1Cl)C 7a_100000696282_100000210202 [2,0,0,0,0,0|2,0,0]=4 4558 B11R1.605 CCOc1c(ncnc1C)C 34a_100009878406_100000210202 [2,0,0,0,0,0|2,0,0]=4 4559 B11R1.605 CCOc1c(ncnc1C)C 7a_100009878406_100000210202 [2,0,0,0,0,0|2,0,0]=4 4560 B11R1.605 CCOc1c(occc1=O)C 34a_100000031901_100000210202 [2,0,0,0,0,0|2,0,0]=4 4561 B11R1.605 CCSc1c(cccc1Br)C 62a_100000210202_100010141302 [2,0,0,0,0,0|1,1,0]=4 4562 B11R1.605 CCSc1c(cccc1Br)C 62a_100010141302_100000210202 [2,0,0,0,0,0|1,1,0]=4 4563 B11R1.605 CCSc1c(cccc1C)C 62a_100000033847_100000210202 [2,0,0,0,0,0|0,1,0]=3 4564 B11R1.605 CCSc1c(cccc1C)C 62a_100000210202_100000033847 [2,0,0,0,0,0|0,1,0]=3 4565 B11R1.605 CCSc1c(cccc1Cl)C 62a_100000043165_100000210202 [2,0,0,0,0,0|1,1,0]=4 4566 B11R1.605 CCSc1c(cccc1Cl)C 62a_100000210202_100000043165 [2,0,0,0,0,0|1,1,0]=4 4567 B11R1.605 CCSc1c(cccc1F)C 62a_100000210202_100011218421 [2,0,0,0,0,0|1,1,0]=4 4568 B11R1.605 CCSc1c(cccc1F)C 62a_100011218421_100000210202 [2,0,0,0,0,0|1,1,0]=4 4569 B11R1.605 CCSc1c(cccc1N)C 62a_100000210202_100000684715 [2,0,0,0,0,0|1,1,0]=4 4570 B11R1.605 CCSc1c(cccc1N)C 62a_100000684715_100000210202 [2,0,0,0,0,0|1,1,0]=4 4571 B11R1.605 CCSc1c(cccc1O)C 62a_100000210202_100000686692 [2,0,0,0,0,0|1,1,0]=4 4572 B11R1.605 CCSc1c(cccc1O)C 62a_100000686692_100000210202 [2,0,0,0,0,0|1,1,0]=4 4573 B11R1.605 CCSc1c(ccnc1C)C 62a_100000210202_100012000501 [2,0,0,0,0,0|1,1,0]=4 4574 B11R1.605 CCSc1c(ccnc1C)C 62a_100012000501_100000210202 [2,0,0,0,0,0|1,1,0]=4 4575 B11R1.605 CCSc1c(cncc1C)C 62a_100000210202_100009817138 [2,0,0,0,0,0|1,1,0]=4 4576 B11R1.605 CCSc1c(cncc1C)C 62a_100009817138_100000210202 [2,0,0,0,0,0|1,1,0]=4 4577 B11R1.605 CNCc1c(cccc1Br)C 207a_100102657272_100009881667 [2,0,0,0,0,0|2,0,0]=4 4578 B11R1.605 CNCc1c(cccc1Br)C 2230a_106832991635_100010146847 [2,0,0,0,0,0|2,0,0]=4 4579 B11R1.605 CNCc1c(cccc1Br)C 26a_100102657272_100009817157 [2,0,0,0,0,0|2,0,0]=4 4580 B11R1.605 CNCc1c(cccc1Br)C 270004a_106832991635_100009881667 [2,0,0,0,0,0|2,0,0]=4 4581 B11R1.605 CNCc1c(cccc1Br)C 34a_100102657272_100010146847 [2,0,0,0,0,0|2,0,0]=4 4582 B11R1.605 CNCc1c(cccc1Br)C 7a_106832991635_100010146847 [2,0,0,0,0,0|2,0,0]=4 4583 B11R1.605 CNCc1c(cccc1C)C 207a_100102657272_100000758299 [2,0,0,0,0,0|1,0,0]=3 4584 B11R1.605 CNCc1c(cccc1C)C 2230a_106832991635_100000758300 [2,0,0,0,0,0|1,0,0]=3 4585 B11R1.605 CNCc1c(cccc1C)C 270004a_106832991635_100000758299 [2,0,0,0,0,0|1,0,0]=3 4586 B11R1.605 CNCc1c(cccc1C)C 34a_100000689800_200000210301 [2,0,0,0,0,0|1,0,0]=3 4587 B11R1.605 CNCc1c(cccc1C)C 34a_100102657272_100000758300 [2,0,0,0,0,0|1,0,0]=3 4588 B11R1.605 CNCc1c(cccc1C)C 7a_106832991635_100000758300 [2,0,0,0,0,0|1,0,0]=3 4589 B11R1.605 CNCc1c(cccc1Cl)C 207a_100102657272_100000041122 [2,0,0,0,0,0|2,0,0]=4 4590 B11R1.605 CNCc1c(cccc1Cl)C 270004a_106832991635_100000041122 [2,0,0,0,0,0|2,0,0]=4 4591 B11R1.605 CNCc1c(cccc1F)C 207a_100102657272_100000069827 [2,0,0,0,0,0|2,0,0]=4 4592 B11R1.605 CNCc1c(cccc1F)C 2230a_106832991635_100009814554 [2,0,0,0,0,0|2,0,0]=4 4593 B11R1.605 CNCc1c(cccc1F)C 270004a_106832991635_100000069827 [2,0,0,0,0,0|2,0,0]=4 4594 B11R1.605 CNCc1c(cccc1F)C 34a_100000762012_200000210301 [2,0,0,0,0,0|2,0,0]=4 4595 B11R1.605 CNCc1c(cccc1F)C 34a_100102657272_100009814554 [2,0,0,0,0,0|2,0,0]=4 4596 B11R1.605 CNCc1c(cccc1F)C 7a_106832991635_100009814554 [2,0,0,0,0,0|2,0,0]=4 4597 B11R1.605 CNCc1c(cccc1I)C 2230a_106832991635_100010150146 [2,0,0,0,0,0|2,0,0]=4 4598 B11R1.605 CNCc1c(cccc1I)C 34a_100102657272_100010150146 [2,0,0,0,0,0|2,0,0]=4 4599 B11R1.605 CNCc1c(cccc1I)C 7a_106832991635_100010150146 [2,0,0,0,0,0|2,0,0]=4 4600 B11R1.605 COCc1c(cccc1Br)C 34a_100138415774_100010146847 [2,0,0,0,0,0|2,0,0]=4 4601 B11R1.605 COCc1c(cccc1C)C 34a_100011933981_200000210301 [2,0,0,0,0,0|1,0,0]=3 4602 B11R1.605 COCc1c(cccc1C)C 34a_100138415774_100000758300 [2,0,0,0,0,0|1,0,0]=3 4603 B11R1.605 COCc1c(cccc1C)C 7a_100011933981_200000210301 [2,0,0,0,0,0|1,0,0]=3 4604 B11R1.605 COCc1c(cccc1Cl)C 34a_100000082531_200000210301 [2,0,0,0,0,0|2,0,0]=4 4605 B11R1.605 COCc1c(cccc1Cl)C 7a_100000082531_200000210301 [2,0,0,0,0,0|2,0,0]=4 4606 B11R1.605 COCc1c(cccc1F)C 34a_100000057874_200000210301 [2,0,0,0,0,0|2,0,0]=4 4607 B11R1.605 COCc1c(cccc1F)C 34a_100138415774_100009814554 [2,0,0,0,0,0|2,0,0]=4 4608 B11R1.605 COCc1c(cccc1F)C 7a_100000057874_200000210301 [2,0,0,0,0,0|2,0,0]=4 4609 B11R1.605 COCc1c(cccc1I)C 34a_100138415774_100010150146 [2,0,0,0,0,0|2,0,0]=4 4610 B11R1.605 CSCc1c(cccc1Br)C 62a_100010146847_200000210301 [2,0,0,0,0,0|2,0,0]=4 4611 B11R1.605 CSCc1c(cccc1Br)C 62a_200000210301_100010146847 [2,0,0,0,0,0|2,0,0]=4 4612 B11R1.605 CSCc1c(cccc1C)C 62a_100000758300_200000210301 [2,0,0,0,0,0|1,0,0]=3 4613 B11R1.605 CSCc1c(cccc1C)C 62a_200000210301_100000758300 [2,0,0,0,0,0|1,0,0]=3 4614 B11R1.605 CSCc1c(cccc1F)C 62a_100009814554_200000210301 [2,0,0,0,0,0|2,0,0]=4 4615 B11R1.605 CSCc1c(cccc1F)C 62a_200000210301_100009814554 [2,0,0,0,0,0|2,0,0]=4 4616 B11R1.605 CSCc1c(cccc1I)C 62a_100010150146_200000210301 [2,0,0,0,0,0|2,0,0]=4 4617 B11R1.605 CSCc1c(cccc1I)C 62a_200000210301_100010150146 [2,0,0,0,0,0|2,0,0]=4 4618 B11R1.605 Cc1cccc(c1CN[13CH3])C 34a_100000689800_200025704644 [2,0,0,0,0,0|1,0,0]=3 4619 B11R1.605 Cc1cccc(c1CN[13CH3])F 34a_100000762012_200025704644 [2,0,0,0,0,0|2,0,0]=4 4620 B11R1.605 Cc1cccc(c1CO[13CH3])C 34a_100011933981_200025704644 [2,0,0,0,0,0|1,0,0]=3 4621 B11R1.605 Cc1cccc(c1CO[13CH3])C 7a_100011933981_200025704644 [2,0,0,0,0,0|1,0,0]=3 4622 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 34a_100000082531_200025704644 [2,0,0,0,0,0|2,0,0]=4 4623 B11R1.605 Cc1cccc(c1CO[13CH3])Cl 7a_100000082531_200025704644 [2,0,0,0,0,0|2,0,0]=4 4624 B11R1.605 Cc1cccc(c1CO[13CH3])F 34a_100000057874_200025704644 [2,0,0,0,0,0|2,0,0]=4 4625 B11R1.605 Cc1cccc(c1CO[13CH3])F 7a_100000057874_200025704644 [2,0,0,0,0,0|2,0,0]=4 4626 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_100010146847_200025704644 [2,0,0,0,0,0|2,0,0]=4 4627 B11R1.605 Cc1cccc(c1CS[13CH3])Br 62a_200025704644_100010146847 [2,0,0,0,0,0|2,0,0]=4 4628 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_100000758300_200025704644 [2,0,0,0,0,0|1,0,0]=3 4629 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_200025704644_100000758300 [2,0,0,0,0,0|1,0,0]=3 4630 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_100009814554_200025704644 [2,0,0,0,0,0|2,0,0]=4 4631 B11R1.605 Cc1cccc(c1CS[13CH3])F 62a_200025704644_100009814554 [2,0,0,0,0,0|2,0,0]=4 4632 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_100010150146_200025704644 [2,0,0,0,0,0|2,0,0]=4 4633 B11R1.605 Cc1cccc(c1CS[13CH3])I 62a_200025704644_100010150146 [2,0,0,0,0,0|2,0,0]=4 4634 B11R1.605 Cc1cccc(c1NCF)C 34a_100000185769_100015361967 [2,0,0,0,0,0|2,0,0]=4 4635 B11R1.605 Cc1cccc(c1OCF)Br 34a_100009817157_100015361967 [2,0,0,0,0,0|2,0,0]=4 4636 B11R1.605 Cc1cccc(c1OCF)Br 7a_100009817157_100015361967 [2,0,0,0,0,0|2,0,0]=4 4637 B11R1.605 Cc1cccc(c1OCF)C 34a_100000210341_100015361967 [2,0,0,0,0,0|1,0,0]=3 4638 B11R1.605 Cc1cccc(c1OCF)C 7a_100000210341_100015361967 [2,0,0,0,0,0|1,0,0]=3 4639 B11R1.605 Cc1cccc(c1OCF)Cl 34a_100000033731_100015361967 [2,0,0,0,0,0|2,0,0]=4 4640 B11R1.605 Cc1cccc(c1OCF)Cl 7a_100000033731_100015361967 [2,0,0,0,0,0|2,0,0]=4 4641 B11R1.605 Cc1cccc(c1OCF)F 34a_100011659162_100015361967 [2,0,0,0,0,0|2,0,0]=4 4642 B11R1.605 Cc1cccc(c1OCF)F 7a_100011659162_100015361967 [2,0,0,0,0,0|2,0,0]=4 4643 B11R1.605 Cc1cccc(c1OCF)N 34a_100000756359_100015361967 [2,0,0,0,0,0|2,0,0]=4 4644 B11R1.605 Cc1cccc(c1OCF)N 7a_100000756359_100015361967 [2,0,0,0,0,0|2,0,0]=4 4645 B11R1.605 Cc1cccc(c1SCF)C 62a_100000033847_100015361967 [2,0,0,0,0,0|1,1,0]=4 4646 B11R1.605 Cc1cccc(c1SCF)C 62a_100015361967_100000033847 [2,0,0,0,0,0|1,1,0]=4 4647 B11R1.605 Cc1ccnc(c1OCF)C 34a_100011934651_100015361967 [2,0,0,0,0,0|2,0,0]=4 4648 B11R1.605 Cc1ccnc(c1OCF)C 7a_100011934651_100015361967 [2,0,0,0,0,0|2,0,0]=4 4649 B13R1.90 C#Cc1ccccc1OCC(C)C 34a_200011470546_100000210624 [1,1,0,0,0,0|1,0,1]=4 4650 B13R1.90 C#Cc1ccccc1OCC(C)C 7a_200011470546_100000210760 [1,1,0,0,0,0|1,0,1]=4 4651 B13R1.90 C#Cc1ccccc1OCC(C)O 34a_200011470546_100011218427 [1,1,0,0,0,0|1,0,1]=4 4652 B13R1.90 C#Cc1ccccc1OCC(C)O 7a_200011470546_100011218427 [1,1,0,0,0,0|1,0,1]=4 4653 B13R1.90 C#Cc1ccccc1OC[C@@H](C)O 34a_200011470546_100009817552 [1,1,0,0,0,0|1,0,1]=4 4654 B13R1.90 C#Cc1ccccc1OC[C@@H](C)O 7a_200011470546_100009817552 [1,1,0,0,0,0|1,0,1]=4 4655 B13R1.90 C=C(C)COc1ccccc1CC 34a_100000210936_100000748629 [1,1,0,0,0,0|1,0,1]=4 4656 B13R1.90 C=C(C)COc1ccccc1CC 7a_100000210936_100000748629 [1,1,0,0,0,0|1,0,1]=4 4657 B13R1.90 C=C(C)COc1ccccc1CN 34a_100000185550_100000748629 [1,1,0,0,0,0|1,0,1]=4 4658 B13R1.90 C=C(C)COc1ccccc1CO 34a_100011216872_100000748629 [1,1,0,0,0,0|1,0,1]=4 4659 B13R1.90 C=C(C)COc1ccccc1NC 2230a_100000243823_200000210301 [1,1,0,0,0,0|1,0,1]=4 4660 B13R1.90 C=C(C)COc1ccccc1NC 34a_100000033821_100000748629 [1,1,0,0,0,0|1,0,1]=4 4661 B13R1.90 C=C(C)COc1ccccc1NC 34a_100000243823_200000210301 [1,1,0,0,0,0|1,0,1]=4 4662 B13R1.90 C=C(C)COc1ccccc1N[13CH3] 2230a_100000243823_200025704644 [1,1,0,0,0,0|1,0,1]=4 4663 B13R1.90 C=C(C)COc1ccccc1N[13CH3] 34a_100000243823_200025704644 [1,1,0,0,0,0|1,0,1]=4 4664 B13R1.90 C=C(C)COc1ccccc1OC 34a_100000210385_100000748629 [1,1,0,0,0,0|1,0,1]=4 4665 B13R1.90 C=C(C)COc1ccccc1SC 34a_100011216402_100000748629 [1,1,0,0,0,0|1,0,1]=4 4666 B13R1.90 CC(=O)COc1ccccc1CO 1458a_200011894254_200000210301 [1,1,0,0,0,0|1,0,1]=4 4667 B13R1.90 CC(C)CNc1ccccc1CO 34a_100000212039_100000210624 [1,1,0,0,0,0|2,0,0]=4 4668 B13R1.90 CC(C)COc1ccccc1C#N 34a_100000211048_100000210624 [1,1,0,0,0,0|1,0,1]=4 4669 B13R1.90 CC(C)COc1ccccc1C#N 7a_100000211048_100000210760 [1,1,0,0,0,0|1,0,1]=4 4670 B13R1.90 CC(C)COc1ccccc1CN 34a_100000185550_100000210624 [1,1,0,0,0,0|1,0,0]=3 4671 B13R1.90 CC(C)COc1ccccc1CO 34a_100011216872_100000210624 [1,1,0,0,0,0|1,0,0]=3 4672 B13R1.90 CC(C)COc1ccccc1N[13CH3] 34a_100000742603_200025704644 [1,1,0,0,0,0|1,0,0]=3 4673 B13R1.90 CC(C)COc1cccnc1CBr 34a_200020655725_100000210624 [1,1,0,0,0,0|2,0,0]=4 4674 B13R1.90 CC(C)COc1cccnc1CBr 7a_200020655725_100000210760 [1,1,0,0,0,0|2,0,0]=4 4675 B13R1.90 CC(C)COc1cccnc1CO 34a_100000731849_100000210624 [1,1,0,0,0,0|2,0,0]=4 4676 B13R1.90 CC(C)COc1cnccc1CO 34a_100000078615_100000210624 [1,1,0,0,0,0|2,0,0]=4 4677 B13R1.90 CC(C)CSc1ccccc1CN 62a_100000210624_100000689332 [1,1,0,0,0,0|1,1,0]=4 4678 B13R1.90 CC(C)CSc1ccccc1CN 62a_100000689332_100000210760 [1,1,0,0,0,0|1,1,0]=4 4679 B13R1.90 CC(C)CSc1ccccc1CO 62a_100000187465_100000210760 [1,1,0,0,0,0|1,1,0]=4 4680 B13R1.90 CC(C)CSc1ccccc1CO 62a_100000210624_100000187465 [1,1,0,0,0,0|1,1,0]=4 4681 B13R1.90 CC(O)CNc1ccccc1CO 34a_100000212039_100011218427 [1,1,0,0,0,0|2,0,0]=4 4682 B13R1.90 CC(O)COc1ccccc1C#N 34a_100000211048_100011218427 [1,1,0,0,0,0|1,0,1]=4 4683 B13R1.90 CC(O)COc1ccccc1C#N 7a_100000211048_100011218427 [1,1,0,0,0,0|1,0,1]=4 4684 B13R1.90 CC(O)COc1ccccc1CN 34a_100000185550_100011218427 [1,1,0,0,0,0|1,0,0]=3 4685 B13R1.90 CC(O)COc1ccccc1CO 34a_100011216872_100011218427 [1,1,0,0,0,0|1,0,0]=3 4686 B13R1.90 CC(O)COc1cccnc1CBr 34a_200020655725_100011218427 [1,1,0,0,0,0|2,0,0]=4 4687 B13R1.90 CC(O)COc1cccnc1CBr 7a_200020655725_100011218427 [1,1,0,0,0,0|2,0,0]=4 4688 B13R1.90 CC(O)COc1cccnc1CO 34a_100000731849_100011218427 [1,1,0,0,0,0|2,0,0]=4 4689 B13R1.90 CC(O)COc1cnccc1CO 34a_100000078615_100011218427 [1,1,0,0,0,0|2,0,0]=4 4690 B13R1.90 CC(O)CSc1ccccc1CN 62a_100000689332_100011218427 [1,1,0,0,0,0|1,1,0]=4 4691 B13R1.90 CC(O)CSc1ccccc1CN 62a_100011218427_100000689332 [1,1,0,0,0,0|1,1,0]=4 4692 B13R1.90 CC(O)CSc1ccccc1CO 62a_100000187465_100011218427 [1,1,0,0,0,0|1,1,0]=4 4693 B13R1.90 CC(O)CSc1ccccc1CO 62a_100011218427_100000187465 [1,1,0,0,0,0|1,1,0]=4 4694 B13R1.90 CCc1ccccc1NCC(C)C 2230a_100000212081_100000210760 [1,1,0,0,0,0|2,0,0]=4 4695 B13R1.90 CCc1ccccc1NCC(C)C 34a_100000212081_100000210624 [1,1,0,0,0,0|2,0,0]=4 4696 B13R1.90 CCc1ccccc1NCC(C)C 7a_100000212081_100000210760 [1,1,0,0,0,0|2,0,0]=4 4697 B13R1.90 CCc1ccccc1NCC(C)O 2230a_100000212081_100011218427 [1,1,0,0,0,0|2,0,0]=4 4698 B13R1.90 CCc1ccccc1NCC(C)O 34a_100000212081_100011218427 [1,1,0,0,0,0|2,0,0]=4 4699 B13R1.90 CCc1ccccc1NCC(C)O 7a_100000212081_100011218427 [1,1,0,0,0,0|2,0,0]=4 4700 B13R1.90 CCc1ccccc1NC[C@@H](C)O 2230a_100000212081_100009817552 [1,1,0,0,0,0|2,0,0]=4 4701 B13R1.90 CCc1ccccc1NC[C@@H](C)O 34a_100000212081_100009817552 [1,1,0,0,0,0|2,0,0]=4 4702 B13R1.90 CCc1ccccc1NC[C@@H](C)O 7a_100000212081_100009817552 [1,1,0,0,0,0|2,0,0]=4 4703 B13R1.90 CCc1ccccc1OCC(=O)C 1458a_100000182566_200000210301 [1,1,0,0,0,0|1,0,1]=4 4704 B13R1.90 CCc1ccccc1OCC(=O)N 34a_100000210936_100000187820 [1,1,0,0,0,0|1,0,1]=4 4705 B13R1.90 CCc1ccccc1OCC(=O)N 7a_100000210936_100000187820 [1,1,0,0,0,0|1,0,1]=4 4706 B13R1.90 CCc1ccccc1OCC(=O)[13CH3] 1458a_100000182566_200025704644 [1,1,0,0,0,0|1,0,1]=4 4707 B13R1.90 CCc1ccccc1OCC(C)C 34a_100000210936_100000210624 [1,1,0,0,0,0|1,0,0]=3 4708 B13R1.90 CCc1ccccc1OCC(C)C 7a_100000210936_100000210760 [1,1,0,0,0,0|1,0,0]=3 4709 B13R1.90 CCc1ccccc1OCC(C)O 34a_100000210936_100011218427 [1,1,0,0,0,0|1,0,0]=3 4710 B13R1.90 CCc1ccccc1OCC(C)O 7a_100000210936_100011218427 [1,1,0,0,0,0|1,0,0]=3 4711 B13R1.90 CCc1ccccc1OCC(F)F 34a_100000210936_100011934356 [1,1,0,0,0,0|2,0,0]=4 4712 B13R1.90 CCc1ccccc1OCC(F)F 7a_100000210936_100011934356 [1,1,0,0,0,0|2,0,0]=4 4713 B13R1.90 CCc1ccccc1OC[C@@H](C)O 34a_100000210936_100009817552 [1,1,0,0,0,0|1,0,0]=3 4714 B13R1.90 CCc1ccccc1OC[C@@H](C)O 7a_100000210936_100009817552 [1,1,0,0,0,0|1,0,0]=3 4715 B13R1.90 CCc1ccccc1SCC(C)C 62a_100000210624_100011215823 [1,1,0,0,0,0|1,1,0]=4 4716 B13R1.90 CCc1ccccc1SCC(C)C 62a_100011215823_100000210760 [1,1,0,0,0,0|1,1,0]=4 4717 B13R1.90 CCc1ccccc1SCC(C)O 62a_100011215823_100011218427 [1,1,0,0,0,0|1,1,0]=4 4718 B13R1.90 CCc1ccccc1SCC(C)O 62a_100011218427_100011215823 [1,1,0,0,0,0|1,1,0]=4 4719 B13R1.90 CCc1ccccc1SC[C@@H](C)O 62a_100009817552_100011215823 [1,1,0,0,0,0|1,1,0]=4 4720 B13R1.90 CCc1ccccc1SC[C@@H](C)O 62a_100011215823_100009817552 [1,1,0,0,0,0|1,1,0]=4 4721 B13R1.90 CNc1ccccc1OCC(=O)N 34a_100000033821_100000187820 [1,1,0,0,0,0|1,0,1]=4 4722 B13R1.90 CNc1ccccc1OCC(C)C 34a_100000033821_100000210624 [1,1,0,0,0,0|1,0,0]=3 4723 B13R1.90 CNc1ccccc1OCC(C)C 34a_100000742603_200000210301 [1,1,0,0,0,0|1,0,0]=3 4724 B13R1.90 CNc1ccccc1OCC(C)O 34a_100000033821_100011218427 [1,1,0,0,0,0|1,0,0]=3 4725 B13R1.90 CNc1ccccc1OCC(F)F 2230a_100000688611_200000210301 [1,1,0,0,0,0|2,0,0]=4 4726 B13R1.90 CNc1ccccc1OCC(F)F 27a_100102657272_100000692002 [1,1,0,0,0,0|2,0,0]=4 4727 B13R1.90 CNc1ccccc1OCC(F)F 34a_100000033821_100011934356 [1,1,0,0,0,0|2,0,0]=4 4728 B13R1.90 CNc1ccccc1OCC(F)F 34a_100000688611_200000210301 [1,1,0,0,0,0|2,0,0]=4 4729 B13R1.90 CNc1ccccc1OC[C@@H](C)O 34a_100000033821_100009817552 [1,1,0,0,0,0|1,0,0]=3 4730 B13R1.90 CNc1ccccc1SCC(C)C 62a_100000210624_100020606079 [1,1,0,0,0,0|1,1,0]=4 4731 B13R1.90 CNc1ccccc1SCC(C)C 62a_100020606079_100000210760 [1,1,0,0,0,0|1,1,0]=4 4732 B13R1.90 CNc1ccccc1SCC(C)O 62a_100011218427_100020606079 [1,1,0,0,0,0|1,1,0]=4 4733 B13R1.90 CNc1ccccc1SCC(C)O 62a_100020606079_100011218427 [1,1,0,0,0,0|1,1,0]=4 4734 B13R1.90 CNc1ccccc1SC[C@@H](C)O 62a_100009817552_100020606079 [1,1,0,0,0,0|1,1,0]=4 4735 B13R1.90 CNc1ccccc1SC[C@@H](C)O 62a_100020606079_100009817552 [1,1,0,0,0,0|1,1,0]=4 4736 B13R1.90 COc1ccccc1NCC(C)C 34a_100000210025_100000210624 [1,1,0,0,0,0|2,0,0]=4 4737 B13R1.90 COc1ccccc1NCC(C)O 34a_100000210025_100011218427 [1,1,0,0,0,0|2,0,0]=4 4738 B13R1.90 COc1ccccc1NC[C@@H](C)O 34a_100000210025_100009817552 [1,1,0,0,0,0|2,0,0]=4 4739 B13R1.90 COc1ccccc1OCC(=O)C 1458a_100000182946_200000210301 [1,1,0,0,0,0|1,0,1]=4 4740 B13R1.90 COc1ccccc1OCC(=O)N 34a_100000210385_100000187820 [1,1,0,0,0,0|1,0,1]=4 4741 B13R1.90 COc1ccccc1OCC(=O)N 7a_100000162348_200000210301 [1,1,0,0,0,0|1,0,1]=4 4742 B13R1.90 COc1ccccc1OCC(=O)[13CH3] 1458a_100000182946_200025704644 [1,1,0,0,0,0|1,0,1]=4 4743 B13R1.90 COc1ccccc1OCC(C)C 34a_100000210385_100000210624 [1,1,0,0,0,0|1,0,0]=3 4744 B13R1.90 COc1ccccc1OCC(C)O 34a_100000210385_100011218427 [1,1,0,0,0,0|1,0,0]=3 4745 B13R1.90 COc1ccccc1OCC(F)F 34a_100000210385_100011934356 [1,1,0,0,0,0|2,0,0]=4 4746 B13R1.90 COc1ccccc1OC[C@@H](C)O 34a_100000210385_100009817552 [1,1,0,0,0,0|1,0,0]=3 4747 B13R1.90 COc1ccccc1SCC(C)C 62a_100000210334_100000210760 [1,1,0,0,0,0|1,1,0]=4 4748 B13R1.90 COc1ccccc1SCC(C)C 62a_100000210624_100000210334 [1,1,0,0,0,0|1,1,0]=4 4749 B13R1.90 COc1ccccc1SCC(C)O 62a_100000210334_100011218427 [1,1,0,0,0,0|1,1,0]=4 4750 B13R1.90 COc1ccccc1SCC(C)O 62a_100011218427_100000210334 [1,1,0,0,0,0|1,1,0]=4 4751 B13R1.90 COc1ccccc1SC[C@@H](C)O 62a_100000210334_100009817552 [1,1,0,0,0,0|1,1,0]=4 4752 B13R1.90 COc1ccccc1SC[C@@H](C)O 62a_100009817552_100000210334 [1,1,0,0,0,0|1,1,0]=4 4753 B13R1.90 COc1cccnc1OCC(C)C 34a_100025773188_100000210624 [1,1,0,0,0,0|2,0,0]=4 4754 B13R1.90 COc1cccnc1OCC(C)O 34a_100025773188_100011218427 [1,1,0,0,0,0|2,0,0]=4 4755 B13R1.90 COc1cccnc1OC[C@@H](C)O 34a_100025773188_100009817552 [1,1,0,0,0,0|2,0,0]=4 4756 B13R1.90 COc1ccncc1OCC(C)C 34a_100000101186_100000210624 [1,1,0,0,0,0|2,0,0]=4 4757 B13R1.90 COc1ccncc1OCC(C)O 34a_100000101186_100011218427 [1,1,0,0,0,0|2,0,0]=4 4758 B13R1.90 COc1ccncc1OC[C@@H](C)O 34a_100000101186_100009817552 [1,1,0,0,0,0|2,0,0]=4 4759 B13R1.90 COc1ncccc1OCC(C)C 34a_100000698397_100000210624 [1,1,0,0,0,0|2,0,0]=4 4760 B13R1.90 COc1ncccc1OCC(C)C 7a_100000698397_100000210760 [1,1,0,0,0,0|2,0,0]=4 4761 B13R1.90 COc1ncccc1OCC(C)O 34a_100000698397_100011218427 [1,1,0,0,0,0|2,0,0]=4 4762 B13R1.90 COc1ncccc1OCC(C)O 7a_100000698397_100011218427 [1,1,0,0,0,0|2,0,0]=4 4763 B13R1.90 COc1ncccc1OC[C@@H](C)O 34a_100000698397_100009817552 [1,1,0,0,0,0|2,0,0]=4 4764 B13R1.90 COc1ncccc1OC[C@@H](C)O 7a_100000698397_100009817552 [1,1,0,0,0,0|2,0,0]=4 4765 B13R1.90 CSc1ccccc1NCC(C)C 34a_100000211160_100000210624 [1,1,0,0,0,0|2,0,0]=4 4766 B13R1.90 CSc1ccccc1NCC(C)O 34a_100000211160_100011218427 [1,1,0,0,0,0|2,0,0]=4 4767 B13R1.90 CSc1ccccc1NC[C@@H](C)O 34a_100000211160_100009817552 [1,1,0,0,0,0|2,0,0]=4 4768 B13R1.90 CSc1ccccc1OCC(=O)N 34a_100011216402_100000187820 [1,1,0,0,0,0|1,0,1]=4 4769 B13R1.90 CSc1ccccc1OCC(=O)N 62a_200000148491_200000210301 [1,1,0,0,0,0|1,0,1]=4 4770 B13R1.90 CSc1ccccc1OCC(C)C 34a_100011216402_100000210624 [1,1,0,0,0,0|1,0,0]=3 4771 B13R1.90 CSc1ccccc1OCC(C)O 34a_100011216402_100011218427 [1,1,0,0,0,0|1,0,0]=3 4772 B13R1.90 CSc1ccccc1OCC(F)F 34a_100011216402_100011934356 [1,1,0,0,0,0|2,0,0]=4 4773 B13R1.90 CSc1ccccc1OCC(F)F 62a_100000692002_200000210301 [1,1,0,0,0,0|2,0,0]=4 4774 B13R1.90 CSc1ccccc1OCC(F)F 62a_200000210301_100000692002 [1,1,0,0,0,0|2,0,0]=4 4775 B13R1.90 CSc1ccccc1OC[C@@H](C)O 34a_100011216402_100009817552 [1,1,0,0,0,0|1,0,0]=3 4776 B13R1.90 CSc1ccccc1SCC(C)C 62a_100000210624_100011217816 [1,1,0,0,0,0|1,1,0]=4 4777 B13R1.90 CSc1ccccc1SCC(C)C 62a_100011217816_100000210760 [1,1,0,0,0,0|1,1,0]=4 4778 B13R1.90 CSc1ccccc1SCC(C)O 62a_100011217816_100011218427 [1,1,0,0,0,0|1,1,0]=4 4779 B13R1.90 CSc1ccccc1SCC(C)O 62a_100011218427_100011217816 [1,1,0,0,0,0|1,1,0]=4 4780 B13R1.90 CSc1ccccc1SC[C@@H](C)O 62a_100009817552_100011217816 [1,1,0,0,0,0|1,1,0]=4 4781 B13R1.90 CSc1ccccc1SC[C@@H](C)O 62a_100011217816_100009817552 [1,1,0,0,0,0|1,1,0]=4 4782 B13R1.90 C[C@@H](O)CNc1ccccc1CO 34a_100000212039_100009817552 [1,1,0,0,0,0|2,0,0]=4 4783 B13R1.90 C[C@@H](O)COc1ccccc1C#N 34a_100000211048_100009817552 [1,1,0,0,0,0|1,0,1]=4 4784 B13R1.90 C[C@@H](O)COc1ccccc1C#N 7a_100000211048_100009817552 [1,1,0,0,0,0|1,0,1]=4 4785 B13R1.90 C[C@@H](O)COc1ccccc1CN 34a_100000185550_100009817552 [1,1,0,0,0,0|1,0,0]=3 4786 B13R1.90 C[C@@H](O)COc1ccccc1CO 34a_100011216872_100009817552 [1,1,0,0,0,0|1,0,0]=3 4787 B13R1.90 C[C@@H](O)COc1cccnc1CBr 34a_200020655725_100009817552 [1,1,0,0,0,0|2,0,0]=4 4788 B13R1.90 C[C@@H](O)COc1cccnc1CBr 7a_200020655725_100009817552 [1,1,0,0,0,0|2,0,0]=4 4789 B13R1.90 C[C@@H](O)COc1cccnc1CO 34a_100000731849_100009817552 [1,1,0,0,0,0|2,0,0]=4 4790 B13R1.90 C[C@@H](O)COc1cnccc1CO 34a_100000078615_100009817552 [1,1,0,0,0,0|2,0,0]=4 4791 B13R1.90 C[C@@H](O)CSc1ccccc1CN 62a_100000689332_100009817552 [1,1,0,0,0,0|1,1,0]=4 4792 B13R1.90 C[C@@H](O)CSc1ccccc1CN 62a_100009817552_100000689332 [1,1,0,0,0,0|1,1,0]=4 4793 B13R1.90 C[C@@H](O)CSc1ccccc1CO 62a_100000187465_100009817552 [1,1,0,0,0,0|1,1,0]=4 4794 B13R1.90 C[C@@H](O)CSc1ccccc1CO 62a_100009817552_100000187465 [1,1,0,0,0,0|1,1,0]=4 4795 B13R1.90 NC(=O)COc1ccccc1CO 34a_100011216872_100000187820 [1,1,0,0,0,0|1,0,1]=4 4796 B13R1.90 NCc1ccccc1OCC(=O)N 34a_100000185550_100000187820 [1,1,0,0,0,0|1,0,1]=4 4797 B13R1.90 NCc1ccccc1OCC(F)F 34a_100000185550_100011934356 [1,1,0,0,0,0|2,0,0]=4 4798 B13R1.90 OCc1ccccc1OCC(F)F 34a_100011216872_100011934356 [1,1,0,0,0,0|2,0,0]=4 4799 B13R1.90 [13CH3]C(=O)COc1ccccc1CO 1458a_200011894254_200025704644 [1,1,0,0,0,0|1,0,1]=4 4800 B13R1.90 [13CH3]Nc1ccccc1OCC(F)F 2230a_100000688611_200025704644 [1,1,0,0,0,0|2,0,0]=4 4801 B13R1.90 [13CH3]Nc1ccccc1OCC(F)F 34a_100000688611_200025704644 [1,1,0,0,0,0|2,0,0]=4 4802 B13R1.90 [13CH3]Oc1ccccc1OCC(=O)N 7a_100000162348_200025704644 [1,1,0,0,0,0|1,0,1]=4 4803 B13R1.90 [13CH3]Sc1ccccc1OCC(=O)N 62a_200000148491_200025704644 [1,1,0,0,0,0|1,0,1]=4 4804 B13R1.90 [13CH3]Sc1ccccc1OCC(F)F 62a_100000692002_200025704644 [1,1,0,0,0,0|2,0,0]=4 4805 B13R1.90 [13CH3]Sc1ccccc1OCC(F)F 62a_200025704644_100000692002 [1,1,0,0,0,0|2,0,0]=4 4806 B13R1.150 C=C(C)COc1cccc(c1C)Br 34a_100012002258_100000748629 [1,1,0,0,0,0|1,0,1]=4 4807 B13R1.150 C=C(C)COc1cccc(c1C)Br 7a_100012002258_100000748629 [1,1,0,0,0,0|1,0,1]=4 4808 B13R1.150 C=C(C)COc1cccc(c1C)C 34a_100000185855_100000748629 [1,1,0,0,0,0|1,0,1]=4 4809 B13R1.150 C=C(C)COc1cccc(c1C)C 7a_100000185855_100000748629 [1,1,0,0,0,0|1,0,1]=4 4810 B13R1.150 C=C(C)COc1cccc(c1C)Cl 34a_100011265684_100000748629 [1,1,0,0,0,0|1,0,1]=4 4811 B13R1.150 C=C(C)COc1cccc(c1C)Cl 7a_100011265684_100000748629 [1,1,0,0,0,0|1,0,1]=4 4812 B13R1.150 C=C(C)COc1cccc(c1C)F 34a_100011217231_100000748629 [1,1,0,0,0,0|1,0,1]=4 4813 B13R1.150 C=C(C)COc1cccc(c1C)F 7a_100011217231_100000748629 [1,1,0,0,0,0|1,0,1]=4 4814 B13R1.150 C=C(C)COc1cccc(c1C)N 34a_100011216573_100000748629 [1,1,0,0,0,0|1,0,1]=4 4815 B13R1.150 C=C(C)COc1cccc(c1C)N 7a_100011216573_100000748629 [1,1,0,0,0,0|1,0,1]=4 4816 B13R1.150 CC(=O)COc1cccc(c1C)C 1458a_200000183798_200000210301 [1,1,0,0,0,0|1,0,1]=4 4817 B13R1.150 CC(C)COc1cccc(c1Br)Br 34a_100010187966_100000210624 [1,1,0,0,0,0|2,0,0]=4 4818 B13R1.150 CC(C)COc1cccc(c1Br)Br 7a_100010187966_100000210760 [1,1,0,0,0,0|2,0,0]=4 4819 B13R1.150 CC(C)COc1cccc(c1Br)Cl 34a_100012348804_100000210624 [1,1,0,0,0,0|2,0,0]=4 4820 B13R1.150 CC(C)COc1cccc(c1Br)Cl 7a_100012348804_100000210760 [1,1,0,0,0,0|2,0,0]=4 4821 B13R1.150 CC(C)COc1cccc(c1Br)F 34a_100009820682_100000210624 [1,1,0,0,0,0|2,0,0]=4 4822 B13R1.150 CC(C)COc1cccc(c1Br)F 7a_100009820682_100000210760 [1,1,0,0,0,0|2,0,0]=4 4823 B13R1.150 CC(C)COc1cccc(c1Br)I 34a_100010187914_100000210624 [1,1,0,0,0,0|2,0,0]=4 4824 B13R1.150 CC(C)COc1cccc(c1Br)I 7a_100010187914_100000210760 [1,1,0,0,0,0|2,0,0]=4 4825 B13R1.150 CC(C)COc1cccc(c1Br)N 34a_100012183704_100000210624 [1,1,0,0,0,0|2,0,0]=4 4826 B13R1.150 CC(C)COc1cccc(c1Br)N 7a_100012183704_100000210760 [1,1,0,0,0,0|2,0,0]=4 4827 B13R1.150 CC(C)COc1cccc(c1Cl)Br 34a_100010187913_100000210624 [1,1,0,0,0,0|2,0,0]=4 4828 B13R1.150 CC(C)COc1cccc(c1Cl)Br 7a_100010187913_100000210760 [1,1,0,0,0,0|2,0,0]=4 4829 B13R1.150 CC(C)COc1cccc(c1Cl)Cl 34a_100000211076_100000210624 [1,1,0,0,0,0|2,0,0]=4 4830 B13R1.150 CC(C)COc1cccc(c1Cl)Cl 7a_100000211076_100000210760 [1,1,0,0,0,0|2,0,0]=4 4831 B13R1.150 CC(C)COc1cccc(c1Cl)F 34a_100000087408_100000210624 [1,1,0,0,0,0|2,0,0]=4 4832 B13R1.150 CC(C)COc1cccc(c1Cl)F 7a_100000087408_100000210760 [1,1,0,0,0,0|2,0,0]=4 4833 B13R1.150 CC(C)COc1cccc(c1Cl)I 34a_100000049636_100000210624 [1,1,0,0,0,0|2,0,0]=4 4834 B13R1.150 CC(C)COc1cccc(c1Cl)I 7a_100000049636_100000210760 [1,1,0,0,0,0|2,0,0]=4 4835 B13R1.150 CC(C)COc1cccc(c1Cl)N 34a_100012002038_100000210624 [1,1,0,0,0,0|2,0,0]=4 4836 B13R1.150 CC(C)COc1cccc(c1Cl)N 7a_100012002038_100000210760 [1,1,0,0,0,0|2,0,0]=4 4837 B13R1.150 CC(C)COc1cccc(c1F)Br 34a_100009817021_100000210624 [1,1,0,0,0,0|2,0,0]=4 4838 B13R1.150 CC(C)COc1cccc(c1F)Br 7a_100009817021_100000210760 [1,1,0,0,0,0|2,0,0]=4 4839 B13R1.150 CC(C)COc1cccc(c1F)Cl 34a_100000687438_100000210624 [1,1,0,0,0,0|2,0,0]=4 4840 B13R1.150 CC(C)COc1cccc(c1F)Cl 7a_100000687438_100000210760 [1,1,0,0,0,0|2,0,0]=4 4841 B13R1.150 CC(C)COc1cccc(c1F)F 34a_100000751161_100000210624 [1,1,0,0,0,0|2,0,0]=4 4842 B13R1.150 CC(C)COc1cccc(c1F)F 7a_100000751161_100000210760 [1,1,0,0,0,0|2,0,0]=4 4843 B13R1.150 CC(C)COc1cccc(c1I)Br 34a_100010187912_100000210624 [1,1,0,0,0,0|2,0,0]=4 4844 B13R1.150 CC(C)COc1cccc(c1I)Br 7a_100010187912_100000210760 [1,1,0,0,0,0|2,0,0]=4 4845 B13R1.150 CC(C)COc1cccc(c1I)Cl 34a_100000050174_100000210624 [1,1,0,0,0,0|2,0,0]=4 4846 B13R1.150 CC(C)COc1cccc(c1I)Cl 7a_100000050174_100000210760 [1,1,0,0,0,0|2,0,0]=4 4847 B13R1.150 CC(C)COc1cccc(c1I)F 34a_100000690913_100000210624 [1,1,0,0,0,0|2,0,0]=4 4848 B13R1.150 CC(C)COc1cccc(c1I)F 7a_100000690913_100000210760 [1,1,0,0,0,0|2,0,0]=4 4849 B13R1.150 CC(C)COc1cccc(c1N)Br 34a_100011934926_100000210624 [1,1,0,0,0,0|2,0,0]=4 4850 B13R1.150 CC(C)COc1cccc(c1N)Br 7a_100011934926_100000210760 [1,1,0,0,0,0|2,0,0]=4 4851 B13R1.150 CC(C)COc1cccc(c1N)Cl 34a_100012022510_100000210624 [1,1,0,0,0,0|2,0,0]=4 4852 B13R1.150 CC(C)COc1cccc(c1N)Cl 7a_100012022510_100000210760 [1,1,0,0,0,0|2,0,0]=4 4853 B13R1.150 CC(C)COc1cccc(c1N)F 34a_100020591140_100000210624 [1,1,0,0,0,0|2,0,0]=4 4854 B13R1.150 CC(C)COc1cccc(c1N)F 7a_100020591140_100000210760 [1,1,0,0,0,0|2,0,0]=4 4855 B13R1.150 CC(C)COc1cccc(c1N)I 34a_200000049512_100000210624 [1,1,0,0,0,0|2,0,0]=4 4856 B13R1.150 CC(C)COc1cccc(c1N)I 7a_200000049512_100000210760 [1,1,0,0,0,0|2,0,0]=4 4857 B13R1.150 CC(C)COc1cccc(c1N)N 34a_100000033209_100000210624 [1,1,0,0,0,0|2,0,0]=4 4858 B13R1.150 CC(O)COc1cccc(c1Br)Br 34a_100010187966_100011218427 [1,1,0,0,0,0|2,0,0]=4 4859 B13R1.150 CC(O)COc1cccc(c1Br)Br 7a_100010187966_100011218427 [1,1,0,0,0,0|2,0,0]=4 4860 B13R1.150 CC(O)COc1cccc(c1Br)Cl 34a_100012348804_100011218427 [1,1,0,0,0,0|2,0,0]=4 4861 B13R1.150 CC(O)COc1cccc(c1Br)Cl 7a_100012348804_100011218427 [1,1,0,0,0,0|2,0,0]=4 4862 B13R1.150 CC(O)COc1cccc(c1Br)F 34a_100009820682_100011218427 [1,1,0,0,0,0|2,0,0]=4 4863 B13R1.150 CC(O)COc1cccc(c1Br)F 7a_100009820682_100011218427 [1,1,0,0,0,0|2,0,0]=4 4864 B13R1.150 CC(O)COc1cccc(c1Br)I 34a_100010187914_100011218427 [1,1,0,0,0,0|2,0,0]=4 4865 B13R1.150 CC(O)COc1cccc(c1Br)I 7a_100010187914_100011218427 [1,1,0,0,0,0|2,0,0]=4 4866 B13R1.150 CC(O)COc1cccc(c1Br)N 34a_100012183704_100011218427 [1,1,0,0,0,0|2,0,0]=4 4867 B13R1.150 CC(O)COc1cccc(c1Br)N 7a_100012183704_100011218427 [1,1,0,0,0,0|2,0,0]=4 4868 B13R1.150 CC(O)COc1cccc(c1Cl)Br 34a_100010187913_100011218427 [1,1,0,0,0,0|2,0,0]=4 4869 B13R1.150 CC(O)COc1cccc(c1Cl)Br 7a_100010187913_100011218427 [1,1,0,0,0,0|2,0,0]=4 4870 B13R1.150 CC(O)COc1cccc(c1Cl)Cl 34a_100000211076_100011218427 [1,1,0,0,0,0|2,0,0]=4 4871 B13R1.150 CC(O)COc1cccc(c1Cl)Cl 7a_100000211076_100011218427 [1,1,0,0,0,0|2,0,0]=4 4872 B13R1.150 CC(O)COc1cccc(c1Cl)F 34a_100000087408_100011218427 [1,1,0,0,0,0|2,0,0]=4 4873 B13R1.150 CC(O)COc1cccc(c1Cl)F 7a_100000087408_100011218427 [1,1,0,0,0,0|2,0,0]=4 4874 B13R1.150 CC(O)COc1cccc(c1Cl)I 34a_100000049636_100011218427 [1,1,0,0,0,0|2,0,0]=4 4875 B13R1.150 CC(O)COc1cccc(c1Cl)I 7a_100000049636_100011218427 [1,1,0,0,0,0|2,0,0]=4 4876 B13R1.150 CC(O)COc1cccc(c1Cl)N 34a_100012002038_100011218427 [1,1,0,0,0,0|2,0,0]=4 4877 B13R1.150 CC(O)COc1cccc(c1Cl)N 7a_100012002038_100011218427 [1,1,0,0,0,0|2,0,0]=4 4878 B13R1.150 CC(O)COc1cccc(c1F)Br 34a_100009817021_100011218427 [1,1,0,0,0,0|2,0,0]=4 4879 B13R1.150 CC(O)COc1cccc(c1F)Br 7a_100009817021_100011218427 [1,1,0,0,0,0|2,0,0]=4 4880 B13R1.150 CC(O)COc1cccc(c1F)Cl 34a_100000687438_100011218427 [1,1,0,0,0,0|2,0,0]=4 4881 B13R1.150 CC(O)COc1cccc(c1F)Cl 7a_100000687438_100011218427 [1,1,0,0,0,0|2,0,0]=4 4882 B13R1.150 CC(O)COc1cccc(c1F)F 34a_100000751161_100011218427 [1,1,0,0,0,0|2,0,0]=4 4883 B13R1.150 CC(O)COc1cccc(c1F)F 7a_100000751161_100011218427 [1,1,0,0,0,0|2,0,0]=4 4884 B13R1.150 CC(O)COc1cccc(c1I)Br 34a_100010187912_100011218427 [1,1,0,0,0,0|2,0,0]=4 4885 B13R1.150 CC(O)COc1cccc(c1I)Br 7a_100010187912_100011218427 [1,1,0,0,0,0|2,0,0]=4 4886 B13R1.150 CC(O)COc1cccc(c1I)Cl 34a_100000050174_100011218427 [1,1,0,0,0,0|2,0,0]=4 4887 B13R1.150 CC(O)COc1cccc(c1I)Cl 7a_100000050174_100011218427 [1,1,0,0,0,0|2,0,0]=4 4888 B13R1.150 CC(O)COc1cccc(c1I)F 34a_100000690913_100011218427 [1,1,0,0,0,0|2,0,0]=4 4889 B13R1.150 CC(O)COc1cccc(c1I)F 7a_100000690913_100011218427 [1,1,0,0,0,0|2,0,0]=4 4890 B13R1.150 CC(O)COc1cccc(c1N)Br 34a_100011934926_100011218427 [1,1,0,0,0,0|2,0,0]=4 4891 B13R1.150 CC(O)COc1cccc(c1N)Br 7a_100011934926_100011218427 [1,1,0,0,0,0|2,0,0]=4 4892 B13R1.150 CC(O)COc1cccc(c1N)Cl 34a_100012022510_100011218427 [1,1,0,0,0,0|2,0,0]=4 4893 B13R1.150 CC(O)COc1cccc(c1N)Cl 7a_100012022510_100011218427 [1,1,0,0,0,0|2,0,0]=4 4894 B13R1.150 CC(O)COc1cccc(c1N)F 34a_100020591140_100011218427 [1,1,0,0,0,0|2,0,0]=4 4895 B13R1.150 CC(O)COc1cccc(c1N)F 7a_100020591140_100011218427 [1,1,0,0,0,0|2,0,0]=4 4896 B13R1.150 CC(O)COc1cccc(c1N)I 34a_200000049512_100011218427 [1,1,0,0,0,0|2,0,0]=4 4897 B13R1.150 CC(O)COc1cccc(c1N)I 7a_200000049512_100011218427 [1,1,0,0,0,0|2,0,0]=4 4898 B13R1.150 CC(O)COc1cccc(c1N)N 34a_100000033209_100011218427 [1,1,0,0,0,0|2,0,0]=4 4899 B13R1.150 C[C@@H](O)COc1cccc(c1Br)Br 34a_100010187966_100009817552 [1,1,0,0,0,0|2,0,0]=4 4900 B13R1.150 C[C@@H](O)COc1cccc(c1Br)Br 7a_100010187966_100009817552 [1,1,0,0,0,0|2,0,0]=4 4901 B13R1.150 C[C@@H](O)COc1cccc(c1Br)Cl 34a_100012348804_100009817552 [1,1,0,0,0,0|2,0,0]=4 4902 B13R1.150 C[C@@H](O)COc1cccc(c1Br)Cl 7a_100012348804_100009817552 [1,1,0,0,0,0|2,0,0]=4 4903 B13R1.150 C[C@@H](O)COc1cccc(c1Br)F 34a_100009820682_100009817552 [1,1,0,0,0,0|2,0,0]=4 4904 B13R1.150 C[C@@H](O)COc1cccc(c1Br)F 7a_100009820682_100009817552 [1,1,0,0,0,0|2,0,0]=4 4905 B13R1.150 C[C@@H](O)COc1cccc(c1Br)I 34a_100010187914_100009817552 [1,1,0,0,0,0|2,0,0]=4 4906 B13R1.150 C[C@@H](O)COc1cccc(c1Br)I 7a_100010187914_100009817552 [1,1,0,0,0,0|2,0,0]=4 4907 B13R1.150 C[C@@H](O)COc1cccc(c1Br)N 34a_100012183704_100009817552 [1,1,0,0,0,0|2,0,0]=4 4908 B13R1.150 C[C@@H](O)COc1cccc(c1Br)N 7a_100012183704_100009817552 [1,1,0,0,0,0|2,0,0]=4 4909 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)Br 34a_100010187913_100009817552 [1,1,0,0,0,0|2,0,0]=4 4910 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)Br 7a_100010187913_100009817552 [1,1,0,0,0,0|2,0,0]=4 4911 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)Cl 34a_100000211076_100009817552 [1,1,0,0,0,0|2,0,0]=4 4912 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)Cl 7a_100000211076_100009817552 [1,1,0,0,0,0|2,0,0]=4 4913 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)F 34a_100000087408_100009817552 [1,1,0,0,0,0|2,0,0]=4 4914 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)F 7a_100000087408_100009817552 [1,1,0,0,0,0|2,0,0]=4 4915 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)I 34a_100000049636_100009817552 [1,1,0,0,0,0|2,0,0]=4 4916 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)I 7a_100000049636_100009817552 [1,1,0,0,0,0|2,0,0]=4 4917 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)N 34a_100012002038_100009817552 [1,1,0,0,0,0|2,0,0]=4 4918 B13R1.150 C[C@@H](O)COc1cccc(c1Cl)N 7a_100012002038_100009817552 [1,1,0,0,0,0|2,0,0]=4 4919 B13R1.150 C[C@@H](O)COc1cccc(c1F)Br 34a_100009817021_100009817552 [1,1,0,0,0,0|2,0,0]=4 4920 B13R1.150 C[C@@H](O)COc1cccc(c1F)Br 7a_100009817021_100009817552 [1,1,0,0,0,0|2,0,0]=4 4921 B13R1.150 C[C@@H](O)COc1cccc(c1F)Cl 34a_100000687438_100009817552 [1,1,0,0,0,0|2,0,0]=4 4922 B13R1.150 C[C@@H](O)COc1cccc(c1F)Cl 7a_100000687438_100009817552 [1,1,0,0,0,0|2,0,0]=4 4923 B13R1.150 C[C@@H](O)COc1cccc(c1F)F 34a_100000751161_100009817552 [1,1,0,0,0,0|2,0,0]=4 4924 B13R1.150 C[C@@H](O)COc1cccc(c1F)F 7a_100000751161_100009817552 [1,1,0,0,0,0|2,0,0]=4 4925 B13R1.150 C[C@@H](O)COc1cccc(c1I)Br 34a_100010187912_100009817552 [1,1,0,0,0,0|2,0,0]=4 4926 B13R1.150 C[C@@H](O)COc1cccc(c1I)Br 7a_100010187912_100009817552 [1,1,0,0,0,0|2,0,0]=4 4927 B13R1.150 C[C@@H](O)COc1cccc(c1I)Cl 34a_100000050174_100009817552 [1,1,0,0,0,0|2,0,0]=4 4928 B13R1.150 C[C@@H](O)COc1cccc(c1I)Cl 7a_100000050174_100009817552 [1,1,0,0,0,0|2,0,0]=4 4929 B13R1.150 C[C@@H](O)COc1cccc(c1I)F 34a_100000690913_100009817552 [1,1,0,0,0,0|2,0,0]=4 4930 B13R1.150 C[C@@H](O)COc1cccc(c1I)F 7a_100000690913_100009817552 [1,1,0,0,0,0|2,0,0]=4 4931 B13R1.150 C[C@@H](O)COc1cccc(c1N)Br 34a_100011934926_100009817552 [1,1,0,0,0,0|2,0,0]=4 4932 B13R1.150 C[C@@H](O)COc1cccc(c1N)Br 7a_100011934926_100009817552 [1,1,0,0,0,0|2,0,0]=4 4933 B13R1.150 C[C@@H](O)COc1cccc(c1N)Cl 34a_100012022510_100009817552 [1,1,0,0,0,0|2,0,0]=4 4934 B13R1.150 C[C@@H](O)COc1cccc(c1N)Cl 7a_100012022510_100009817552 [1,1,0,0,0,0|2,0,0]=4 4935 B13R1.150 C[C@@H](O)COc1cccc(c1N)F 34a_100020591140_100009817552 [1,1,0,0,0,0|2,0,0]=4 4936 B13R1.150 C[C@@H](O)COc1cccc(c1N)F 7a_100020591140_100009817552 [1,1,0,0,0,0|2,0,0]=4 4937 B13R1.150 C[C@@H](O)COc1cccc(c1N)I 34a_200000049512_100009817552 [1,1,0,0,0,0|2,0,0]=4 4938 B13R1.150 C[C@@H](O)COc1cccc(c1N)I 7a_200000049512_100009817552 [1,1,0,0,0,0|2,0,0]=4 4939 B13R1.150 C[C@@H](O)COc1cccc(c1N)N 34a_100000033209_100009817552 [1,1,0,0,0,0|2,0,0]=4 4940 B13R1.150 Cc1c(cccc1NCC(C)C)Br 34a_100000750434_100000210624 [1,1,0,0,0,0|2,0,0]=4 4941 B13R1.150 Cc1c(cccc1NCC(C)C)Cl 2230a_100000210441_100000210760 [1,1,0,0,0,0|2,0,0]=4 4942 B13R1.150 Cc1c(cccc1NCC(C)C)Cl 34a_100000210441_100000210624 [1,1,0,0,0,0|2,0,0]=4 4943 B13R1.150 Cc1c(cccc1NCC(C)C)Cl 7a_100000210441_100000210760 [1,1,0,0,0,0|2,0,0]=4 4944 B13R1.150 Cc1c(cccc1NCC(C)C)F 34a_100000745574_100000210624 [1,1,0,0,0,0|2,0,0]=4 4945 B13R1.150 Cc1c(cccc1NCC(C)C)F 7a_100000745574_100000210760 [1,1,0,0,0,0|2,0,0]=4 4946 B13R1.150 Cc1c(cccc1NCC(C)C)I 34a_100000761887_100000210624 [1,1,0,0,0,0|2,0,0]=4 4947 B13R1.150 Cc1c(cccc1NCC(C)C)O 34a_100011216573_100000210624 [1,1,0,0,0,0|2,0,0]=4 4948 B13R1.150 Cc1c(cccc1NCC(C)C)O 7a_100011216573_100000210760 [1,1,0,0,0,0|2,0,0]=4 4949 B13R1.150 Cc1c(cccc1NCC(C)O)Br 34a_100000750434_100011218427 [1,1,0,0,0,0|2,0,0]=4 4950 B13R1.150 Cc1c(cccc1NCC(C)O)Cl 2230a_100000210441_100011218427 [1,1,0,0,0,0|2,0,0]=4 4951 B13R1.150 Cc1c(cccc1NCC(C)O)Cl 34a_100000210441_100011218427 [1,1,0,0,0,0|2,0,0]=4 4952 B13R1.150 Cc1c(cccc1NCC(C)O)Cl 7a_100000210441_100011218427 [1,1,0,0,0,0|2,0,0]=4 4953 B13R1.150 Cc1c(cccc1NCC(C)O)F 34a_100000745574_100011218427 [1,1,0,0,0,0|2,0,0]=4 4954 B13R1.150 Cc1c(cccc1NCC(C)O)F 7a_100000745574_100011218427 [1,1,0,0,0,0|2,0,0]=4 4955 B13R1.150 Cc1c(cccc1NCC(C)O)I 34a_100000761887_100011218427 [1,1,0,0,0,0|2,0,0]=4 4956 B13R1.150 Cc1c(cccc1NCC(C)O)O 34a_100011216573_100011218427 [1,1,0,0,0,0|2,0,0]=4 4957 B13R1.150 Cc1c(cccc1NCC(C)O)O 7a_100011216573_100011218427 [1,1,0,0,0,0|2,0,0]=4 4958 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)Br 34a_100000750434_100009817552 [1,1,0,0,0,0|2,0,0]=4 4959 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)Cl 2230a_100000210441_100009817552 [1,1,0,0,0,0|2,0,0]=4 4960 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)Cl 34a_100000210441_100009817552 [1,1,0,0,0,0|2,0,0]=4 4961 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)Cl 7a_100000210441_100009817552 [1,1,0,0,0,0|2,0,0]=4 4962 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)F 34a_100000745574_100009817552 [1,1,0,0,0,0|2,0,0]=4 4963 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)F 7a_100000745574_100009817552 [1,1,0,0,0,0|2,0,0]=4 4964 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)I 34a_100000761887_100009817552 [1,1,0,0,0,0|2,0,0]=4 4965 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)O 34a_100011216573_100009817552 [1,1,0,0,0,0|2,0,0]=4 4966 B13R1.150 Cc1c(cccc1NC[C@@H](C)O)O 7a_100011216573_100009817552 [1,1,0,0,0,0|2,0,0]=4 4967 B13R1.150 Cc1c(cccc1OCC(=O)N)Br 34a_100012002258_100000187820 [1,1,0,0,0,0|1,0,1]=4 4968 B13R1.150 Cc1c(cccc1OCC(=O)N)Br 7a_100012002258_100000187820 [1,1,0,0,0,0|1,0,1]=4 4969 B13R1.150 Cc1c(cccc1OCC(=O)N)Cl 34a_100011265684_100000187820 [1,1,0,0,0,0|1,0,1]=4 4970 B13R1.150 Cc1c(cccc1OCC(=O)N)Cl 7a_100011265684_100000187820 [1,1,0,0,0,0|1,0,1]=4 4971 B13R1.150 Cc1c(cccc1OCC(=O)N)F 34a_100011217231_100000187820 [1,1,0,0,0,0|1,0,1]=4 4972 B13R1.150 Cc1c(cccc1OCC(=O)N)F 7a_100011217231_100000187820 [1,1,0,0,0,0|1,0,1]=4 4973 B13R1.150 Cc1c(cccc1OCC(=O)N)N 34a_100011216573_100000187820 [1,1,0,0,0,0|1,0,1]=4 4974 B13R1.150 Cc1c(cccc1OCC(=O)N)N 7a_100011216573_100000187820 [1,1,0,0,0,0|1,0,1]=4 4975 B13R1.150 Cc1c(cccc1OCC(C)C)Br 34a_100012002258_100000210624 [1,1,0,0,0,0|1,0,0]=3 4976 B13R1.150 Cc1c(cccc1OCC(C)C)Br 7a_100012002258_100000210760 [1,1,0,0,0,0|1,0,0]=3 4977 B13R1.150 Cc1c(cccc1OCC(C)C)Cl 34a_100011265684_100000210624 [1,1,0,0,0,0|1,0,0]=3 4978 B13R1.150 Cc1c(cccc1OCC(C)C)Cl 7a_100011265684_100000210760 [1,1,0,0,0,0|1,0,0]=3 4979 B13R1.150 Cc1c(cccc1OCC(C)C)F 34a_100011217231_100000210624 [1,1,0,0,0,0|1,0,0]=3 4980 B13R1.150 Cc1c(cccc1OCC(C)C)F 7a_100011217231_100000210760 [1,1,0,0,0,0|1,0,0]=3 4981 B13R1.150 Cc1c(cccc1OCC(C)C)N 34a_100011216573_100000210624 [1,1,0,0,0,0|1,0,0]=3 4982 B13R1.150 Cc1c(cccc1OCC(C)C)N 7a_100011216573_100000210760 [1,1,0,0,0,0|1,0,0]=3 4983 B13R1.150 Cc1c(cccc1OCC(C)O)Br 34a_100012002258_100011218427 [1,1,0,0,0,0|1,0,0]=3 4984 B13R1.150 Cc1c(cccc1OCC(C)O)Br 7a_100012002258_100011218427 [1,1,0,0,0,0|1,0,0]=3 4985 B13R1.150 Cc1c(cccc1OCC(C)O)Cl 34a_100011265684_100011218427 [1,1,0,0,0,0|1,0,0]=3 4986 B13R1.150 Cc1c(cccc1OCC(C)O)Cl 7a_100011265684_100011218427 [1,1,0,0,0,0|1,0,0]=3 4987 B13R1.150 Cc1c(cccc1OCC(C)O)F 34a_100011217231_100011218427 [1,1,0,0,0,0|1,0,0]=3 4988 B13R1.150 Cc1c(cccc1OCC(C)O)F 7a_100011217231_100011218427 [1,1,0,0,0,0|1,0,0]=3 4989 B13R1.150 Cc1c(cccc1OCC(C)O)N 34a_100011216573_100011218427 [1,1,0,0,0,0|1,0,0]=3 4990 B13R1.150 Cc1c(cccc1OCC(C)O)N 7a_100011216573_100011218427 [1,1,0,0,0,0|1,0,0]=3 4991 B13R1.150 Cc1c(cccc1OCC(F)F)Br 34a_100012002258_100011934356 [1,1,0,0,0,0|2,0,0]=4 4992 B13R1.150 Cc1c(cccc1OCC(F)F)Br 7a_100012002258_100011934356 [1,1,0,0,0,0|2,0,0]=4 4993 B13R1.150 Cc1c(cccc1OCC(F)F)Cl 34a_100011265684_100011934356 [1,1,0,0,0,0|2,0,0]=4 4994 B13R1.150 Cc1c(cccc1OCC(F)F)Cl 7a_100011265684_100011934356 [1,1,0,0,0,0|2,0,0]=4 4995 B13R1.150 Cc1c(cccc1OCC(F)F)F 34a_100011217231_100011934356 [1,1,0,0,0,0|2,0,0]=4 4996 B13R1.150 Cc1c(cccc1OCC(F)F)F 7a_100011217231_100011934356 [1,1,0,0,0,0|2,0,0]=4 4997 B13R1.150 Cc1c(cccc1OCC(F)F)N 34a_100011216573_100011934356 [1,1,0,0,0,0|2,0,0]=4 4998 B13R1.150 Cc1c(cccc1OCC(F)F)N 7a_100011216573_100011934356 [1,1,0,0,0,0|2,0,0]=4 4999 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)Br 34a_100012002258_100009817552 [1,1,0,0,0,0|1,0,0]=3 5000 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)Br 7a_100012002258_100009817552 [1,1,0,0,0,0|1,0,0]=3 5001 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)Cl 34a_100011265684_100009817552 [1,1,0,0,0,0|1,0,0]=3 5002 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)Cl 7a_100011265684_100009817552 [1,1,0,0,0,0|1,0,0]=3 5003 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)F 34a_100011217231_100009817552 [1,1,0,0,0,0|1,0,0]=3 5004 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)F 7a_100011217231_100009817552 [1,1,0,0,0,0|1,0,0]=3 5005 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)N 34a_100011216573_100009817552 [1,1,0,0,0,0|1,0,0]=3 5006 B13R1.150 Cc1c(cccc1OC[C@@H](C)O)N 7a_100011216573_100009817552 [1,1,0,0,0,0|1,0,0]=3 5007 B13R1.150 Cc1c(cccc1SCC(C)C)Br 62a_100000210624_100012353703 [1,1,0,0,0,0|1,1,0]=4 5008 B13R1.150 Cc1c(cccc1SCC(C)C)Br 62a_100012353703_100000210760 [1,1,0,0,0,0|1,1,0]=4 5009 B13R1.150 Cc1c(cccc1SCC(C)C)Cl 62a_100000210624_100000726075 [1,1,0,0,0,0|1,1,0]=4 5010 B13R1.150 Cc1c(cccc1SCC(C)C)Cl 62a_100000726075_100000210760 [1,1,0,0,0,0|1,1,0]=4 5011 B13R1.150 Cc1c(cccc1SCC(C)C)F 62a_100000210624_100011216893 [1,1,0,0,0,0|1,1,0]=4 5012 B13R1.150 Cc1c(cccc1SCC(C)C)F 62a_100011216893_100000210760 [1,1,0,0,0,0|1,1,0]=4 5013 B13R1.150 Cc1c(cccc1SCC(C)C)N 62a_100000210624_100000761887 [1,1,0,0,0,0|1,1,0]=4 5014 B13R1.150 Cc1c(cccc1SCC(C)C)N 62a_100000761887_100000210760 [1,1,0,0,0,0|1,1,0]=4 5015 B13R1.150 Cc1c(cccc1SCC(C)C)O 62a_100000210624_100012002258 [1,1,0,0,0,0|1,1,0]=4 5016 B13R1.150 Cc1c(cccc1SCC(C)C)O 62a_100012002258_100000210760 [1,1,0,0,0,0|1,1,0]=4 5017 B13R1.150 Cc1c(cccc1SCC(C)O)Br 62a_100011218427_100012353703 [1,1,0,0,0,0|1,1,0]=4 5018 B13R1.150 Cc1c(cccc1SCC(C)O)Br 62a_100012353703_100011218427 [1,1,0,0,0,0|1,1,0]=4 5019 B13R1.150 Cc1c(cccc1SCC(C)O)Cl 62a_100000726075_100011218427 [1,1,0,0,0,0|1,1,0]=4 5020 B13R1.150 Cc1c(cccc1SCC(C)O)Cl 62a_100011218427_100000726075 [1,1,0,0,0,0|1,1,0]=4 5021 B13R1.150 Cc1c(cccc1SCC(C)O)F 62a_100011216893_100011218427 [1,1,0,0,0,0|1,1,0]=4 5022 B13R1.150 Cc1c(cccc1SCC(C)O)F 62a_100011218427_100011216893 [1,1,0,0,0,0|1,1,0]=4 5023 B13R1.150 Cc1c(cccc1SCC(C)O)N 62a_100000761887_100011218427 [1,1,0,0,0,0|1,1,0]=4 5024 B13R1.150 Cc1c(cccc1SCC(C)O)N 62a_100011218427_100000761887 [1,1,0,0,0,0|1,1,0]=4 5025 B13R1.150 Cc1c(cccc1SCC(C)O)O 62a_100011218427_100012002258 [1,1,0,0,0,0|1,1,0]=4 5026 B13R1.150 Cc1c(cccc1SCC(C)O)O 62a_100012002258_100011218427 [1,1,0,0,0,0|1,1,0]=4 5027 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)Br 62a_100009817552_100012353703 [1,1,0,0,0,0|1,1,0]=4 5028 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)Br 62a_100012353703_100009817552 [1,1,0,0,0,0|1,1,0]=4 5029 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)Cl 62a_100000726075_100009817552 [1,1,0,0,0,0|1,1,0]=4 5030 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)Cl 62a_100009817552_100000726075 [1,1,0,0,0,0|1,1,0]=4 5031 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)F 62a_100009817552_100011216893 [1,1,0,0,0,0|1,1,0]=4 5032 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)F 62a_100011216893_100009817552 [1,1,0,0,0,0|1,1,0]=4 5033 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)N 62a_100000761887_100009817552 [1,1,0,0,0,0|1,1,0]=4 5034 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)N 62a_100009817552_100000761887 [1,1,0,0,0,0|1,1,0]=4 5035 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)O 62a_100009817552_100012002258 [1,1,0,0,0,0|1,1,0]=4 5036 B13R1.150 Cc1c(cccc1SC[C@@H](C)O)O 62a_100012002258_100009817552 [1,1,0,0,0,0|1,1,0]=4 5037 B13R1.150 Cc1c(ccnc1OCC(C)C)Br 34a_100009858498_100000210624 [1,1,0,0,0,0|2,0,0]=4 5038 B13R1.150 Cc1c(ccnc1OCC(C)O)Br 34a_100009858498_100011218427 [1,1,0,0,0,0|2,0,0]=4 5039 B13R1.150 Cc1c(ccnc1OC[C@@H](C)O)Br 34a_100009858498_100009817552 [1,1,0,0,0,0|2,0,0]=4 5040 B13R1.150 Cc1cccc(c1Br)OCC(C)C 34a_100000686692_100000210624 [1,1,0,0,0,0|2,0,0]=4 5041 B13R1.150 Cc1cccc(c1Br)OCC(C)C 7a_100000686692_100000210760 [1,1,0,0,0,0|2,0,0]=4 5042 B13R1.150 Cc1cccc(c1Br)OCC(C)O 34a_100000686692_100011218427 [1,1,0,0,0,0|2,0,0]=4 5043 B13R1.150 Cc1cccc(c1Br)OCC(C)O 7a_100000686692_100011218427 [1,1,0,0,0,0|2,0,0]=4 5044 B13R1.150 Cc1cccc(c1Br)OC[C@@H](C)O 34a_100000686692_100009817552 [1,1,0,0,0,0|2,0,0]=4 5045 B13R1.150 Cc1cccc(c1Br)OC[C@@H](C)O 7a_100000686692_100009817552 [1,1,0,0,0,0|2,0,0]=4 5046 B13R1.150 Cc1cccc(c1C)NCC(C)C 2230a_100000210026_100000210760 [1,1,0,0,0,0|2,0,0]=4 5047 B13R1.150 Cc1cccc(c1C)NCC(C)C 34a_100000210026_100000210624 [1,1,0,0,0,0|2,0,0]=4 5048 B13R1.150 Cc1cccc(c1C)NCC(C)C 7a_100000210026_100000210760 [1,1,0,0,0,0|2,0,0]=4 5049 B13R1.150 Cc1cccc(c1C)NCC(C)O 2230a_100000210026_100011218427 [1,1,0,0,0,0|2,0,0]=4 5050 B13R1.150 Cc1cccc(c1C)NCC(C)O 34a_100000210026_100011218427 [1,1,0,0,0,0|2,0,0]=4 5051 B13R1.150 Cc1cccc(c1C)NCC(C)O 7a_100000210026_100011218427 [1,1,0,0,0,0|2,0,0]=4 5052 B13R1.150 Cc1cccc(c1C)NC[C@@H](C)O 2230a_100000210026_100009817552 [1,1,0,0,0,0|2,0,0]=4 5053 B13R1.150 Cc1cccc(c1C)NC[C@@H](C)O 34a_100000210026_100009817552 [1,1,0,0,0,0|2,0,0]=4 5054 B13R1.150 Cc1cccc(c1C)NC[C@@H](C)O 7a_100000210026_100009817552 [1,1,0,0,0,0|2,0,0]=4 5055 B13R1.150 Cc1cccc(c1C)OCC(=O)N 34a_100000185855_100000187820 [1,1,0,0,0,0|1,0,1]=4 5056 B13R1.150 Cc1cccc(c1C)OCC(=O)N 7a_100000185855_100000187820 [1,1,0,0,0,0|1,0,1]=4 5057 B13R1.150 Cc1cccc(c1C)OCC(=O)[13CH3] 1458a_200000183798_200025704644 [1,1,0,0,0,0|1,0,1]=4 5058 B13R1.150 Cc1cccc(c1C)OCC(C)C 34a_100000185855_100000210624 [1,1,0,0,0,0|1,0,0]=3 5059 B13R1.150 Cc1cccc(c1C)OCC(C)C 7a_100000185855_100000210760 [1,1,0,0,0,0|1,0,0]=3 5060 B13R1.150 Cc1cccc(c1C)OCC(C)O 34a_100000185855_100011218427 [1,1,0,0,0,0|1,0,0]=3 5061 B13R1.150 Cc1cccc(c1C)OCC(C)O 7a_100000185855_100011218427 [1,1,0,0,0,0|1,0,0]=3 5062 B13R1.150 Cc1cccc(c1C)OCC(F)F 34a_100000185855_100011934356 [1,1,0,0,0,0|2,0,0]=4 5063 B13R1.150 Cc1cccc(c1C)OCC(F)F 7a_100000185855_100011934356 [1,1,0,0,0,0|2,0,0]=4 5064 B13R1.150 Cc1cccc(c1C)OC[C@@H](C)O 34a_100000185855_100009817552 [1,1,0,0,0,0|1,0,0]=3 5065 B13R1.150 Cc1cccc(c1C)OC[C@@H](C)O 7a_100000185855_100009817552 [1,1,0,0,0,0|1,0,0]=3 5066 B13R1.150 Cc1cccc(c1C)SCC(C)C 62a_100000210624_100011214922 [1,1,0,0,0,0|1,1,0]=4 5067 B13R1.150 Cc1cccc(c1C)SCC(C)C 62a_100011214922_100000210760 [1,1,0,0,0,0|1,1,0]=4 5068 B13R1.150 Cc1cccc(c1C)SCC(C)O 62a_100011214922_100011218427 [1,1,0,0,0,0|1,1,0]=4 5069 B13R1.150 Cc1cccc(c1C)SCC(C)O 62a_100011218427_100011214922 [1,1,0,0,0,0|1,1,0]=4 5070 B13R1.150 Cc1cccc(c1C)SC[C@@H](C)O 62a_100009817552_100011214922 [1,1,0,0,0,0|1,1,0]=4 5071 B13R1.150 Cc1cccc(c1C)SC[C@@H](C)O 62a_100011214922_100009817552 [1,1,0,0,0,0|1,1,0]=4 5072 B13R1.150 Cc1cccc(c1Cl)OCC(C)C 34a_100000695629_100000210624 [1,1,0,0,0,0|2,0,0]=4 5073 B13R1.150 Cc1cccc(c1Cl)OCC(C)C 7a_100000695629_100000210760 [1,1,0,0,0,0|2,0,0]=4 5074 B13R1.150 Cc1cccc(c1Cl)OCC(C)O 34a_100000695629_100011218427 [1,1,0,0,0,0|2,0,0]=4 5075 B13R1.150 Cc1cccc(c1Cl)OCC(C)O 7a_100000695629_100011218427 [1,1,0,0,0,0|2,0,0]=4 5076 B13R1.150 Cc1cccc(c1Cl)OC[C@@H](C)O 34a_100000695629_100009817552 [1,1,0,0,0,0|2,0,0]=4 5077 B13R1.150 Cc1cccc(c1Cl)OC[C@@H](C)O 7a_100000695629_100009817552 [1,1,0,0,0,0|2,0,0]=4 5078 B13R1.150 Cc1cccc(c1F)OCC(C)C 34a_100000751311_100000210624 [1,1,0,0,0,0|2,0,0]=4 5079 B13R1.150 Cc1cccc(c1F)OCC(C)C 7a_100000751311_100000210760 [1,1,0,0,0,0|2,0,0]=4 5080 B13R1.150 Cc1cccc(c1F)OCC(C)O 34a_100000751311_100011218427 [1,1,0,0,0,0|2,0,0]=4 5081 B13R1.150 Cc1cccc(c1F)OCC(C)O 7a_100000751311_100011218427 [1,1,0,0,0,0|2,0,0]=4 5082 B13R1.150 Cc1cccc(c1F)OC[C@@H](C)O 34a_100000751311_100009817552 [1,1,0,0,0,0|2,0,0]=4 5083 B13R1.150 Cc1cccc(c1F)OC[C@@H](C)O 7a_100000751311_100009817552 [1,1,0,0,0,0|2,0,0]=4 5084 B13R1.150 Cc1cccc(c1I)OCC(C)C 34a_100010083724_100000210624 [1,1,0,0,0,0|2,0,0]=4 5085 B13R1.150 Cc1cccc(c1I)OCC(C)C 7a_100010083724_100000210760 [1,1,0,0,0,0|2,0,0]=4 5086 B13R1.150 Cc1cccc(c1I)OCC(C)O 34a_100010083724_100011218427 [1,1,0,0,0,0|2,0,0]=4 5087 B13R1.150 Cc1cccc(c1I)OCC(C)O 7a_100010083724_100011218427 [1,1,0,0,0,0|2,0,0]=4 5088 B13R1.150 Cc1cccc(c1I)OC[C@@H](C)O 34a_100010083724_100009817552 [1,1,0,0,0,0|2,0,0]=4 5089 B13R1.150 Cc1cccc(c1I)OC[C@@H](C)O 7a_100010083724_100009817552 [1,1,0,0,0,0|2,0,0]=4 5090 B13R1.150 Cc1cccc(c1N)OCC(C)C 34a_100000743429_100000210624 [1,1,0,0,0,0|2,0,0]=4 5091 B13R1.150 Cc1cccc(c1N)OCC(C)C 7a_100000743429_100000210760 [1,1,0,0,0,0|2,0,0]=4 5092 B13R1.150 Cc1cccc(c1N)OCC(C)O 34a_100000743429_100011218427 [1,1,0,0,0,0|2,0,0]=4 5093 B13R1.150 Cc1cccc(c1N)OCC(C)O 7a_100000743429_100011218427 [1,1,0,0,0,0|2,0,0]=4 5094 B13R1.150 Cc1cccc(c1N)OC[C@@H](C)O 34a_100000743429_100009817552 [1,1,0,0,0,0|2,0,0]=4 5095 B13R1.150 Cc1cccc(c1N)OC[C@@H](C)O 7a_100000743429_100009817552 [1,1,0,0,0,0|2,0,0]=4 5096 B13R1.157 CC(C)(C)COc1ccccc1Br 34a_100000181306_100011219605 [1,1,0,0,0,0|2,0,0]=4 5097 B13R1.157 CC(C)(C)COc1ccccc1Cl 34a_100000210172_100011219605 [1,1,0,0,0,0|2,0,0]=4 5098 B13R1.157 CC(C)(C)COc1ccccc1F 34a_100000210171_100011219605 [1,1,0,0,0,0|2,0,0]=4 5099 B13R1.157 CC(C)(C)COc1ccccc1I 34a_100000739446_100011219605 [1,1,0,0,0,0|2,0,0]=4 5100 B13R1.157 CC(C)(C)COc1ccccc1N 34a_100000185747_100011219605 [1,1,0,0,0,0|2,0,0]=4 5101 B13R1.157 CC(C)(F)COc1ccccc1Br 34a_100000181306_100011997219 [1,1,0,0,0,0|2,0,0]=4 5102 B13R1.157 CC(C)(F)COc1ccccc1Cl 34a_100000210172_100011997219 [1,1,0,0,0,0|2,0,0]=4 5103 B13R1.157 CC(C)(F)COc1ccccc1F 34a_100000210171_100011997219 [1,1,0,0,0,0|2,0,0]=4 5104 B13R1.157 CC(C)(F)COc1ccccc1I 34a_100000739446_100011997219 [1,1,0,0,0,0|2,0,0]=4 5105 B13R1.157 CC(C)(F)COc1ccccc1N 34a_100000185747_100011997219 [1,1,0,0,0,0|2,0,0]=4 5106 B13R1.157 CC(C)(O)COc1ccccc1Br 34a_100000181306_100000764493 [1,1,0,0,0,0|2,0,0]=4 5107 B13R1.157 CC(C)(O)COc1ccccc1Br 7a_100000181306_100000764493 [1,1,0,0,0,0|2,0,0]=4 5108 B13R1.157 CC(C)(O)COc1ccccc1Cl 34a_100000210172_100000764493 [1,1,0,0,0,0|2,0,0]=4 5109 B13R1.157 CC(C)(O)COc1ccccc1Cl 7a_100000210172_100000764493 [1,1,0,0,0,0|2,0,0]=4 5110 B13R1.157 CC(C)(O)COc1ccccc1F 34a_100000210171_100000764493 [1,1,0,0,0,0|2,0,0]=4 5111 B13R1.157 CC(C)(O)COc1ccccc1F 7a_100000210171_100000764493 [1,1,0,0,0,0|2,0,0]=4 5112 B13R1.157 CC(C)(O)COc1ccccc1I 34a_100000739446_100000764493 [1,1,0,0,0,0|2,0,0]=4 5113 B13R1.157 CC(C)(O)COc1ccccc1I 7a_100000739446_100000764493 [1,1,0,0,0,0|2,0,0]=4 5114 B13R1.157 CC(C)(O)COc1ccccc1N 34a_100000185747_100000764493 [1,1,0,0,0,0|2,0,0]=4 5115 B13R1.157 CC(C)(O)COc1ccccc1N 7a_100000185747_100000764493 [1,1,0,0,0,0|2,0,0]=4 5116 B13R1.157 Cc1ccccc1NCC(C)(C)C 34a_100015192222_100011219605 [1,1,0,0,0,0|2,0,0]=4 5117 B13R1.157 Cc1ccccc1NCC(C)(C)F 34a_100015192222_100011997219 [1,1,0,0,0,0|2,0,0]=4 5118 B13R1.157 Cc1ccccc1NCC(C)(C)O 34a_100015192222_100000764493 [1,1,0,0,0,0|2,0,0]=4 5119 B13R1.157 Cc1ccccc1OCC(C)(C)C 34a_100000210338_100011219605 [1,1,0,0,0,0|1,0,0]=3 5120 B13R1.157 Cc1ccccc1OCC(C)(C)F 34a_100000210338_100011997219 [1,1,0,0,0,0|1,0,0]=3 5121 B13R1.157 Cc1ccccc1OCC(C)(C)O 34a_100000210338_100000764493 [1,1,0,0,0,0|1,0,0]=3 5122 B13R1.157 Cc1ccccc1OCC(C)(C)O 7a_100000210338_100000764493 [1,1,0,0,0,0|1,0,0]=3 5123 B13R1.157 Cc1ccccc1OC[Si](C)(C)C 7a_100000210338_100000233785 [1,1,0,0,0,0|1,1,0]=4 5124 B13R1.157 Cc1ccccc1SCC(C)(C)C 62a_100000210755_100011219605 [1,1,0,0,0,0|1,1,0]=4 5125 B13R1.157 Cc1ccccc1SCC(C)(C)C 62a_100011219605_100000210755 [1,1,0,0,0,0|1,1,0]=4 5126 B13R1.157 Cc1ccccc1SCC(C)(C)F 62a_100000210755_100011997219 [1,1,0,0,0,0|1,1,0]=4 5127 B13R1.157 Cc1ccccc1SCC(C)(C)F 62a_100011997219_100000210755 [1,1,0,0,0,0|1,1,0]=4 5128 B13R1.157 Cc1ccccc1SCC(C)(C)O 62a_100000210755_100000764493 [1,1,0,0,0,0|1,1,0]=4 5129 B13R1.157 Cc1ccccc1SCC(C)(C)O 62a_100000764493_100000210755 [1,1,0,0,0,0|1,1,0]=4 5130 B13R1.157 Cc1ccncc1OCC(C)(C)C 34a_100011997053_100011219605 [1,1,0,0,0,0|2,0,0]=4 5131 B13R1.157 Cc1ccncc1OCC(C)(C)F 34a_100011997053_100011997219 [1,1,0,0,0,0|2,0,0]=4 5132 B13R1.157 Cc1ccncc1OCC(C)(C)O 34a_100011997053_100000764493 [1,1,0,0,0,0|2,0,0]=4 5133 B13R1.157 Cc1ccncc1OCC(C)(C)O 7a_100011997053_100000764493 [1,1,0,0,0,0|2,0,0]=4 5134 B13R1.157 Cc1cnccc1OCC(C)(C)C 34a_100000694293_100011219605 [1,1,0,0,0,0|2,0,0]=4 5135 B13R1.157 Cc1cnccc1OCC(C)(C)F 34a_100000694293_100011997219 [1,1,0,0,0,0|2,0,0]=4 5136 B13R1.157 Cc1cnccc1OCC(C)(C)O 34a_100000694293_100000764493 [1,1,0,0,0,0|2,0,0]=4 5137 B13R1.157 Cc1ncccc1OCC(C)(C)C 34a_100000745507_100011219605 [1,1,0,0,0,0|2,0,0]=4 5138 B13R1.157 Cc1ncccc1OCC(C)(C)F 34a_100000745507_100011997219 [1,1,0,0,0,0|2,0,0]=4 5139 B13R1.157 Cc1ncccc1OCC(C)(C)O 34a_100000745507_100000764493 [1,1,0,0,0,0|2,0,0]=4 5140 B13R1.157 Cc1ncccc1OCC(C)(C)O 7a_100000745507_100000764493 [1,1,0,0,0,0|2,0,0]=4 5141 B13R1.164 C=C(C)COc1ccc(cc1C)Br 34a_100000186361_100000748629 [1,1,0,0,0,0|1,0,1]=4 5142 B13R1.164 C=C(C)COc1ccc(cc1C)Br 7a_100000186361_100000748629 [1,1,0,0,0,0|1,0,1]=4 5143 B13R1.164 C=C(C)COc1ccc(cc1C)C 34a_100000211776_100000748629 [1,1,0,0,0,0|1,0,1]=4 5144 B13R1.164 C=C(C)COc1ccc(cc1C)C 7a_100000211776_100000748629 [1,1,0,0,0,0|1,0,1]=4 5145 B13R1.164 C=C(C)COc1ccc(cc1C)Cl 34a_100000211091_100000748629 [1,1,0,0,0,0|1,0,1]=4 5146 B13R1.164 C=C(C)COc1ccc(cc1C)Cl 7a_100000211091_100000748629 [1,1,0,0,0,0|1,0,1]=4 5147 B13R1.164 C=C(C)COc1ccc(cc1C)F 34a_100000764316_100000748629 [1,1,0,0,0,0|1,0,1]=4 5148 B13R1.164 C=C(C)COc1ccc(cc1C)F 7a_100000764316_100000748629 [1,1,0,0,0,0|1,0,1]=4 5149 B13R1.164 C=C(C)COc1ccc(cc1C)I 34a_100011218673_100000748629 [1,1,0,0,0,0|1,0,1]=4 5150 B13R1.164 C=C(C)COc1ccc(cc1C)I 7a_100011218673_100000748629 [1,1,0,0,0,0|1,0,1]=4 5151 B13R1.164 C=C(C)COc1ccc(cc1C)N 34a_100011218179_100000748629 [1,1,0,0,0,0|1,0,1]=4 5152 B13R1.164 C=C(C)COc1ccc(cc1C)N 7a_100011218179_100000748629 [1,1,0,0,0,0|1,0,1]=4 5153 B13R1.164 CC(=O)COc1ccc(cc1C)C 1458a_200000185146_200000210301 [1,1,0,0,0,0|1,0,1]=4 5154 B13R1.164 CC(=O)COc1ccc(cc1C)Cl 1458a_100000182498_200000210301 [1,1,0,0,0,0|1,0,1]=4 5155 B13R1.164 CC(C)COc1ccc(cc1Br)Br 34a_100000188717_100000210624 [1,1,0,0,0,0|2,0,0]=4 5156 B13R1.164 CC(C)COc1ccc(cc1Br)Br 7a_100000188717_100000210760 [1,1,0,0,0,0|2,0,0]=4 5157 B13R1.164 CC(C)COc1ccc(cc1Br)Cl 34a_100000211998_100000210624 [1,1,0,0,0,0|2,0,0]=4 5158 B13R1.164 CC(C)COc1ccc(cc1Br)Cl 7a_100000211998_100000210760 [1,1,0,0,0,0|2,0,0]=4 5159 B13R1.164 CC(C)COc1ccc(cc1Br)F 34a_100000211999_100000210624 [1,1,0,0,0,0|2,0,0]=4 5160 B13R1.164 CC(C)COc1ccc(cc1Br)F 7a_100000211999_100000210760 [1,1,0,0,0,0|2,0,0]=4 5161 B13R1.164 CC(C)COc1ccc(cc1Br)I 34a_100012361655_100000210624 [1,1,0,0,0,0|2,0,0]=4 5162 B13R1.164 CC(C)COc1ccc(cc1Br)I 7a_100012361655_100000210760 [1,1,0,0,0,0|2,0,0]=4 5163 B13R1.164 CC(C)COc1ccc(cc1Br)N 34a_100011534360_100000210624 [1,1,0,0,0,0|2,0,0]=4 5164 B13R1.164 CC(C)COc1ccc(cc1Br)N 7a_100011534360_100000210760 [1,1,0,0,0,0|2,0,0]=4 5165 B13R1.164 CC(C)COc1ccc(cc1Cl)Br 34a_100000186472_100000210624 [1,1,0,0,0,0|2,0,0]=4 5166 B13R1.164 CC(C)COc1ccc(cc1Cl)Br 7a_100000186472_100000210760 [1,1,0,0,0,0|2,0,0]=4 5167 B13R1.164 CC(C)COc1ccc(cc1Cl)Cl 34a_100015191787_100000210624 [1,1,0,0,0,0|2,0,0]=4 5168 B13R1.164 CC(C)COc1ccc(cc1Cl)Cl 7a_100015191787_100000210760 [1,1,0,0,0,0|2,0,0]=4 5169 B13R1.164 CC(C)COc1ccc(cc1Cl)F 34a_100000212004_100000210624 [1,1,0,0,0,0|2,0,0]=4 5170 B13R1.164 CC(C)COc1ccc(cc1Cl)F 7a_100000212004_100000210760 [1,1,0,0,0,0|2,0,0]=4 5171 B13R1.164 CC(C)COc1ccc(cc1Cl)I 34a_100012360047_100000210624 [1,1,0,0,0,0|2,0,0]=4 5172 B13R1.164 CC(C)COc1ccc(cc1Cl)I 7a_100012360047_100000210760 [1,1,0,0,0,0|2,0,0]=4 5173 B13R1.164 CC(C)COc1ccc(cc1Cl)N 34a_100000744943_100000210624 [1,1,0,0,0,0|2,0,0]=4 5174 B13R1.164 CC(C)COc1ccc(cc1Cl)N 7a_100000744943_100000210760 [1,1,0,0,0,0|2,0,0]=4 5175 B13R1.164 CC(C)COc1ccc(cc1F)Br 34a_100000185481_100000210624 [1,1,0,0,0,0|2,0,0]=4 5176 B13R1.164 CC(C)COc1ccc(cc1F)Br 7a_100000185481_100000210760 [1,1,0,0,0,0|2,0,0]=4 5177 B13R1.164 CC(C)COc1ccc(cc1F)Cl 34a_100000230166_100000210624 [1,1,0,0,0,0|2,0,0]=4 5178 B13R1.164 CC(C)COc1ccc(cc1F)Cl 7a_100000230166_100000210760 [1,1,0,0,0,0|2,0,0]=4 5179 B13R1.164 CC(C)COc1ccc(cc1F)F 34a_100000230127_100000210624 [1,1,0,0,0,0|2,0,0]=4 5180 B13R1.164 CC(C)COc1ccc(cc1F)F 7a_100000230127_100000210760 [1,1,0,0,0,0|2,0,0]=4 5181 B13R1.164 CC(C)COc1ccc(cc1F)I 34a_100011356965_100000210624 [1,1,0,0,0,0|2,0,0]=4 5182 B13R1.164 CC(C)COc1ccc(cc1F)I 7a_100011356965_100000210760 [1,1,0,0,0,0|2,0,0]=4 5183 B13R1.164 CC(C)COc1ccc(cc1F)N 34a_100011220035_100000210624 [1,1,0,0,0,0|2,0,0]=4 5184 B13R1.164 CC(C)COc1ccc(cc1F)N 7a_100011220035_100000210760 [1,1,0,0,0,0|2,0,0]=4 5185 B13R1.164 CC(C)COc1ccc(cc1I)Br 34a_100012355227_100000210624 [1,1,0,0,0,0|2,0,0]=4 5186 B13R1.164 CC(C)COc1ccc(cc1I)Br 7a_100012355227_100000210760 [1,1,0,0,0,0|2,0,0]=4 5187 B13R1.164 CC(C)COc1ccc(cc1I)Cl 34a_100011356953_100000210624 [1,1,0,0,0,0|2,0,0]=4 5188 B13R1.164 CC(C)COc1ccc(cc1I)Cl 7a_100011356953_100000210760 [1,1,0,0,0,0|2,0,0]=4 5189 B13R1.164 CC(C)COc1ccc(cc1I)F 34a_100012355409_100000210624 [1,1,0,0,0,0|2,0,0]=4 5190 B13R1.164 CC(C)COc1ccc(cc1I)F 7a_100012355409_100000210760 [1,1,0,0,0,0|2,0,0]=4 5191 B13R1.164 CC(C)COc1ccc(cc1I)I 7a_100010001573_100000210760 [1,1,0,0,0,0|2,0,0]=4 5192 B13R1.164 CC(C)COc1ccc(cc1N)Br 34a_100000752626_100000210624 [1,1,0,0,0,0|2,0,0]=4 5193 B13R1.164 CC(C)COc1ccc(cc1N)Br 7a_100000752626_100000210760 [1,1,0,0,0,0|2,0,0]=4 5194 B13R1.164 CC(C)COc1ccc(cc1N)Cl 34a_100000210500_100000210624 [1,1,0,0,0,0|2,0,0]=4 5195 B13R1.164 CC(C)COc1ccc(cc1N)Cl 7a_100000210500_100000210760 [1,1,0,0,0,0|2,0,0]=4 5196 B13R1.164 CC(C)COc1ccc(cc1N)F 34a_100000759472_100000210624 [1,1,0,0,0,0|2,0,0]=4 5197 B13R1.164 CC(C)COc1ccc(cc1N)F 7a_100000759472_100000210760 [1,1,0,0,0,0|2,0,0]=4 5198 B13R1.164 CC(C)COc1ccc(cc1N)I 34a_100000753495_100000210624 [1,1,0,0,0,0|2,0,0]=4 5199 B13R1.164 CC(C)COc1ccc(cc1N)I 7a_100000753495_100000210760 [1,1,0,0,0,0|2,0,0]=4 5200 B13R1.164 CC(C)COc1ccc(cc1N)N 34a_100000725306_100000210624 [1,1,0,0,0,0|2,0,0]=4 5201 B13R1.164 CC(O)COc1ccc(cc1Br)Br 34a_100000188717_100011218427 [1,1,0,0,0,0|2,0,0]=4 5202 B13R1.164 CC(O)COc1ccc(cc1Br)Br 7a_100000188717_100011218427 [1,1,0,0,0,0|2,0,0]=4 5203 B13R1.164 CC(O)COc1ccc(cc1Br)Cl 34a_100000211998_100011218427 [1,1,0,0,0,0|2,0,0]=4 5204 B13R1.164 CC(O)COc1ccc(cc1Br)Cl 7a_100000211998_100011218427 [1,1,0,0,0,0|2,0,0]=4 5205 B13R1.164 CC(O)COc1ccc(cc1Br)F 34a_100000211999_100011218427 [1,1,0,0,0,0|2,0,0]=4 5206 B13R1.164 CC(O)COc1ccc(cc1Br)F 7a_100000211999_100011218427 [1,1,0,0,0,0|2,0,0]=4 5207 B13R1.164 CC(O)COc1ccc(cc1Br)I 34a_100012361655_100011218427 [1,1,0,0,0,0|2,0,0]=4 5208 B13R1.164 CC(O)COc1ccc(cc1Br)I 7a_100012361655_100011218427 [1,1,0,0,0,0|2,0,0]=4 5209 B13R1.164 CC(O)COc1ccc(cc1Br)N 34a_100011534360_100011218427 [1,1,0,0,0,0|2,0,0]=4 5210 B13R1.164 CC(O)COc1ccc(cc1Br)N 7a_100011534360_100011218427 [1,1,0,0,0,0|2,0,0]=4 5211 B13R1.164 CC(O)COc1ccc(cc1Cl)Br 34a_100000186472_100011218427 [1,1,0,0,0,0|2,0,0]=4 5212 B13R1.164 CC(O)COc1ccc(cc1Cl)Br 7a_100000186472_100011218427 [1,1,0,0,0,0|2,0,0]=4 5213 B13R1.164 CC(O)COc1ccc(cc1Cl)Cl 34a_100015191787_100011218427 [1,1,0,0,0,0|2,0,0]=4 5214 B13R1.164 CC(O)COc1ccc(cc1Cl)Cl 7a_100015191787_100011218427 [1,1,0,0,0,0|2,0,0]=4 5215 B13R1.164 CC(O)COc1ccc(cc1Cl)F 34a_100000212004_100011218427 [1,1,0,0,0,0|2,0,0]=4 5216 B13R1.164 CC(O)COc1ccc(cc1Cl)F 7a_100000212004_100011218427 [1,1,0,0,0,0|2,0,0]=4 5217 B13R1.164 CC(O)COc1ccc(cc1Cl)I 34a_100012360047_100011218427 [1,1,0,0,0,0|2,0,0]=4 5218 B13R1.164 CC(O)COc1ccc(cc1Cl)I 7a_100012360047_100011218427 [1,1,0,0,0,0|2,0,0]=4 5219 B13R1.164 CC(O)COc1ccc(cc1Cl)N 34a_100000744943_100011218427 [1,1,0,0,0,0|2,0,0]=4 5220 B13R1.164 CC(O)COc1ccc(cc1Cl)N 7a_100000744943_100011218427 [1,1,0,0,0,0|2,0,0]=4 5221 B13R1.164 CC(O)COc1ccc(cc1F)Br 34a_100000185481_100011218427 [1,1,0,0,0,0|2,0,0]=4 5222 B13R1.164 CC(O)COc1ccc(cc1F)Br 7a_100000185481_100011218427 [1,1,0,0,0,0|2,0,0]=4 5223 B13R1.164 CC(O)COc1ccc(cc1F)Cl 34a_100000230166_100011218427 [1,1,0,0,0,0|2,0,0]=4 5224 B13R1.164 CC(O)COc1ccc(cc1F)Cl 7a_100000230166_100011218427 [1,1,0,0,0,0|2,0,0]=4 5225 B13R1.164 CC(O)COc1ccc(cc1F)F 34a_100000230127_100011218427 [1,1,0,0,0,0|2,0,0]=4 5226 B13R1.164 CC(O)COc1ccc(cc1F)F 7a_100000230127_100011218427 [1,1,0,0,0,0|2,0,0]=4 5227 B13R1.164 CC(O)COc1ccc(cc1F)I 34a_100011356965_100011218427 [1,1,0,0,0,0|2,0,0]=4 5228 B13R1.164 CC(O)COc1ccc(cc1F)I 7a_100011356965_100011218427 [1,1,0,0,0,0|2,0,0]=4 5229 B13R1.164 CC(O)COc1ccc(cc1F)N 34a_100011220035_100011218427 [1,1,0,0,0,0|2,0,0]=4 5230 B13R1.164 CC(O)COc1ccc(cc1F)N 7a_100011220035_100011218427 [1,1,0,0,0,0|2,0,0]=4 5231 B13R1.164 CC(O)COc1ccc(cc1I)Br 34a_100012355227_100011218427 [1,1,0,0,0,0|2,0,0]=4 5232 B13R1.164 CC(O)COc1ccc(cc1I)Br 7a_100012355227_100011218427 [1,1,0,0,0,0|2,0,0]=4 5233 B13R1.164 CC(O)COc1ccc(cc1I)Cl 34a_100011356953_100011218427 [1,1,0,0,0,0|2,0,0]=4 5234 B13R1.164 CC(O)COc1ccc(cc1I)Cl 7a_100011356953_100011218427 [1,1,0,0,0,0|2,0,0]=4 5235 B13R1.164 CC(O)COc1ccc(cc1I)F 34a_100012355409_100011218427 [1,1,0,0,0,0|2,0,0]=4 5236 B13R1.164 CC(O)COc1ccc(cc1I)F 7a_100012355409_100011218427 [1,1,0,0,0,0|2,0,0]=4 5237 B13R1.164 CC(O)COc1ccc(cc1I)I 7a_100010001573_100011218427 [1,1,0,0,0,0|2,0,0]=4 5238 B13R1.164 CC(O)COc1ccc(cc1N)Br 34a_100000752626_100011218427 [1,1,0,0,0,0|2,0,0]=4 5239 B13R1.164 CC(O)COc1ccc(cc1N)Br 7a_100000752626_100011218427 [1,1,0,0,0,0|2,0,0]=4 5240 B13R1.164 CC(O)COc1ccc(cc1N)Cl 34a_100000210500_100011218427 [1,1,0,0,0,0|2,0,0]=4 5241 B13R1.164 CC(O)COc1ccc(cc1N)Cl 7a_100000210500_100011218427 [1,1,0,0,0,0|2,0,0]=4 5242 B13R1.164 CC(O)COc1ccc(cc1N)F 34a_100000759472_100011218427 [1,1,0,0,0,0|2,0,0]=4 5243 B13R1.164 CC(O)COc1ccc(cc1N)F 7a_100000759472_100011218427 [1,1,0,0,0,0|2,0,0]=4 5244 B13R1.164 CC(O)COc1ccc(cc1N)I 34a_100000753495_100011218427 [1,1,0,0,0,0|2,0,0]=4 5245 B13R1.164 CC(O)COc1ccc(cc1N)I 7a_100000753495_100011218427 [1,1,0,0,0,0|2,0,0]=4 5246 B13R1.164 CC(O)COc1ccc(cc1N)N 34a_100000725306_100011218427 [1,1,0,0,0,0|2,0,0]=4 5247 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)Br 34a_100000188717_100009817552 [1,1,0,0,0,0|2,0,0]=4 5248 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)Br 7a_100000188717_100009817552 [1,1,0,0,0,0|2,0,0]=4 5249 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)Cl 34a_100000211998_100009817552 [1,1,0,0,0,0|2,0,0]=4 5250 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)Cl 7a_100000211998_100009817552 [1,1,0,0,0,0|2,0,0]=4 5251 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)F 34a_100000211999_100009817552 [1,1,0,0,0,0|2,0,0]=4 5252 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)F 7a_100000211999_100009817552 [1,1,0,0,0,0|2,0,0]=4 5253 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)I 34a_100012361655_100009817552 [1,1,0,0,0,0|2,0,0]=4 5254 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)I 7a_100012361655_100009817552 [1,1,0,0,0,0|2,0,0]=4 5255 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)N 34a_100011534360_100009817552 [1,1,0,0,0,0|2,0,0]=4 5256 B13R1.164 C[C@@H](O)COc1ccc(cc1Br)N 7a_100011534360_100009817552 [1,1,0,0,0,0|2,0,0]=4 5257 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)Br 34a_100000186472_100009817552 [1,1,0,0,0,0|2,0,0]=4 5258 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)Br 7a_100000186472_100009817552 [1,1,0,0,0,0|2,0,0]=4 5259 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)Cl 34a_100015191787_100009817552 [1,1,0,0,0,0|2,0,0]=4 5260 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)Cl 7a_100015191787_100009817552 [1,1,0,0,0,0|2,0,0]=4 5261 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)F 34a_100000212004_100009817552 [1,1,0,0,0,0|2,0,0]=4 5262 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)F 7a_100000212004_100009817552 [1,1,0,0,0,0|2,0,0]=4 5263 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)I 34a_100012360047_100009817552 [1,1,0,0,0,0|2,0,0]=4 5264 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)I 7a_100012360047_100009817552 [1,1,0,0,0,0|2,0,0]=4 5265 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)N 34a_100000744943_100009817552 [1,1,0,0,0,0|2,0,0]=4 5266 B13R1.164 C[C@@H](O)COc1ccc(cc1Cl)N 7a_100000744943_100009817552 [1,1,0,0,0,0|2,0,0]=4 5267 B13R1.164 C[C@@H](O)COc1ccc(cc1F)Br 34a_100000185481_100009817552 [1,1,0,0,0,0|2,0,0]=4 5268 B13R1.164 C[C@@H](O)COc1ccc(cc1F)Br 7a_100000185481_100009817552 [1,1,0,0,0,0|2,0,0]=4 5269 B13R1.164 C[C@@H](O)COc1ccc(cc1F)Cl 34a_100000230166_100009817552 [1,1,0,0,0,0|2,0,0]=4 5270 B13R1.164 C[C@@H](O)COc1ccc(cc1F)Cl 7a_100000230166_100009817552 [1,1,0,0,0,0|2,0,0]=4 5271 B13R1.164 C[C@@H](O)COc1ccc(cc1F)F 34a_100000230127_100009817552 [1,1,0,0,0,0|2,0,0]=4 5272 B13R1.164 C[C@@H](O)COc1ccc(cc1F)F 7a_100000230127_100009817552 [1,1,0,0,0,0|2,0,0]=4 5273 B13R1.164 C[C@@H](O)COc1ccc(cc1F)I 34a_100011356965_100009817552 [1,1,0,0,0,0|2,0,0]=4 5274 B13R1.164 C[C@@H](O)COc1ccc(cc1F)I 7a_100011356965_100009817552 [1,1,0,0,0,0|2,0,0]=4 5275 B13R1.164 C[C@@H](O)COc1ccc(cc1F)N 34a_100011220035_100009817552 [1,1,0,0,0,0|2,0,0]=4 5276 B13R1.164 C[C@@H](O)COc1ccc(cc1F)N 7a_100011220035_100009817552 [1,1,0,0,0,0|2,0,0]=4 5277 B13R1.164 C[C@@H](O)COc1ccc(cc1I)Br 34a_100012355227_100009817552 [1,1,0,0,0,0|2,0,0]=4 5278 B13R1.164 C[C@@H](O)COc1ccc(cc1I)Br 7a_100012355227_100009817552 [1,1,0,0,0,0|2,0,0]=4 5279 B13R1.164 C[C@@H](O)COc1ccc(cc1I)Cl 34a_100011356953_100009817552 [1,1,0,0,0,0|2,0,0]=4 5280 B13R1.164 C[C@@H](O)COc1ccc(cc1I)Cl 7a_100011356953_100009817552 [1,1,0,0,0,0|2,0,0]=4 5281 B13R1.164 C[C@@H](O)COc1ccc(cc1I)F 34a_100012355409_100009817552 [1,1,0,0,0,0|2,0,0]=4 5282 B13R1.164 C[C@@H](O)COc1ccc(cc1I)F 7a_100012355409_100009817552 [1,1,0,0,0,0|2,0,0]=4 5283 B13R1.164 C[C@@H](O)COc1ccc(cc1I)I 7a_100010001573_100009817552 [1,1,0,0,0,0|2,0,0]=4 5284 B13R1.164 C[C@@H](O)COc1ccc(cc1N)Br 34a_100000752626_100009817552 [1,1,0,0,0,0|2,0,0]=4 5285 B13R1.164 C[C@@H](O)COc1ccc(cc1N)Br 7a_100000752626_100009817552 [1,1,0,0,0,0|2,0,0]=4 5286 B13R1.164 C[C@@H](O)COc1ccc(cc1N)Cl 34a_100000210500_100009817552 [1,1,0,0,0,0|2,0,0]=4 5287 B13R1.164 C[C@@H](O)COc1ccc(cc1N)Cl 7a_100000210500_100009817552 [1,1,0,0,0,0|2,0,0]=4 5288 B13R1.164 C[C@@H](O)COc1ccc(cc1N)F 34a_100000759472_100009817552 [1,1,0,0,0,0|2,0,0]=4 5289 B13R1.164 C[C@@H](O)COc1ccc(cc1N)F 7a_100000759472_100009817552 [1,1,0,0,0,0|2,0,0]=4 5290 B13R1.164 C[C@@H](O)COc1ccc(cc1N)I 34a_100000753495_100009817552 [1,1,0,0,0,0|2,0,0]=4 5291 B13R1.164 C[C@@H](O)COc1ccc(cc1N)I 7a_100000753495_100009817552 [1,1,0,0,0,0|2,0,0]=4 5292 B13R1.164 C[C@@H](O)COc1ccc(cc1N)N 34a_100000725306_100009817552 [1,1,0,0,0,0|2,0,0]=4 5293 B13R1.164 Cc1cc(c(cn1)OCC(C)C)C 34a_200000068632_100000210624 [1,1,0,0,0,0|2,0,0]=4 5294 B13R1.164 Cc1cc(c(cn1)OCC(C)C)C 7a_200000068632_100000210760 [1,1,0,0,0,0|2,0,0]=4 5295 B13R1.164 Cc1cc(c(cn1)OCC(C)O)C 34a_200000068632_100011218427 [1,1,0,0,0,0|2,0,0]=4 5296 B13R1.164 Cc1cc(c(cn1)OCC(C)O)C 7a_200000068632_100011218427 [1,1,0,0,0,0|2,0,0]=4 5297 B13R1.164 Cc1cc(c(cn1)OC[C@@H](C)O)C 34a_200000068632_100009817552 [1,1,0,0,0,0|2,0,0]=4 5298 B13R1.164 Cc1cc(c(cn1)OC[C@@H](C)O)C 7a_200000068632_100009817552 [1,1,0,0,0,0|2,0,0]=4 5299 B13R1.164 Cc1cc(ccc1NCC(C)C)Br 34a_100000211769_100000210624 [1,1,0,0,0,0|2,0,0]=4 5300 B13R1.164 Cc1cc(ccc1NCC(C)C)Br 7a_100000211769_100000210760 [1,1,0,0,0,0|2,0,0]=4 5301 B13R1.164 Cc1cc(ccc1NCC(C)C)Cl 34a_100000210418_100000210624 [1,1,0,0,0,0|2,0,0]=4 5302 B13R1.164 Cc1cc(ccc1NCC(C)C)Cl 7a_100000210418_100000210760 [1,1,0,0,0,0|2,0,0]=4 5303 B13R1.164 Cc1cc(ccc1NCC(C)C)F 34a_100000211637_100000210624 [1,1,0,0,0,0|2,0,0]=4 5304 B13R1.164 Cc1cc(ccc1NCC(C)C)F 7a_100000211637_100000210760 [1,1,0,0,0,0|2,0,0]=4 5305 B13R1.164 Cc1cc(ccc1NCC(C)C)I 34a_100000184554_100000210624 [1,1,0,0,0,0|2,0,0]=4 5306 B13R1.164 Cc1cc(ccc1NCC(C)C)I 7a_100000184554_100000210760 [1,1,0,0,0,0|2,0,0]=4 5307 B13R1.164 Cc1cc(ccc1NCC(C)C)O 34a_100000756630_100000210624 [1,1,0,0,0,0|2,0,0]=4 5308 B13R1.164 Cc1cc(ccc1NCC(C)O)Br 34a_100000211769_100011218427 [1,1,0,0,0,0|2,0,0]=4 5309 B13R1.164 Cc1cc(ccc1NCC(C)O)Br 7a_100000211769_100011218427 [1,1,0,0,0,0|2,0,0]=4 5310 B13R1.164 Cc1cc(ccc1NCC(C)O)Cl 34a_100000210418_100011218427 [1,1,0,0,0,0|2,0,0]=4 5311 B13R1.164 Cc1cc(ccc1NCC(C)O)Cl 7a_100000210418_100011218427 [1,1,0,0,0,0|2,0,0]=4 5312 B13R1.164 Cc1cc(ccc1NCC(C)O)F 34a_100000211637_100011218427 [1,1,0,0,0,0|2,0,0]=4 5313 B13R1.164 Cc1cc(ccc1NCC(C)O)F 7a_100000211637_100011218427 [1,1,0,0,0,0|2,0,0]=4 5314 B13R1.164 Cc1cc(ccc1NCC(C)O)I 34a_100000184554_100011218427 [1,1,0,0,0,0|2,0,0]=4 5315 B13R1.164 Cc1cc(ccc1NCC(C)O)I 7a_100000184554_100011218427 [1,1,0,0,0,0|2,0,0]=4 5316 B13R1.164 Cc1cc(ccc1NCC(C)O)O 34a_100000756630_100011218427 [1,1,0,0,0,0|2,0,0]=4 5317 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)Br 34a_100000211769_100009817552 [1,1,0,0,0,0|2,0,0]=4 5318 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)Br 7a_100000211769_100009817552 [1,1,0,0,0,0|2,0,0]=4 5319 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)Cl 34a_100000210418_100009817552 [1,1,0,0,0,0|2,0,0]=4 5320 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)Cl 7a_100000210418_100009817552 [1,1,0,0,0,0|2,0,0]=4 5321 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)F 34a_100000211637_100009817552 [1,1,0,0,0,0|2,0,0]=4 5322 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)F 7a_100000211637_100009817552 [1,1,0,0,0,0|2,0,0]=4 5323 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)I 34a_100000184554_100009817552 [1,1,0,0,0,0|2,0,0]=4 5324 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)I 7a_100000184554_100009817552 [1,1,0,0,0,0|2,0,0]=4 5325 B13R1.164 Cc1cc(ccc1NC[C@@H](C)O)O 34a_100000756630_100009817552 [1,1,0,0,0,0|2,0,0]=4 5326 B13R1.164 Cc1cc(ccc1OCC(=O)N)Br 34a_100000186361_100000187820 [1,1,0,0,0,0|1,0,1]=4 5327 B13R1.164 Cc1cc(ccc1OCC(=O)N)Br 7a_100000186361_100000187820 [1,1,0,0,0,0|1,0,1]=4 5328 B13R1.164 Cc1cc(ccc1OCC(=O)N)Cl 34a_100000211091_100000187820 [1,1,0,0,0,0|1,0,1]=4 5329 B13R1.164 Cc1cc(ccc1OCC(=O)N)Cl 7a_100000211091_100000187820 [1,1,0,0,0,0|1,0,1]=4 5330 B13R1.164 Cc1cc(ccc1OCC(=O)N)F 34a_100000764316_100000187820 [1,1,0,0,0,0|1,0,1]=4 5331 B13R1.164 Cc1cc(ccc1OCC(=O)N)F 7a_100000764316_100000187820 [1,1,0,0,0,0|1,0,1]=4 5332 B13R1.164 Cc1cc(ccc1OCC(=O)N)I 34a_100011218673_100000187820 [1,1,0,0,0,0|1,0,1]=4 5333 B13R1.164 Cc1cc(ccc1OCC(=O)N)I 7a_100011218673_100000187820 [1,1,0,0,0,0|1,0,1]=4 5334 B13R1.164 Cc1cc(ccc1OCC(=O)N)N 34a_100011218179_100000187820 [1,1,0,0,0,0|1,0,1]=4 5335 B13R1.164 Cc1cc(ccc1OCC(=O)N)N 7a_100011218179_100000187820 [1,1,0,0,0,0|1,0,1]=4 5336 B13R1.164 Cc1cc(ccc1OCC(=O)[13CH3])Cl 1458a_100000182498_200025704644 [1,1,0,0,0,0|1,0,1]=4 5337 B13R1.164 Cc1cc(ccc1OCC(C)C)Br 34a_100000186361_100000210624 [1,1,0,0,0,0|1,0,0]=3 5338 B13R1.164 Cc1cc(ccc1OCC(C)C)Br 7a_100000186361_100000210760 [1,1,0,0,0,0|1,0,0]=3 5339 B13R1.164 Cc1cc(ccc1OCC(C)C)Cl 34a_100000211091_100000210624 [1,1,0,0,0,0|1,0,0]=3 5340 B13R1.164 Cc1cc(ccc1OCC(C)C)Cl 7a_100000211091_100000210760 [1,1,0,0,0,0|1,0,0]=3 5341 B13R1.164 Cc1cc(ccc1OCC(C)C)F 34a_100000764316_100000210624 [1,1,0,0,0,0|1,0,0]=3 5342 B13R1.164 Cc1cc(ccc1OCC(C)C)F 7a_100000764316_100000210760 [1,1,0,0,0,0|1,0,0]=3 5343 B13R1.164 Cc1cc(ccc1OCC(C)C)I 34a_100011218673_100000210624 [1,1,0,0,0,0|1,0,0]=3 5344 B13R1.164 Cc1cc(ccc1OCC(C)C)I 7a_100011218673_100000210760 [1,1,0,0,0,0|1,0,0]=3 5345 B13R1.164 Cc1cc(ccc1OCC(C)C)N 34a_100011218179_100000210624 [1,1,0,0,0,0|1,0,0]=3 5346 B13R1.164 Cc1cc(ccc1OCC(C)C)N 7a_100011218179_100000210760 [1,1,0,0,0,0|1,0,0]=3 5347 B13R1.164 Cc1cc(ccc1OCC(C)O)Br 34a_100000186361_100011218427 [1,1,0,0,0,0|1,0,0]=3 5348 B13R1.164 Cc1cc(ccc1OCC(C)O)Br 7a_100000186361_100011218427 [1,1,0,0,0,0|1,0,0]=3 5349 B13R1.164 Cc1cc(ccc1OCC(C)O)Cl 34a_100000211091_100011218427 [1,1,0,0,0,0|1,0,0]=3 5350 B13R1.164 Cc1cc(ccc1OCC(C)O)Cl 7a_100000211091_100011218427 [1,1,0,0,0,0|1,0,0]=3 5351 B13R1.164 Cc1cc(ccc1OCC(C)O)F 34a_100000764316_100011218427 [1,1,0,0,0,0|1,0,0]=3 5352 B13R1.164 Cc1cc(ccc1OCC(C)O)F 7a_100000764316_100011218427 [1,1,0,0,0,0|1,0,0]=3 5353 B13R1.164 Cc1cc(ccc1OCC(C)O)I 34a_100011218673_100011218427 [1,1,0,0,0,0|1,0,0]=3 5354 B13R1.164 Cc1cc(ccc1OCC(C)O)I 7a_100011218673_100011218427 [1,1,0,0,0,0|1,0,0]=3 5355 B13R1.164 Cc1cc(ccc1OCC(C)O)N 34a_100011218179_100011218427 [1,1,0,0,0,0|1,0,0]=3 5356 B13R1.164 Cc1cc(ccc1OCC(C)O)N 7a_100011218179_100011218427 [1,1,0,0,0,0|1,0,0]=3 5357 B13R1.164 Cc1cc(ccc1OCC(F)F)Br 34a_100000186361_100011934356 [1,1,0,0,0,0|2,0,0]=4 5358 B13R1.164 Cc1cc(ccc1OCC(F)F)Br 7a_100000186361_100011934356 [1,1,0,0,0,0|2,0,0]=4 5359 B13R1.164 Cc1cc(ccc1OCC(F)F)Cl 34a_100000211091_100011934356 [1,1,0,0,0,0|2,0,0]=4 5360 B13R1.164 Cc1cc(ccc1OCC(F)F)Cl 7a_100000211091_100011934356 [1,1,0,0,0,0|2,0,0]=4 5361 B13R1.164 Cc1cc(ccc1OCC(F)F)F 34a_100000764316_100011934356 [1,1,0,0,0,0|2,0,0]=4 5362 B13R1.164 Cc1cc(ccc1OCC(F)F)F 7a_100000764316_100011934356 [1,1,0,0,0,0|2,0,0]=4 5363 B13R1.164 Cc1cc(ccc1OCC(F)F)I 34a_100011218673_100011934356 [1,1,0,0,0,0|2,0,0]=4 5364 B13R1.164 Cc1cc(ccc1OCC(F)F)I 7a_100011218673_100011934356 [1,1,0,0,0,0|2,0,0]=4 5365 B13R1.164 Cc1cc(ccc1OCC(F)F)N 34a_100011218179_100011934356 [1,1,0,0,0,0|2,0,0]=4 5366 B13R1.164 Cc1cc(ccc1OCC(F)F)N 7a_100011218179_100011934356 [1,1,0,0,0,0|2,0,0]=4 5367 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)Br 34a_100000186361_100009817552 [1,1,0,0,0,0|1,0,0]=3 5368 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)Br 7a_100000186361_100009817552 [1,1,0,0,0,0|1,0,0]=3 5369 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)Cl 34a_100000211091_100009817552 [1,1,0,0,0,0|1,0,0]=3 5370 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)Cl 7a_100000211091_100009817552 [1,1,0,0,0,0|1,0,0]=3 5371 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)F 34a_100000764316_100009817552 [1,1,0,0,0,0|1,0,0]=3 5372 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)F 7a_100000764316_100009817552 [1,1,0,0,0,0|1,0,0]=3 5373 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)I 34a_100011218673_100009817552 [1,1,0,0,0,0|1,0,0]=3 5374 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)I 7a_100011218673_100009817552 [1,1,0,0,0,0|1,0,0]=3 5375 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)N 34a_100011218179_100009817552 [1,1,0,0,0,0|1,0,0]=3 5376 B13R1.164 Cc1cc(ccc1OC[C@@H](C)O)N 7a_100011218179_100009817552 [1,1,0,0,0,0|1,0,0]=3 5377 B13R1.164 Cc1cc(ccc1SCC(C)C)Br 62a_100000210624_100000701812 [1,1,0,0,0,0|1,1,0]=4 5378 B13R1.164 Cc1cc(ccc1SCC(C)C)Br 62a_100000701812_100000210760 [1,1,0,0,0,0|1,1,0]=4 5379 B13R1.164 Cc1cc(ccc1SCC(C)C)Cl 62a_100000210624_100011219607 [1,1,0,0,0,0|1,1,0]=4 5380 B13R1.164 Cc1cc(ccc1SCC(C)C)Cl 62a_100011219607_100000210760 [1,1,0,0,0,0|1,1,0]=4 5381 B13R1.164 Cc1cc(ccc1SCC(C)C)F 62a_100000210624_100011205405 [1,1,0,0,0,0|1,1,0]=4 5382 B13R1.164 Cc1cc(ccc1SCC(C)C)F 62a_100011205405_100000210760 [1,1,0,0,0,0|1,1,0]=4 5383 B13R1.164 Cc1cc(ccc1SCC(C)C)N 62a_100000210624_100000210723 [1,1,0,0,0,0|1,1,0]=4 5384 B13R1.164 Cc1cc(ccc1SCC(C)C)N 62a_100000210723_100000210760 [1,1,0,0,0,0|1,1,0]=4 5385 B13R1.164 Cc1cc(ccc1SCC(C)C)O 62a_100000210624_100000690111 [1,1,0,0,0,0|1,1,0]=4 5386 B13R1.164 Cc1cc(ccc1SCC(C)O)Br 62a_100000701812_100011218427 [1,1,0,0,0,0|1,1,0]=4 5387 B13R1.164 Cc1cc(ccc1SCC(C)O)Br 62a_100011218427_100000701812 [1,1,0,0,0,0|1,1,0]=4 5388 B13R1.164 Cc1cc(ccc1SCC(C)O)Cl 62a_100011218427_100011219607 [1,1,0,0,0,0|1,1,0]=4 5389 B13R1.164 Cc1cc(ccc1SCC(C)O)Cl 62a_100011219607_100011218427 [1,1,0,0,0,0|1,1,0]=4 5390 B13R1.164 Cc1cc(ccc1SCC(C)O)F 62a_100011205405_100011218427 [1,1,0,0,0,0|1,1,0]=4 5391 B13R1.164 Cc1cc(ccc1SCC(C)O)F 62a_100011218427_100011205405 [1,1,0,0,0,0|1,1,0]=4 5392 B13R1.164 Cc1cc(ccc1SCC(C)O)N 62a_100000210723_100011218427 [1,1,0,0,0,0|1,1,0]=4 5393 B13R1.164 Cc1cc(ccc1SCC(C)O)N 62a_100011218427_100000210723 [1,1,0,0,0,0|1,1,0]=4 5394 B13R1.164 Cc1cc(ccc1SCC(C)O)O 62a_100011218427_100000690111 [1,1,0,0,0,0|1,1,0]=4 5395 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)Br 62a_100000701812_100009817552 [1,1,0,0,0,0|1,1,0]=4 5396 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)Br 62a_100009817552_100000701812 [1,1,0,0,0,0|1,1,0]=4 5397 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)Cl 62a_100009817552_100011219607 [1,1,0,0,0,0|1,1,0]=4 5398 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)Cl 62a_100011219607_100009817552 [1,1,0,0,0,0|1,1,0]=4 5399 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)F 62a_100009817552_100011205405 [1,1,0,0,0,0|1,1,0]=4 5400 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)F 62a_100011205405_100009817552 [1,1,0,0,0,0|1,1,0]=4 5401 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)N 62a_100000210723_100009817552 [1,1,0,0,0,0|1,1,0]=4 5402 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)N 62a_100009817552_100000210723 [1,1,0,0,0,0|1,1,0]=4 5403 B13R1.164 Cc1cc(ccc1SC[C@@H](C)O)O 62a_100009817552_100000690111 [1,1,0,0,0,0|1,1,0]=4 5404 B13R1.164 Cc1cc(cnc1OCC(C)C)Br 34a_100000685391_100000210624 [1,1,0,0,0,0|2,0,0]=4 5405 B13R1.164 Cc1cc(cnc1OCC(C)O)Br 34a_100000685391_100011218427 [1,1,0,0,0,0|2,0,0]=4 5406 B13R1.164 Cc1cc(cnc1OC[C@@H](C)O)Br 34a_100000685391_100009817552 [1,1,0,0,0,0|2,0,0]=4 5407 B13R1.164 Cc1cc(ncc1OCC(C)C)Cl 34a_100000692680_100000210624 [1,1,0,0,0,0|2,0,0]=4 5408 B13R1.164 Cc1cc(ncc1OCC(C)C)Cl 7a_100000692680_100000210760 [1,1,0,0,0,0|2,0,0]=4 5409 B13R1.164 Cc1cc(ncc1OCC(C)C)F 34a_100009856773_100000210624 [1,1,0,0,0,0|2,0,0]=4 5410 B13R1.164 Cc1cc(ncc1OCC(C)C)F 7a_100009856773_100000210760 [1,1,0,0,0,0|2,0,0]=4 5411 B13R1.164 Cc1cc(ncc1OCC(C)O)Cl 34a_100000692680_100011218427 [1,1,0,0,0,0|2,0,0]=4 5412 B13R1.164 Cc1cc(ncc1OCC(C)O)Cl 7a_100000692680_100011218427 [1,1,0,0,0,0|2,0,0]=4 5413 B13R1.164 Cc1cc(ncc1OCC(C)O)F 34a_100009856773_100011218427 [1,1,0,0,0,0|2,0,0]=4 5414 B13R1.164 Cc1cc(ncc1OCC(C)O)F 7a_100009856773_100011218427 [1,1,0,0,0,0|2,0,0]=4 5415 B13R1.164 Cc1cc(ncc1OC[C@@H](C)O)Cl 34a_100000692680_100009817552 [1,1,0,0,0,0|2,0,0]=4 5416 B13R1.164 Cc1cc(ncc1OC[C@@H](C)O)Cl 7a_100000692680_100009817552 [1,1,0,0,0,0|2,0,0]=4 5417 B13R1.164 Cc1cc(ncc1OC[C@@H](C)O)F 34a_100009856773_100009817552 [1,1,0,0,0,0|2,0,0]=4 5418 B13R1.164 Cc1cc(ncc1OC[C@@H](C)O)F 7a_100009856773_100009817552 [1,1,0,0,0,0|2,0,0]=4 5419 B13R1.164 Cc1ccc(c(c1)Br)OCC(C)C 34a_100000210800_100000210624 [1,1,0,0,0,0|2,0,0]=4 5420 B13R1.164 Cc1ccc(c(c1)Br)OCC(C)C 7a_100000210800_100000210760 [1,1,0,0,0,0|2,0,0]=4 5421 B13R1.164 Cc1ccc(c(c1)Br)OCC(C)O 34a_100000210800_100011218427 [1,1,0,0,0,0|2,0,0]=4 5422 B13R1.164 Cc1ccc(c(c1)Br)OCC(C)O 7a_100000210800_100011218427 [1,1,0,0,0,0|2,0,0]=4 5423 B13R1.164 Cc1ccc(c(c1)Br)OC[C@@H](C)O 34a_100000210800_100009817552 [1,1,0,0,0,0|2,0,0]=4 5424 B13R1.164 Cc1ccc(c(c1)Br)OC[C@@H](C)O 7a_100000210800_100009817552 [1,1,0,0,0,0|2,0,0]=4 5425 B13R1.164 Cc1ccc(c(c1)C)NCC(C)C 34a_100000736561_100000210624 [1,1,0,0,0,0|2,0,0]=4 5426 B13R1.164 Cc1ccc(c(c1)C)NCC(C)C 7a_100000736561_100000210760 [1,1,0,0,0,0|2,0,0]=4 5427 B13R1.164 Cc1ccc(c(c1)C)NCC(C)O 34a_100000736561_100011218427 [1,1,0,0,0,0|2,0,0]=4 5428 B13R1.164 Cc1ccc(c(c1)C)NCC(C)O 7a_100000736561_100011218427 [1,1,0,0,0,0|2,0,0]=4 5429 B13R1.164 Cc1ccc(c(c1)C)NC[C@@H](C)O 34a_100000736561_100009817552 [1,1,0,0,0,0|2,0,0]=4 5430 B13R1.164 Cc1ccc(c(c1)C)NC[C@@H](C)O 7a_100000736561_100009817552 [1,1,0,0,0,0|2,0,0]=4 5431 B13R1.164 Cc1ccc(c(c1)C)OCC(=O)N 34a_100000211776_100000187820 [1,1,0,0,0,0|1,0,1]=4 5432 B13R1.164 Cc1ccc(c(c1)C)OCC(=O)N 7a_100000211776_100000187820 [1,1,0,0,0,0|1,0,1]=4 5433 B13R1.164 Cc1ccc(c(c1)C)OCC(=O)[13CH3] 1458a_200000185146_200025704644 [1,1,0,0,0,0|1,0,1]=4 5434 B13R1.164 Cc1ccc(c(c1)C)OCC(C)C 34a_100000211776_100000210624 [1,1,0,0,0,0|1,0,0]=3 5435 B13R1.164 Cc1ccc(c(c1)C)OCC(C)C 7a_100000211776_100000210760 [1,1,0,0,0,0|1,0,0]=3 5436 B13R1.164 Cc1ccc(c(c1)C)OCC(C)O 34a_100000211776_100011218427 [1,1,0,0,0,0|1,0,0]=3 5437 B13R1.164 Cc1ccc(c(c1)C)OCC(C)O 7a_100000211776_100011218427 [1,1,0,0,0,0|1,0,0]=3 5438 B13R1.164 Cc1ccc(c(c1)C)OCC(F)F 34a_100000211776_100011934356 [1,1,0,0,0,0|2,0,0]=4 5439 B13R1.164 Cc1ccc(c(c1)C)OCC(F)F 7a_100000211776_100011934356 [1,1,0,0,0,0|2,0,0]=4 5440 B13R1.164 Cc1ccc(c(c1)C)OC[C@@H](C)O 34a_100000211776_100009817552 [1,1,0,0,0,0|1,0,0]=3 5441 B13R1.164 Cc1ccc(c(c1)C)OC[C@@H](C)O 7a_100000211776_100009817552 [1,1,0,0,0,0|1,0,0]=3 5442 B13R1.164 Cc1ccc(c(c1)C)SCC(C)C 62a_100000210624_100011217332 [1,1,0,0,0,0|1,1,0]=4 5443 B13R1.164 Cc1ccc(c(c1)C)SCC(C)C 62a_100011217332_100000210760 [1,1,0,0,0,0|1,1,0]=4 5444 B13R1.164 Cc1ccc(c(c1)C)SCC(C)O 62a_100011217332_100011218427 [1,1,0,0,0,0|1,1,0]=4 5445 B13R1.164 Cc1ccc(c(c1)C)SCC(C)O 62a_100011218427_100011217332 [1,1,0,0,0,0|1,1,0]=4 5446 B13R1.164 Cc1ccc(c(c1)C)SC[C@@H](C)O 62a_100009817552_100011217332 [1,1,0,0,0,0|1,1,0]=4 5447 B13R1.164 Cc1ccc(c(c1)C)SC[C@@H](C)O 62a_100011217332_100009817552 [1,1,0,0,0,0|1,1,0]=4 5448 B13R1.164 Cc1ccc(c(c1)Cl)OCC(C)C 34a_100000749699_100000210624 [1,1,0,0,0,0|2,0,0]=4 5449 B13R1.164 Cc1ccc(c(c1)Cl)OCC(C)C 7a_100000749699_100000210760 [1,1,0,0,0,0|2,0,0]=4 5450 B13R1.164 Cc1ccc(c(c1)Cl)OCC(C)O 34a_100000749699_100011218427 [1,1,0,0,0,0|2,0,0]=4 5451 B13R1.164 Cc1ccc(c(c1)Cl)OCC(C)O 7a_100000749699_100011218427 [1,1,0,0,0,0|2,0,0]=4 5452 B13R1.164 Cc1ccc(c(c1)Cl)OC[C@@H](C)O 34a_100000749699_100009817552 [1,1,0,0,0,0|2,0,0]=4 5453 B13R1.164 Cc1ccc(c(c1)Cl)OC[C@@H](C)O 7a_100000749699_100009817552 [1,1,0,0,0,0|2,0,0]=4 5454 B13R1.164 Cc1ccc(c(c1)F)OCC(C)C 34a_100011216688_100000210624 [1,1,0,0,0,0|2,0,0]=4 5455 B13R1.164 Cc1ccc(c(c1)F)OCC(C)C 7a_100011216688_100000210760 [1,1,0,0,0,0|2,0,0]=4 5456 B13R1.164 Cc1ccc(c(c1)F)OCC(C)O 34a_100011216688_100011218427 [1,1,0,0,0,0|2,0,0]=4 5457 B13R1.164 Cc1ccc(c(c1)F)OCC(C)O 7a_100011216688_100011218427 [1,1,0,0,0,0|2,0,0]=4 5458 B13R1.164 Cc1ccc(c(c1)F)OC[C@@H](C)O 34a_100011216688_100009817552 [1,1,0,0,0,0|2,0,0]=4 5459 B13R1.164 Cc1ccc(c(c1)F)OC[C@@H](C)O 7a_100011216688_100009817552 [1,1,0,0,0,0|2,0,0]=4 5460 B13R1.164 Cc1ccc(c(c1)I)OCC(C)C 34a_100000765521_100000210624 [1,1,0,0,0,0|2,0,0]=4 5461 B13R1.164 Cc1ccc(c(c1)I)OCC(C)C 7a_100000765521_100000210760 [1,1,0,0,0,0|2,0,0]=4 5462 B13R1.164 Cc1ccc(c(c1)I)OCC(C)O 34a_100000765521_100011218427 [1,1,0,0,0,0|2,0,0]=4 5463 B13R1.164 Cc1ccc(c(c1)I)OCC(C)O 7a_100000765521_100011218427 [1,1,0,0,0,0|2,0,0]=4 5464 B13R1.164 Cc1ccc(c(c1)I)OC[C@@H](C)O 34a_100000765521_100009817552 [1,1,0,0,0,0|2,0,0]=4 5465 B13R1.164 Cc1ccc(c(c1)I)OC[C@@H](C)O 7a_100000765521_100009817552 [1,1,0,0,0,0|2,0,0]=4 5466 B13R1.164 Cc1ccc(c(c1)N)OCC(C)C 34a_100011215204_100000210624 [1,1,0,0,0,0|2,0,0]=4 5467 B13R1.164 Cc1ccc(c(c1)N)OCC(C)C 7a_100011215204_100000210760 [1,1,0,0,0,0|2,0,0]=4 5468 B13R1.164 Cc1ccc(c(c1)N)OCC(C)O 34a_100011215204_100011218427 [1,1,0,0,0,0|2,0,0]=4 5469 B13R1.164 Cc1ccc(c(c1)N)OCC(C)O 7a_100011215204_100011218427 [1,1,0,0,0,0|2,0,0]=4 5470 B13R1.164 Cc1ccc(c(c1)N)OC[C@@H](C)O 34a_100011215204_100009817552 [1,1,0,0,0,0|2,0,0]=4 5471 B13R1.164 Cc1ccc(c(c1)N)OC[C@@H](C)O 7a_100011215204_100009817552 [1,1,0,0,0,0|2,0,0]=4 5472 B13R1.164 Cc1ccc(c(n1)C)OCC(C)C 34a_100011218912_100000210624 [1,1,0,0,0,0|2,0,0]=4 5473 B13R1.164 Cc1ccc(c(n1)C)OCC(C)C 7a_100011218912_100000210760 [1,1,0,0,0,0|2,0,0]=4 5474 B13R1.164 Cc1ccc(c(n1)C)OCC(C)O 34a_100011218912_100011218427 [1,1,0,0,0,0|2,0,0]=4 5475 B13R1.164 Cc1ccc(c(n1)C)OCC(C)O 7a_100011218912_100011218427 [1,1,0,0,0,0|2,0,0]=4 5476 B13R1.164 Cc1ccc(c(n1)C)OC[C@@H](C)O 34a_100011218912_100009817552 [1,1,0,0,0,0|2,0,0]=4 5477 B13R1.164 Cc1ccc(c(n1)C)OC[C@@H](C)O 7a_100011218912_100009817552 [1,1,0,0,0,0|2,0,0]=4 5478 B13R1.164 Cc1nc(ccc1OCC(C)C)Br 34a_100012002022_100000210624 [1,1,0,0,0,0|2,0,0]=4 5479 B13R1.164 Cc1nc(ccc1OCC(C)C)Br 7a_100012002022_100000210760 [1,1,0,0,0,0|2,0,0]=4 5480 B13R1.164 Cc1nc(ccc1OCC(C)C)Cl 34a_100012184626_100000210624 [1,1,0,0,0,0|2,0,0]=4 5481 B13R1.164 Cc1nc(ccc1OCC(C)C)Cl 7a_100012184626_100000210760 [1,1,0,0,0,0|2,0,0]=4 5482 B13R1.164 Cc1nc(ccc1OCC(C)C)F 34a_100009881036_100000210624 [1,1,0,0,0,0|2,0,0]=4 5483 B13R1.164 Cc1nc(ccc1OCC(C)C)F 7a_100009881036_100000210760 [1,1,0,0,0,0|2,0,0]=4 5484 B13R1.164 Cc1nc(ccc1OCC(C)C)I 34a_100010233687_100000210624 [1,1,0,0,0,0|2,0,0]=4 5485 B13R1.164 Cc1nc(ccc1OCC(C)C)I 7a_100010233687_100000210760 [1,1,0,0,0,0|2,0,0]=4 5486 B13R1.164 Cc1nc(ccc1OCC(C)O)Br 34a_100012002022_100011218427 [1,1,0,0,0,0|2,0,0]=4 5487 B13R1.164 Cc1nc(ccc1OCC(C)O)Br 7a_100012002022_100011218427 [1,1,0,0,0,0|2,0,0]=4 5488 B13R1.164 Cc1nc(ccc1OCC(C)O)Cl 34a_100012184626_100011218427 [1,1,0,0,0,0|2,0,0]=4 5489 B13R1.164 Cc1nc(ccc1OCC(C)O)Cl 7a_100012184626_100011218427 [1,1,0,0,0,0|2,0,0]=4 5490 B13R1.164 Cc1nc(ccc1OCC(C)O)F 34a_100009881036_100011218427 [1,1,0,0,0,0|2,0,0]=4 5491 B13R1.164 Cc1nc(ccc1OCC(C)O)F 7a_100009881036_100011218427 [1,1,0,0,0,0|2,0,0]=4 5492 B13R1.164 Cc1nc(ccc1OCC(C)O)I 34a_100010233687_100011218427 [1,1,0,0,0,0|2,0,0]=4 5493 B13R1.164 Cc1nc(ccc1OCC(C)O)I 7a_100010233687_100011218427 [1,1,0,0,0,0|2,0,0]=4 5494 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)Br 34a_100012002022_100009817552 [1,1,0,0,0,0|2,0,0]=4 5495 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)Br 7a_100012002022_100009817552 [1,1,0,0,0,0|2,0,0]=4 5496 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)Cl 34a_100012184626_100009817552 [1,1,0,0,0,0|2,0,0]=4 5497 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)Cl 7a_100012184626_100009817552 [1,1,0,0,0,0|2,0,0]=4 5498 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)F 34a_100009881036_100009817552 [1,1,0,0,0,0|2,0,0]=4 5499 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)F 7a_100009881036_100009817552 [1,1,0,0,0,0|2,0,0]=4 5500 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)I 34a_100010233687_100009817552 [1,1,0,0,0,0|2,0,0]=4 5501 B13R1.164 Cc1nc(ccc1OC[C@@H](C)O)I 7a_100010233687_100009817552 [1,1,0,0,0,0|2,0,0]=4 5502 B13R1.201 Cc1ccccc1C(=O)CC(C)C 1458a_100000212026_100000210624 [1,1,0,0,0,0|2,0,0]=4 5503 B13R1.201 Cc1ccccc1C(=O)CC(C)O 1458a_100000212026_100011218427 [1,1,0,0,0,0|2,0,0]=4 5504 B13R1.201 Cc1ccccc1N(C)CC(C)C 2230a_100000219699_100000210760 [1,1,0,0,0,0|2,0,0]=4 5505 B13R1.201 Cc1ccccc1N(C)CC(C)C 269982a_100000219699_100000210624 [1,1,0,0,0,0|2,0,0]=4 5506 B13R1.201 Cc1ccccc1N(C)CC(C)C 34a_100000219699_100000210624 [1,1,0,0,0,0|2,0,0]=4 5507 B13R1.201 Cc1ccccc1N(C)CC(C)O 2230a_100000219699_100011218427 [1,1,0,0,0,0|2,0,0]=4 5508 B13R1.201 Cc1ccccc1N(C)CC(C)O 269982a_100000219699_100011218427 [1,1,0,0,0,0|2,0,0]=4 5509 B13R1.201 Cc1ccccc1N(C)CC(C)O 34a_100000219699_100011218427 [1,1,0,0,0,0|2,0,0]=4 5510 B13R1.201 Cc1ccccc1N(C)C[C@@H](C)O 2230a_100000219699_100009817552 [1,1,0,0,0,0|2,0,0]=4 5511 B13R1.201 Cc1ccccc1N(C)C[C@@H](C)O 269982a_100000219699_100009817552 [1,1,0,0,0,0|2,0,0]=4 5512 B13R1.201 Cc1ccccc1N(C)C[C@@H](C)O 34a_100000219699_100009817552 [1,1,0,0,0,0|2,0,0]=4 5513 B13R1.201 Cc1ccccc1[C@@H](N)CC(C)C 271570a_100015190218_100000210755 [1,1,0,0,0,0|2,0,0]=4 5514 B13R1.202 CC(=O)C(C)Oc1ccccc1C 1458a_100000189243_200000210301 [1,1,0,0,0,0|1,0,1]=4 5515 B13R1.202 CC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000179758 [1,1,0,0,0,0|1,0,1]=4 5516 B13R1.202 Cc1ccccc1OC(C)C(=O)N 34a_100000210338_100000702099 [1,1,0,0,0,0|1,0,1]=4 5517 B13R1.202 Cc1ccccc1OC(C)C(=O)N 7a_100000210338_100000702099 [1,1,0,0,0,0|1,0,1]=4 5518 B13R1.202 Cc1ccccc1OC(C)C(=O)[13CH3] 1458a_100000189243_200025704644 [1,1,0,0,0,0|1,0,1]=4 5519 B13R1.202 Cc1ccccc1OC(F)C(=O)N 34a_100000210338_100009813875 [1,1,0,0,0,0|1,0,1]=4 5520 B13R1.202 Cc1ccccc1OC(F)C(=O)N 7a_100000210338_100009813875 [1,1,0,0,0,0|1,0,1]=4 5521 B13R1.528 C=CC(O)COc1ccccc1C 34a_100000210338_100000730141 [1,1,0,0,0,0|1,0,1]=4 5522 B13R1.528 C=CC(O)COc1ccccc1C 7a_100000210338_100000730141 [1,1,0,0,0,0|1,0,1]=4 5523 B13R1.528 CCC(=O)COc1ccccc1C 1458a_100000182418_100000210202 [1,1,0,0,0,0|1,0,1]=4 5524 B13R1.528 CCC(=O)COc1ccccc1C 7a_100000210338_100000747405 [1,1,0,0,0,0|1,0,1]=4 5525 B13R1.528 CCC(C)CNc1ccccc1C 34a_100015192222_100000748023 [1,1,0,0,0,0|2,0,0]=4 5526 B13R1.528 CCC(C)COc1ccccc1Br 34a_100000181306_100000748023 [1,1,0,0,0,0|2,0,0]=4 5527 B13R1.528 CCC(C)COc1ccccc1Br 7a_100000181306_100000748023 [1,1,0,0,0,0|2,0,0]=4 5528 B13R1.528 CCC(C)COc1ccccc1C 34a_100000210338_100000748023 [1,1,0,0,0,0|1,0,0]=3 5529 B13R1.528 CCC(C)COc1ccccc1C 7a_100000210338_100000748023 [1,1,0,0,0,0|1,0,0]=3 5530 B13R1.528 CCC(C)COc1ccccc1Cl 34a_100000210172_100000748023 [1,1,0,0,0,0|2,0,0]=4 5531 B13R1.528 CCC(C)COc1ccccc1Cl 7a_100000210172_100000748023 [1,1,0,0,0,0|2,0,0]=4 5532 B13R1.528 CCC(C)COc1ccccc1F 34a_100000210171_100000748023 [1,1,0,0,0,0|2,0,0]=4 5533 B13R1.528 CCC(C)COc1ccccc1F 7a_100000210171_100000748023 [1,1,0,0,0,0|2,0,0]=4 5534 B13R1.528 CCC(C)COc1ccccc1I 34a_100000739446_100000748023 [1,1,0,0,0,0|2,0,0]=4 5535 B13R1.528 CCC(C)COc1ccccc1I 7a_100000739446_100000748023 [1,1,0,0,0,0|2,0,0]=4 5536 B13R1.528 CCC(C)COc1ccccc1N 34a_100000185747_100000748023 [1,1,0,0,0,0|2,0,0]=4 5537 B13R1.528 CCC(C)COc1ccccc1N 7a_100000185747_100000748023 [1,1,0,0,0,0|2,0,0]=4 5538 B13R1.528 CCC(C)COc1cccnc1C 34a_100000745507_100000748023 [1,1,0,0,0,0|2,0,0]=4 5539 B13R1.528 CCC(C)COc1cccnc1C 7a_100000745507_100000748023 [1,1,0,0,0,0|2,0,0]=4 5540 B13R1.528 CCC(C)COc1ccncc1C 34a_100000694293_100000748023 [1,1,0,0,0,0|2,0,0]=4 5541 B13R1.528 CCC(C)COc1cnccc1C 34a_100011997053_100000748023 [1,1,0,0,0,0|2,0,0]=4 5542 B13R1.528 CCC(C)COc1cnccc1C 7a_100011997053_100000748023 [1,1,0,0,0,0|2,0,0]=4 5543 B13R1.528 CCC(C)CSc1ccccc1C 62a_100000210755_100000748023 [1,1,0,0,0,0|1,1,0]=4 5544 B13R1.528 CCC(C)CSc1ccccc1C 62a_100000748023_100000210755 [1,1,0,0,0,0|1,1,0]=4 5545 B13R1.528 CCC(O)CNc1ccccc1C 34a_100015192222_100011218378 [1,1,0,0,0,0|2,0,0]=4 5546 B13R1.528 CCC(O)COc1ccccc1Br 34a_100000181306_100011218378 [1,1,0,0,0,0|2,0,0]=4 5547 B13R1.528 CCC(O)COc1ccccc1Br 7a_100000181306_100011218378 [1,1,0,0,0,0|2,0,0]=4 5548 B13R1.528 CCC(O)COc1ccccc1C 34a_100000210338_100011218378 [1,1,0,0,0,0|1,0,0]=3 5549 B13R1.528 CCC(O)COc1ccccc1C 7a_100000210338_100011218378 [1,1,0,0,0,0|1,0,0]=3 5550 B13R1.528 CCC(O)COc1ccccc1Cl 34a_100000210172_100011218378 [1,1,0,0,0,0|2,0,0]=4 5551 B13R1.528 CCC(O)COc1ccccc1Cl 7a_100000210172_100011218378 [1,1,0,0,0,0|2,0,0]=4 5552 B13R1.528 CCC(O)COc1ccccc1F 34a_100000210171_100011218378 [1,1,0,0,0,0|2,0,0]=4 5553 B13R1.528 CCC(O)COc1ccccc1F 7a_100000210171_100011218378 [1,1,0,0,0,0|2,0,0]=4 5554 B13R1.528 CCC(O)COc1ccccc1I 34a_100000739446_100011218378 [1,1,0,0,0,0|2,0,0]=4 5555 B13R1.528 CCC(O)COc1ccccc1I 7a_100000739446_100011218378 [1,1,0,0,0,0|2,0,0]=4 5556 B13R1.528 CCC(O)COc1ccccc1N 34a_100000185747_100011218378 [1,1,0,0,0,0|2,0,0]=4 5557 B13R1.528 CCC(O)COc1ccccc1N 7a_100000185747_100011218378 [1,1,0,0,0,0|2,0,0]=4 5558 B13R1.528 CCC(O)COc1cccnc1C 34a_100000745507_100011218378 [1,1,0,0,0,0|2,0,0]=4 5559 B13R1.528 CCC(O)COc1cccnc1C 7a_100000745507_100011218378 [1,1,0,0,0,0|2,0,0]=4 5560 B13R1.528 CCC(O)COc1ccncc1C 34a_100000694293_100011218378 [1,1,0,0,0,0|2,0,0]=4 5561 B13R1.528 CCC(O)COc1cnccc1C 34a_100011997053_100011218378 [1,1,0,0,0,0|2,0,0]=4 5562 B13R1.528 CCC(O)COc1cnccc1C 7a_100011997053_100011218378 [1,1,0,0,0,0|2,0,0]=4 5563 B13R1.528 CCC(O)CSc1ccccc1C 62a_100000210755_100011218378 [1,1,0,0,0,0|1,1,0]=4 5564 B13R1.528 CCC(O)CSc1ccccc1C 62a_100011218378_100000210755 [1,1,0,0,0,0|1,1,0]=4 5565 B13R1.528 CC[C@H](C)CNc1ccccc1C 34a_100015192222_100009816398 [1,1,0,0,0,0|2,0,0]=4 5566 B13R1.528 CC[C@H](C)COc1ccccc1Br 34a_100000181306_100009816398 [1,1,0,0,0,0|2,0,0]=4 5567 B13R1.528 CC[C@H](C)COc1ccccc1Br 7a_100000181306_100009816398 [1,1,0,0,0,0|2,0,0]=4 5568 B13R1.528 CC[C@H](C)COc1ccccc1C 34a_100000210338_100009816398 [1,1,0,0,0,0|1,0,0]=3 5569 B13R1.528 CC[C@H](C)COc1ccccc1C 7a_100000210338_100009816398 [1,1,0,0,0,0|1,0,0]=3 5570 B13R1.528 CC[C@H](C)COc1ccccc1Cl 34a_100000210172_100009816398 [1,1,0,0,0,0|2,0,0]=4 5571 B13R1.528 CC[C@H](C)COc1ccccc1Cl 7a_100000210172_100009816398 [1,1,0,0,0,0|2,0,0]=4 5572 B13R1.528 CC[C@H](C)COc1ccccc1F 34a_100000210171_100009816398 [1,1,0,0,0,0|2,0,0]=4 5573 B13R1.528 CC[C@H](C)COc1ccccc1F 7a_100000210171_100009816398 [1,1,0,0,0,0|2,0,0]=4 5574 B13R1.528 CC[C@H](C)COc1ccccc1I 34a_100000739446_100009816398 [1,1,0,0,0,0|2,0,0]=4 5575 B13R1.528 CC[C@H](C)COc1ccccc1I 7a_100000739446_100009816398 [1,1,0,0,0,0|2,0,0]=4 5576 B13R1.528 CC[C@H](C)COc1ccccc1N 34a_100000185747_100009816398 [1,1,0,0,0,0|2,0,0]=4 5577 B13R1.528 CC[C@H](C)COc1ccccc1N 7a_100000185747_100009816398 [1,1,0,0,0,0|2,0,0]=4 5578 B13R1.528 CC[C@H](C)COc1cccnc1C 34a_100000745507_100009816398 [1,1,0,0,0,0|2,0,0]=4 5579 B13R1.528 CC[C@H](C)COc1cccnc1C 7a_100000745507_100009816398 [1,1,0,0,0,0|2,0,0]=4 5580 B13R1.528 CC[C@H](C)COc1ccncc1C 34a_100000694293_100009816398 [1,1,0,0,0,0|2,0,0]=4 5581 B13R1.528 CC[C@H](C)COc1cnccc1C 34a_100011997053_100009816398 [1,1,0,0,0,0|2,0,0]=4 5582 B13R1.528 CC[C@H](C)COc1cnccc1C 7a_100011997053_100009816398 [1,1,0,0,0,0|2,0,0]=4 5583 B13R1.528 CC[C@H](C)CSc1ccccc1C 62a_100000210755_100009816398 [1,1,0,0,0,0|1,1,0]=4 5584 B13R1.528 CC[C@H](C)CSc1ccccc1C 62a_100009816398_100000210755 [1,1,0,0,0,0|1,1,0]=4 5585 B13R1.528 CNC(=O)COc1ccccc1C 11a_106832991635_100000182418 [1,1,0,0,0,0|1,0,1]=4 5586 B13R1.528 CNC(=O)COc1ccccc1C 1626a_100102657272_100000182418 [1,1,0,0,0,0|1,0,1]=4 5587 B13R1.528 CNC(=O)COc1ccccc1C 240690a_100102657272_100000182418 [1,1,0,0,0,0|1,0,1]=4 5588 B13R1.528 CNC(=O)COc1ccccc1C 34a_100000210338_100000183359 [1,1,0,0,0,0|1,0,1]=4 5589 B13R1.528 CNC(=O)COc1ccccc1C 527a_100102657272_100000182418 [1,1,0,0,0,0|1,0,1]=4 5590 B13R1.528 CNC(=O)COc1ccccc1C 7a_100000210338_100000183359 [1,1,0,0,0,0|1,0,1]=4 5591 B13R1.528 CNC(C)COc1ccccc1C 2230a_100000744241_200000210301 [1,1,0,0,0,0|0,0,0]=2 5592 B13R1.528 CNC(C)COc1ccccc1C 34a_100000744241_200000210301 [1,1,0,0,0,0|0,0,0]=2 5593 B13R1.528 COC(=O)COc1ccccc1C 34a_100000210338_100000747449 [1,1,0,0,0,0|1,0,1]=4 5594 B13R1.528 COC(=O)COc1ccccc1C 7a_100000210338_100000747449 [1,1,0,0,0,0|1,0,1]=4 5595 B13R1.528 COC(C)COc1ccccc1C 34a_200011217337_200000210301 [1,1,0,0,0,0|1,0,0]=3 5596 B13R1.528 COC(C)COc1ccccc1C 7a_200011217337_200000210301 [1,1,0,0,0,0|1,0,0]=3 5597 B13R1.528 C[C@@H](CO)COc1ccccc1Br 34a_100000181306_100000059175 [1,1,0,0,0,0|2,0,0]=4 5598 B13R1.528 C[C@@H](CO)COc1ccccc1Br 7a_100000181306_100000059175 [1,1,0,0,0,0|2,0,0]=4 5599 B13R1.528 C[C@@H](CO)COc1ccccc1Cl 34a_100000210172_100000059175 [1,1,0,0,0,0|2,0,0]=4 5600 B13R1.528 C[C@@H](CO)COc1ccccc1Cl 7a_100000210172_100000059175 [1,1,0,0,0,0|2,0,0]=4 5601 B13R1.528 C[C@@H](CO)COc1ccccc1F 34a_100000210171_100000059175 [1,1,0,0,0,0|2,0,0]=4 5602 B13R1.528 C[C@@H](CO)COc1ccccc1F 7a_100000210171_100000059175 [1,1,0,0,0,0|2,0,0]=4 5603 B13R1.528 C[C@@H](CO)COc1ccccc1I 34a_100000739446_100000059175 [1,1,0,0,0,0|2,0,0]=4 5604 B13R1.528 C[C@@H](CO)COc1ccccc1I 7a_100000739446_100000059175 [1,1,0,0,0,0|2,0,0]=4 5605 B13R1.528 C[C@@H](CO)COc1ccccc1N 34a_100000185747_100000059175 [1,1,0,0,0,0|2,0,0]=4 5606 B13R1.528 C[C@@H](CO)COc1ccccc1N 7a_100000185747_100000059175 [1,1,0,0,0,0|2,0,0]=4 5607 B13R1.528 Cc1ccccc1COC(C)CN 34a_100000210904_100000211839 [1,1,0,0,0,0|2,0,0]=4 5608 B13R1.528 Cc1ccccc1NCC(O)CO 34a_100015192222_100011219619 [1,1,0,0,0,0|2,0,0]=4 5609 B13R1.528 Cc1ccccc1NC[C@@H](C)CO 34a_100015192222_100000059175 [1,1,0,0,0,0|2,0,0]=4 5610 B13R1.528 Cc1ccccc1NC[C@@H](O)CF 34a_100015192222_100015614560 [1,1,0,0,0,0|2,0,0]=4 5611 B13R1.528 Cc1ccccc1NC[C@@H](O)CO 34a_100015192222_100009815848 [1,1,0,0,0,0|2,0,0]=4 5612 B13R1.528 Cc1ccccc1OCC(=O)CF 1458a_100000182418_100015361967 [1,1,0,0,0,0|1,0,1]=4 5613 B13R1.528 Cc1ccccc1OCC(C)N[13CH3] 2230a_100000744241_200025704644 [1,1,0,0,0,0|0,0,0]=2 5614 B13R1.528 Cc1ccccc1OCC(C)N[13CH3] 34a_100000744241_200025704644 [1,1,0,0,0,0|0,0,0]=2 5615 B13R1.528 Cc1ccccc1OCC(C)O[13CH3] 34a_200011217337_200025704644 [1,1,0,0,0,0|1,0,0]=3 5616 B13R1.528 Cc1ccccc1OCC(C)O[13CH3] 7a_200011217337_200025704644 [1,1,0,0,0,0|1,0,0]=3 5617 B13R1.528 Cc1ccccc1OCC(O)CO 34a_100000210338_100011219619 [1,1,0,0,0,0|1,0,0]=3 5618 B13R1.528 Cc1ccccc1OCC(O)CO 7a_100000210338_100011219619 [1,1,0,0,0,0|1,0,0]=3 5619 B13R1.528 Cc1ccccc1OC[C@@H](C)CO 34a_100000210338_100000059175 [1,1,0,0,0,0|1,0,0]=3 5620 B13R1.528 Cc1ccccc1OC[C@@H](C)CO 7a_100000210338_100000059175 [1,1,0,0,0,0|1,0,0]=3 5621 B13R1.528 Cc1ccccc1OC[C@@H](O)CF 34a_100000210338_100015614560 [1,1,0,0,0,0|1,0,0]=3 5622 B13R1.528 Cc1ccccc1OC[C@@H](O)CF 7a_100000210338_100015614560 [1,1,0,0,0,0|1,0,0]=3 5623 B13R1.528 Cc1ccccc1OC[C@@H](O)CO 34a_100000210338_100009815848 [1,1,0,0,0,0|1,0,0]=3 5624 B13R1.528 Cc1ccccc1OC[C@@H](O)CO 7a_100000210338_100009815848 [1,1,0,0,0,0|1,0,0]=3 5625 B13R1.528 Cc1ccccc1SCC(O)CO 62a_100000210755_100011219619 [1,1,0,0,0,0|1,1,0]=4 5626 B13R1.528 Cc1ccccc1SCC(O)CO 62a_100011219619_100000210755 [1,1,0,0,0,0|1,1,0]=4 5627 B13R1.528 Cc1ccccc1SC[C@@H](C)CO 62a_100000059175_100000210755 [1,1,0,0,0,0|1,1,0]=4 5628 B13R1.528 Cc1ccccc1SC[C@@H](C)CO 62a_100000210755_100000059175 [1,1,0,0,0,0|1,1,0]=4 5629 B13R1.528 Cc1ccccc1SC[C@@H](O)CF 62a_100000210755_100015614560 [1,1,0,0,0,0|1,1,0]=4 5630 B13R1.528 Cc1ccccc1SC[C@@H](O)CF 62a_100015614560_100000210755 [1,1,0,0,0,0|1,1,0]=4 5631 B13R1.528 Cc1ccccc1SC[C@@H](O)CO 62a_100000210755_100009815848 [1,1,0,0,0,0|1,1,0]=4 5632 B13R1.528 Cc1ccccc1SC[C@@H](O)CO 62a_100009815848_100000210755 [1,1,0,0,0,0|1,1,0]=4 5633 B13R1.528 Cc1ccncc1OCC(O)CO 34a_100011997053_100011219619 [1,1,0,0,0,0|2,0,0]=4 5634 B13R1.528 Cc1ccncc1OCC(O)CO 7a_100011997053_100011219619 [1,1,0,0,0,0|2,0,0]=4 5635 B13R1.528 Cc1ccncc1OC[C@@H](C)CO 34a_100011997053_100000059175 [1,1,0,0,0,0|2,0,0]=4 5636 B13R1.528 Cc1ccncc1OC[C@@H](C)CO 7a_100011997053_100000059175 [1,1,0,0,0,0|2,0,0]=4 5637 B13R1.528 Cc1ccncc1OC[C@@H](O)CF 34a_100011997053_100015614560 [1,1,0,0,0,0|2,0,0]=4 5638 B13R1.528 Cc1ccncc1OC[C@@H](O)CF 7a_100011997053_100015614560 [1,1,0,0,0,0|2,0,0]=4 5639 B13R1.528 Cc1ccncc1OC[C@@H](O)CO 34a_100011997053_100009815848 [1,1,0,0,0,0|2,0,0]=4 5640 B13R1.528 Cc1ccncc1OC[C@@H](O)CO 7a_100011997053_100009815848 [1,1,0,0,0,0|2,0,0]=4 5641 B13R1.528 Cc1cnccc1OCC(O)CO 34a_100000694293_100011219619 [1,1,0,0,0,0|2,0,0]=4 5642 B13R1.528 Cc1cnccc1OC[C@@H](C)CO 34a_100000694293_100000059175 [1,1,0,0,0,0|2,0,0]=4 5643 B13R1.528 Cc1cnccc1OC[C@@H](O)CF 34a_100000694293_100015614560 [1,1,0,0,0,0|2,0,0]=4 5644 B13R1.528 Cc1cnccc1OC[C@@H](O)CO 34a_100000694293_100009815848 [1,1,0,0,0,0|2,0,0]=4 5645 B13R1.528 Cc1ncccc1OCC(O)CO 34a_100000745507_100011219619 [1,1,0,0,0,0|2,0,0]=4 5646 B13R1.528 Cc1ncccc1OCC(O)CO 7a_100000745507_100011219619 [1,1,0,0,0,0|2,0,0]=4 5647 B13R1.528 Cc1ncccc1OC[C@@H](C)CO 34a_100000745507_100000059175 [1,1,0,0,0,0|2,0,0]=4 5648 B13R1.528 Cc1ncccc1OC[C@@H](C)CO 7a_100000745507_100000059175 [1,1,0,0,0,0|2,0,0]=4 5649 B13R1.528 Cc1ncccc1OC[C@@H](O)CF 34a_100000745507_100015614560 [1,1,0,0,0,0|2,0,0]=4 5650 B13R1.528 Cc1ncccc1OC[C@@H](O)CF 7a_100000745507_100015614560 [1,1,0,0,0,0|2,0,0]=4 5651 B13R1.528 Cc1ncccc1OC[C@@H](O)CO 34a_100000745507_100009815848 [1,1,0,0,0,0|2,0,0]=4 5652 B13R1.528 Cc1ncccc1OC[C@@H](O)CO 7a_100000745507_100009815848 [1,1,0,0,0,0|2,0,0]=4 5653 B13R1.528 Nc1ccccc1OCC(O)CO 34a_100000185747_100011219619 [1,1,0,0,0,0|2,0,0]=4 5654 B13R1.528 Nc1ccccc1OCC(O)CO 7a_100000185747_100011219619 [1,1,0,0,0,0|2,0,0]=4 5655 B13R1.528 Nc1ccccc1OC[C@@H](O)CF 34a_100000185747_100015614560 [1,1,0,0,0,0|2,0,0]=4 5656 B13R1.528 Nc1ccccc1OC[C@@H](O)CF 7a_100000185747_100015614560 [1,1,0,0,0,0|2,0,0]=4 5657 B13R1.528 Nc1ccccc1OC[C@@H](O)CO 34a_100000185747_100009815848 [1,1,0,0,0,0|2,0,0]=4 5658 B13R1.528 Nc1ccccc1OC[C@@H](O)CO 7a_100000185747_100009815848 [1,1,0,0,0,0|2,0,0]=4 5659 B13R1.528 OCC(O)COc1ccccc1Br 34a_100000181306_100011219619 [1,1,0,0,0,0|2,0,0]=4 5660 B13R1.528 OCC(O)COc1ccccc1Br 7a_100000181306_100011219619 [1,1,0,0,0,0|2,0,0]=4 5661 B13R1.528 OCC(O)COc1ccccc1Cl 34a_100000210172_100011219619 [1,1,0,0,0,0|2,0,0]=4 5662 B13R1.528 OCC(O)COc1ccccc1Cl 7a_100000210172_100011219619 [1,1,0,0,0,0|2,0,0]=4 5663 B13R1.528 OCC(O)COc1ccccc1F 34a_100000210171_100011219619 [1,1,0,0,0,0|2,0,0]=4 5664 B13R1.528 OCC(O)COc1ccccc1F 7a_100000210171_100011219619 [1,1,0,0,0,0|2,0,0]=4 5665 B13R1.528 OCC(O)COc1ccccc1I 34a_100000739446_100011219619 [1,1,0,0,0,0|2,0,0]=4 5666 B13R1.528 OCC(O)COc1ccccc1I 7a_100000739446_100011219619 [1,1,0,0,0,0|2,0,0]=4 5667 B13R1.528 OC[C@H](O)COc1ccccc1Br 34a_100000181306_100009815848 [1,1,0,0,0,0|2,0,0]=4 5668 B13R1.528 OC[C@H](O)COc1ccccc1Br 7a_100000181306_100009815848 [1,1,0,0,0,0|2,0,0]=4 5669 B13R1.528 OC[C@H](O)COc1ccccc1Cl 34a_100000210172_100009815848 [1,1,0,0,0,0|2,0,0]=4 5670 B13R1.528 OC[C@H](O)COc1ccccc1Cl 7a_100000210172_100009815848 [1,1,0,0,0,0|2,0,0]=4 5671 B13R1.528 OC[C@H](O)COc1ccccc1F 34a_100000210171_100009815848 [1,1,0,0,0,0|2,0,0]=4 5672 B13R1.528 OC[C@H](O)COc1ccccc1F 7a_100000210171_100009815848 [1,1,0,0,0,0|2,0,0]=4 5673 B13R1.528 OC[C@H](O)COc1ccccc1I 34a_100000739446_100009815848 [1,1,0,0,0,0|2,0,0]=4 5674 B13R1.528 OC[C@H](O)COc1ccccc1I 7a_100000739446_100009815848 [1,1,0,0,0,0|2,0,0]=4 5675 B13R1.528 O[C@@H](CF)COc1ccccc1Br 34a_100000181306_100015614560 [1,1,0,0,0,0|2,0,0]=4 5676 B13R1.528 O[C@@H](CF)COc1ccccc1Br 7a_100000181306_100015614560 [1,1,0,0,0,0|2,0,0]=4 5677 B13R1.528 O[C@@H](CF)COc1ccccc1Cl 34a_100000210172_100015614560 [1,1,0,0,0,0|2,0,0]=4 5678 B13R1.528 O[C@@H](CF)COc1ccccc1Cl 7a_100000210172_100015614560 [1,1,0,0,0,0|2,0,0]=4 5679 B13R1.528 O[C@@H](CF)COc1ccccc1F 34a_100000210171_100015614560 [1,1,0,0,0,0|2,0,0]=4 5680 B13R1.528 O[C@@H](CF)COc1ccccc1F 7a_100000210171_100015614560 [1,1,0,0,0,0|2,0,0]=4 5681 B13R1.528 O[C@@H](CF)COc1ccccc1I 34a_100000739446_100015614560 [1,1,0,0,0,0|2,0,0]=4 5682 B13R1.528 O[C@@H](CF)COc1ccccc1I 7a_100000739446_100015614560 [1,1,0,0,0,0|2,0,0]=4 5683 B13R1.893 C=C(C)COc1cc(ccc1C)Br 34a_100000685420_100000748629 [1,1,0,0,0,0|1,0,1]=4 5684 B13R1.893 C=C(C)COc1cc(ccc1C)Br 7a_100000685420_100000748629 [1,1,0,0,0,0|1,0,1]=4 5685 B13R1.893 C=C(C)COc1cc(ccc1C)C 34a_100000210931_100000748629 [1,1,0,0,0,0|1,0,1]=4 5686 B13R1.893 C=C(C)COc1cc(ccc1C)C 7a_100000210931_100000748629 [1,1,0,0,0,0|1,0,1]=4 5687 B13R1.893 C=C(C)COc1cc(ccc1C)Cl 34a_100000756515_100000748629 [1,1,0,0,0,0|1,0,1]=4 5688 B13R1.893 C=C(C)COc1cc(ccc1C)Cl 7a_100000756515_100000748629 [1,1,0,0,0,0|1,0,1]=4 5689 B13R1.893 C=C(C)COc1cc(ccc1C)F 34a_100000690566_100000748629 [1,1,0,0,0,0|1,0,1]=4 5690 B13R1.893 C=C(C)COc1cc(ccc1C)F 7a_100000690566_100000748629 [1,1,0,0,0,0|1,0,1]=4 5691 B13R1.893 C=C(C)COc1cc(ccc1C)I 7a_100000766334_100000748629 [1,1,0,0,0,0|1,0,1]=4 5692 B13R1.893 C=C(C)COc1cc(ccc1C)N 34a_100000759471_100000748629 [1,1,0,0,0,0|1,0,1]=4 5693 B13R1.893 C=C(C)COc1cc(ccc1C)N 7a_100000759471_100000748629 [1,1,0,0,0,0|1,0,1]=4 5694 B13R1.893 CC(=O)COc1cc(ccc1C)C 1458a_100000182428_200000210301 [1,1,0,0,0,0|1,0,1]=4 5695 B13R1.893 CC(C)COc1cc(ccc1Br)Br 34a_100011220040_100000210624 [1,1,0,0,0,0|2,0,0]=4 5696 B13R1.893 CC(C)COc1cc(ccc1Br)Br 7a_100011220040_100000210760 [1,1,0,0,0,0|2,0,0]=4 5697 B13R1.893 CC(C)COc1cc(ccc1Br)Cl 34a_100012339455_100000210624 [1,1,0,0,0,0|2,0,0]=4 5698 B13R1.893 CC(C)COc1cc(ccc1Br)Cl 7a_100012339455_100000210760 [1,1,0,0,0,0|2,0,0]=4 5699 B13R1.893 CC(C)COc1cc(ccc1Br)F 34a_100000690578_100000210624 [1,1,0,0,0,0|2,0,0]=4 5700 B13R1.893 CC(C)COc1cc(ccc1Br)F 7a_100000690578_100000210760 [1,1,0,0,0,0|2,0,0]=4 5701 B13R1.893 CC(C)COc1cc(ccc1Br)I 34a_100012356990_100000210624 [1,1,0,0,0,0|2,0,0]=4 5702 B13R1.893 CC(C)COc1cc(ccc1Br)I 7a_100012356990_100000210760 [1,1,0,0,0,0|2,0,0]=4 5703 B13R1.893 CC(C)COc1cc(ccc1Cl)Br 34a_100000738945_100000210624 [1,1,0,0,0,0|2,0,0]=4 5704 B13R1.893 CC(C)COc1cc(ccc1Cl)Br 7a_100000738945_100000210760 [1,1,0,0,0,0|2,0,0]=4 5705 B13R1.893 CC(C)COc1cc(ccc1Cl)Cl 34a_100000211422_100000210624 [1,1,0,0,0,0|2,0,0]=4 5706 B13R1.893 CC(C)COc1cc(ccc1Cl)Cl 7a_100000211422_100000210760 [1,1,0,0,0,0|2,0,0]=4 5707 B13R1.893 CC(C)COc1cc(ccc1Cl)F 34a_100000692107_100000210624 [1,1,0,0,0,0|2,0,0]=4 5708 B13R1.893 CC(C)COc1cc(ccc1Cl)F 7a_100000692107_100000210760 [1,1,0,0,0,0|2,0,0]=4 5709 B13R1.893 CC(C)COc1cc(ccc1Cl)I 34a_100011356854_100000210624 [1,1,0,0,0,0|2,0,0]=4 5710 B13R1.893 CC(C)COc1cc(ccc1Cl)I 7a_100011356854_100000210760 [1,1,0,0,0,0|2,0,0]=4 5711 B13R1.893 CC(C)COc1cc(ccc1Cl)N 34a_100011934209_100000210624 [1,1,0,0,0,0|2,0,0]=4 5712 B13R1.893 CC(C)COc1cc(ccc1F)Br 34a_100000686035_100000210624 [1,1,0,0,0,0|2,0,0]=4 5713 B13R1.893 CC(C)COc1cc(ccc1F)Br 7a_100000686035_100000210760 [1,1,0,0,0,0|2,0,0]=4 5714 B13R1.893 CC(C)COc1cc(ccc1F)Cl 34a_100000757397_100000210624 [1,1,0,0,0,0|2,0,0]=4 5715 B13R1.893 CC(C)COc1cc(ccc1F)Cl 7a_100000757397_100000210760 [1,1,0,0,0,0|2,0,0]=4 5716 B13R1.893 CC(C)COc1cc(ccc1F)F 34a_100000752141_100000210624 [1,1,0,0,0,0|2,0,0]=4 5717 B13R1.893 CC(C)COc1cc(ccc1F)F 7a_100000752141_100000210760 [1,1,0,0,0,0|2,0,0]=4 5718 B13R1.893 CC(C)COc1cc(ccc1F)I 34a_100009958187_100000210624 [1,1,0,0,0,0|2,0,0]=4 5719 B13R1.893 CC(C)COc1cc(ccc1F)I 7a_100009958187_100000210760 [1,1,0,0,0,0|2,0,0]=4 5720 B13R1.893 CC(C)COc1cc(ccc1F)N 34a_100012017398_100000210624 [1,1,0,0,0,0|2,0,0]=4 5721 B13R1.893 CC(C)COc1cc(ccc1F)N 7a_100012017398_100000210760 [1,1,0,0,0,0|2,0,0]=4 5722 B13R1.893 CC(C)COc1cc(ccc1I)Br 34a_100012344904_100000210624 [1,1,0,0,0,0|2,0,0]=4 5723 B13R1.893 CC(C)COc1cc(ccc1I)Br 7a_100012344904_100000210760 [1,1,0,0,0,0|2,0,0]=4 5724 B13R1.893 CC(C)COc1cc(ccc1I)Cl 34a_100000050036_100000210624 [1,1,0,0,0,0|2,0,0]=4 5725 B13R1.893 CC(C)COc1cc(ccc1I)Cl 7a_100000050036_100000210760 [1,1,0,0,0,0|2,0,0]=4 5726 B13R1.893 CC(C)COc1cc(ccc1I)F 34a_100010084537_100000210624 [1,1,0,0,0,0|2,0,0]=4 5727 B13R1.893 CC(C)COc1cc(ccc1I)F 7a_100010084537_100000210760 [1,1,0,0,0,0|2,0,0]=4 5728 B13R1.893 CC(C)COc1cc(ccc1N)Br 34a_100000739049_100000210624 [1,1,0,0,0,0|2,0,0]=4 5729 B13R1.893 CC(C)COc1cc(ccc1N)Br 7a_100000739049_100000210760 [1,1,0,0,0,0|2,0,0]=4 5730 B13R1.893 CC(C)COc1cc(ccc1N)Cl 34a_100000185728_100000210624 [1,1,0,0,0,0|2,0,0]=4 5731 B13R1.893 CC(C)COc1cc(ccc1N)Cl 7a_100000185728_100000210760 [1,1,0,0,0,0|2,0,0]=4 5732 B13R1.893 CC(C)COc1cc(ccc1N)F 34a_100000753323_100000210624 [1,1,0,0,0,0|2,0,0]=4 5733 B13R1.893 CC(C)COc1cc(ccc1N)F 7a_100000753323_100000210760 [1,1,0,0,0,0|2,0,0]=4 5734 B13R1.893 CC(C)COc1cc(ccc1N)I 34a_100000057187_100000210624 [1,1,0,0,0,0|2,0,0]=4 5735 B13R1.893 CC(C)COc1cc(ccc1N)I 7a_100000057187_100000210760 [1,1,0,0,0,0|2,0,0]=4 5736 B13R1.893 CC(C)COc1cc(ccc1N)N 34a_100025717382_100000210624 [1,1,0,0,0,0|2,0,0]=4 5737 B13R1.893 CC(O)COc1cc(ccc1Br)Br 34a_100011220040_100011218427 [1,1,0,0,0,0|2,0,0]=4 5738 B13R1.893 CC(O)COc1cc(ccc1Br)Br 7a_100011220040_100011218427 [1,1,0,0,0,0|2,0,0]=4 5739 B13R1.893 CC(O)COc1cc(ccc1Br)Cl 34a_100012339455_100011218427 [1,1,0,0,0,0|2,0,0]=4 5740 B13R1.893 CC(O)COc1cc(ccc1Br)Cl 7a_100012339455_100011218427 [1,1,0,0,0,0|2,0,0]=4 5741 B13R1.893 CC(O)COc1cc(ccc1Br)F 34a_100000690578_100011218427 [1,1,0,0,0,0|2,0,0]=4 5742 B13R1.893 CC(O)COc1cc(ccc1Br)F 7a_100000690578_100011218427 [1,1,0,0,0,0|2,0,0]=4 5743 B13R1.893 CC(O)COc1cc(ccc1Br)I 34a_100012356990_100011218427 [1,1,0,0,0,0|2,0,0]=4 5744 B13R1.893 CC(O)COc1cc(ccc1Br)I 7a_100012356990_100011218427 [1,1,0,0,0,0|2,0,0]=4 5745 B13R1.893 CC(O)COc1cc(ccc1Cl)Br 34a_100000738945_100011218427 [1,1,0,0,0,0|2,0,0]=4 5746 B13R1.893 CC(O)COc1cc(ccc1Cl)Br 7a_100000738945_100011218427 [1,1,0,0,0,0|2,0,0]=4 5747 B13R1.893 CC(O)COc1cc(ccc1Cl)Cl 34a_100000211422_100011218427 [1,1,0,0,0,0|2,0,0]=4 5748 B13R1.893 CC(O)COc1cc(ccc1Cl)Cl 7a_100000211422_100011218427 [1,1,0,0,0,0|2,0,0]=4 5749 B13R1.893 CC(O)COc1cc(ccc1Cl)F 34a_100000692107_100011218427 [1,1,0,0,0,0|2,0,0]=4 5750 B13R1.893 CC(O)COc1cc(ccc1Cl)F 7a_100000692107_100011218427 [1,1,0,0,0,0|2,0,0]=4 5751 B13R1.893 CC(O)COc1cc(ccc1Cl)I 34a_100011356854_100011218427 [1,1,0,0,0,0|2,0,0]=4 5752 B13R1.893 CC(O)COc1cc(ccc1Cl)I 7a_100011356854_100011218427 [1,1,0,0,0,0|2,0,0]=4 5753 B13R1.893 CC(O)COc1cc(ccc1Cl)N 34a_100011934209_100011218427 [1,1,0,0,0,0|2,0,0]=4 5754 B13R1.893 CC(O)COc1cc(ccc1F)Br 34a_100000686035_100011218427 [1,1,0,0,0,0|2,0,0]=4 5755 B13R1.893 CC(O)COc1cc(ccc1F)Br 7a_100000686035_100011218427 [1,1,0,0,0,0|2,0,0]=4 5756 B13R1.893 CC(O)COc1cc(ccc1F)Cl 34a_100000757397_100011218427 [1,1,0,0,0,0|2,0,0]=4 5757 B13R1.893 CC(O)COc1cc(ccc1F)Cl 7a_100000757397_100011218427 [1,1,0,0,0,0|2,0,0]=4 5758 B13R1.893 CC(O)COc1cc(ccc1F)F 34a_100000752141_100011218427 [1,1,0,0,0,0|2,0,0]=4 5759 B13R1.893 CC(O)COc1cc(ccc1F)F 7a_100000752141_100011218427 [1,1,0,0,0,0|2,0,0]=4 5760 B13R1.893 CC(O)COc1cc(ccc1F)I 34a_100009958187_100011218427 [1,1,0,0,0,0|2,0,0]=4 5761 B13R1.893 CC(O)COc1cc(ccc1F)I 7a_100009958187_100011218427 [1,1,0,0,0,0|2,0,0]=4 5762 B13R1.893 CC(O)COc1cc(ccc1F)N 34a_100012017398_100011218427 [1,1,0,0,0,0|2,0,0]=4 5763 B13R1.893 CC(O)COc1cc(ccc1F)N 7a_100012017398_100011218427 [1,1,0,0,0,0|2,0,0]=4 5764 B13R1.893 CC(O)COc1cc(ccc1I)Br 34a_100012344904_100011218427 [1,1,0,0,0,0|2,0,0]=4 5765 B13R1.893 CC(O)COc1cc(ccc1I)Br 7a_100012344904_100011218427 [1,1,0,0,0,0|2,0,0]=4 5766 B13R1.893 CC(O)COc1cc(ccc1I)Cl 34a_100000050036_100011218427 [1,1,0,0,0,0|2,0,0]=4 5767 B13R1.893 CC(O)COc1cc(ccc1I)Cl 7a_100000050036_100011218427 [1,1,0,0,0,0|2,0,0]=4 5768 B13R1.893 CC(O)COc1cc(ccc1I)F 34a_100010084537_100011218427 [1,1,0,0,0,0|2,0,0]=4 5769 B13R1.893 CC(O)COc1cc(ccc1I)F 7a_100010084537_100011218427 [1,1,0,0,0,0|2,0,0]=4 5770 B13R1.893 CC(O)COc1cc(ccc1N)Br 34a_100000739049_100011218427 [1,1,0,0,0,0|2,0,0]=4 5771 B13R1.893 CC(O)COc1cc(ccc1N)Br 7a_100000739049_100011218427 [1,1,0,0,0,0|2,0,0]=4 5772 B13R1.893 CC(O)COc1cc(ccc1N)Cl 34a_100000185728_100011218427 [1,1,0,0,0,0|2,0,0]=4 5773 B13R1.893 CC(O)COc1cc(ccc1N)Cl 7a_100000185728_100011218427 [1,1,0,0,0,0|2,0,0]=4 5774 B13R1.893 CC(O)COc1cc(ccc1N)F 34a_100000753323_100011218427 [1,1,0,0,0,0|2,0,0]=4 5775 B13R1.893 CC(O)COc1cc(ccc1N)F 7a_100000753323_100011218427 [1,1,0,0,0,0|2,0,0]=4 5776 B13R1.893 CC(O)COc1cc(ccc1N)I 34a_100000057187_100011218427 [1,1,0,0,0,0|2,0,0]=4 5777 B13R1.893 CC(O)COc1cc(ccc1N)I 7a_100000057187_100011218427 [1,1,0,0,0,0|2,0,0]=4 5778 B13R1.893 CC(O)COc1cc(ccc1N)N 34a_100025717382_100011218427 [1,1,0,0,0,0|2,0,0]=4 5779 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)Br 34a_100011220040_100009817552 [1,1,0,0,0,0|2,0,0]=4 5780 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)Br 7a_100011220040_100009817552 [1,1,0,0,0,0|2,0,0]=4 5781 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)Cl 34a_100012339455_100009817552 [1,1,0,0,0,0|2,0,0]=4 5782 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)Cl 7a_100012339455_100009817552 [1,1,0,0,0,0|2,0,0]=4 5783 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)F 34a_100000690578_100009817552 [1,1,0,0,0,0|2,0,0]=4 5784 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)F 7a_100000690578_100009817552 [1,1,0,0,0,0|2,0,0]=4 5785 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)I 34a_100012356990_100009817552 [1,1,0,0,0,0|2,0,0]=4 5786 B13R1.893 C[C@@H](O)COc1cc(ccc1Br)I 7a_100012356990_100009817552 [1,1,0,0,0,0|2,0,0]=4 5787 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)Br 34a_100000738945_100009817552 [1,1,0,0,0,0|2,0,0]=4 5788 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)Br 7a_100000738945_100009817552 [1,1,0,0,0,0|2,0,0]=4 5789 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)Cl 34a_100000211422_100009817552 [1,1,0,0,0,0|2,0,0]=4 5790 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)Cl 7a_100000211422_100009817552 [1,1,0,0,0,0|2,0,0]=4 5791 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)F 34a_100000692107_100009817552 [1,1,0,0,0,0|2,0,0]=4 5792 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)F 7a_100000692107_100009817552 [1,1,0,0,0,0|2,0,0]=4 5793 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)I 34a_100011356854_100009817552 [1,1,0,0,0,0|2,0,0]=4 5794 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)I 7a_100011356854_100009817552 [1,1,0,0,0,0|2,0,0]=4 5795 B13R1.893 C[C@@H](O)COc1cc(ccc1Cl)N 34a_100011934209_100009817552 [1,1,0,0,0,0|2,0,0]=4 5796 B13R1.893 C[C@@H](O)COc1cc(ccc1F)Br 34a_100000686035_100009817552 [1,1,0,0,0,0|2,0,0]=4 5797 B13R1.893 C[C@@H](O)COc1cc(ccc1F)Br 7a_100000686035_100009817552 [1,1,0,0,0,0|2,0,0]=4 5798 B13R1.893 C[C@@H](O)COc1cc(ccc1F)Cl 34a_100000757397_100009817552 [1,1,0,0,0,0|2,0,0]=4 5799 B13R1.893 C[C@@H](O)COc1cc(ccc1F)Cl 7a_100000757397_100009817552 [1,1,0,0,0,0|2,0,0]=4 5800 B13R1.893 C[C@@H](O)COc1cc(ccc1F)F 34a_100000752141_100009817552 [1,1,0,0,0,0|2,0,0]=4 5801 B13R1.893 C[C@@H](O)COc1cc(ccc1F)F 7a_100000752141_100009817552 [1,1,0,0,0,0|2,0,0]=4 5802 B13R1.893 C[C@@H](O)COc1cc(ccc1F)I 34a_100009958187_100009817552 [1,1,0,0,0,0|2,0,0]=4 5803 B13R1.893 C[C@@H](O)COc1cc(ccc1F)I 7a_100009958187_100009817552 [1,1,0,0,0,0|2,0,0]=4 5804 B13R1.893 C[C@@H](O)COc1cc(ccc1F)N 34a_100012017398_100009817552 [1,1,0,0,0,0|2,0,0]=4 5805 B13R1.893 C[C@@H](O)COc1cc(ccc1F)N 7a_100012017398_100009817552 [1,1,0,0,0,0|2,0,0]=4 5806 B13R1.893 C[C@@H](O)COc1cc(ccc1I)Br 34a_100012344904_100009817552 [1,1,0,0,0,0|2,0,0]=4 5807 B13R1.893 C[C@@H](O)COc1cc(ccc1I)Br 7a_100012344904_100009817552 [1,1,0,0,0,0|2,0,0]=4 5808 B13R1.893 C[C@@H](O)COc1cc(ccc1I)Cl 34a_100000050036_100009817552 [1,1,0,0,0,0|2,0,0]=4 5809 B13R1.893 C[C@@H](O)COc1cc(ccc1I)Cl 7a_100000050036_100009817552 [1,1,0,0,0,0|2,0,0]=4 5810 B13R1.893 C[C@@H](O)COc1cc(ccc1I)F 34a_100010084537_100009817552 [1,1,0,0,0,0|2,0,0]=4 5811 B13R1.893 C[C@@H](O)COc1cc(ccc1I)F 7a_100010084537_100009817552 [1,1,0,0,0,0|2,0,0]=4 5812 B13R1.893 C[C@@H](O)COc1cc(ccc1N)Br 34a_100000739049_100009817552 [1,1,0,0,0,0|2,0,0]=4 5813 B13R1.893 C[C@@H](O)COc1cc(ccc1N)Br 7a_100000739049_100009817552 [1,1,0,0,0,0|2,0,0]=4 5814 B13R1.893 C[C@@H](O)COc1cc(ccc1N)Cl 34a_100000185728_100009817552 [1,1,0,0,0,0|2,0,0]=4 5815 B13R1.893 C[C@@H](O)COc1cc(ccc1N)Cl 7a_100000185728_100009817552 [1,1,0,0,0,0|2,0,0]=4 5816 B13R1.893 C[C@@H](O)COc1cc(ccc1N)F 34a_100000753323_100009817552 [1,1,0,0,0,0|2,0,0]=4 5817 B13R1.893 C[C@@H](O)COc1cc(ccc1N)F 7a_100000753323_100009817552 [1,1,0,0,0,0|2,0,0]=4 5818 B13R1.893 C[C@@H](O)COc1cc(ccc1N)I 34a_100000057187_100009817552 [1,1,0,0,0,0|2,0,0]=4 5819 B13R1.893 C[C@@H](O)COc1cc(ccc1N)I 7a_100000057187_100009817552 [1,1,0,0,0,0|2,0,0]=4 5820 B13R1.893 C[C@@H](O)COc1cc(ccc1N)N 34a_100025717382_100009817552 [1,1,0,0,0,0|2,0,0]=4 5821 B13R1.893 Cc1ccc(c(c1)NCC(C)C)C 2230a_100000185781_100000210760 [1,1,0,0,0,0|2,0,0]=4 5822 B13R1.893 Cc1ccc(c(c1)NCC(C)C)C 34a_100000185781_100000210624 [1,1,0,0,0,0|2,0,0]=4 5823 B13R1.893 Cc1ccc(c(c1)NCC(C)C)C 7a_100000185781_100000210760 [1,1,0,0,0,0|2,0,0]=4 5824 B13R1.893 Cc1ccc(c(c1)NCC(C)O)C 2230a_100000185781_100011218427 [1,1,0,0,0,0|2,0,0]=4 5825 B13R1.893 Cc1ccc(c(c1)NCC(C)O)C 34a_100000185781_100011218427 [1,1,0,0,0,0|2,0,0]=4 5826 B13R1.893 Cc1ccc(c(c1)NCC(C)O)C 7a_100000185781_100011218427 [1,1,0,0,0,0|2,0,0]=4 5827 B13R1.893 Cc1ccc(c(c1)NC[C@@H](C)O)C 2230a_100000185781_100009817552 [1,1,0,0,0,0|2,0,0]=4 5828 B13R1.893 Cc1ccc(c(c1)NC[C@@H](C)O)C 34a_100000185781_100009817552 [1,1,0,0,0,0|2,0,0]=4 5829 B13R1.893 Cc1ccc(c(c1)NC[C@@H](C)O)C 7a_100000185781_100009817552 [1,1,0,0,0,0|2,0,0]=4 5830 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)C 34a_100000210931_100000187820 [1,1,0,0,0,0|1,0,1]=4 5831 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)C 7a_100000210931_100000187820 [1,1,0,0,0,0|1,0,1]=4 5832 B13R1.893 Cc1ccc(c(c1)OCC(=O)[13CH3])C 1458a_100000182428_200025704644 [1,1,0,0,0,0|1,0,1]=4 5833 B13R1.893 Cc1ccc(c(c1)OCC(C)C)Br 34a_100012002257_100000210624 [1,1,0,0,0,0|2,0,0]=4 5834 B13R1.893 Cc1ccc(c(c1)OCC(C)C)Br 7a_100012002257_100000210760 [1,1,0,0,0,0|2,0,0]=4 5835 B13R1.893 Cc1ccc(c(c1)OCC(C)C)C 34a_100000210931_100000210624 [1,1,0,0,0,0|1,0,0]=3 5836 B13R1.893 Cc1ccc(c(c1)OCC(C)C)C 7a_100000210931_100000210760 [1,1,0,0,0,0|1,0,0]=3 5837 B13R1.893 Cc1ccc(c(c1)OCC(C)C)Cl 34a_100000211493_100000210624 [1,1,0,0,0,0|2,0,0]=4 5838 B13R1.893 Cc1ccc(c(c1)OCC(C)C)Cl 7a_100000211493_100000210760 [1,1,0,0,0,0|2,0,0]=4 5839 B13R1.893 Cc1ccc(c(c1)OCC(C)C)F 34a_100000759540_100000210624 [1,1,0,0,0,0|2,0,0]=4 5840 B13R1.893 Cc1ccc(c(c1)OCC(C)C)F 7a_100000759540_100000210760 [1,1,0,0,0,0|2,0,0]=4 5841 B13R1.893 Cc1ccc(c(c1)OCC(C)C)N 34a_100000211527_100000210624 [1,1,0,0,0,0|2,0,0]=4 5842 B13R1.893 Cc1ccc(c(c1)OCC(C)C)N 7a_100000211527_100000210760 [1,1,0,0,0,0|2,0,0]=4 5843 B13R1.893 Cc1ccc(c(c1)OCC(C)O)Br 34a_100012002257_100011218427 [1,1,0,0,0,0|2,0,0]=4 5844 B13R1.893 Cc1ccc(c(c1)OCC(C)O)Br 7a_100012002257_100011218427 [1,1,0,0,0,0|2,0,0]=4 5845 B13R1.893 Cc1ccc(c(c1)OCC(C)O)C 34a_100000210931_100011218427 [1,1,0,0,0,0|1,0,0]=3 5846 B13R1.893 Cc1ccc(c(c1)OCC(C)O)C 7a_100000210931_100011218427 [1,1,0,0,0,0|1,0,0]=3 5847 B13R1.893 Cc1ccc(c(c1)OCC(C)O)Cl 34a_100000211493_100011218427 [1,1,0,0,0,0|2,0,0]=4 5848 B13R1.893 Cc1ccc(c(c1)OCC(C)O)Cl 7a_100000211493_100011218427 [1,1,0,0,0,0|2,0,0]=4 5849 B13R1.893 Cc1ccc(c(c1)OCC(C)O)F 34a_100000759540_100011218427 [1,1,0,0,0,0|2,0,0]=4 5850 B13R1.893 Cc1ccc(c(c1)OCC(C)O)F 7a_100000759540_100011218427 [1,1,0,0,0,0|2,0,0]=4 5851 B13R1.893 Cc1ccc(c(c1)OCC(C)O)N 34a_100000211527_100011218427 [1,1,0,0,0,0|2,0,0]=4 5852 B13R1.893 Cc1ccc(c(c1)OCC(C)O)N 7a_100000211527_100011218427 [1,1,0,0,0,0|2,0,0]=4 5853 B13R1.893 Cc1ccc(c(c1)OCC(F)F)C 34a_100000210931_100011934356 [1,1,0,0,0,0|2,0,0]=4 5854 B13R1.893 Cc1ccc(c(c1)OCC(F)F)C 7a_100000210931_100011934356 [1,1,0,0,0,0|2,0,0]=4 5855 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)Br 34a_100012002257_100009817552 [1,1,0,0,0,0|2,0,0]=4 5856 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)Br 7a_100012002257_100009817552 [1,1,0,0,0,0|2,0,0]=4 5857 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)C 34a_100000210931_100009817552 [1,1,0,0,0,0|1,0,0]=3 5858 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)C 7a_100000210931_100009817552 [1,1,0,0,0,0|1,0,0]=3 5859 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)Cl 34a_100000211493_100009817552 [1,1,0,0,0,0|2,0,0]=4 5860 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)Cl 7a_100000211493_100009817552 [1,1,0,0,0,0|2,0,0]=4 5861 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)F 34a_100000759540_100009817552 [1,1,0,0,0,0|2,0,0]=4 5862 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)F 7a_100000759540_100009817552 [1,1,0,0,0,0|2,0,0]=4 5863 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)N 34a_100000211527_100009817552 [1,1,0,0,0,0|2,0,0]=4 5864 B13R1.893 Cc1ccc(c(c1)OC[C@@H](C)O)N 7a_100000211527_100009817552 [1,1,0,0,0,0|2,0,0]=4 5865 B13R1.893 Cc1ccc(c(c1)SCC(C)C)C 62a_100000210624_100000210833 [1,1,0,0,0,0|1,1,0]=4 5866 B13R1.893 Cc1ccc(c(c1)SCC(C)C)C 62a_100000210833_100000210760 [1,1,0,0,0,0|1,1,0]=4 5867 B13R1.893 Cc1ccc(c(c1)SCC(C)O)C 62a_100000210833_100011218427 [1,1,0,0,0,0|1,1,0]=4 5868 B13R1.893 Cc1ccc(c(c1)SCC(C)O)C 62a_100011218427_100000210833 [1,1,0,0,0,0|1,1,0]=4 5869 B13R1.893 Cc1ccc(c(c1)SC[C@@H](C)O)C 62a_100000210833_100009817552 [1,1,0,0,0,0|1,1,0]=4 5870 B13R1.893 Cc1ccc(c(c1)SC[C@@H](C)O)C 62a_100009817552_100000210833 [1,1,0,0,0,0|1,1,0]=4 5871 B13R1.893 Cc1ccc(cc1NCC(C)C)Br 34a_100000741167_100000210624 [1,1,0,0,0,0|2,0,0]=4 5872 B13R1.893 Cc1ccc(cc1NCC(C)C)Br 7a_100000741167_100000210760 [1,1,0,0,0,0|2,0,0]=4 5873 B13R1.893 Cc1ccc(cc1NCC(C)C)Cl 34a_100000211374_100000210624 [1,1,0,0,0,0|2,0,0]=4 5874 B13R1.893 Cc1ccc(cc1NCC(C)C)Cl 7a_100000211374_100000210760 [1,1,0,0,0,0|2,0,0]=4 5875 B13R1.893 Cc1ccc(cc1NCC(C)C)F 34a_100000211107_100000210624 [1,1,0,0,0,0|2,0,0]=4 5876 B13R1.893 Cc1ccc(cc1NCC(C)C)F 7a_100000211107_100000210760 [1,1,0,0,0,0|2,0,0]=4 5877 B13R1.893 Cc1ccc(cc1NCC(C)C)I 7a_100000761890_100000210760 [1,1,0,0,0,0|2,0,0]=4 5878 B13R1.893 Cc1ccc(cc1NCC(C)C)O 34a_100011216113_100000210624 [1,1,0,0,0,0|2,0,0]=4 5879 B13R1.893 Cc1ccc(cc1NCC(C)O)Br 34a_100000741167_100011218427 [1,1,0,0,0,0|2,0,0]=4 5880 B13R1.893 Cc1ccc(cc1NCC(C)O)Br 7a_100000741167_100011218427 [1,1,0,0,0,0|2,0,0]=4 5881 B13R1.893 Cc1ccc(cc1NCC(C)O)Cl 34a_100000211374_100011218427 [1,1,0,0,0,0|2,0,0]=4 5882 B13R1.893 Cc1ccc(cc1NCC(C)O)Cl 7a_100000211374_100011218427 [1,1,0,0,0,0|2,0,0]=4 5883 B13R1.893 Cc1ccc(cc1NCC(C)O)F 34a_100000211107_100011218427 [1,1,0,0,0,0|2,0,0]=4 5884 B13R1.893 Cc1ccc(cc1NCC(C)O)F 7a_100000211107_100011218427 [1,1,0,0,0,0|2,0,0]=4 5885 B13R1.893 Cc1ccc(cc1NCC(C)O)I 7a_100000761890_100011218427 [1,1,0,0,0,0|2,0,0]=4 5886 B13R1.893 Cc1ccc(cc1NCC(C)O)O 34a_100011216113_100011218427 [1,1,0,0,0,0|2,0,0]=4 5887 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)Br 34a_100000741167_100009817552 [1,1,0,0,0,0|2,0,0]=4 5888 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)Br 7a_100000741167_100009817552 [1,1,0,0,0,0|2,0,0]=4 5889 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)Cl 34a_100000211374_100009817552 [1,1,0,0,0,0|2,0,0]=4 5890 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)Cl 7a_100000211374_100009817552 [1,1,0,0,0,0|2,0,0]=4 5891 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)F 34a_100000211107_100009817552 [1,1,0,0,0,0|2,0,0]=4 5892 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)F 7a_100000211107_100009817552 [1,1,0,0,0,0|2,0,0]=4 5893 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)I 7a_100000761890_100009817552 [1,1,0,0,0,0|2,0,0]=4 5894 B13R1.893 Cc1ccc(cc1NC[C@@H](C)O)O 34a_100011216113_100009817552 [1,1,0,0,0,0|2,0,0]=4 5895 B13R1.893 Cc1ccc(cc1OCC(=O)N)Br 34a_100000685420_100000187820 [1,1,0,0,0,0|1,0,1]=4 5896 B13R1.893 Cc1ccc(cc1OCC(=O)N)Br 7a_100000685420_100000187820 [1,1,0,0,0,0|1,0,1]=4 5897 B13R1.893 Cc1ccc(cc1OCC(=O)N)Cl 34a_100000756515_100000187820 [1,1,0,0,0,0|1,0,1]=4 5898 B13R1.893 Cc1ccc(cc1OCC(=O)N)Cl 7a_100000756515_100000187820 [1,1,0,0,0,0|1,0,1]=4 5899 B13R1.893 Cc1ccc(cc1OCC(=O)N)F 34a_100000690566_100000187820 [1,1,0,0,0,0|1,0,1]=4 5900 B13R1.893 Cc1ccc(cc1OCC(=O)N)F 7a_100000690566_100000187820 [1,1,0,0,0,0|1,0,1]=4 5901 B13R1.893 Cc1ccc(cc1OCC(=O)N)I 7a_100000766334_100000187820 [1,1,0,0,0,0|1,0,1]=4 5902 B13R1.893 Cc1ccc(cc1OCC(=O)N)N 34a_100000759471_100000187820 [1,1,0,0,0,0|1,0,1]=4 5903 B13R1.893 Cc1ccc(cc1OCC(=O)N)N 7a_100000759471_100000187820 [1,1,0,0,0,0|1,0,1]=4 5904 B13R1.893 Cc1ccc(cc1OCC(C)C)Br 34a_100000685420_100000210624 [1,1,0,0,0,0|1,0,0]=3 5905 B13R1.893 Cc1ccc(cc1OCC(C)C)Br 7a_100000685420_100000210760 [1,1,0,0,0,0|1,0,0]=3 5906 B13R1.893 Cc1ccc(cc1OCC(C)C)Cl 34a_100000756515_100000210624 [1,1,0,0,0,0|1,0,0]=3 5907 B13R1.893 Cc1ccc(cc1OCC(C)C)Cl 7a_100000756515_100000210760 [1,1,0,0,0,0|1,0,0]=3 5908 B13R1.893 Cc1ccc(cc1OCC(C)C)F 34a_100000690566_100000210624 [1,1,0,0,0,0|1,0,0]=3 5909 B13R1.893 Cc1ccc(cc1OCC(C)C)F 7a_100000690566_100000210760 [1,1,0,0,0,0|1,0,0]=3 5910 B13R1.893 Cc1ccc(cc1OCC(C)C)I 7a_100000766334_100000210760 [1,1,0,0,0,0|1,0,0]=3 5911 B13R1.893 Cc1ccc(cc1OCC(C)C)N 34a_100000759471_100000210624 [1,1,0,0,0,0|1,0,0]=3 5912 B13R1.893 Cc1ccc(cc1OCC(C)C)N 7a_100000759471_100000210760 [1,1,0,0,0,0|1,0,0]=3 5913 B13R1.893 Cc1ccc(cc1OCC(C)O)Br 34a_100000685420_100011218427 [1,1,0,0,0,0|1,0,0]=3 5914 B13R1.893 Cc1ccc(cc1OCC(C)O)Br 7a_100000685420_100011218427 [1,1,0,0,0,0|1,0,0]=3 5915 B13R1.893 Cc1ccc(cc1OCC(C)O)Cl 34a_100000756515_100011218427 [1,1,0,0,0,0|1,0,0]=3 5916 B13R1.893 Cc1ccc(cc1OCC(C)O)Cl 7a_100000756515_100011218427 [1,1,0,0,0,0|1,0,0]=3 5917 B13R1.893 Cc1ccc(cc1OCC(C)O)F 34a_100000690566_100011218427 [1,1,0,0,0,0|1,0,0]=3 5918 B13R1.893 Cc1ccc(cc1OCC(C)O)F 7a_100000690566_100011218427 [1,1,0,0,0,0|1,0,0]=3 5919 B13R1.893 Cc1ccc(cc1OCC(C)O)I 7a_100000766334_100011218427 [1,1,0,0,0,0|1,0,0]=3 5920 B13R1.893 Cc1ccc(cc1OCC(C)O)N 34a_100000759471_100011218427 [1,1,0,0,0,0|1,0,0]=3 5921 B13R1.893 Cc1ccc(cc1OCC(C)O)N 7a_100000759471_100011218427 [1,1,0,0,0,0|1,0,0]=3 5922 B13R1.893 Cc1ccc(cc1OCC(F)F)Br 34a_100000685420_100011934356 [1,1,0,0,0,0|2,0,0]=4 5923 B13R1.893 Cc1ccc(cc1OCC(F)F)Br 7a_100000685420_100011934356 [1,1,0,0,0,0|2,0,0]=4 5924 B13R1.893 Cc1ccc(cc1OCC(F)F)Cl 34a_100000756515_100011934356 [1,1,0,0,0,0|2,0,0]=4 5925 B13R1.893 Cc1ccc(cc1OCC(F)F)Cl 7a_100000756515_100011934356 [1,1,0,0,0,0|2,0,0]=4 5926 B13R1.893 Cc1ccc(cc1OCC(F)F)F 34a_100000690566_100011934356 [1,1,0,0,0,0|2,0,0]=4 5927 B13R1.893 Cc1ccc(cc1OCC(F)F)F 7a_100000690566_100011934356 [1,1,0,0,0,0|2,0,0]=4 5928 B13R1.893 Cc1ccc(cc1OCC(F)F)I 7a_100000766334_100011934356 [1,1,0,0,0,0|2,0,0]=4 5929 B13R1.893 Cc1ccc(cc1OCC(F)F)N 34a_100000759471_100011934356 [1,1,0,0,0,0|2,0,0]=4 5930 B13R1.893 Cc1ccc(cc1OCC(F)F)N 7a_100000759471_100011934356 [1,1,0,0,0,0|2,0,0]=4 5931 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)Br 34a_100000685420_100009817552 [1,1,0,0,0,0|1,0,0]=3 5932 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)Br 7a_100000685420_100009817552 [1,1,0,0,0,0|1,0,0]=3 5933 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)Cl 34a_100000756515_100009817552 [1,1,0,0,0,0|1,0,0]=3 5934 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)Cl 7a_100000756515_100009817552 [1,1,0,0,0,0|1,0,0]=3 5935 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)F 34a_100000690566_100009817552 [1,1,0,0,0,0|1,0,0]=3 5936 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)F 7a_100000690566_100009817552 [1,1,0,0,0,0|1,0,0]=3 5937 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)I 7a_100000766334_100009817552 [1,1,0,0,0,0|1,0,0]=3 5938 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)N 34a_100000759471_100009817552 [1,1,0,0,0,0|1,0,0]=3 5939 B13R1.893 Cc1ccc(cc1OC[C@@H](C)O)N 7a_100000759471_100009817552 [1,1,0,0,0,0|1,0,0]=3 5940 B13R1.893 Cc1ccc(cc1SCC(C)C)Br 62a_100000210624_100011344865 [1,1,0,0,0,0|1,1,0]=4 5941 B13R1.893 Cc1ccc(cc1SCC(C)C)Br 62a_100011344865_100000210760 [1,1,0,0,0,0|1,1,0]=4 5942 B13R1.893 Cc1ccc(cc1SCC(C)C)Cl 62a_100000210624_100011263213 [1,1,0,0,0,0|1,1,0]=4 5943 B13R1.893 Cc1ccc(cc1SCC(C)C)Cl 62a_100011263213_100000210760 [1,1,0,0,0,0|1,1,0]=4 5944 B13R1.893 Cc1ccc(cc1SCC(C)C)F 62a_100000210624_100011218078 [1,1,0,0,0,0|1,1,0]=4 5945 B13R1.893 Cc1ccc(cc1SCC(C)C)F 62a_100011218078_100000210760 [1,1,0,0,0,0|1,1,0]=4 5946 B13R1.893 Cc1ccc(cc1SCC(C)C)N 62a_100000210624_100000736455 [1,1,0,0,0,0|1,1,0]=4 5947 B13R1.893 Cc1ccc(cc1SCC(C)C)N 62a_100000736455_100000210760 [1,1,0,0,0,0|1,1,0]=4 5948 B13R1.893 Cc1ccc(cc1SCC(C)C)O 62a_100000210624_100011380479 [1,1,0,0,0,0|1,1,0]=4 5949 B13R1.893 Cc1ccc(cc1SCC(C)C)O 62a_100011380479_100000210760 [1,1,0,0,0,0|1,1,0]=4 5950 B13R1.893 Cc1ccc(cc1SCC(C)O)Br 62a_100011218427_100011344865 [1,1,0,0,0,0|1,1,0]=4 5951 B13R1.893 Cc1ccc(cc1SCC(C)O)Br 62a_100011344865_100011218427 [1,1,0,0,0,0|1,1,0]=4 5952 B13R1.893 Cc1ccc(cc1SCC(C)O)Cl 62a_100011218427_100011263213 [1,1,0,0,0,0|1,1,0]=4 5953 B13R1.893 Cc1ccc(cc1SCC(C)O)Cl 62a_100011263213_100011218427 [1,1,0,0,0,0|1,1,0]=4 5954 B13R1.893 Cc1ccc(cc1SCC(C)O)F 62a_100011218078_100011218427 [1,1,0,0,0,0|1,1,0]=4 5955 B13R1.893 Cc1ccc(cc1SCC(C)O)F 62a_100011218427_100011218078 [1,1,0,0,0,0|1,1,0]=4 5956 B13R1.893 Cc1ccc(cc1SCC(C)O)N 62a_100000736455_100011218427 [1,1,0,0,0,0|1,1,0]=4 5957 B13R1.893 Cc1ccc(cc1SCC(C)O)N 62a_100011218427_100000736455 [1,1,0,0,0,0|1,1,0]=4 5958 B13R1.893 Cc1ccc(cc1SCC(C)O)O 62a_100011218427_100011380479 [1,1,0,0,0,0|1,1,0]=4 5959 B13R1.893 Cc1ccc(cc1SCC(C)O)O 62a_100011380479_100011218427 [1,1,0,0,0,0|1,1,0]=4 5960 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)Br 62a_100009817552_100011344865 [1,1,0,0,0,0|1,1,0]=4 5961 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)Br 62a_100011344865_100009817552 [1,1,0,0,0,0|1,1,0]=4 5962 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)Cl 62a_100009817552_100011263213 [1,1,0,0,0,0|1,1,0]=4 5963 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)Cl 62a_100011263213_100009817552 [1,1,0,0,0,0|1,1,0]=4 5964 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)F 62a_100009817552_100011218078 [1,1,0,0,0,0|1,1,0]=4 5965 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)F 62a_100011218078_100009817552 [1,1,0,0,0,0|1,1,0]=4 5966 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)N 62a_100000736455_100009817552 [1,1,0,0,0,0|1,1,0]=4 5967 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)N 62a_100009817552_100000736455 [1,1,0,0,0,0|1,1,0]=4 5968 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)O 62a_100009817552_100011380479 [1,1,0,0,0,0|1,1,0]=4 5969 B13R1.893 Cc1ccc(cc1SC[C@@H](C)O)O 62a_100011380479_100009817552 [1,1,0,0,0,0|1,1,0]=4 5970 B13R1.893 Cc1cnc(cc1OCC(C)C)Br 34a_100000704368_100000210624 [1,1,0,0,0,0|2,0,0]=4 5971 B13R1.893 Cc1cnc(cc1OCC(C)C)Br 7a_100000704368_100000210760 [1,1,0,0,0,0|2,0,0]=4 5972 B13R1.893 Cc1cnc(cc1OCC(C)O)Br 34a_100000704368_100011218427 [1,1,0,0,0,0|2,0,0]=4 5973 B13R1.893 Cc1cnc(cc1OCC(C)O)Br 7a_100000704368_100011218427 [1,1,0,0,0,0|2,0,0]=4 5974 B13R1.893 Cc1cnc(cc1OC[C@@H](C)O)Br 34a_100000704368_100009817552 [1,1,0,0,0,0|2,0,0]=4 5975 B13R1.893 Cc1cnc(cc1OC[C@@H](C)O)Br 7a_100000704368_100009817552 [1,1,0,0,0,0|2,0,0]=4 5976 B13R1.893 Cc1ncc(cc1OCC(C)C)Br 34a_100009864810_100000210624 [1,1,0,0,0,0|2,0,0]=4 5977 B13R1.893 Cc1ncc(cc1OCC(C)C)Br 7a_100009864810_100000210760 [1,1,0,0,0,0|2,0,0]=4 5978 B13R1.893 Cc1ncc(cc1OCC(C)O)Br 34a_100009864810_100011218427 [1,1,0,0,0,0|2,0,0]=4 5979 B13R1.893 Cc1ncc(cc1OCC(C)O)Br 7a_100009864810_100011218427 [1,1,0,0,0,0|2,0,0]=4 5980 B13R1.893 Cc1ncc(cc1OC[C@@H](C)O)Br 34a_100009864810_100009817552 [1,1,0,0,0,0|2,0,0]=4 5981 B13R1.893 Cc1ncc(cc1OC[C@@H](C)O)Br 7a_100009864810_100009817552 [1,1,0,0,0,0|2,0,0]=4 5982 B13R1.1601 C#CCOc1c(cc(cc1C)Br)C 34a_100000187306_100000184674 [1,1,0,0,0,0|0,0,2]=4 5983 B13R1.1601 C#CCOc1c(cc(cc1C)Br)C 7a_100000187306_100000038162 [1,1,0,0,0,0|0,0,2]=4 5984 B13R1.1601 C#CCOc1c(cc(cc1C)C)C 34a_100000212074_100000184674 [1,1,0,0,0,0|0,0,2]=4 5985 B13R1.1601 C#CCOc1c(cc(cc1C)C)C 7a_100000212074_100000038162 [1,1,0,0,0,0|0,0,2]=4 5986 B13R1.1601 C#CCOc1c(cc(cc1C)Cl)C 34a_100000211519_100000184674 [1,1,0,0,0,0|0,0,2]=4 5987 B13R1.1601 C#CCOc1c(cc(cc1C)Cl)C 7a_100000211519_100000038162 [1,1,0,0,0,0|0,0,2]=4 5988 B13R1.1601 C#CCOc1c(cc(cc1C)F)C 34a_100000081862_100000184674 [1,1,0,0,0,0|0,0,2]=4 5989 B13R1.1601 C#CCOc1c(cc(cc1C)F)C 7a_100000081862_100000038162 [1,1,0,0,0,0|0,0,2]=4 5990 B13R1.1601 C#CCOc1c(cc(cc1C)I)C 34a_100011216129_100000184674 [1,1,0,0,0,0|0,0,2]=4 5991 B13R1.1601 C#CCOc1c(cc(cc1C)I)C 7a_100011216129_100000038162 [1,1,0,0,0,0|0,0,2]=4 5992 B13R1.1601 C#CCOc1c(cc(cc1C)N)C 34a_100000703291_100000184674 [1,1,0,0,0,0|0,0,2]=4 5993 B13R1.1601 C#CCOc1c(cc(cc1C)N)C 7a_100000703291_100000038162 [1,1,0,0,0,0|0,0,2]=4 5994 B13R1.1601 C=CCOc1c(cc(cc1C)Br)C 34a_100000187306_100015514636 [1,1,0,0,0,0|0,0,2]=4 5995 B13R1.1601 C=CCOc1c(cc(cc1C)Br)C 7a_100000187306_100015514636 [1,1,0,0,0,0|0,0,2]=4 5996 B13R1.1601 C=CCOc1c(cc(cc1C)C)C 34a_100000212074_100015514636 [1,1,0,0,0,0|0,0,2]=4 5997 B13R1.1601 C=CCOc1c(cc(cc1C)C)C 7a_100000212074_100015514636 [1,1,0,0,0,0|0,0,2]=4 5998 B13R1.1601 C=CCOc1c(cc(cc1C)Cl)C 34a_100000211519_100015514636 [1,1,0,0,0,0|0,0,2]=4 5999 B13R1.1601 C=CCOc1c(cc(cc1C)Cl)C 7a_100000211519_100015514636 [1,1,0,0,0,0|0,0,2]=4 6000 B13R1.1601 C=CCOc1c(cc(cc1C)F)C 34a_100000081862_100015514636 [1,1,0,0,0,0|0,0,2]=4 6001 B13R1.1601 C=CCOc1c(cc(cc1C)F)C 7a_100000081862_100015514636 [1,1,0,0,0,0|0,0,2]=4 6002 B13R1.1601 C=CCOc1c(cc(cc1C)I)C 34a_100011216129_100015514636 [1,1,0,0,0,0|0,0,2]=4 6003 B13R1.1601 C=CCOc1c(cc(cc1C)I)C 7a_100011216129_100015514636 [1,1,0,0,0,0|0,0,2]=4 6004 B13R1.1601 C=CCOc1c(cc(cc1C)N)C 34a_100000703291_100015514636 [1,1,0,0,0,0|0,0,2]=4 6005 B13R1.1601 C=CCOc1c(cc(cc1C)N)C 7a_100000703291_100015514636 [1,1,0,0,0,0|0,0,2]=4 6006 B13R1.1601 CCCCc1c(cc(cc1Br)C)C 271570a_100020621405_200012353697 [1,1,0,0,0,0|2,0,0]=4 6007 B13R1.1601 CCCCc1c(cc(cc1Br)F)C 271570a_100020621405_100010208209 [1,1,0,0,0,0|2,0,0]=4 6008 B13R1.1601 CCCCc1c(cc(cc1C)Br)C 271570a_100020621405_100009814048 [1,1,0,0,0,0|1,0,0]=3 6009 B13R1.1601 CCCCc1c(cc(cc1C)C)C 271570a_100020621405_100011204320 [1,1,0,0,0,0|1,0,0]=3 6010 B13R1.1601 CCCCc1c(cc(cc1C)Cl)C 271570a_100020621405_100010244930 [1,1,0,0,0,0|1,0,0]=3 6011 B13R1.1601 CCCCc1c(cc(cc1C)F)C 271570a_100020621405_100012356666 [1,1,0,0,0,0|1,0,0]=3 6012 B13R1.1601 CCCCc1c(cc(cc1C)O)C 271570a_100020621405_100000243743 [1,1,0,0,0,0|1,0,0]=3 6013 B13R1.1601 CCCCc1c(cc(cc1Cl)Cl)C 271570a_100020621405_200000035511 [1,1,0,0,0,0|2,0,0]=4 6014 B13R1.1601 CCCCc1c(cc(cc1Cl)F)C 271570a_100020621405_100010079234 [1,1,0,0,0,0|2,0,0]=4 6015 B13R1.1601 CCCCc1c(cc(cc1N)Cl)C 271570a_100020621405_100000698757 [1,1,0,0,0,0|2,0,0]=4 6016 B13R1.1601 CCCCc1c(cc(cc1O)C)C 271570a_100020621405_100010342985 [1,1,0,0,0,0|2,0,0]=4 6017 B13R1.1601 CCCCc1c(cc(cc1O)Cl)C 271570a_100020621405_100010254216 [1,1,0,0,0,0|2,0,0]=4 6018 B13R1.1601 CCCCc1c(cc(nc1C)N)C 271570a_100020621405_100000699364 [1,1,0,0,0,0|2,0,0]=4 6019 B13R1.1601 CCCNc1c(cc(cc1Br)Br)C 34a_100012047207_100000210303 [1,1,0,0,0,0|2,0,0]=4 6020 B13R1.1601 CCCNc1c(cc(cc1Br)Br)C 7a_100012047207_100000210303 [1,1,0,0,0,0|2,0,0]=4 6021 B13R1.1601 CCCNc1c(cc(cc1Br)C)C 34a_100000688863_100000210303 [1,1,0,0,0,0|2,0,0]=4 6022 B13R1.1601 CCCNc1c(cc(cc1Br)Cl)C 34a_100012353696_100000210303 [1,1,0,0,0,0|2,0,0]=4 6023 B13R1.1601 CCCNc1c(cc(cc1Br)Cl)C 7a_100012353696_100000210303 [1,1,0,0,0,0|2,0,0]=4 6024 B13R1.1601 CCCNc1c(cc(cc1Br)F)C 34a_100011216670_100000210303 [1,1,0,0,0,0|2,0,0]=4 6025 B13R1.1601 CCCNc1c(cc(cc1Br)F)C 7a_100011216670_100000210303 [1,1,0,0,0,0|2,0,0]=4 6026 B13R1.1601 CCCNc1c(cc(cc1C)Br)C 34a_100000737279_100000210303 [1,1,0,0,0,0|1,0,0]=3 6027 B13R1.1601 CCCNc1c(cc(cc1C)Br)C 7a_100000737279_100000210303 [1,1,0,0,0,0|1,0,0]=3 6028 B13R1.1601 CCCNc1c(cc(cc1C)C)C 34a_100000210045_100000210303 [1,1,0,0,0,0|1,0,0]=3 6029 B13R1.1601 CCCNc1c(cc(cc1C)C)C 7a_100000210045_100000210303 [1,1,0,0,0,0|1,0,0]=3 6030 B13R1.1601 CCCNc1c(cc(cc1C)Cl)C 34a_100000692879_100000210303 [1,1,0,0,0,0|1,0,0]=3 6031 B13R1.1601 CCCNc1c(cc(cc1C)Cl)C 7a_100000692879_100000210303 [1,1,0,0,0,0|1,0,0]=3 6032 B13R1.1601 CCCNc1c(cc(cc1C)F)C 34a_100011290887_100000210303 [1,1,0,0,0,0|1,0,0]=3 6033 B13R1.1601 CCCNc1c(cc(cc1C)F)C 7a_100011290887_100000210303 [1,1,0,0,0,0|1,0,0]=3 6034 B13R1.1601 CCCNc1c(cc(cc1C)I)C 7a_100011356821_100000210303 [1,1,0,0,0,0|1,0,0]=3 6035 B13R1.1601 CCCNc1c(cc(cc1C)O)C 34a_100011934200_100000210303 [1,1,0,0,0,0|1,0,0]=3 6036 B13R1.1601 CCCNc1c(cc(cc1Cl)Br)C 34a_100000741131_100000210303 [1,1,0,0,0,0|2,0,0]=4 6037 B13R1.1601 CCCNc1c(cc(cc1Cl)Br)C 7a_100000741131_100000210303 [1,1,0,0,0,0|2,0,0]=4 6038 B13R1.1601 CCCNc1c(cc(cc1Cl)C)C 34a_100000211461_100000210303 [1,1,0,0,0,0|2,0,0]=4 6039 B13R1.1601 CCCNc1c(cc(cc1Cl)C)C 7a_100000211461_100000210303 [1,1,0,0,0,0|2,0,0]=4 6040 B13R1.1601 CCCNc1c(cc(cc1Cl)Cl)C 34a_100011215104_100000210303 [1,1,0,0,0,0|2,0,0]=4 6041 B13R1.1601 CCCNc1c(cc(cc1Cl)Cl)C 7a_100011215104_100000210303 [1,1,0,0,0,0|2,0,0]=4 6042 B13R1.1601 CCCNc1c(cc(cc1Cl)F)C 34a_100000725997_100000210303 [1,1,0,0,0,0|2,0,0]=4 6043 B13R1.1601 CCCNc1c(cc(cc1Cl)F)C 7a_100000725997_100000210303 [1,1,0,0,0,0|2,0,0]=4 6044 B13R1.1601 CCCNc1c(cc(cc1F)Br)C 34a_100000709789_100000210303 [1,1,0,0,0,0|2,0,0]=4 6045 B13R1.1601 CCCNc1c(cc(cc1F)Br)C 7a_100000709789_100000210303 [1,1,0,0,0,0|2,0,0]=4 6046 B13R1.1601 CCCNc1c(cc(cc1F)Cl)C 34a_100012017672_100000210303 [1,1,0,0,0,0|2,0,0]=4 6047 B13R1.1601 CCCNc1c(cc(cc1F)Cl)C 7a_100012017672_100000210303 [1,1,0,0,0,0|2,0,0]=4 6048 B13R1.1601 CCCNc1c(cc(cc1I)Br)C 7a_200000690823_100000210303 [1,1,0,0,0,0|2,0,0]=4 6049 B13R1.1601 CCCNc1c(cc(cc1I)Cl)C 7a_100012344046_100000210303 [1,1,0,0,0,0|2,0,0]=4 6050 B13R1.1601 CCCNc1c(cc(cc1O)Br)C 34a_100010371313_100000210303 [1,1,0,0,0,0|2,0,0]=4 6051 B13R1.1601 CCCNc1c(cc(cc1O)Br)C 7a_100010371313_100000210303 [1,1,0,0,0,0|2,0,0]=4 6052 B13R1.1601 CCCOc1c(cc(cc1Br)Br)Br 34a_100000210219_100000210303 [1,1,0,0,0,0|2,0,0]=4 6053 B13R1.1601 CCCOc1c(cc(cc1Br)Br)Br 7a_100000210219_100000210303 [1,1,0,0,0,0|2,0,0]=4 6054 B13R1.1601 CCCOc1c(cc(cc1Br)Br)C 34a_100000186369_100000210303 [1,1,0,0,0,0|1,0,0]=3 6055 B13R1.1601 CCCOc1c(cc(cc1Br)Br)C 7a_100000186369_100000210303 [1,1,0,0,0,0|1,0,0]=3 6056 B13R1.1601 CCCOc1c(cc(cc1Br)Br)Cl 34a_100012337755_100000210303 [1,1,0,0,0,0|2,0,0]=4 6057 B13R1.1601 CCCOc1c(cc(cc1Br)Br)Cl 7a_100012337755_100000210303 [1,1,0,0,0,0|2,0,0]=4 6058 B13R1.1601 CCCOc1c(cc(cc1Br)Br)F 34a_100011216695_100000210303 [1,1,0,0,0,0|2,0,0]=4 6059 B13R1.1601 CCCOc1c(cc(cc1Br)Br)F 7a_100011216695_100000210303 [1,1,0,0,0,0|2,0,0]=4 6060 B13R1.1601 CCCOc1c(cc(cc1Br)Br)N 34a_100010781877_100000210303 [1,1,0,0,0,0|2,0,0]=4 6061 B13R1.1601 CCCOc1c(cc(cc1Br)Br)N 7a_100010781877_100000210303 [1,1,0,0,0,0|2,0,0]=4 6062 B13R1.1601 CCCOc1c(cc(cc1Br)C)Br 34a_100000203795_100000210303 [1,1,0,0,0,0|2,0,0]=4 6063 B13R1.1601 CCCOc1c(cc(cc1Br)C)Br 7a_100000203795_100000210303 [1,1,0,0,0,0|2,0,0]=4 6064 B13R1.1601 CCCOc1c(cc(cc1Br)C)C 34a_100011934984_100000210303 [1,1,0,0,0,0|1,0,0]=3 6065 B13R1.1601 CCCOc1c(cc(cc1Br)C)C 7a_100011934984_100000210303 [1,1,0,0,0,0|1,0,0]=3 6066 B13R1.1601 CCCOc1c(cc(cc1Br)C)F 34a_200010713133_100000210303 [1,1,0,0,0,0|2,0,0]=4 6067 B13R1.1601 CCCOc1c(cc(cc1Br)C)F 7a_200010713133_100000210303 [1,1,0,0,0,0|2,0,0]=4 6068 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)Br 34a_100012337757_100000210303 [1,1,0,0,0,0|2,0,0]=4 6069 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)Br 7a_100012337757_100000210303 [1,1,0,0,0,0|2,0,0]=4 6070 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)C 34a_100012337756_100000210303 [1,1,0,0,0,0|1,0,0]=3 6071 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)C 7a_100012337756_100000210303 [1,1,0,0,0,0|1,0,0]=3 6072 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)Cl 34a_200000243811_100000210303 [1,1,0,0,0,0|2,0,0]=4 6073 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)Cl 7a_200000243811_100000210303 [1,1,0,0,0,0|2,0,0]=4 6074 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)F 34a_100011830412_100000210303 [1,1,0,0,0,0|2,0,0]=4 6075 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)F 7a_100011830412_100000210303 [1,1,0,0,0,0|2,0,0]=4 6076 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)N 34a_106741647128_100000210303 [1,1,0,0,0,0|2,0,0]=4 6077 B13R1.1601 CCCOc1c(cc(cc1Br)Cl)N 7a_106741647128_100000210303 [1,1,0,0,0,0|2,0,0]=4 6078 B13R1.1601 CCCOc1c(cc(cc1Br)F)Br 34a_100011215434_100000210303 [1,1,0,0,0,0|2,0,0]=4 6079 B13R1.1601 CCCOc1c(cc(cc1Br)F)Br 7a_100011215434_100000210303 [1,1,0,0,0,0|2,0,0]=4 6080 B13R1.1601 CCCOc1c(cc(cc1Br)F)Cl 34a_100011830411_100000210303 [1,1,0,0,0,0|2,0,0]=4 6081 B13R1.1601 CCCOc1c(cc(cc1Br)F)Cl 7a_100011830411_100000210303 [1,1,0,0,0,0|2,0,0]=4 6082 B13R1.1601 CCCOc1c(cc(cc1Br)F)F 34a_100000688693_100000210303 [1,1,0,0,0,0|2,0,0]=4 6083 B13R1.1601 CCCOc1c(cc(cc1Br)F)F 7a_100000688693_100000210303 [1,1,0,0,0,0|2,0,0]=4 6084 B13R1.1601 CCCOc1c(cc(cc1Br)F)N 34a_200011217456_100000210303 [1,1,0,0,0,0|2,0,0]=4 6085 B13R1.1601 CCCOc1c(cc(cc1Br)F)N 7a_200011217456_100000210303 [1,1,0,0,0,0|2,0,0]=4 6086 B13R1.1601 CCCOc1c(cc(cc1Br)I)C 34a_100010982682_100000210303 [1,1,0,0,0,0|1,0,0]=3 6087 B13R1.1601 CCCOc1c(cc(cc1Br)I)C 7a_100010982682_100000210303 [1,1,0,0,0,0|1,0,0]=3 6088 B13R1.1601 CCCOc1c(cc(cc1Br)N)Br 34a_200000186426_100000210303 [1,1,0,0,0,0|2,0,0]=4 6089 B13R1.1601 CCCOc1c(cc(cc1Br)N)C 34a_100010064301_100000210303 [1,1,0,0,0,0|1,0,0]=3 6090 B13R1.1601 CCCOc1c(cc(cc1Br)N)C 7a_100010064301_100000210303 [1,1,0,0,0,0|1,0,0]=3 6091 B13R1.1601 CCCOc1c(cc(cc1C)Br)C 34a_100000187306_100000210303 [1,1,0,0,0,0|0,0,0]=2 6092 B13R1.1601 CCCOc1c(cc(cc1C)Br)C 7a_100000187306_100000210303 [1,1,0,0,0,0|0,0,0]=2 6093 B13R1.1601 CCCOc1c(cc(cc1C)C)C 34a_100000212074_100000210303 [1,1,0,0,0,0|0,0,0]=2 6094 B13R1.1601 CCCOc1c(cc(cc1C)C)C 7a_100000212074_100000210303 [1,1,0,0,0,0|0,0,0]=2 6095 B13R1.1601 CCCOc1c(cc(cc1C)Cl)C 34a_100000211519_100000210303 [1,1,0,0,0,0|0,0,0]=2 6096 B13R1.1601 CCCOc1c(cc(cc1C)Cl)C 7a_100000211519_100000210303 [1,1,0,0,0,0|0,0,0]=2 6097 B13R1.1601 CCCOc1c(cc(cc1C)F)C 34a_100000081862_100000210303 [1,1,0,0,0,0|0,0,0]=2 6098 B13R1.1601 CCCOc1c(cc(cc1C)F)C 7a_100000081862_100000210303 [1,1,0,0,0,0|0,0,0]=2 6099 B13R1.1601 CCCOc1c(cc(cc1C)I)C 34a_100011216129_100000210303 [1,1,0,0,0,0|0,0,0]=2 6100 B13R1.1601 CCCOc1c(cc(cc1C)I)C 7a_100011216129_100000210303 [1,1,0,0,0,0|0,0,0]=2 6101 B13R1.1601 CCCOc1c(cc(cc1C)N)C 34a_100000703291_100000210303 [1,1,0,0,0,0|0,0,0]=2 6102 B13R1.1601 CCCOc1c(cc(cc1C)N)C 7a_100000703291_100000210303 [1,1,0,0,0,0|0,0,0]=2 6103 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)C 34a_100000211485_100000210303 [1,1,0,0,0,0|1,0,0]=3 6104 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)C 7a_100000211485_100000210303 [1,1,0,0,0,0|1,0,0]=3 6105 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)Cl 34a_100000753780_100000210303 [1,1,0,0,0,0|2,0,0]=4 6106 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)Cl 7a_100000753780_100000210303 [1,1,0,0,0,0|2,0,0]=4 6107 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)F 34a_100011216646_100000210303 [1,1,0,0,0,0|2,0,0]=4 6108 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)F 7a_100011216646_100000210303 [1,1,0,0,0,0|2,0,0]=4 6109 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)N 34a_100000694353_100000210303 [1,1,0,0,0,0|2,0,0]=4 6110 B13R1.1601 CCCOc1c(cc(cc1Cl)Br)N 7a_100000694353_100000210303 [1,1,0,0,0,0|2,0,0]=4 6111 B13R1.1601 CCCOc1c(cc(cc1Cl)C)Cl 34a_100000034925_100000210303 [1,1,0,0,0,0|2,0,0]=4 6112 B13R1.1601 CCCOc1c(cc(cc1Cl)C)Cl 7a_100000034925_100000210303 [1,1,0,0,0,0|2,0,0]=4 6113 B13R1.1601 CCCOc1c(cc(cc1Cl)Cl)C 34a_100011218458_100000210303 [1,1,0,0,0,0|1,0,0]=3 6114 B13R1.1601 CCCOc1c(cc(cc1Cl)Cl)C 7a_100011218458_100000210303 [1,1,0,0,0,0|1,0,0]=3 6115 B13R1.1601 CCCOc1c(cc(cc1Cl)Cl)Cl 34a_100000210218_100000210303 [1,1,0,0,0,0|2,0,0]=4 6116 B13R1.1601 CCCOc1c(cc(cc1Cl)Cl)Cl 7a_100000210218_100000210303 [1,1,0,0,0,0|2,0,0]=4 6117 B13R1.1601 CCCOc1c(cc(cc1Cl)Cl)N 34a_100000695819_100000210303 [1,1,0,0,0,0|2,0,0]=4 6118 B13R1.1601 CCCOc1c(cc(cc1Cl)Cl)N 7a_100000695819_100000210303 [1,1,0,0,0,0|2,0,0]=4 6119 B13R1.1601 CCCOc1c(cc(cc1Cl)F)Cl 34a_100011217724_100000210303 [1,1,0,0,0,0|2,0,0]=4 6120 B13R1.1601 CCCOc1c(cc(cc1Cl)F)Cl 7a_100011217724_100000210303 [1,1,0,0,0,0|2,0,0]=4 6121 B13R1.1601 CCCOc1c(cc(cc1Cl)F)F 34a_100011935252_100000210303 [1,1,0,0,0,0|2,0,0]=4 6122 B13R1.1601 CCCOc1c(cc(cc1Cl)F)F 7a_100011935252_100000210303 [1,1,0,0,0,0|2,0,0]=4 6123 B13R1.1601 CCCOc1c(cc(cc1Cl)I)C 34a_200015900153_100000210303 [1,1,0,0,0,0|1,0,0]=3 6124 B13R1.1601 CCCOc1c(cc(cc1Cl)I)C 7a_200015900153_100000210303 [1,1,0,0,0,0|1,0,0]=3 6125 B13R1.1601 CCCOc1c(cc(cc1Cl)I)Cl 7a_100012339652_100000210303 [1,1,0,0,0,0|2,0,0]=4 6126 B13R1.1601 CCCOc1c(cc(cc1Cl)N)Cl 34a_100000695418_100000210303 [1,1,0,0,0,0|2,0,0]=4 6127 B13R1.1601 CCCOc1c(cc(cc1Cl)N)Cl 7a_100000695418_100000210303 [1,1,0,0,0,0|2,0,0]=4 6128 B13R1.1601 CCCOc1c(cc(cc1F)Br)F 34a_100011216917_100000210303 [1,1,0,0,0,0|2,0,0]=4 6129 B13R1.1601 CCCOc1c(cc(cc1F)Br)F 7a_100011216917_100000210303 [1,1,0,0,0,0|2,0,0]=4 6130 B13R1.1601 CCCOc1c(cc(cc1F)Br)N 34a_100011217383_100000210303 [1,1,0,0,0,0|2,0,0]=4 6131 B13R1.1601 CCCOc1c(cc(cc1F)Br)N 7a_100011217383_100000210303 [1,1,0,0,0,0|2,0,0]=4 6132 B13R1.1601 CCCOc1c(cc(cc1F)Cl)F 34a_100011830429_100000210303 [1,1,0,0,0,0|2,0,0]=4 6133 B13R1.1601 CCCOc1c(cc(cc1F)Cl)F 7a_100011830429_100000210303 [1,1,0,0,0,0|2,0,0]=4 6134 B13R1.1601 CCCOc1c(cc(cc1F)F)F 34a_100011218396_100000210303 [1,1,0,0,0,0|2,0,0]=4 6135 B13R1.1601 CCCOc1c(cc(cc1F)F)F 7a_100011218396_100000210303 [1,1,0,0,0,0|2,0,0]=4 6136 B13R1.1601 CCCOc1c(cc(cc1F)F)N 34a_100015205836_100000210303 [1,1,0,0,0,0|2,0,0]=4 6137 B13R1.1601 CCCOc1c(cc(cc1F)F)N 7a_100015205836_100000210303 [1,1,0,0,0,0|2,0,0]=4 6138 B13R1.1601 CCCOc1c(cc(cc1F)I)F 34a_200011830255_100000210303 [1,1,0,0,0,0|2,0,0]=4 6139 B13R1.1601 CCCOc1c(cc(cc1F)I)F 7a_200011830255_100000210303 [1,1,0,0,0,0|2,0,0]=4 6140 B13R1.1601 CCCOc1c(cc(cc1F)N)F 34a_100016987357_100000210303 [1,1,0,0,0,0|2,0,0]=4 6141 B13R1.1601 CCCOc1c(cc(cc1F)N)F 7a_100016987357_100000210303 [1,1,0,0,0,0|2,0,0]=4 6142 B13R1.1601 CCCOc1c(cc(cc1F)O)F 271570a_203496583355_200016150419 [1,1,0,0,0,0|2,0,0]=4 6143 B13R1.1601 CCCOc1c(cc(cc1I)Br)F 34a_100013354677_100000210303 [1,1,0,0,0,0|2,0,0]=4 6144 B13R1.1601 CCCOc1c(cc(cc1I)Br)F 7a_100013354677_100000210303 [1,1,0,0,0,0|2,0,0]=4 6145 B13R1.1601 CCCOc1c(cc(cc1I)Br)I 7a_100009997433_100000210303 [1,1,0,0,0,0|2,0,0]=4 6146 B13R1.1601 CCCOc1c(cc(cc1I)Br)N 7a_100016071998_100000210303 [1,1,0,0,0,0|2,0,0]=4 6147 B13R1.1601 CCCOc1c(cc(cc1I)C)F 34a_200135191068_100000210303 [1,1,0,0,0,0|2,0,0]=4 6148 B13R1.1601 CCCOc1c(cc(cc1I)C)F 7a_200135191068_100000210303 [1,1,0,0,0,0|2,0,0]=4 6149 B13R1.1601 CCCOc1c(cc(cc1I)Cl)C 34a_100012343667_100000210303 [1,1,0,0,0,0|1,0,0]=3 6150 B13R1.1601 CCCOc1c(cc(cc1I)Cl)C 7a_100012343667_100000210303 [1,1,0,0,0,0|1,0,0]=3 6151 B13R1.1601 CCCOc1c(cc(cc1I)Cl)Cl 34a_200012339341_100000210303 [1,1,0,0,0,0|2,0,0]=4 6152 B13R1.1601 CCCOc1c(cc(cc1I)Cl)Cl 7a_200012339341_100000210303 [1,1,0,0,0,0|2,0,0]=4 6153 B13R1.1601 CCCOc1c(cc(cc1I)Cl)I 7a_100000730656_100000210303 [1,1,0,0,0,0|2,0,0]=4 6154 B13R1.1601 CCCOc1c(cc(cc1I)F)Br 34a_200013085147_100000210303 [1,1,0,0,0,0|2,0,0]=4 6155 B13R1.1601 CCCOc1c(cc(cc1I)F)Br 7a_200013085147_100000210303 [1,1,0,0,0,0|2,0,0]=4 6156 B13R1.1601 CCCOc1c(cc(cc1I)F)F 34a_200013204775_100000210303 [1,1,0,0,0,0|2,0,0]=4 6157 B13R1.1601 CCCOc1c(cc(cc1I)F)F 7a_200013204775_100000210303 [1,1,0,0,0,0|2,0,0]=4 6158 B13R1.1601 CCCOc1c(cc(cc1I)I)Cl 7a_100009997439_100000210303 [1,1,0,0,0,0|2,0,0]=4 6159 B13R1.1601 CCCOc1c(cc(cc1I)I)I 7a_100000210296_100000210303 [1,1,0,0,0,0|2,0,0]=4 6160 B13R1.1601 CCCOc1c(cc(cc1N)Br)C 34a_100011825904_100000210303 [1,1,0,0,0,0|1,0,0]=3 6161 B13R1.1601 CCCOc1c(cc(cc1N)Br)C 7a_100011825904_100000210303 [1,1,0,0,0,0|1,0,0]=3 6162 B13R1.1601 CCCOc1c(cc(cc1N)C)C 34a_100011216242_100000210303 [1,1,0,0,0,0|1,0,0]=3 6163 B13R1.1601 CCCOc1c(cc(cc1N)C)C 7a_100011216242_100000210303 [1,1,0,0,0,0|1,0,0]=3 6164 B13R1.1601 CCCOc1c(cc(cc1N)F)C 34a_100000130126_100000210303 [1,1,0,0,0,0|1,0,0]=3 6165 B13R1.1601 CCCOc1c(cc(cc1N)F)C 7a_100000130126_100000210303 [1,1,0,0,0,0|1,0,0]=3 6166 B13R1.1601 CCCOc1c(cc(nc1C)Br)Br 34a_200010233669_100000210303 [1,1,0,0,0,0|2,0,0]=4 6167 B13R1.1601 CCCOc1c(cc(nc1C)Br)Br 7a_200010233669_100000210303 [1,1,0,0,0,0|2,0,0]=4 6168 B13R1.1601 CCCSc1c(cc(cc1Br)Br)C 62a_100000210303_200010208242 [1,1,0,0,0,0|1,1,0]=4 6169 B13R1.1601 CCCSc1c(cc(cc1Br)Br)C 62a_200010208242_100000210303 [1,1,0,0,0,0|1,1,0]=4 6170 B13R1.1601 CCCSc1c(cc(cc1Br)C)C 62a_100000210303_200012353697 [1,1,0,0,0,0|1,1,0]=4 6171 B13R1.1601 CCCSc1c(cc(cc1Br)C)C 62a_200012353697_100000210303 [1,1,0,0,0,0|1,1,0]=4 6172 B13R1.1601 CCCSc1c(cc(cc1Br)F)C 62a_100000210303_100010208209 [1,1,0,0,0,0|1,1,0]=4 6173 B13R1.1601 CCCSc1c(cc(cc1Br)F)C 62a_100010208209_100000210303 [1,1,0,0,0,0|1,1,0]=4 6174 B13R1.1601 CCCSc1c(cc(cc1C)Br)C 62a_100000210303_100009814048 [1,1,0,0,0,0|0,1,0]=3 6175 B13R1.1601 CCCSc1c(cc(cc1C)Br)C 62a_100009814048_100000210303 [1,1,0,0,0,0|0,1,0]=3 6176 B13R1.1601 CCCSc1c(cc(cc1C)C)C 62a_100000210303_100011204320 [1,1,0,0,0,0|0,1,0]=3 6177 B13R1.1601 CCCSc1c(cc(cc1C)C)C 62a_100011204320_100000210303 [1,1,0,0,0,0|0,1,0]=3 6178 B13R1.1601 CCCSc1c(cc(cc1C)Cl)C 62a_100000210303_100010244930 [1,1,0,0,0,0|0,1,0]=3 6179 B13R1.1601 CCCSc1c(cc(cc1C)Cl)C 62a_100010244930_100000210303 [1,1,0,0,0,0|0,1,0]=3 6180 B13R1.1601 CCCSc1c(cc(cc1C)F)C 62a_100000210303_100012356666 [1,1,0,0,0,0|0,1,0]=3 6181 B13R1.1601 CCCSc1c(cc(cc1C)F)C 62a_100012356666_100000210303 [1,1,0,0,0,0|0,1,0]=3 6182 B13R1.1601 CCCSc1c(cc(cc1C)N)C 62a_100000210303_100000215964 [1,1,0,0,0,0|0,1,0]=3 6183 B13R1.1601 CCCSc1c(cc(cc1C)N)C 62a_100000215964_100000210303 [1,1,0,0,0,0|0,1,0]=3 6184 B13R1.1601 CCCSc1c(cc(cc1C)O)C 62a_100000210303_100000243743 [1,1,0,0,0,0|0,1,0]=3 6185 B13R1.1601 CCCSc1c(cc(cc1C)O)C 62a_100000243743_100000210303 [1,1,0,0,0,0|0,1,0]=3 6186 B13R1.1601 CCCSc1c(cc(cc1Cl)Cl)C 62a_100000210303_200000035511 [1,1,0,0,0,0|1,1,0]=4 6187 B13R1.1601 CCCSc1c(cc(cc1Cl)Cl)C 62a_200000035511_100000210303 [1,1,0,0,0,0|1,1,0]=4 6188 B13R1.1601 CCCSc1c(cc(cc1Cl)F)C 62a_100000210303_100010079234 [1,1,0,0,0,0|1,1,0]=4 6189 B13R1.1601 CCCSc1c(cc(cc1Cl)F)C 62a_100010079234_100000210303 [1,1,0,0,0,0|1,1,0]=4 6190 B13R1.1601 CCCSc1c(cc(cc1F)F)C 62a_100000210303_100015332101 [1,1,0,0,0,0|1,1,0]=4 6191 B13R1.1601 CCCSc1c(cc(cc1F)F)C 62a_100015332101_100000210303 [1,1,0,0,0,0|1,1,0]=4 6192 B13R1.1601 CCCSc1c(cc(cc1F)N)C 62a_100000210303_100010115923 [1,1,0,0,0,0|1,1,0]=4 6193 B13R1.1601 CCCSc1c(cc(cc1F)N)C 62a_100010115923_100000210303 [1,1,0,0,0,0|1,1,0]=4 6194 B13R1.1601 CCCSc1c(cc(cc1N)Cl)C 62a_100000210303_100000698757 [1,1,0,0,0,0|1,1,0]=4 6195 B13R1.1601 CCCSc1c(cc(cc1N)Cl)C 62a_100000698757_100000210303 [1,1,0,0,0,0|1,1,0]=4 6196 B13R1.1601 CCCSc1c(cc(cc1O)C)C 62a_100000210303_100010342985 [1,1,0,0,0,0|1,1,0]=4 6197 B13R1.1601 CCCSc1c(cc(cc1O)C)C 62a_100010342985_100000210303 [1,1,0,0,0,0|1,1,0]=4 6198 B13R1.1601 CCCSc1c(cc(cc1O)Cl)C 62a_100000210303_100010254216 [1,1,0,0,0,0|1,1,0]=4 6199 B13R1.1601 CCCSc1c(cc(cc1O)Cl)C 62a_100010254216_100000210303 [1,1,0,0,0,0|1,1,0]=4 6200 B13R1.1601 CCCSc1c(cc(nc1C)N)C 62a_100000210303_100000699364 [1,1,0,0,0,0|1,1,0]=4 6201 B13R1.1601 CCCSc1c(cc(nc1C)N)C 62a_100000699364_100000210303 [1,1,0,0,0,0|1,1,0]=4 6202 B13R1.1601 CCNCc1c(cc(cc1C)Br)C 207a_100015525214_100010238521 [1,1,0,0,0,0|2,0,0]=4 6203 B13R1.1601 CCNCc1c(cc(cc1C)Br)C 270004a_100015525214_100010238521 [1,1,0,0,0,0|2,0,0]=4 6204 B13R1.1601 CCNCc1c(cc(cc1C)C)C 207a_100015525214_100000211105 [1,1,0,0,0,0|2,0,0]=4 6205 B13R1.1601 CCNCc1c(cc(cc1C)C)C 2230a_100000737526_100000210202 [1,1,0,0,0,0|2,0,0]=4 6206 B13R1.1601 CCNCc1c(cc(cc1C)C)C 2230a_100015525214_100000749405 [1,1,0,0,0,0|2,0,0]=4 6207 B13R1.1601 CCNCc1c(cc(cc1C)C)C 270004a_100015525214_100000211105 [1,1,0,0,0,0|2,0,0]=4 6208 B13R1.1601 CCNCc1c(cc(cc1C)C)C 34a_100000737526_100000210202 [1,1,0,0,0,0|2,0,0]=4 6209 B13R1.1601 CCNCc1c(cc(cc1C)Cl)C 207a_100015525214_100000693520 [1,1,0,0,0,0|2,0,0]=4 6210 B13R1.1601 CCNCc1c(cc(cc1C)Cl)C 270004a_100015525214_100000693520 [1,1,0,0,0,0|2,0,0]=4 6211 B13R1.1601 CCNCc1c(cc(cc1C)F)C 207a_100015525214_100012179923 [1,1,0,0,0,0|2,0,0]=4 6212 B13R1.1601 CCNCc1c(cc(cc1C)F)C 270004a_100015525214_100012179923 [1,1,0,0,0,0|2,0,0]=4 6213 B13R1.1601 CCNCc1c(cc(cc1C)O)C 207a_100015525214_100011827661 [1,1,0,0,0,0|2,0,0]=4 6214 B13R1.1601 CCOCc1c(cc(cc1C)Br)C 34a_100010128451_100000210202 [1,1,0,0,0,0|2,0,0]=4 6215 B13R1.1601 CCOCc1c(cc(cc1C)Br)C 7a_100010128451_100000210202 [1,1,0,0,0,0|2,0,0]=4 6216 B13R1.1601 CCOCc1c(cc(cc1C)C)C 34a_100011215277_100000210202 [1,1,0,0,0,0|2,0,0]=4 6217 B13R1.1601 CCOCc1c(cc(cc1C)C)C 34a_100121572206_100000749405 [1,1,0,0,0,0|2,0,0]=4 6218 B13R1.1601 CCOCc1c(cc(cc1C)C)C 7a_100011215277_100000210202 [1,1,0,0,0,0|2,0,0]=4 6219 B13R1.1601 CCSCc1c(cc(cc1C)C)C 62a_100000210202_100000749405 [1,1,0,0,0,0|2,0,0]=4 6220 B13R1.1601 CCSCc1c(cc(cc1C)C)C 62a_100000749405_100000210202 [1,1,0,0,0,0|2,0,0]=4 6221 B13R1.1601 CNCCc1c(cc(cc1C)C)C 2230a_100000692091_200000210301 [1,1,0,0,0,0|2,0,0]=4 6222 B13R1.1601 CNCCc1c(cc(cc1C)C)C 34a_100000692091_200000210301 [1,1,0,0,0,0|2,0,0]=4 6223 B13R1.1601 COCCc1c(cc(cc1C)C)C 34a_100011216341_200000210301 [1,1,0,0,0,0|2,0,0]=4 6224 B13R1.1601 COCCc1c(cc(cc1C)C)C 7a_100011216341_200000210301 [1,1,0,0,0,0|2,0,0]=4 6225 B13R1.1601 COCSc1c(cc(cc1C)Br)C 62a_100000766300_100009814048 [1,1,0,0,0,0|1,1,0]=4 6226 B13R1.1601 COCSc1c(cc(cc1C)Br)C 62a_100009814048_100000766300 [1,1,0,0,0,0|1,1,0]=4 6227 B13R1.1601 COCSc1c(cc(cc1C)C)C 62a_100000766300_100011204320 [1,1,0,0,0,0|1,1,0]=4 6228 B13R1.1601 COCSc1c(cc(cc1C)C)C 62a_100011204320_100000766300 [1,1,0,0,0,0|1,1,0]=4 6229 B13R1.1601 COCSc1c(cc(cc1C)Cl)C 62a_100000766300_100010244930 [1,1,0,0,0,0|1,1,0]=4 6230 B13R1.1601 COCSc1c(cc(cc1C)Cl)C 62a_100010244930_100000766300 [1,1,0,0,0,0|1,1,0]=4 6231 B13R1.1601 COCSc1c(cc(cc1C)F)C 62a_100000766300_100012356666 [1,1,0,0,0,0|1,1,0]=4 6232 B13R1.1601 COCSc1c(cc(cc1C)F)C 62a_100012356666_100000766300 [1,1,0,0,0,0|1,1,0]=4 6233 B13R1.1601 COCSc1c(cc(cc1C)N)C 62a_100000215964_100000766300 [1,1,0,0,0,0|1,1,0]=4 6234 B13R1.1601 COCSc1c(cc(cc1C)N)C 62a_100000766300_100000215964 [1,1,0,0,0,0|1,1,0]=4 6235 B13R1.1601 COCSc1c(cc(cc1C)O)C 62a_100000243743_100000766300 [1,1,0,0,0,0|1,1,0]=4 6236 B13R1.1601 COCSc1c(cc(cc1C)O)C 62a_100000766300_100000243743 [1,1,0,0,0,0|1,1,0]=4 6237 B13R1.1601 CSCNc1c(cc(cc1C)Br)C 34a_100000737279_100011218213 [1,1,0,0,0,0|2,0,0]=4 6238 B13R1.1601 CSCNc1c(cc(cc1C)C)C 34a_100000210045_100011218213 [1,1,0,0,0,0|2,0,0]=4 6239 B13R1.1601 CSCNc1c(cc(cc1C)Cl)C 34a_100000692879_100011218213 [1,1,0,0,0,0|2,0,0]=4 6240 B13R1.1601 CSCNc1c(cc(cc1C)F)C 34a_100011290887_100011218213 [1,1,0,0,0,0|2,0,0]=4 6241 B13R1.1601 CSCNc1c(cc(cc1C)O)C 34a_100011934200_100011218213 [1,1,0,0,0,0|2,0,0]=4 6242 B13R1.1601 CSCOc1c(cc(cc1Br)Br)C 34a_100000186369_100011218213 [1,1,0,0,0,0|2,0,0]=4 6243 B13R1.1601 CSCOc1c(cc(cc1Br)C)C 34a_100011934984_100011218213 [1,1,0,0,0,0|2,0,0]=4 6244 B13R1.1601 CSCOc1c(cc(cc1Br)Cl)C 34a_100012337756_100011218213 [1,1,0,0,0,0|2,0,0]=4 6245 B13R1.1601 CSCOc1c(cc(cc1Br)I)C 34a_100010982682_100011218213 [1,1,0,0,0,0|2,0,0]=4 6246 B13R1.1601 CSCOc1c(cc(cc1Br)N)C 34a_100010064301_100011218213 [1,1,0,0,0,0|2,0,0]=4 6247 B13R1.1601 CSCOc1c(cc(cc1C)Br)C 34a_100000187306_100011218213 [1,1,0,0,0,0|1,0,0]=3 6248 B13R1.1601 CSCOc1c(cc(cc1C)C)C 34a_100000212074_100011218213 [1,1,0,0,0,0|1,0,0]=3 6249 B13R1.1601 CSCOc1c(cc(cc1C)Cl)C 34a_100000211519_100011218213 [1,1,0,0,0,0|1,0,0]=3 6250 B13R1.1601 CSCOc1c(cc(cc1C)F)C 34a_100000081862_100011218213 [1,1,0,0,0,0|1,0,0]=3 6251 B13R1.1601 CSCOc1c(cc(cc1C)I)C 34a_100011216129_100011218213 [1,1,0,0,0,0|1,0,0]=3 6252 B13R1.1601 CSCOc1c(cc(cc1C)N)C 34a_100000703291_100011218213 [1,1,0,0,0,0|1,0,0]=3 6253 B13R1.1601 CSCOc1c(cc(cc1Cl)Br)C 34a_100000211485_100011218213 [1,1,0,0,0,0|2,0,0]=4 6254 B13R1.1601 CSCOc1c(cc(cc1Cl)Cl)C 34a_100011218458_100011218213 [1,1,0,0,0,0|2,0,0]=4 6255 B13R1.1601 CSCOc1c(cc(cc1Cl)I)C 34a_200015900153_100011218213 [1,1,0,0,0,0|2,0,0]=4 6256 B13R1.1601 CSCOc1c(cc(cc1I)Cl)C 34a_100012343667_100011218213 [1,1,0,0,0,0|2,0,0]=4 6257 B13R1.1601 CSCOc1c(cc(cc1N)Br)C 34a_100011825904_100011218213 [1,1,0,0,0,0|2,0,0]=4 6258 B13R1.1601 CSCOc1c(cc(cc1N)C)C 34a_100011216242_100011218213 [1,1,0,0,0,0|2,0,0]=4 6259 B13R1.1601 CSCOc1c(cc(cc1N)F)C 34a_100000130126_100011218213 [1,1,0,0,0,0|2,0,0]=4 6260 B13R1.1601 CSCSc1c(cc(cc1C)Br)C 62a_100009814048_100011218213 [1,1,0,0,0,0|1,1,0]=4 6261 B13R1.1601 CSCSc1c(cc(cc1C)Br)C 62a_100011218213_100009814048 [1,1,0,0,0,0|1,1,0]=4 6262 B13R1.1601 CSCSc1c(cc(cc1C)C)C 62a_100011204320_100011218213 [1,1,0,0,0,0|1,1,0]=4 6263 B13R1.1601 CSCSc1c(cc(cc1C)C)C 62a_100011218213_100011204320 [1,1,0,0,0,0|1,1,0]=4 6264 B13R1.1601 CSCSc1c(cc(cc1C)Cl)C 62a_100010244930_100011218213 [1,1,0,0,0,0|1,1,0]=4 6265 B13R1.1601 CSCSc1c(cc(cc1C)Cl)C 62a_100011218213_100010244930 [1,1,0,0,0,0|1,1,0]=4 6266 B13R1.1601 CSCSc1c(cc(cc1C)F)C 62a_100011218213_100012356666 [1,1,0,0,0,0|1,1,0]=4 6267 B13R1.1601 CSCSc1c(cc(cc1C)F)C 62a_100012356666_100011218213 [1,1,0,0,0,0|1,1,0]=4 6268 B13R1.1601 CSCSc1c(cc(cc1C)N)C 62a_100000215964_100011218213 [1,1,0,0,0,0|1,1,0]=4 6269 B13R1.1601 CSCSc1c(cc(cc1C)N)C 62a_100011218213_100000215964 [1,1,0,0,0,0|1,1,0]=4 6270 B13R1.1601 CSCSc1c(cc(cc1C)O)C 62a_100000243743_100011218213 [1,1,0,0,0,0|1,1,0]=4 6271 B13R1.1601 CSCSc1c(cc(cc1C)O)C 62a_100011218213_100000243743 [1,1,0,0,0,0|1,1,0]=4 6272 B13R1.1601 Cc1cc(c(c(c1)Br)OCCF)C 34a_100011934984_100011217306 [1,1,0,0,0,0|2,0,0]=4 6273 B13R1.1601 Cc1cc(c(c(c1)Br)OCCF)C 7a_100011934984_100011217306 [1,1,0,0,0,0|2,0,0]=4 6274 B13R1.1601 Cc1cc(c(c(c1)Br)OCCO)C 34a_100011934984_100000211926 [1,1,0,0,0,0|2,0,0]=4 6275 B13R1.1601 Cc1cc(c(c(c1)Br)OCCO)C 7a_100011934984_100000211926 [1,1,0,0,0,0|2,0,0]=4 6276 B13R1.1601 Cc1cc(c(c(c1)C)CCN[13CH3])C 2230a_100000692091_200025704644 [1,1,0,0,0,0|2,0,0]=4 6277 B13R1.1601 Cc1cc(c(c(c1)C)CCN[13CH3])C 34a_100000692091_200025704644 [1,1,0,0,0,0|2,0,0]=4 6278 B13R1.1601 Cc1cc(c(c(c1)C)CCO[13CH3])C 34a_100011216341_200025704644 [1,1,0,0,0,0|2,0,0]=4 6279 B13R1.1601 Cc1cc(c(c(c1)C)CCO[13CH3])C 7a_100011216341_200025704644 [1,1,0,0,0,0|2,0,0]=4 6280 B13R1.1601 Cc1cc(c(c(c1)C)NCCF)C 34a_100000210045_100011217306 [1,1,0,0,0,0|2,0,0]=4 6281 B13R1.1601 Cc1cc(c(c(c1)C)NCCF)C 7a_100000210045_100011217306 [1,1,0,0,0,0|2,0,0]=4 6282 B13R1.1601 Cc1cc(c(c(c1)C)NCCO)C 34a_100000210045_100000211926 [1,1,0,0,0,0|2,0,0]=4 6283 B13R1.1601 Cc1cc(c(c(c1)C)NCCO)C 7a_100000210045_100000211926 [1,1,0,0,0,0|2,0,0]=4 6284 B13R1.1601 Cc1cc(c(c(c1)C)OCC#N)C 7a_100000212074_100011215382 [1,1,0,0,0,0|0,0,2]=4 6285 B13R1.1601 Cc1cc(c(c(c1)C)OCC=O)C 34a_100000212074_200009817547 [1,1,0,0,0,0|1,0,1]=4 6286 B13R1.1601 Cc1cc(c(c(c1)C)OCC=O)C 7a_100000212074_200015260668 [1,1,0,0,0,0|1,0,1]=4 6287 B13R1.1601 Cc1cc(c(c(c1)C)OCCF)C 34a_100000212074_100011217306 [1,1,0,0,0,0|1,0,0]=3 6288 B13R1.1601 Cc1cc(c(c(c1)C)OCCF)C 7a_100000212074_100011217306 [1,1,0,0,0,0|1,0,0]=3 6289 B13R1.1601 Cc1cc(c(c(c1)C)OCCO)C 34a_100000212074_100000211926 [1,1,0,0,0,0|1,0,0]=3 6290 B13R1.1601 Cc1cc(c(c(c1)C)OCCO)C 7a_100000212074_100000211926 [1,1,0,0,0,0|1,0,0]=3 6291 B13R1.1601 Cc1cc(c(c(c1)C)SCCF)C 62a_100011204320_100011217306 [1,1,0,0,0,0|1,1,0]=4 6292 B13R1.1601 Cc1cc(c(c(c1)C)SCCF)C 62a_100011217306_100011204320 [1,1,0,0,0,0|1,1,0]=4 6293 B13R1.1601 Cc1cc(c(c(c1)C)SCCO)C 62a_100000211926_100011204320 [1,1,0,0,0,0|1,1,0]=4 6294 B13R1.1601 Cc1cc(c(c(c1)C)SCCO)C 62a_100011204320_100000211926 [1,1,0,0,0,0|1,1,0]=4 6295 B13R1.1601 Cc1cc(c(c(c1)N)OCCF)C 34a_100011216242_100011217306 [1,1,0,0,0,0|2,0,0]=4 6296 B13R1.1601 Cc1cc(c(c(c1)N)OCCF)C 7a_100011216242_100011217306 [1,1,0,0,0,0|2,0,0]=4 6297 B13R1.1601 Cc1cc(c(c(c1)N)OCCO)C 34a_100011216242_100000211926 [1,1,0,0,0,0|2,0,0]=4 6298 B13R1.1601 Cc1cc(c(c(c1)N)OCCO)C 7a_100011216242_100000211926 [1,1,0,0,0,0|2,0,0]=4 6299 B13R1.1601 Cc1cc(cc(c1NCCF)C)Br 34a_100000737279_100011217306 [1,1,0,0,0,0|2,0,0]=4 6300 B13R1.1601 Cc1cc(cc(c1NCCF)C)Br 7a_100000737279_100011217306 [1,1,0,0,0,0|2,0,0]=4 6301 B13R1.1601 Cc1cc(cc(c1NCCF)C)Cl 34a_100000692879_100011217306 [1,1,0,0,0,0|2,0,0]=4 6302 B13R1.1601 Cc1cc(cc(c1NCCF)C)Cl 7a_100000692879_100011217306 [1,1,0,0,0,0|2,0,0]=4 6303 B13R1.1601 Cc1cc(cc(c1NCCF)C)F 34a_100011290887_100011217306 [1,1,0,0,0,0|2,0,0]=4 6304 B13R1.1601 Cc1cc(cc(c1NCCF)C)F 7a_100011290887_100011217306 [1,1,0,0,0,0|2,0,0]=4 6305 B13R1.1601 Cc1cc(cc(c1NCCF)C)I 7a_100011356821_100011217306 [1,1,0,0,0,0|2,0,0]=4 6306 B13R1.1601 Cc1cc(cc(c1NCCF)C)O 34a_100011934200_100011217306 [1,1,0,0,0,0|2,0,0]=4 6307 B13R1.1601 Cc1cc(cc(c1NCCO)C)Br 34a_100000737279_100000211926 [1,1,0,0,0,0|2,0,0]=4 6308 B13R1.1601 Cc1cc(cc(c1NCCO)C)Br 7a_100000737279_100000211926 [1,1,0,0,0,0|2,0,0]=4 6309 B13R1.1601 Cc1cc(cc(c1NCCO)C)Cl 34a_100000692879_100000211926 [1,1,0,0,0,0|2,0,0]=4 6310 B13R1.1601 Cc1cc(cc(c1NCCO)C)Cl 7a_100000692879_100000211926 [1,1,0,0,0,0|2,0,0]=4 6311 B13R1.1601 Cc1cc(cc(c1NCCO)C)F 34a_100011290887_100000211926 [1,1,0,0,0,0|2,0,0]=4 6312 B13R1.1601 Cc1cc(cc(c1NCCO)C)F 7a_100011290887_100000211926 [1,1,0,0,0,0|2,0,0]=4 6313 B13R1.1601 Cc1cc(cc(c1NCCO)C)I 7a_100011356821_100000211926 [1,1,0,0,0,0|2,0,0]=4 6314 B13R1.1601 Cc1cc(cc(c1NCCO)C)O 34a_100011934200_100000211926 [1,1,0,0,0,0|2,0,0]=4 6315 B13R1.1601 Cc1cc(cc(c1OCC#N)C)Br 7a_100000187306_100011215382 [1,1,0,0,0,0|0,0,2]=4 6316 B13R1.1601 Cc1cc(cc(c1OCC#N)C)Cl 7a_100000211519_100011215382 [1,1,0,0,0,0|0,0,2]=4 6317 B13R1.1601 Cc1cc(cc(c1OCC#N)C)F 7a_100000081862_100011215382 [1,1,0,0,0,0|0,0,2]=4 6318 B13R1.1601 Cc1cc(cc(c1OCC#N)C)I 7a_100011216129_100011215382 [1,1,0,0,0,0|0,0,2]=4 6319 B13R1.1601 Cc1cc(cc(c1OCC#N)C)N 7a_100000703291_100011215382 [1,1,0,0,0,0|0,0,2]=4 6320 B13R1.1601 Cc1cc(cc(c1OCC#N)C)O 271570a_203496583355_200010214319 [1,1,0,0,0,0|0,0,2]=4 6321 B13R1.1601 Cc1cc(cc(c1OCC=O)C)Br 34a_100000187306_200009817547 [1,1,0,0,0,0|1,0,1]=4 6322 B13R1.1601 Cc1cc(cc(c1OCC=O)C)Br 7a_100000187306_200015260668 [1,1,0,0,0,0|1,0,1]=4 6323 B13R1.1601 Cc1cc(cc(c1OCC=O)C)Cl 34a_100000211519_200009817547 [1,1,0,0,0,0|1,0,1]=4 6324 B13R1.1601 Cc1cc(cc(c1OCC=O)C)Cl 7a_100000211519_200015260668 [1,1,0,0,0,0|1,0,1]=4 6325 B13R1.1601 Cc1cc(cc(c1OCC=O)C)F 34a_100000081862_200009817547 [1,1,0,0,0,0|1,0,1]=4 6326 B13R1.1601 Cc1cc(cc(c1OCC=O)C)F 7a_100000081862_200015260668 [1,1,0,0,0,0|1,0,1]=4 6327 B13R1.1601 Cc1cc(cc(c1OCC=O)C)I 34a_100011216129_200009817547 [1,1,0,0,0,0|1,0,1]=4 6328 B13R1.1601 Cc1cc(cc(c1OCC=O)C)I 7a_100011216129_200015260668 [1,1,0,0,0,0|1,0,1]=4 6329 B13R1.1601 Cc1cc(cc(c1OCC=O)C)N 34a_100000703291_200009817547 [1,1,0,0,0,0|1,0,1]=4 6330 B13R1.1601 Cc1cc(cc(c1OCC=O)C)N 7a_100000703291_200015260668 [1,1,0,0,0,0|1,0,1]=4 6331 B13R1.1601 Cc1cc(cc(c1OCCF)Br)Br 34a_100000186369_100011217306 [1,1,0,0,0,0|2,0,0]=4 6332 B13R1.1601 Cc1cc(cc(c1OCCF)Br)Br 7a_100000186369_100011217306 [1,1,0,0,0,0|2,0,0]=4 6333 B13R1.1601 Cc1cc(cc(c1OCCF)Br)Cl 34a_100012337756_100011217306 [1,1,0,0,0,0|2,0,0]=4 6334 B13R1.1601 Cc1cc(cc(c1OCCF)Br)Cl 7a_100012337756_100011217306 [1,1,0,0,0,0|2,0,0]=4 6335 B13R1.1601 Cc1cc(cc(c1OCCF)Br)I 34a_100010982682_100011217306 [1,1,0,0,0,0|2,0,0]=4 6336 B13R1.1601 Cc1cc(cc(c1OCCF)Br)I 7a_100010982682_100011217306 [1,1,0,0,0,0|2,0,0]=4 6337 B13R1.1601 Cc1cc(cc(c1OCCF)Br)N 34a_100010064301_100011217306 [1,1,0,0,0,0|2,0,0]=4 6338 B13R1.1601 Cc1cc(cc(c1OCCF)Br)N 7a_100010064301_100011217306 [1,1,0,0,0,0|2,0,0]=4 6339 B13R1.1601 Cc1cc(cc(c1OCCF)C)Br 34a_100000187306_100011217306 [1,1,0,0,0,0|1,0,0]=3 6340 B13R1.1601 Cc1cc(cc(c1OCCF)C)Br 7a_100000187306_100011217306 [1,1,0,0,0,0|1,0,0]=3 6341 B13R1.1601 Cc1cc(cc(c1OCCF)C)Cl 34a_100000211519_100011217306 [1,1,0,0,0,0|1,0,0]=3 6342 B13R1.1601 Cc1cc(cc(c1OCCF)C)Cl 7a_100000211519_100011217306 [1,1,0,0,0,0|1,0,0]=3 6343 B13R1.1601 Cc1cc(cc(c1OCCF)C)F 34a_100000081862_100011217306 [1,1,0,0,0,0|1,0,0]=3 6344 B13R1.1601 Cc1cc(cc(c1OCCF)C)F 7a_100000081862_100011217306 [1,1,0,0,0,0|1,0,0]=3 6345 B13R1.1601 Cc1cc(cc(c1OCCF)C)I 34a_100011216129_100011217306 [1,1,0,0,0,0|1,0,0]=3 6346 B13R1.1601 Cc1cc(cc(c1OCCF)C)I 7a_100011216129_100011217306 [1,1,0,0,0,0|1,0,0]=3 6347 B13R1.1601 Cc1cc(cc(c1OCCF)C)N 34a_100000703291_100011217306 [1,1,0,0,0,0|1,0,0]=3 6348 B13R1.1601 Cc1cc(cc(c1OCCF)C)N 7a_100000703291_100011217306 [1,1,0,0,0,0|1,0,0]=3 6349 B13R1.1601 Cc1cc(cc(c1OCCF)Cl)Br 34a_100000211485_100011217306 [1,1,0,0,0,0|2,0,0]=4 6350 B13R1.1601 Cc1cc(cc(c1OCCF)Cl)Br 7a_100000211485_100011217306 [1,1,0,0,0,0|2,0,0]=4 6351 B13R1.1601 Cc1cc(cc(c1OCCF)Cl)Cl 34a_100011218458_100011217306 [1,1,0,0,0,0|2,0,0]=4 6352 B13R1.1601 Cc1cc(cc(c1OCCF)Cl)Cl 7a_100011218458_100011217306 [1,1,0,0,0,0|2,0,0]=4 6353 B13R1.1601 Cc1cc(cc(c1OCCF)Cl)I 34a_200015900153_100011217306 [1,1,0,0,0,0|2,0,0]=4 6354 B13R1.1601 Cc1cc(cc(c1OCCF)Cl)I 7a_200015900153_100011217306 [1,1,0,0,0,0|2,0,0]=4 6355 B13R1.1601 Cc1cc(cc(c1OCCF)I)Cl 34a_100012343667_100011217306 [1,1,0,0,0,0|2,0,0]=4 6356 B13R1.1601 Cc1cc(cc(c1OCCF)I)Cl 7a_100012343667_100011217306 [1,1,0,0,0,0|2,0,0]=4 6357 B13R1.1601 Cc1cc(cc(c1OCCF)N)Br 34a_100011825904_100011217306 [1,1,0,0,0,0|2,0,0]=4 6358 B13R1.1601 Cc1cc(cc(c1OCCF)N)Br 7a_100011825904_100011217306 [1,1,0,0,0,0|2,0,0]=4 6359 B13R1.1601 Cc1cc(cc(c1OCCF)N)F 34a_100000130126_100011217306 [1,1,0,0,0,0|2,0,0]=4 6360 B13R1.1601 Cc1cc(cc(c1OCCF)N)F 7a_100000130126_100011217306 [1,1,0,0,0,0|2,0,0]=4 6361 B13R1.1601 Cc1cc(cc(c1OCCN)C)O 271570a_203496583355_100025753799 [1,1,0,0,0,0|0,0,0]=2 6362 B13R1.1601 Cc1cc(cc(c1OCCO)Br)Br 34a_100000186369_100000211926 [1,1,0,0,0,0|2,0,0]=4 6363 B13R1.1601 Cc1cc(cc(c1OCCO)Br)Br 7a_100000186369_100000211926 [1,1,0,0,0,0|2,0,0]=4 6364 B13R1.1601 Cc1cc(cc(c1OCCO)Br)Cl 34a_100012337756_100000211926 [1,1,0,0,0,0|2,0,0]=4 6365 B13R1.1601 Cc1cc(cc(c1OCCO)Br)Cl 7a_100012337756_100000211926 [1,1,0,0,0,0|2,0,0]=4 6366 B13R1.1601 Cc1cc(cc(c1OCCO)Br)I 34a_100010982682_100000211926 [1,1,0,0,0,0|2,0,0]=4 6367 B13R1.1601 Cc1cc(cc(c1OCCO)Br)I 7a_100010982682_100000211926 [1,1,0,0,0,0|2,0,0]=4 6368 B13R1.1601 Cc1cc(cc(c1OCCO)Br)N 34a_100010064301_100000211926 [1,1,0,0,0,0|2,0,0]=4 6369 B13R1.1601 Cc1cc(cc(c1OCCO)Br)N 7a_100010064301_100000211926 [1,1,0,0,0,0|2,0,0]=4 6370 B13R1.1601 Cc1cc(cc(c1OCCO)C)Br 34a_100000187306_100000211926 [1,1,0,0,0,0|1,0,0]=3 6371 B13R1.1601 Cc1cc(cc(c1OCCO)C)Br 7a_100000187306_100000211926 [1,1,0,0,0,0|1,0,0]=3 6372 B13R1.1601 Cc1cc(cc(c1OCCO)C)Cl 34a_100000211519_100000211926 [1,1,0,0,0,0|1,0,0]=3 6373 B13R1.1601 Cc1cc(cc(c1OCCO)C)Cl 7a_100000211519_100000211926 [1,1,0,0,0,0|1,0,0]=3 6374 B13R1.1601 Cc1cc(cc(c1OCCO)C)F 34a_100000081862_100000211926 [1,1,0,0,0,0|1,0,0]=3 6375 B13R1.1601 Cc1cc(cc(c1OCCO)C)F 7a_100000081862_100000211926 [1,1,0,0,0,0|1,0,0]=3 6376 B13R1.1601 Cc1cc(cc(c1OCCO)C)I 34a_100011216129_100000211926 [1,1,0,0,0,0|1,0,0]=3 6377 B13R1.1601 Cc1cc(cc(c1OCCO)C)I 7a_100011216129_100000211926 [1,1,0,0,0,0|1,0,0]=3 6378 B13R1.1601 Cc1cc(cc(c1OCCO)C)N 34a_100000703291_100000211926 [1,1,0,0,0,0|1,0,0]=3 6379 B13R1.1601 Cc1cc(cc(c1OCCO)C)N 7a_100000703291_100000211926 [1,1,0,0,0,0|1,0,0]=3 6380 B13R1.1601 Cc1cc(cc(c1OCCO)Cl)Br 34a_100000211485_100000211926 [1,1,0,0,0,0|2,0,0]=4 6381 B13R1.1601 Cc1cc(cc(c1OCCO)Cl)Br 7a_100000211485_100000211926 [1,1,0,0,0,0|2,0,0]=4 6382 B13R1.1601 Cc1cc(cc(c1OCCO)Cl)Cl 34a_100011218458_100000211926 [1,1,0,0,0,0|2,0,0]=4 6383 B13R1.1601 Cc1cc(cc(c1OCCO)Cl)Cl 7a_100011218458_100000211926 [1,1,0,0,0,0|2,0,0]=4 6384 B13R1.1601 Cc1cc(cc(c1OCCO)Cl)I 34a_200015900153_100000211926 [1,1,0,0,0,0|2,0,0]=4 6385 B13R1.1601 Cc1cc(cc(c1OCCO)Cl)I 7a_200015900153_100000211926 [1,1,0,0,0,0|2,0,0]=4 6386 B13R1.1601 Cc1cc(cc(c1OCCO)I)Cl 34a_100012343667_100000211926 [1,1,0,0,0,0|2,0,0]=4 6387 B13R1.1601 Cc1cc(cc(c1OCCO)I)Cl 7a_100012343667_100000211926 [1,1,0,0,0,0|2,0,0]=4 6388 B13R1.1601 Cc1cc(cc(c1OCCO)N)Br 34a_100011825904_100000211926 [1,1,0,0,0,0|2,0,0]=4 6389 B13R1.1601 Cc1cc(cc(c1OCCO)N)Br 7a_100011825904_100000211926 [1,1,0,0,0,0|2,0,0]=4 6390 B13R1.1601 Cc1cc(cc(c1OCCO)N)F 34a_100000130126_100000211926 [1,1,0,0,0,0|2,0,0]=4 6391 B13R1.1601 Cc1cc(cc(c1OCCO)N)F 7a_100000130126_100000211926 [1,1,0,0,0,0|2,0,0]=4 6392 B13R1.1601 Cc1cc(cc(c1SCCF)C)Br 62a_100009814048_100011217306 [1,1,0,0,0,0|1,1,0]=4 6393 B13R1.1601 Cc1cc(cc(c1SCCF)C)Br 62a_100011217306_100009814048 [1,1,0,0,0,0|1,1,0]=4 6394 B13R1.1601 Cc1cc(cc(c1SCCF)C)Cl 62a_100010244930_100011217306 [1,1,0,0,0,0|1,1,0]=4 6395 B13R1.1601 Cc1cc(cc(c1SCCF)C)Cl 62a_100011217306_100010244930 [1,1,0,0,0,0|1,1,0]=4 6396 B13R1.1601 Cc1cc(cc(c1SCCF)C)F 62a_100011217306_100012356666 [1,1,0,0,0,0|1,1,0]=4 6397 B13R1.1601 Cc1cc(cc(c1SCCF)C)F 62a_100012356666_100011217306 [1,1,0,0,0,0|1,1,0]=4 6398 B13R1.1601 Cc1cc(cc(c1SCCF)C)N 62a_100000215964_100011217306 [1,1,0,0,0,0|1,1,0]=4 6399 B13R1.1601 Cc1cc(cc(c1SCCF)C)N 62a_100011217306_100000215964 [1,1,0,0,0,0|1,1,0]=4 6400 B13R1.1601 Cc1cc(cc(c1SCCF)C)O 62a_100000243743_100011217306 [1,1,0,0,0,0|1,1,0]=4 6401 B13R1.1601 Cc1cc(cc(c1SCCF)C)O 62a_100011217306_100000243743 [1,1,0,0,0,0|1,1,0]=4 6402 B13R1.1601 Cc1cc(cc(c1SCCO)C)Br 62a_100000211926_100009814048 [1,1,0,0,0,0|1,1,0]=4 6403 B13R1.1601 Cc1cc(cc(c1SCCO)C)Br 62a_100009814048_100000211926 [1,1,0,0,0,0|1,1,0]=4 6404 B13R1.1601 Cc1cc(cc(c1SCCO)C)Cl 62a_100000211926_100010244930 [1,1,0,0,0,0|1,1,0]=4 6405 B13R1.1601 Cc1cc(cc(c1SCCO)C)Cl 62a_100010244930_100000211926 [1,1,0,0,0,0|1,1,0]=4 6406 B13R1.1601 Cc1cc(cc(c1SCCO)C)F 62a_100000211926_100012356666 [1,1,0,0,0,0|1,1,0]=4 6407 B13R1.1601 Cc1cc(cc(c1SCCO)C)F 62a_100012356666_100000211926 [1,1,0,0,0,0|1,1,0]=4 6408 B13R1.1601 Cc1cc(cc(c1SCCO)C)N 62a_100000211926_100000215964 [1,1,0,0,0,0|1,1,0]=4 6409 B13R1.1601 Cc1cc(cc(c1SCCO)C)N 62a_100000215964_100000211926 [1,1,0,0,0,0|1,1,0]=4 6410 B13R1.1601 Cc1cc(cc(c1SCCO)C)O 62a_100000211926_100000243743 [1,1,0,0,0,0|1,1,0]=4 6411 B13R1.1601 Cc1cc(cc(c1SCCO)C)O 62a_100000243743_100000211926 [1,1,0,0,0,0|1,1,0]=4 6412 B13R1.1619 C#CCOc1c(cccc1CC)C 34a_100000034007_100000184674 [1,1,0,0,0,0|0,0,2]=4 6413 B13R1.1619 C#CCOc1c(cccc1CC)C 7a_100000034007_100000038162 [1,1,0,0,0,0|0,0,2]=4 6414 B13R1.1619 C#CCOc1c(cccc1CN)C 34a_100020639391_100000184674 [1,1,0,0,0,0|0,0,2]=4 6415 B13R1.1619 C#CCOc1c(cccc1OC)C 34a_100011219253_100000184674 [1,1,0,0,0,0|0,0,2]=4 6416 B13R1.1619 C#CCOc1c(cccc1OC)C 7a_100011219253_100000038162 [1,1,0,0,0,0|0,0,2]=4 6417 B13R1.1619 C=CCOc1c(cccc1CC)C 34a_100000034007_100015514636 [1,1,0,0,0,0|0,0,2]=4 6418 B13R1.1619 C=CCOc1c(cccc1CC)C 7a_100000034007_100015514636 [1,1,0,0,0,0|0,0,2]=4 6419 B13R1.1619 C=CCOc1c(cccc1CN)C 34a_100020639391_100015514636 [1,1,0,0,0,0|0,0,2]=4 6420 B13R1.1619 C=CCOc1c(cccc1OC)C 34a_100011219253_100015514636 [1,1,0,0,0,0|0,0,2]=4 6421 B13R1.1619 C=CCOc1c(cccc1OC)C 7a_100011219253_100015514636 [1,1,0,0,0,0|0,0,2]=4 6422 B13R1.1619 CCCCc1c(cccc1C#N)C 271570a_100020621405_100011934862 [1,1,0,0,0,0|1,0,1]=4 6423 B13R1.1619 CCCCc1c(cccc1CC)C 271570a_100020621405_100000036235 [1,1,0,0,0,0|1,0,0]=3 6424 B13R1.1619 CCCCc1c(cccc1CO)Br 271570a_100020621405_100010146604 [1,1,0,0,0,0|2,0,0]=4 6425 B13R1.1619 CCCCc1c(cccc1CO)C 271570a_100020621405_100011659289 [1,1,0,0,0,0|1,0,0]=3 6426 B13R1.1619 CCCCc1c(cccc1CO)F 271570a_100020621405_100000692438 [1,1,0,0,0,0|2,0,0]=4 6427 B13R1.1619 CCCCc1c(cccc1OC)Br 271570a_100020621405_100010131421 [1,1,0,0,0,0|2,0,0]=4 6428 B13R1.1619 CCCCc1c(cccc1OC)F 271570a_100020621405_100000041735 [1,1,0,0,0,0|2,0,0]=4 6429 B13R1.1619 CCCCc1c(cccc1OC)N 271570a_100020621405_100000703447 [1,1,0,0,0,0|2,0,0]=4 6430 B13R1.1619 CCCCc1c(cccc1OC)O 271570a_100020621405_100010202623 [1,1,0,0,0,0|2,0,0]=4 6431 B13R1.1619 CCCCc1c(ccnc1OC)C 271570a_100020621405_100012353928 [1,1,0,0,0,0|2,0,0]=4 6432 B13R1.1619 CCCNc1c(cccc1C#N)C 2230a_100011826843_100000210303 [1,1,0,0,0,0|1,0,1]=4 6433 B13R1.1619 CCCNc1c(cccc1CC)C 2230a_100000210048_100000210303 [1,1,0,0,0,0|1,0,0]=3 6434 B13R1.1619 CCCNc1c(cccc1CC)C 34a_100000210048_100000210303 [1,1,0,0,0,0|1,0,0]=3 6435 B13R1.1619 CCCNc1c(cccc1CC)C 7a_100000210048_100000210303 [1,1,0,0,0,0|1,0,0]=3 6436 B13R1.1619 CCCNc1c(cccc1CO)C 34a_100011215590_100000210303 [1,1,0,0,0,0|1,0,0]=3 6437 B13R1.1619 CCCNc1c(cccc1CO)Cl 34a_100012182729_100000210303 [1,1,0,0,0,0|2,0,0]=4 6438 B13R1.1619 CCCNc1c(cccc1CO)F 34a_100000692437_100000210303 [1,1,0,0,0,0|2,0,0]=4 6439 B13R1.1619 CCCNc1c(cccc1OC)Br 34a_100000708083_100000210303 [1,1,0,0,0,0|2,0,0]=4 6440 B13R1.1619 CCCNc1c(cccc1OC)C 2230a_100000758225_100000210303 [1,1,0,0,0,0|1,0,0]=3 6441 B13R1.1619 CCCNc1c(cccc1OC)C 34a_100000758225_100000210303 [1,1,0,0,0,0|1,0,0]=3 6442 B13R1.1619 CCCNc1c(cccc1OC)Cl 34a_100011309317_100000210303 [1,1,0,0,0,0|2,0,0]=4 6443 B13R1.1619 CCCNc1c(cccc1OC)F 34a_100000686744_100000210303 [1,1,0,0,0,0|2,0,0]=4 6444 B13R1.1619 CCCNc1c(cccc1OC)O 34a_100012022766_100000210303 [1,1,0,0,0,0|2,0,0]=4 6445 B13R1.1619 CCCOc1c(cccc1C#N)Br 34a_100009817103_100000210303 [1,1,0,0,0,0|1,0,1]=4 6446 B13R1.1619 CCCOc1c(cccc1C#N)C 34a_100011659161_100000210303 [1,1,0,0,0,0|0,0,1]=3 6447 B13R1.1619 CCCOc1c(cccc1C#N)C 7a_100011659161_100000210303 [1,1,0,0,0,0|0,0,1]=3 6448 B13R1.1619 CCCOc1c(cccc1C#N)Cl 34a_100009866432_100000210303 [1,1,0,0,0,0|1,0,1]=4 6449 B13R1.1619 CCCOc1c(cccc1C#N)Cl 7a_100009866432_100000210303 [1,1,0,0,0,0|1,0,1]=4 6450 B13R1.1619 CCCOc1c(cccc1C#N)F 34a_100000117915_100000210303 [1,1,0,0,0,0|1,0,1]=4 6451 B13R1.1619 CCCOc1c(cccc1C#N)F 7a_100000117915_100000210303 [1,1,0,0,0,0|1,0,1]=4 6452 B13R1.1619 CCCOc1c(cccc1CC)Br 34a_200010001580_100000210303 [1,1,0,0,0,0|1,0,0]=3 6453 B13R1.1619 CCCOc1c(cccc1CC)Br 7a_200010001580_100000210303 [1,1,0,0,0,0|1,0,0]=3 6454 B13R1.1619 CCCOc1c(cccc1CC)C 34a_100000034007_100000210303 [1,1,0,0,0,0|0,0,0]=2 6455 B13R1.1619 CCCOc1c(cccc1CC)C 7a_100000034007_100000210303 [1,1,0,0,0,0|0,0,0]=2 6456 B13R1.1619 CCCOc1c(cccc1CN)C 34a_100020639391_100000210303 [1,1,0,0,0,0|0,0,0]=2 6457 B13R1.1619 CCCOc1c(cccc1CO)F 34a_100011997349_100000210303 [1,1,0,0,0,0|1,0,0]=3 6458 B13R1.1619 CCCOc1c(cccc1CO)F 7a_100011997349_100000210303 [1,1,0,0,0,0|1,0,0]=3 6459 B13R1.1619 CCCOc1c(cccc1NC)C 34a_100012283158_200000210301 [1,1,0,0,0,0|0,0,0]=2 6460 B13R1.1619 CCCOc1c(cccc1NC)Cl 34a_200015187207_200000210301 [1,1,0,0,0,0|1,0,0]=3 6461 B13R1.1619 CCCOc1c(cccc1N[13CH3])C 34a_100012283158_200025704644 [1,1,0,0,0,0|0,0,0]=2 6462 B13R1.1619 CCCOc1c(cccc1N[13CH3])Cl 34a_200015187207_200025704644 [1,1,0,0,0,0|1,0,0]=3 6463 B13R1.1619 CCCOc1c(cccc1OC)Br 34a_100000686866_100000210303 [1,1,0,0,0,0|1,0,0]=3 6464 B13R1.1619 CCCOc1c(cccc1OC)C 34a_100011219253_100000210303 [1,1,0,0,0,0|0,0,0]=2 6465 B13R1.1619 CCCOc1c(cccc1OC)C 7a_100011219253_100000210303 [1,1,0,0,0,0|0,0,0]=2 6466 B13R1.1619 CCCOc1c(cccc1OC)Cl 34a_100009851661_100000210303 [1,1,0,0,0,0|1,0,0]=3 6467 B13R1.1619 CCCOc1c(cccc1OC)Cl 7a_100009851661_100000210303 [1,1,0,0,0,0|1,0,0]=3 6468 B13R1.1619 CCCOc1c(cccc1OC)F 34a_100000036725_100000210303 [1,1,0,0,0,0|1,0,0]=3 6469 B13R1.1619 CCCOc1c(cccc1OC)F 7a_100000036725_100000210303 [1,1,0,0,0,0|1,0,0]=3 6470 B13R1.1619 CCCOc1c(cccc1OC)N 34a_100000123586_100000210303 [1,1,0,0,0,0|1,0,0]=3 6471 B13R1.1619 CCCOc1c(occc1=O)CC 34a_100000033269_100000210303 [1,1,0,0,0,0|2,0,0]=4 6472 B13R1.1619 CCCSc1c(cccc1C#N)C 62a_100000210303_100011934862 [1,1,0,0,0,0|0,1,1]=4 6473 B13R1.1619 CCCSc1c(cccc1C=O)C 62a_100000210303_100012186367 [1,1,0,0,0,0|0,1,1]=4 6474 B13R1.1619 CCCSc1c(cccc1C=O)C 62a_100012186367_100000210303 [1,1,0,0,0,0|0,1,1]=4 6475 B13R1.1619 CCCSc1c(cccc1CC)C 62a_100000036235_100000210303 [1,1,0,0,0,0|0,1,0]=3 6476 B13R1.1619 CCCSc1c(cccc1CC)C 62a_100000210303_100000036235 [1,1,0,0,0,0|0,1,0]=3 6477 B13R1.1619 CCCSc1c(cccc1CN)F 62a_100000210303_100020638964 [1,1,0,0,0,0|1,1,0]=4 6478 B13R1.1619 CCCSc1c(cccc1CN)F 62a_100020638964_100000210303 [1,1,0,0,0,0|1,1,0]=4 6479 B13R1.1619 CCCSc1c(cccc1CO)Br 62a_100000210303_100010146604 [1,1,0,0,0,0|1,1,0]=4 6480 B13R1.1619 CCCSc1c(cccc1CO)Br 62a_100010146604_100000210303 [1,1,0,0,0,0|1,1,0]=4 6481 B13R1.1619 CCCSc1c(cccc1CO)C 62a_100000210303_100011659289 [1,1,0,0,0,0|0,1,0]=3 6482 B13R1.1619 CCCSc1c(cccc1CO)C 62a_100011659289_100000210303 [1,1,0,0,0,0|0,1,0]=3 6483 B13R1.1619 CCCSc1c(cccc1CO)F 62a_100000210303_100012351117 [1,1,0,0,0,0|1,1,0]=4 6484 B13R1.1619 CCCSc1c(cccc1CO)F 62a_100012351117_100000210303 [1,1,0,0,0,0|1,1,0]=4 6485 B13R1.1619 CCCSc1c(cccc1OC)Br 62a_100000210303_100010131421 [1,1,0,0,0,0|1,1,0]=4 6486 B13R1.1619 CCCSc1c(cccc1OC)Br 62a_100010131421_100000210303 [1,1,0,0,0,0|1,1,0]=4 6487 B13R1.1619 CCCSc1c(cccc1OC)C 62a_100000210303_100010191535 [1,1,0,0,0,0|0,1,0]=3 6488 B13R1.1619 CCCSc1c(cccc1OC)C 62a_100010191535_100000210303 [1,1,0,0,0,0|0,1,0]=3 6489 B13R1.1619 CCCSc1c(cccc1OC)F 62a_100000210303_100000703912 [1,1,0,0,0,0|1,1,0]=4 6490 B13R1.1619 CCCSc1c(cccc1OC)F 62a_100000703912_100000210303 [1,1,0,0,0,0|1,1,0]=4 6491 B13R1.1619 CCCSc1c(cccc1OC)N 62a_100000210303_100000703447 [1,1,0,0,0,0|1,1,0]=4 6492 B13R1.1619 CCCSc1c(cccc1OC)N 62a_100000703447_100000210303 [1,1,0,0,0,0|1,1,0]=4 6493 B13R1.1619 CCCSc1c(cccc1OC)O 62a_100000210303_100010202623 [1,1,0,0,0,0|1,1,0]=4 6494 B13R1.1619 CCCSc1c(ccnc1OC)C 62a_100000210303_100012353928 [1,1,0,0,0,0|1,1,0]=4 6495 B13R1.1619 CCCSc1c(ccnc1OC)C 62a_100012353928_100000210303 [1,1,0,0,0,0|1,1,0]=4 6496 B13R1.1619 CCNCc1c(cccc1OC)C 207a_100015525214_100000050978 [1,1,0,0,0,0|2,0,0]=4 6497 B13R1.1619 CCNCc1c(cccc1OC)C 270004a_100015525214_100000050978 [1,1,0,0,0,0|2,0,0]=4 6498 B13R1.1619 CCc1cccc(c1NCCF)C 2230a_100000210048_100011217306 [1,1,0,0,0,0|2,0,0]=4 6499 B13R1.1619 CCc1cccc(c1NCCF)C 34a_100000210048_100011217306 [1,1,0,0,0,0|2,0,0]=4 6500 B13R1.1619 CCc1cccc(c1NCCF)C 7a_100000210048_100011217306 [1,1,0,0,0,0|2,0,0]=4 6501 B13R1.1619 CCc1cccc(c1NCCO)C 2230a_100000210048_100000211926 [1,1,0,0,0,0|2,0,0]=4 6502 B13R1.1619 CCc1cccc(c1NCCO)C 34a_100000210048_100000211926 [1,1,0,0,0,0|2,0,0]=4 6503 B13R1.1619 CCc1cccc(c1NCCO)C 7a_100000210048_100000211926 [1,1,0,0,0,0|2,0,0]=4 6504 B13R1.1619 CCc1cccc(c1NCOC)C 2230a_100000210048_100000766300 [1,1,0,0,0,0|2,0,0]=4 6505 B13R1.1619 CCc1cccc(c1NCSC)C 2230a_100000210048_100011218213 [1,1,0,0,0,0|2,0,0]=4 6506 B13R1.1619 CCc1cccc(c1NCSC)C 34a_100000210048_100011218213 [1,1,0,0,0,0|2,0,0]=4 6507 B13R1.1619 CCc1cccc(c1OCC#N)C 7a_100000034007_100011215382 [1,1,0,0,0,0|0,0,2]=4 6508 B13R1.1619 CCc1cccc(c1OCC=O)C 34a_100000034007_200009817547 [1,1,0,0,0,0|1,0,1]=4 6509 B13R1.1619 CCc1cccc(c1OCC=O)C 7a_100000034007_200015260668 [1,1,0,0,0,0|1,0,1]=4 6510 B13R1.1619 CCc1cccc(c1OCCF)Br 34a_200010001580_100011217306 [1,1,0,0,0,0|2,0,0]=4 6511 B13R1.1619 CCc1cccc(c1OCCF)Br 7a_200010001580_100011217306 [1,1,0,0,0,0|2,0,0]=4 6512 B13R1.1619 CCc1cccc(c1OCCF)C 34a_100000034007_100011217306 [1,1,0,0,0,0|1,0,0]=3 6513 B13R1.1619 CCc1cccc(c1OCCF)C 7a_100000034007_100011217306 [1,1,0,0,0,0|1,0,0]=3 6514 B13R1.1619 CCc1cccc(c1OCCO)Br 34a_200010001580_100000211926 [1,1,0,0,0,0|2,0,0]=4 6515 B13R1.1619 CCc1cccc(c1OCCO)Br 7a_200010001580_100000211926 [1,1,0,0,0,0|2,0,0]=4 6516 B13R1.1619 CCc1cccc(c1OCCO)C 34a_100000034007_100000211926 [1,1,0,0,0,0|1,0,0]=3 6517 B13R1.1619 CCc1cccc(c1OCCO)C 7a_100000034007_100000211926 [1,1,0,0,0,0|1,0,0]=3 6518 B13R1.1619 CCc1cccc(c1OCSC)Br 34a_200010001580_100011218213 [1,1,0,0,0,0|2,0,0]=4 6519 B13R1.1619 CCc1cccc(c1OCSC)C 34a_100000034007_100011218213 [1,1,0,0,0,0|1,0,0]=3 6520 B13R1.1619 CCc1cccc(c1SCCF)C 62a_100000036235_100011217306 [1,1,0,0,0,0|1,1,0]=4 6521 B13R1.1619 CCc1cccc(c1SCCF)C 62a_100011217306_100000036235 [1,1,0,0,0,0|1,1,0]=4 6522 B13R1.1619 CCc1cccc(c1SCCO)C 62a_100000036235_100000211926 [1,1,0,0,0,0|1,1,0]=4 6523 B13R1.1619 CCc1cccc(c1SCCO)C 62a_100000211926_100000036235 [1,1,0,0,0,0|1,1,0]=4 6524 B13R1.1619 CCc1cccc(c1SCOC)C 62a_100000036235_100000766300 [1,1,0,0,0,0|1,1,0]=4 6525 B13R1.1619 CCc1cccc(c1SCOC)C 62a_100000766300_100000036235 [1,1,0,0,0,0|1,1,0]=4 6526 B13R1.1619 CCc1cccc(c1SCSC)C 62a_100000036235_100011218213 [1,1,0,0,0,0|1,1,0]=4 6527 B13R1.1619 CCc1cccc(c1SCSC)C 62a_100011218213_100000036235 [1,1,0,0,0,0|1,1,0]=4 6528 B13R1.1619 COCNc1c(cccc1OC)C 2230a_100000758225_100000766300 [1,1,0,0,0,0|2,0,0]=4 6529 B13R1.1619 COCOc1c(cccc1OC)O 271570a_203496583355_200019925563 [1,1,0,0,0,0|2,0,0]=4 6530 B13R1.1619 COCSc1c(cccc1CO)C 62a_100000766300_100011659289 [1,1,0,0,0,0|1,1,0]=4 6531 B13R1.1619 COCSc1c(cccc1CO)C 62a_100011659289_100000766300 [1,1,0,0,0,0|1,1,0]=4 6532 B13R1.1619 COCSc1c(cccc1OC)C 62a_100000766300_100010191535 [1,1,0,0,0,0|1,1,0]=4 6533 B13R1.1619 COCSc1c(cccc1OC)C 62a_100010191535_100000766300 [1,1,0,0,0,0|1,1,0]=4 6534 B13R1.1619 COc1cccc(c1NCCF)C 2230a_100000758225_100011217306 [1,1,0,0,0,0|2,0,0]=4 6535 B13R1.1619 COc1cccc(c1NCCF)C 34a_100000758225_100011217306 [1,1,0,0,0,0|2,0,0]=4 6536 B13R1.1619 COc1cccc(c1NCCO)C 2230a_100000758225_100000211926 [1,1,0,0,0,0|2,0,0]=4 6537 B13R1.1619 COc1cccc(c1NCCO)C 34a_100000758225_100000211926 [1,1,0,0,0,0|2,0,0]=4 6538 B13R1.1619 COc1cccc(c1NCSC)C 2230a_100000758225_100011218213 [1,1,0,0,0,0|2,0,0]=4 6539 B13R1.1619 COc1cccc(c1NCSC)C 34a_100000758225_100011218213 [1,1,0,0,0,0|2,0,0]=4 6540 B13R1.1619 COc1cccc(c1OCC#N)C 7a_100011219253_100011215382 [1,1,0,0,0,0|0,0,2]=4 6541 B13R1.1619 COc1cccc(c1OCC=O)C 34a_100011219253_200009817547 [1,1,0,0,0,0|1,0,1]=4 6542 B13R1.1619 COc1cccc(c1OCC=O)C 7a_100011219253_200015260668 [1,1,0,0,0,0|1,0,1]=4 6543 B13R1.1619 COc1cccc(c1OCCF)Br 34a_100000686866_100011217306 [1,1,0,0,0,0|2,0,0]=4 6544 B13R1.1619 COc1cccc(c1OCCF)C 34a_100011219253_100011217306 [1,1,0,0,0,0|1,0,0]=3 6545 B13R1.1619 COc1cccc(c1OCCF)C 7a_100011219253_100011217306 [1,1,0,0,0,0|1,0,0]=3 6546 B13R1.1619 COc1cccc(c1OCCF)Cl 34a_100009851661_100011217306 [1,1,0,0,0,0|2,0,0]=4 6547 B13R1.1619 COc1cccc(c1OCCF)Cl 7a_100009851661_100011217306 [1,1,0,0,0,0|2,0,0]=4 6548 B13R1.1619 COc1cccc(c1OCCF)F 34a_100000036725_100011217306 [1,1,0,0,0,0|2,0,0]=4 6549 B13R1.1619 COc1cccc(c1OCCF)F 7a_100000036725_100011217306 [1,1,0,0,0,0|2,0,0]=4 6550 B13R1.1619 COc1cccc(c1OCCF)N 34a_100000123586_100011217306 [1,1,0,0,0,0|2,0,0]=4 6551 B13R1.1619 COc1cccc(c1OCCO)Br 34a_100000686866_100000211926 [1,1,0,0,0,0|2,0,0]=4 6552 B13R1.1619 COc1cccc(c1OCCO)C 34a_100011219253_100000211926 [1,1,0,0,0,0|1,0,0]=3 6553 B13R1.1619 COc1cccc(c1OCCO)C 7a_100011219253_100000211926 [1,1,0,0,0,0|1,0,0]=3 6554 B13R1.1619 COc1cccc(c1OCCO)Cl 34a_100009851661_100000211926 [1,1,0,0,0,0|2,0,0]=4 6555 B13R1.1619 COc1cccc(c1OCCO)Cl 7a_100009851661_100000211926 [1,1,0,0,0,0|2,0,0]=4 6556 B13R1.1619 COc1cccc(c1OCCO)F 34a_100000036725_100000211926 [1,1,0,0,0,0|2,0,0]=4 6557 B13R1.1619 COc1cccc(c1OCCO)F 7a_100000036725_100000211926 [1,1,0,0,0,0|2,0,0]=4 6558 B13R1.1619 COc1cccc(c1OCCO)N 34a_100000123586_100000211926 [1,1,0,0,0,0|2,0,0]=4 6559 B13R1.1619 COc1cccc(c1OCSC)Br 34a_100000686866_100011218213 [1,1,0,0,0,0|2,0,0]=4 6560 B13R1.1619 COc1cccc(c1OCSC)C 34a_100011219253_100011218213 [1,1,0,0,0,0|1,0,0]=3 6561 B13R1.1619 COc1cccc(c1OCSC)Cl 34a_100009851661_100011218213 [1,1,0,0,0,0|2,0,0]=4 6562 B13R1.1619 COc1cccc(c1OCSC)F 34a_100000036725_100011218213 [1,1,0,0,0,0|2,0,0]=4 6563 B13R1.1619 COc1cccc(c1OCSC)N 34a_100000123586_100011218213 [1,1,0,0,0,0|2,0,0]=4 6564 B13R1.1619 COc1cccc(c1SCCF)C 62a_100010191535_100011217306 [1,1,0,0,0,0|1,1,0]=4 6565 B13R1.1619 COc1cccc(c1SCCF)C 62a_100011217306_100010191535 [1,1,0,0,0,0|1,1,0]=4 6566 B13R1.1619 COc1cccc(c1SCCO)C 62a_100000211926_100010191535 [1,1,0,0,0,0|1,1,0]=4 6567 B13R1.1619 COc1cccc(c1SCCO)C 62a_100010191535_100000211926 [1,1,0,0,0,0|1,1,0]=4 6568 B13R1.1619 COc1cccc(c1SCSC)C 62a_100010191535_100011218213 [1,1,0,0,0,0|1,1,0]=4 6569 B13R1.1619 COc1cccc(c1SCSC)C 62a_100011218213_100010191535 [1,1,0,0,0,0|1,1,0]=4 6570 B13R1.1619 CSCNc1c(cccc1CO)C 34a_100011215590_100011218213 [1,1,0,0,0,0|2,0,0]=4 6571 B13R1.1619 CSCOc1c(cccc1C#N)C 34a_100011659161_100011218213 [1,1,0,0,0,0|1,0,1]=4 6572 B13R1.1619 CSCOc1c(cccc1CN)C 34a_100020639391_100011218213 [1,1,0,0,0,0|1,0,0]=3 6573 B13R1.1619 CSCOc1c(cccc1CO)F 34a_100011997349_100011218213 [1,1,0,0,0,0|2,0,0]=4 6574 B13R1.1619 CSCSc1c(cccc1CO)C 62a_100011218213_100011659289 [1,1,0,0,0,0|1,1,0]=4 6575 B13R1.1619 CSCSc1c(cccc1CO)C 62a_100011659289_100011218213 [1,1,0,0,0,0|1,1,0]=4 6576 B13R1.1619 Cc1cccc(c1NCCF)CO 34a_100011215590_100011217306 [1,1,0,0,0,0|2,0,0]=4 6577 B13R1.1619 Cc1cccc(c1NCCO)CO 34a_100011215590_100000211926 [1,1,0,0,0,0|2,0,0]=4 6578 B13R1.1619 Cc1cccc(c1OCC=O)CN 34a_100020639391_200009817547 [1,1,0,0,0,0|1,0,1]=4 6579 B13R1.1619 Cc1cccc(c1OCCF)C#N 34a_100011659161_100011217306 [1,1,0,0,0,0|1,0,1]=4 6580 B13R1.1619 Cc1cccc(c1OCCF)C#N 7a_100011659161_100011217306 [1,1,0,0,0,0|1,0,1]=4 6581 B13R1.1619 Cc1cccc(c1OCCF)CN 34a_100020639391_100011217306 [1,1,0,0,0,0|1,0,0]=3 6582 B13R1.1619 Cc1cccc(c1OCCO)C#N 34a_100011659161_100000211926 [1,1,0,0,0,0|1,0,1]=4 6583 B13R1.1619 Cc1cccc(c1OCCO)C#N 7a_100011659161_100000211926 [1,1,0,0,0,0|1,0,1]=4 6584 B13R1.1619 Cc1cccc(c1OCCO)CN 34a_100020639391_100000211926 [1,1,0,0,0,0|1,0,0]=3 6585 B13R1.1619 Cc1cccc(c1SCCF)CO 62a_100011217306_100011659289 [1,1,0,0,0,0|1,1,0]=4 6586 B13R1.1619 Cc1cccc(c1SCCF)CO 62a_100011659289_100011217306 [1,1,0,0,0,0|1,1,0]=4 6587 B13R1.1619 Cc1cccc(c1SCCO)CO 62a_100000211926_100011659289 [1,1,0,0,0,0|1,1,0]=4 6588 B13R1.1619 Cc1cccc(c1SCCO)CO 62a_100011659289_100000211926 [1,1,0,0,0,0|1,1,0]=4 6589 B13R1.1619 OCCOc1c(cccc1CO)F 34a_100011997349_100000211926 [1,1,0,0,0,0|2,0,0]=4 6590 B13R1.1619 OCCOc1c(cccc1CO)F 7a_100011997349_100000211926 [1,1,0,0,0,0|2,0,0]=4 6591 B13R1.1619 OCc1cccc(c1OCCF)F 34a_100011997349_100011217306 [1,1,0,0,0,0|2,0,0]=4 6592 B13R1.1619 OCc1cccc(c1OCCF)F 7a_100011997349_100011217306 [1,1,0,0,0,0|2,0,0]=4 6593 B13R1.3395 C#CCOc1c(ccc(c1C)C)C 34a_100000211305_100000184674 [1,1,0,0,0,0|0,0,2]=4 6594 B13R1.3395 C#CCOc1c(ccc(c1C)C)C 7a_100000211305_100000038162 [1,1,0,0,0,0|0,0,2]=4 6595 B13R1.3395 C=CCOc1c(ccc(c1C)C)C 34a_100000211305_100015514636 [1,1,0,0,0,0|0,0,2]=4 6596 B13R1.3395 C=CCOc1c(ccc(c1C)C)C 7a_100000211305_100015514636 [1,1,0,0,0,0|0,0,2]=4 6597 B13R1.3395 CCCCc1c(ccc(c1C)F)C 271570a_100020621405_100011068659 [1,1,0,0,0,0|1,0,0]=3 6598 B13R1.3395 CCCCc1c(ccc(c1C)F)F 271570a_100020621405_100010167959 [1,1,0,0,0,0|2,0,0]=4 6599 B13R1.3395 CCCCc1c(ccc(c1C)N)C 271570a_100020621405_106354213274 [1,1,0,0,0,0|1,0,0]=3 6600 B13R1.3395 CCCCc1c(ccc(c1C)O)C 271570a_100020621405_100010659238 [1,1,0,0,0,0|1,0,0]=3 6601 B13R1.3395 CCCCc1c(ccc(c1O)F)C 271570a_100020621405_200010223207 [1,1,0,0,0,0|2,0,0]=4 6602 B13R1.3395 CCCCc1c(cnc(c1C)F)C 271570a_100020621405_100011016222 [1,1,0,0,0,0|2,0,0]=4 6603 B13R1.3395 CCCCc1c(ncc(c1C)N)C 271570a_100020621405_100012352430 [1,1,0,0,0,0|2,0,0]=4 6604 B13R1.3395 CCCNc1c(ccc(c1C)Br)C 34a_200010074581_100000210303 [1,1,0,0,0,0|1,0,0]=3 6605 B13R1.3395 CCCNc1c(ccc(c1C)Br)F 2230a_100010588651_100000210303 [1,1,0,0,0,0|2,0,0]=4 6606 B13R1.3395 CCCNc1c(ccc(c1C)Br)F 34a_100010588651_100000210303 [1,1,0,0,0,0|2,0,0]=4 6607 B13R1.3395 CCCNc1c(ccc(c1C)Br)O 34a_100013039247_100000210303 [1,1,0,0,0,0|2,0,0]=4 6608 B13R1.3395 CCCNc1c(ccc(c1C)C)C 2230a_100000117417_100000210303 [1,1,0,0,0,0|1,0,0]=3 6609 B13R1.3395 CCCNc1c(ccc(c1C)C)C 34a_100000117417_100000210303 [1,1,0,0,0,0|1,0,0]=3 6610 B13R1.3395 CCCNc1c(ccc(c1C)C)C 7a_100000117417_100000210303 [1,1,0,0,0,0|1,0,0]=3 6611 B13R1.3395 CCCNc1c(ccc(c1C)Cl)C 2230a_200020642106_100000210303 [1,1,0,0,0,0|1,0,0]=3 6612 B13R1.3395 CCCNc1c(ccc(c1C)Cl)C 34a_200020642106_100000210303 [1,1,0,0,0,0|1,0,0]=3 6613 B13R1.3395 CCCNc1c(ccc(c1C)Cl)Cl 34a_100009961198_100000210303 [1,1,0,0,0,0|2,0,0]=4 6614 B13R1.3395 CCCNc1c(ccc(c1C)F)Br 34a_100011009917_100000210303 [1,1,0,0,0,0|2,0,0]=4 6615 B13R1.3395 CCCNc1c(ccc(c1C)I)C 34a_200010115591_100000210303 [1,1,0,0,0,0|1,0,0]=3 6616 B13R1.3395 CCCOc1c(ccc(c1Br)C)F 34a_200010223207_100000210303 [1,1,0,0,0,0|2,0,0]=4 6617 B13R1.3395 CCCOc1c(ccc(c1Br)C)F 7a_200010223207_100000210303 [1,1,0,0,0,0|2,0,0]=4 6618 B13R1.3395 CCCOc1c(ccc(c1Br)F)F 34a_100010170822_100000210303 [1,1,0,0,0,0|2,0,0]=4 6619 B13R1.3395 CCCOc1c(ccc(c1Br)F)F 7a_100010170822_100000210303 [1,1,0,0,0,0|2,0,0]=4 6620 B13R1.3395 CCCOc1c(ccc(c1Br)F)N 34a_100010128263_100000210303 [1,1,0,0,0,0|2,0,0]=4 6621 B13R1.3395 CCCOc1c(ccc(c1Br)F)N 7a_100010128263_100000210303 [1,1,0,0,0,0|2,0,0]=4 6622 B13R1.3395 CCCOc1c(ccc(c1C)C)C 34a_100000211305_100000210303 [1,1,0,0,0,0|0,0,0]=2 6623 B13R1.3395 CCCOc1c(ccc(c1C)C)C 7a_100000211305_100000210303 [1,1,0,0,0,0|0,0,0]=2 6624 B13R1.3395 CCCOc1c(ccc(c1C)Cl)Br 34a_200010391122_100000210303 [1,1,0,0,0,0|1,0,0]=3 6625 B13R1.3395 CCCOc1c(ccc(c1C)Cl)Br 7a_200010391122_100000210303 [1,1,0,0,0,0|1,0,0]=3 6626 B13R1.3395 CCCOc1c(ccc(c1C)F)Br 34a_200010391124_100000210303 [1,1,0,0,0,0|1,0,0]=3 6627 B13R1.3395 CCCOc1c(ccc(c1C)F)Br 7a_200010391124_100000210303 [1,1,0,0,0,0|1,0,0]=3 6628 B13R1.3395 CCCOc1c(ccc(c1Cl)Br)Cl 34a_100010089855_100000210303 [1,1,0,0,0,0|2,0,0]=4 6629 B13R1.3395 CCCOc1c(ccc(c1Cl)Br)Cl 7a_100010089855_100000210303 [1,1,0,0,0,0|2,0,0]=4 6630 B13R1.3395 CCCOc1c(ccc(c1Cl)C)Cl 34a_200000087117_100000210303 [1,1,0,0,0,0|2,0,0]=4 6631 B13R1.3395 CCCOc1c(ccc(c1Cl)C)Cl 7a_200000087117_100000210303 [1,1,0,0,0,0|2,0,0]=4 6632 B13R1.3395 CCCOc1c(ccc(c1Cl)C)F 34a_100000035349_100000210303 [1,1,0,0,0,0|2,0,0]=4 6633 B13R1.3395 CCCOc1c(ccc(c1Cl)C)F 7a_100000035349_100000210303 [1,1,0,0,0,0|2,0,0]=4 6634 B13R1.3395 CCCOc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_100000210303 [1,1,0,0,0,0|2,0,0]=4 6635 B13R1.3395 CCCOc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_100000210303 [1,1,0,0,0,0|2,0,0]=4 6636 B13R1.3395 CCCOc1c(ccc(c1Cl)Cl)F 34a_100000062035_100000210303 [1,1,0,0,0,0|2,0,0]=4 6637 B13R1.3395 CCCOc1c(ccc(c1Cl)Cl)F 7a_100000062035_100000210303 [1,1,0,0,0,0|2,0,0]=4 6638 B13R1.3395 CCCOc1c(ccc(c1Cl)F)Br 34a_100014979575_100000210303 [1,1,0,0,0,0|2,0,0]=4 6639 B13R1.3395 CCCOc1c(ccc(c1Cl)F)Br 7a_100014979575_100000210303 [1,1,0,0,0,0|2,0,0]=4 6640 B13R1.3395 CCCOc1c(ccc(c1Cl)F)F 34a_100000038336_100000210303 [1,1,0,0,0,0|2,0,0]=4 6641 B13R1.3395 CCCOc1c(ccc(c1Cl)F)F 7a_100000038336_100000210303 [1,1,0,0,0,0|2,0,0]=4 6642 B13R1.3395 CCCOc1c(ccc(c1Cl)N)C 34a_100000036876_100000210303 [1,1,0,0,0,0|1,0,0]=3 6643 B13R1.3395 CCCOc1c(ccc(c1Cl)N)C 7a_100000036876_100000210303 [1,1,0,0,0,0|1,0,0]=3 6644 B13R1.3395 CCCOc1c(ccc(c1F)Br)Cl 34a_100010240321_100000210303 [1,1,0,0,0,0|2,0,0]=4 6645 B13R1.3395 CCCOc1c(ccc(c1F)Br)Cl 7a_100010240321_100000210303 [1,1,0,0,0,0|2,0,0]=4 6646 B13R1.3395 CCCOc1c(ccc(c1F)Br)F 34a_100010167067_100000210303 [1,1,0,0,0,0|2,0,0]=4 6647 B13R1.3395 CCCOc1c(ccc(c1F)Br)F 7a_100010167067_100000210303 [1,1,0,0,0,0|2,0,0]=4 6648 B13R1.3395 CCCOc1c(ccc(c1F)C)Br 34a_100000722096_100000210303 [1,1,0,0,0,0|2,0,0]=4 6649 B13R1.3395 CCCOc1c(ccc(c1F)C)Br 7a_100000722096_100000210303 [1,1,0,0,0,0|2,0,0]=4 6650 B13R1.3395 CCCOc1c(ccc(c1F)C)Cl 34a_200000034537_100000210303 [1,1,0,0,0,0|2,0,0]=4 6651 B13R1.3395 CCCOc1c(ccc(c1F)C)Cl 7a_200000034537_100000210303 [1,1,0,0,0,0|2,0,0]=4 6652 B13R1.3395 CCCOc1c(ccc(c1F)C)F 34a_100011216644_100000210303 [1,1,0,0,0,0|2,0,0]=4 6653 B13R1.3395 CCCOc1c(ccc(c1F)C)F 7a_100011216644_100000210303 [1,1,0,0,0,0|2,0,0]=4 6654 B13R1.3395 CCCOc1c(ccc(c1F)Cl)Br 34a_100010081130_100000210303 [1,1,0,0,0,0|2,0,0]=4 6655 B13R1.3395 CCCOc1c(ccc(c1F)Cl)Br 7a_100010081130_100000210303 [1,1,0,0,0,0|2,0,0]=4 6656 B13R1.3395 CCCOc1c(ccc(c1F)Cl)F 34a_100000034634_100000210303 [1,1,0,0,0,0|2,0,0]=4 6657 B13R1.3395 CCCOc1c(ccc(c1F)Cl)F 7a_100000034634_100000210303 [1,1,0,0,0,0|2,0,0]=4 6658 B13R1.3395 CCCOc1c(ccc(c1F)F)Br 34a_100010243909_100000210303 [1,1,0,0,0,0|2,0,0]=4 6659 B13R1.3395 CCCOc1c(ccc(c1F)F)Br 7a_100010243909_100000210303 [1,1,0,0,0,0|2,0,0]=4 6660 B13R1.3395 CCCOc1c(ccc(c1F)F)F 34a_100000031686_100000210303 [1,1,0,0,0,0|2,0,0]=4 6661 B13R1.3395 CCCOc1c(ccc(c1F)F)F 7a_100000031686_100000210303 [1,1,0,0,0,0|2,0,0]=4 6662 B13R1.3395 CCCOc1c(ccc(c1F)F)N 34a_100015205010_100000210303 [1,1,0,0,0,0|2,0,0]=4 6663 B13R1.3395 CCCOc1c(ccc(c1F)F)N 7a_100015205010_100000210303 [1,1,0,0,0,0|2,0,0]=4 6664 B13R1.3395 CCCOc1c(ccc(c1F)I)Br 34a_200010782288_100000210303 [1,1,0,0,0,0|2,0,0]=4 6665 B13R1.3395 CCCOc1c(ccc(c1F)I)Br 7a_200010782288_100000210303 [1,1,0,0,0,0|2,0,0]=4 6666 B13R1.3395 CCCOc1c(n(ccc1=O)C)C 34a_100000032683_100000210303 [1,1,0,0,0,0|2,0,0]=4 6667 B13R1.3395 CCCOc1c(n(ccc1=O)C)C 7a_100000032683_100000210303 [1,1,0,0,0,0|2,0,0]=4 6668 B13R1.3395 CCCSc1c(ccc(c1C)F)C 62a_100000210303_100011068659 [1,1,0,0,0,0|0,1,0]=3 6669 B13R1.3395 CCCSc1c(ccc(c1C)F)C 62a_100011068659_100000210303 [1,1,0,0,0,0|0,1,0]=3 6670 B13R1.3395 CCCSc1c(ccc(c1C)F)F 62a_100000210303_100010167959 [1,1,0,0,0,0|1,1,0]=4 6671 B13R1.3395 CCCSc1c(ccc(c1C)F)F 62a_100010167959_100000210303 [1,1,0,0,0,0|1,1,0]=4 6672 B13R1.3395 CCCSc1c(ccc(c1C)N)C 62a_100000210303_106354213274 [1,1,0,0,0,0|0,1,0]=3 6673 B13R1.3395 CCCSc1c(ccc(c1C)N)C 62a_106354213274_100000210303 [1,1,0,0,0,0|0,1,0]=3 6674 B13R1.3395 CCCSc1c(ccc(c1C)O)C 62a_100000210303_100010659238 [1,1,0,0,0,0|0,1,0]=3 6675 B13R1.3395 CCCSc1c(ccc(c1C)O)C 62a_100010659238_100000210303 [1,1,0,0,0,0|0,1,0]=3 6676 B13R1.3395 CCCSc1c(ccc(c1O)F)C 62a_100000210303_200010223207 [1,1,0,0,0,0|1,1,0]=4 6677 B13R1.3395 CCCSc1c(ccc(c1O)F)C 62a_200010223207_100000210303 [1,1,0,0,0,0|1,1,0]=4 6678 B13R1.3395 CCCSc1c(cnc(c1C)F)C 62a_100000210303_100011016222 [1,1,0,0,0,0|1,1,0]=4 6679 B13R1.3395 CCCSc1c(cnc(c1C)F)C 62a_100011016222_100000210303 [1,1,0,0,0,0|1,1,0]=4 6680 B13R1.3395 CCCSc1c(ncc(c1C)N)C 62a_100000210303_100012352430 [1,1,0,0,0,0|1,1,0]=4 6681 B13R1.3395 CCCSc1c(ncc(c1C)N)C 62a_100012352430_100000210303 [1,1,0,0,0,0|1,1,0]=4 6682 B13R1.3395 COCNc1c(ccc(c1C)C)C 2230a_100000117417_100000766300 [1,1,0,0,0,0|2,0,0]=4 6683 B13R1.3395 COCNc1c(ccc(c1C)Cl)C 2230a_200020642106_100000766300 [1,1,0,0,0,0|2,0,0]=4 6684 B13R1.3395 COCSc1c(ccc(c1C)F)C 62a_100000766300_100011068659 [1,1,0,0,0,0|1,1,0]=4 6685 B13R1.3395 COCSc1c(ccc(c1C)F)C 62a_100011068659_100000766300 [1,1,0,0,0,0|1,1,0]=4 6686 B13R1.3395 COCSc1c(ccc(c1C)N)C 62a_100000766300_106354213274 [1,1,0,0,0,0|1,1,0]=4 6687 B13R1.3395 COCSc1c(ccc(c1C)N)C 62a_106354213274_100000766300 [1,1,0,0,0,0|1,1,0]=4 6688 B13R1.3395 COCSc1c(ccc(c1C)O)C 62a_100000766300_100010659238 [1,1,0,0,0,0|1,1,0]=4 6689 B13R1.3395 COCSc1c(ccc(c1C)O)C 62a_100010659238_100000766300 [1,1,0,0,0,0|1,1,0]=4 6690 B13R1.3395 CSCNc1c(ccc(c1C)Br)C 34a_200010074581_100011218213 [1,1,0,0,0,0|2,0,0]=4 6691 B13R1.3395 CSCNc1c(ccc(c1C)C)C 2230a_100000117417_100011218213 [1,1,0,0,0,0|2,0,0]=4 6692 B13R1.3395 CSCNc1c(ccc(c1C)C)C 34a_100000117417_100011218213 [1,1,0,0,0,0|2,0,0]=4 6693 B13R1.3395 CSCNc1c(ccc(c1C)Cl)C 2230a_200020642106_100011218213 [1,1,0,0,0,0|2,0,0]=4 6694 B13R1.3395 CSCNc1c(ccc(c1C)Cl)C 34a_200020642106_100011218213 [1,1,0,0,0,0|2,0,0]=4 6695 B13R1.3395 CSCNc1c(ccc(c1C)I)C 34a_200010115591_100011218213 [1,1,0,0,0,0|2,0,0]=4 6696 B13R1.3395 CSCOc1c(ccc(c1C)C)C 34a_100000211305_100011218213 [1,1,0,0,0,0|1,0,0]=3 6697 B13R1.3395 CSCOc1c(ccc(c1C)Cl)Br 34a_200010391122_100011218213 [1,1,0,0,0,0|2,0,0]=4 6698 B13R1.3395 CSCOc1c(ccc(c1C)F)Br 34a_200010391124_100011218213 [1,1,0,0,0,0|2,0,0]=4 6699 B13R1.3395 CSCOc1c(ccc(c1Cl)N)C 34a_100000036876_100011218213 [1,1,0,0,0,0|2,0,0]=4 6700 B13R1.3395 CSCSc1c(ccc(c1C)F)C 62a_100011068659_100011218213 [1,1,0,0,0,0|1,1,0]=4 6701 B13R1.3395 CSCSc1c(ccc(c1C)F)C 62a_100011218213_100011068659 [1,1,0,0,0,0|1,1,0]=4 6702 B13R1.3395 CSCSc1c(ccc(c1C)N)C 62a_100011218213_106354213274 [1,1,0,0,0,0|1,1,0]=4 6703 B13R1.3395 CSCSc1c(ccc(c1C)N)C 62a_106354213274_100011218213 [1,1,0,0,0,0|1,1,0]=4 6704 B13R1.3395 CSCSc1c(ccc(c1C)O)C 62a_100010659238_100011218213 [1,1,0,0,0,0|1,1,0]=4 6705 B13R1.3395 CSCSc1c(ccc(c1C)O)C 62a_100011218213_100010659238 [1,1,0,0,0,0|1,1,0]=4 6706 B13R1.3395 Cc1c(ccc(c1OCCF)Br)Cl 34a_200010391122_100011217306 [1,1,0,0,0,0|2,0,0]=4 6707 B13R1.3395 Cc1c(ccc(c1OCCF)Br)Cl 7a_200010391122_100011217306 [1,1,0,0,0,0|2,0,0]=4 6708 B13R1.3395 Cc1c(ccc(c1OCCF)Br)F 34a_200010391124_100011217306 [1,1,0,0,0,0|2,0,0]=4 6709 B13R1.3395 Cc1c(ccc(c1OCCF)Br)F 7a_200010391124_100011217306 [1,1,0,0,0,0|2,0,0]=4 6710 B13R1.3395 Cc1c(ccc(c1OCCO)Br)Cl 34a_200010391122_100000211926 [1,1,0,0,0,0|2,0,0]=4 6711 B13R1.3395 Cc1c(ccc(c1OCCO)Br)Cl 7a_200010391122_100000211926 [1,1,0,0,0,0|2,0,0]=4 6712 B13R1.3395 Cc1c(ccc(c1OCCO)Br)F 34a_200010391124_100000211926 [1,1,0,0,0,0|2,0,0]=4 6713 B13R1.3395 Cc1c(ccc(c1OCCO)Br)F 7a_200010391124_100000211926 [1,1,0,0,0,0|2,0,0]=4 6714 B13R1.3395 Cc1ccc(c(c1C)NCCF)C 2230a_100000117417_100011217306 [1,1,0,0,0,0|2,0,0]=4 6715 B13R1.3395 Cc1ccc(c(c1C)NCCF)C 34a_100000117417_100011217306 [1,1,0,0,0,0|2,0,0]=4 6716 B13R1.3395 Cc1ccc(c(c1C)NCCF)C 7a_100000117417_100011217306 [1,1,0,0,0,0|2,0,0]=4 6717 B13R1.3395 Cc1ccc(c(c1C)NCCO)C 2230a_100000117417_100000211926 [1,1,0,0,0,0|2,0,0]=4 6718 B13R1.3395 Cc1ccc(c(c1C)NCCO)C 34a_100000117417_100000211926 [1,1,0,0,0,0|2,0,0]=4 6719 B13R1.3395 Cc1ccc(c(c1C)NCCO)C 7a_100000117417_100000211926 [1,1,0,0,0,0|2,0,0]=4 6720 B13R1.3395 Cc1ccc(c(c1C)OCC#N)C 7a_100000211305_100011215382 [1,1,0,0,0,0|0,0,2]=4 6721 B13R1.3395 Cc1ccc(c(c1C)OCC=O)C 34a_100000211305_200009817547 [1,1,0,0,0,0|1,0,1]=4 6722 B13R1.3395 Cc1ccc(c(c1C)OCC=O)C 7a_100000211305_200015260668 [1,1,0,0,0,0|1,0,1]=4 6723 B13R1.3395 Cc1ccc(c(c1C)OCCF)C 34a_100000211305_100011217306 [1,1,0,0,0,0|1,0,0]=3 6724 B13R1.3395 Cc1ccc(c(c1C)OCCF)C 7a_100000211305_100011217306 [1,1,0,0,0,0|1,0,0]=3 6725 B13R1.3395 Cc1ccc(c(c1C)OCCO)C 34a_100000211305_100000211926 [1,1,0,0,0,0|1,0,0]=3 6726 B13R1.3395 Cc1ccc(c(c1C)OCCO)C 7a_100000211305_100000211926 [1,1,0,0,0,0|1,0,0]=3 6727 B13R1.3395 Cc1ccc(c(c1NCCF)C)Br 34a_200010074581_100011217306 [1,1,0,0,0,0|2,0,0]=4 6728 B13R1.3395 Cc1ccc(c(c1NCCF)C)Cl 2230a_200020642106_100011217306 [1,1,0,0,0,0|2,0,0]=4 6729 B13R1.3395 Cc1ccc(c(c1NCCF)C)Cl 34a_200020642106_100011217306 [1,1,0,0,0,0|2,0,0]=4 6730 B13R1.3395 Cc1ccc(c(c1NCCF)C)I 34a_200010115591_100011217306 [1,1,0,0,0,0|2,0,0]=4 6731 B13R1.3395 Cc1ccc(c(c1NCCO)C)Br 34a_200010074581_100000211926 [1,1,0,0,0,0|2,0,0]=4 6732 B13R1.3395 Cc1ccc(c(c1NCCO)C)Cl 2230a_200020642106_100000211926 [1,1,0,0,0,0|2,0,0]=4 6733 B13R1.3395 Cc1ccc(c(c1NCCO)C)Cl 34a_200020642106_100000211926 [1,1,0,0,0,0|2,0,0]=4 6734 B13R1.3395 Cc1ccc(c(c1NCCO)C)I 34a_200010115591_100000211926 [1,1,0,0,0,0|2,0,0]=4 6735 B13R1.3395 Cc1ccc(c(c1OCCF)Cl)N 34a_100000036876_100011217306 [1,1,0,0,0,0|2,0,0]=4 6736 B13R1.3395 Cc1ccc(c(c1OCCF)Cl)N 7a_100000036876_100011217306 [1,1,0,0,0,0|2,0,0]=4 6737 B13R1.3395 Cc1ccc(c(c1OCCO)Cl)N 34a_100000036876_100000211926 [1,1,0,0,0,0|2,0,0]=4 6738 B13R1.3395 Cc1ccc(c(c1OCCO)Cl)N 7a_100000036876_100000211926 [1,1,0,0,0,0|2,0,0]=4 6739 B13R1.3395 Cc1ccc(c(c1SCCF)C)F 62a_100011068659_100011217306 [1,1,0,0,0,0|1,1,0]=4 6740 B13R1.3395 Cc1ccc(c(c1SCCF)C)F 62a_100011217306_100011068659 [1,1,0,0,0,0|1,1,0]=4 6741 B13R1.3395 Cc1ccc(c(c1SCCF)C)N 62a_100011217306_106354213274 [1,1,0,0,0,0|1,1,0]=4 6742 B13R1.3395 Cc1ccc(c(c1SCCF)C)N 62a_106354213274_100011217306 [1,1,0,0,0,0|1,1,0]=4 6743 B13R1.3395 Cc1ccc(c(c1SCCF)C)O 62a_100010659238_100011217306 [1,1,0,0,0,0|1,1,0]=4 6744 B13R1.3395 Cc1ccc(c(c1SCCF)C)O 62a_100011217306_100010659238 [1,1,0,0,0,0|1,1,0]=4 6745 B13R1.3395 Cc1ccc(c(c1SCCO)C)F 62a_100000211926_100011068659 [1,1,0,0,0,0|1,1,0]=4 6746 B13R1.3395 Cc1ccc(c(c1SCCO)C)F 62a_100011068659_100000211926 [1,1,0,0,0,0|1,1,0]=4 6747 B13R1.3395 Cc1ccc(c(c1SCCO)C)N 62a_100000211926_106354213274 [1,1,0,0,0,0|1,1,0]=4 6748 B13R1.3395 Cc1ccc(c(c1SCCO)C)N 62a_106354213274_100000211926 [1,1,0,0,0,0|1,1,0]=4 6749 B13R1.3395 Cc1ccc(c(c1SCCO)C)O 62a_100000211926_100010659238 [1,1,0,0,0,0|1,1,0]=4 6750 B13R1.3395 Cc1ccc(c(c1SCCO)C)O 62a_100010659238_100000211926 [1,1,0,0,0,0|1,1,0]=4 6751 B13R1.4453 CCCC(=O)c1c(cccc1Br)C 1458a_100000701904_100000210303 [1,1,0,0,0,0|2,0,0]=4 6752 B13R1.4453 CCCC(=O)c1c(cccc1C)C 1458a_100000758298_100000210303 [1,1,0,0,0,0|1,0,0]=3 6753 B13R1.4453 CCCC(=O)c1c(cccc1Cl)C 1458a_100000692601_100000210303 [1,1,0,0,0,0|2,0,0]=4 6754 B13R1.4453 CCCC(=O)c1c(cccc1F)C 1458a_100000762013_100000210303 [1,1,0,0,0,0|2,0,0]=4 6755 B13R1.4453 CCCC(=O)c1c(cccc1I)C 1458a_100000688020_100000210303 [1,1,0,0,0,0|2,0,0]=4 6756 B13R1.4453 CCCC(=O)c1c(cccc1O)C 1458a_100011934116_100000210303 [1,1,0,0,0,0|2,0,0]=4 6757 B13R1.4453 CCCN(C)c1c(cccc1C)C 2230a_100011645471_100000210303 [1,1,0,0,0,0|1,0,0]=3 6758 B13R1.4453 CCCN(C)c1c(cccc1C)C 269982a_100011645471_100000210303 [1,1,0,0,0,0|1,0,0]=3 6759 B13R1.4453 CCCN(C)c1c(cccc1C)C 34a_100011645471_100000210303 [1,1,0,0,0,0|1,0,0]=3 6760 B13R1.4453 CCNC(=O)c1c(cccc1C)C 11a_100015525214_100000758298 [1,1,0,0,0,0|2,0,0]=4 6761 B13R1.4453 CCNC(=O)c1c(cccc1C)C 240690a_100015525214_100000758298 [1,1,0,0,0,0|2,0,0]=4 6762 B13R1.4453 CCN[C@@H](C)c1c(cccc1C)C 2230a_100016987977_100000210202 [1,1,0,0,0,0|2,0,0]=4 6763 B13R1.4453 CCN[C@@H](C)c1c(cccc1C)C 34a_100016987977_100000210202 [1,1,0,0,0,0|2,0,0]=4 6764 B13R1.4453 CCOC(C)c1c(cccc1C)C 34a_200000695261_100000210202 [1,1,0,0,0,0|2,0,0]=4 6765 B13R1.4453 CCOC(C)c1c(cccc1C)C 7a_200000695261_100000210202 [1,1,0,0,0,0|2,0,0]=4 6766 B13R1.4453 COCN(C)c1c(cccc1C)C 2230a_100011645471_100000766300 [1,1,0,0,0,0|2,0,0]=4 6767 B13R1.4453 COCN(C)c1c(cccc1C)C 269982a_100011645471_100000766300 [1,1,0,0,0,0|2,0,0]=4 6768 B13R1.4453 CSCN(C)c1c(cccc1C)C 2230a_100011645471_100011218213 [1,1,0,0,0,0|2,0,0]=4 6769 B13R1.4453 CSCN(C)c1c(cccc1C)C 269982a_100011645471_100011218213 [1,1,0,0,0,0|2,0,0]=4 6770 B13R1.4453 CSCN(C)c1c(cccc1C)C 34a_100011645471_100011218213 [1,1,0,0,0,0|2,0,0]=4 6771 B13R1.4453 Cc1cccc(c1C(=O)CCF)C 1458a_100000758298_100011217306 [1,1,0,0,0,0|2,0,0]=4 6772 B13R1.4453 Cc1cccc(c1C(=O)CCO)C 1458a_100000758298_100000211926 [1,1,0,0,0,0|2,0,0]=4 6773 B13R1.4453 Cc1cccc(c1N(C)CCF)C 2230a_100011645471_100011217306 [1,1,0,0,0,0|2,0,0]=4 6774 B13R1.4453 Cc1cccc(c1N(C)CCF)C 269982a_100011645471_100011217306 [1,1,0,0,0,0|2,0,0]=4 6775 B13R1.4453 Cc1cccc(c1N(C)CCF)C 34a_100011645471_100011217306 [1,1,0,0,0,0|2,0,0]=4 6776 B13R1.4453 Cc1cccc(c1N(C)CCO)C 2230a_100011645471_100000211926 [1,1,0,0,0,0|2,0,0]=4 6777 B13R1.4453 Cc1cccc(c1N(C)CCO)C 269982a_100011645471_100000211926 [1,1,0,0,0,0|2,0,0]=4 6778 B13R1.4453 Cc1cccc(c1N(C)CCO)C 34a_100011645471_100000211926 [1,1,0,0,0,0|2,0,0]=4 6779 B13R1.4928 C#CC(C)Oc1c(cccc1C)C 34a_100000210341_200000035995 [1,1,0,0,0,0|0,0,2]=4 6780 B13R1.4928 CCC(=O)Cc1c(cccc1C)C 1458a_100000210414_100000758300 [1,1,0,0,0,0|1,0,1]=4 6781 B13R1.4928 CCC(=O)Cc1c(cccc1C)C 1458a_100000689862_100000210202 [1,1,0,0,0,0|1,0,1]=4 6782 B13R1.4928 CCC(=O)Nc1c(cccc1C)C 11a_100000185769_100000210414 [1,1,0,0,0,0|1,0,1]=4 6783 B13R1.4928 CCC(=O)Nc1c(cccc1C)C 1626a_100000185769_100000210414 [1,1,0,0,0,0|1,0,1]=4 6784 B13R1.4928 CCC(=O)Nc1c(cccc1C)C 22a_100000185769_100000210414 [1,1,0,0,0,0|1,0,1]=4 6785 B13R1.4928 CCC(C)Nc1c(cccc1Br)C 34a_100011834072_100011215416 [1,1,0,0,0,0|2,0,0]=4 6786 B13R1.4928 CCC(C)Nc1c(cccc1C)C 34a_100000185769_100011215416 [1,1,0,0,0,0|1,0,0]=3 6787 B13R1.4928 CCC(C)Nc1c(cccc1Cl)C 34a_100000756524_100011215416 [1,1,0,0,0,0|2,0,0]=4 6788 B13R1.4928 CCC(C)Nc1c(cccc1F)C 34a_100000766463_100011215416 [1,1,0,0,0,0|2,0,0]=4 6789 B13R1.4928 CCC(C)Nc1c(cccc1O)C 34a_100000743429_100011215416 [1,1,0,0,0,0|2,0,0]=4 6790 B13R1.4928 CCC(C)Oc1c(cccc1Br)Br 34a_100000736428_100011215416 [1,1,0,0,0,0|2,0,0]=4 6791 B13R1.4928 CCC(C)Oc1c(cccc1Br)Br 7a_100000736428_100000758301 [1,1,0,0,0,0|2,0,0]=4 6792 B13R1.4928 CCC(C)Oc1c(cccc1Br)C 34a_100009817157_100011215416 [1,1,0,0,0,0|1,0,0]=3 6793 B13R1.4928 CCC(C)Oc1c(cccc1Br)C 7a_100009817157_100000758301 [1,1,0,0,0,0|1,0,0]=3 6794 B13R1.4928 CCC(C)Oc1c(cccc1Br)Cl 34a_100010214474_100011215416 [1,1,0,0,0,0|2,0,0]=4 6795 B13R1.4928 CCC(C)Oc1c(cccc1Br)Cl 7a_100010214474_100000758301 [1,1,0,0,0,0|2,0,0]=4 6796 B13R1.4928 CCC(C)Oc1c(cccc1Br)F 34a_100009813666_100011215416 [1,1,0,0,0,0|2,0,0]=4 6797 B13R1.4928 CCC(C)Oc1c(cccc1Br)F 7a_100009813666_100000758301 [1,1,0,0,0,0|2,0,0]=4 6798 B13R1.4928 CCC(C)Oc1c(cccc1Br)N 34a_100011934915_100011215416 [1,1,0,0,0,0|2,0,0]=4 6799 B13R1.4928 CCC(C)Oc1c(cccc1C)C 34a_100000210341_100011215416 [1,1,0,0,0,0|0,0,0]=2 6800 B13R1.4928 CCC(C)Oc1c(cccc1C)C 7a_100000210341_100000758301 [1,1,0,0,0,0|0,0,0]=2 6801 B13R1.4928 CCC(C)Oc1c(cccc1Cl)C 34a_100000033731_100011215416 [1,1,0,0,0,0|1,0,0]=3 6802 B13R1.4928 CCC(C)Oc1c(cccc1Cl)C 7a_100000033731_100000758301 [1,1,0,0,0,0|1,0,0]=3 6803 B13R1.4928 CCC(C)Oc1c(cccc1Cl)Cl 34a_100000211709_100011215416 [1,1,0,0,0,0|2,0,0]=4 6804 B13R1.4928 CCC(C)Oc1c(cccc1Cl)Cl 7a_100000211709_100000758301 [1,1,0,0,0,0|2,0,0]=4 6805 B13R1.4928 CCC(C)Oc1c(cccc1Cl)F 34a_100000694953_100011215416 [1,1,0,0,0,0|2,0,0]=4 6806 B13R1.4928 CCC(C)Oc1c(cccc1Cl)F 7a_100000694953_100000758301 [1,1,0,0,0,0|2,0,0]=4 6807 B13R1.4928 CCC(C)Oc1c(cccc1Cl)N 34a_100000754742_100011215416 [1,1,0,0,0,0|2,0,0]=4 6808 B13R1.4928 CCC(C)Oc1c(cccc1F)C 34a_100011659162_100011215416 [1,1,0,0,0,0|1,0,0]=3 6809 B13R1.4928 CCC(C)Oc1c(cccc1F)C 7a_100011659162_100000758301 [1,1,0,0,0,0|1,0,0]=3 6810 B13R1.4928 CCC(C)Oc1c(cccc1F)F 34a_100000230165_100011215416 [1,1,0,0,0,0|2,0,0]=4 6811 B13R1.4928 CCC(C)Oc1c(cccc1F)F 7a_100000230165_100000758301 [1,1,0,0,0,0|2,0,0]=4 6812 B13R1.4928 CCC(C)Oc1c(cccc1F)N 34a_100011934987_100011215416 [1,1,0,0,0,0|2,0,0]=4 6813 B13R1.4928 CCC(C)Oc1c(cccc1I)Br 34a_100010084509_100011215416 [1,1,0,0,0,0|2,0,0]=4 6814 B13R1.4928 CCC(C)Oc1c(cccc1I)Br 7a_100010084509_100000758301 [1,1,0,0,0,0|2,0,0]=4 6815 B13R1.4928 CCC(C)Oc1c(cccc1I)Cl 34a_100010202889_100011215416 [1,1,0,0,0,0|2,0,0]=4 6816 B13R1.4928 CCC(C)Oc1c(cccc1I)Cl 7a_100010202889_100000758301 [1,1,0,0,0,0|2,0,0]=4 6817 B13R1.4928 CCC(C)Oc1c(cccc1I)F 34a_100010186298_100011215416 [1,1,0,0,0,0|2,0,0]=4 6818 B13R1.4928 CCC(C)Oc1c(cccc1I)F 7a_100010186298_100000758301 [1,1,0,0,0,0|2,0,0]=4 6819 B13R1.4928 CCC(C)Oc1c(cccc1I)N 34a_100010084371_100011215416 [1,1,0,0,0,0|2,0,0]=4 6820 B13R1.4928 CCC(C)Oc1c(cccc1N)C 34a_100000756359_100011215416 [1,1,0,0,0,0|1,0,0]=3 6821 B13R1.4928 CCC(C)Oc1c(cccc1N)C 7a_100000756359_100000758301 [1,1,0,0,0,0|1,0,0]=3 6822 B13R1.4928 CCC(C)Oc1c(cccc1N)N 34a_200016994477_100011215416 [1,1,0,0,0,0|2,0,0]=4 6823 B13R1.4928 CCC(C)Oc1c(ccnc1C)C 34a_100011934651_100011215416 [1,1,0,0,0,0|1,0,0]=3 6824 B13R1.4928 CCC(C)Oc1c(ccnc1C)C 7a_100011934651_100000758301 [1,1,0,0,0,0|1,0,0]=3 6825 B13R1.4928 CCC(C)Oc1c(ccnc1Cl)C 34a_100000696282_100011215416 [1,1,0,0,0,0|2,0,0]=4 6826 B13R1.4928 CCC(C)Oc1c(ccnc1Cl)C 7a_100000696282_100000758301 [1,1,0,0,0,0|2,0,0]=4 6827 B13R1.4928 CCC(C)Oc1c(ncnc1C)C 34a_100009878406_100011215416 [1,1,0,0,0,0|2,0,0]=4 6828 B13R1.4928 CCC(C)Oc1c(ncnc1C)C 7a_100009878406_100000758301 [1,1,0,0,0,0|2,0,0]=4 6829 B13R1.4928 CCC(C)Oc1c(occc1=O)C 34a_100000031901_100011215416 [1,1,0,0,0,0|2,0,0]=4 6830 B13R1.4928 CCC(C)Sc1c(cccc1Br)C 62a_100000758301_100010141302 [1,1,0,0,0,0|1,1,0]=4 6831 B13R1.4928 CCC(C)Sc1c(cccc1Br)C 62a_100010141302_100000758301 [1,1,0,0,0,0|1,1,0]=4 6832 B13R1.4928 CCC(C)Sc1c(cccc1C)C 62a_100000033847_100000758301 [1,1,0,0,0,0|0,1,0]=3 6833 B13R1.4928 CCC(C)Sc1c(cccc1C)C 62a_100000758301_100000033847 [1,1,0,0,0,0|0,1,0]=3 6834 B13R1.4928 CCC(C)Sc1c(cccc1Cl)C 62a_100000043165_100000758301 [1,1,0,0,0,0|1,1,0]=4 6835 B13R1.4928 CCC(C)Sc1c(cccc1Cl)C 62a_100000758301_100000043165 [1,1,0,0,0,0|1,1,0]=4 6836 B13R1.4928 CCC(C)Sc1c(cccc1F)C 62a_100000758301_100011218421 [1,1,0,0,0,0|1,1,0]=4 6837 B13R1.4928 CCC(C)Sc1c(cccc1F)C 62a_100011218421_100000758301 [1,1,0,0,0,0|1,1,0]=4 6838 B13R1.4928 CCC(C)Sc1c(cccc1N)C 62a_100000684715_100000758301 [1,1,0,0,0,0|1,1,0]=4 6839 B13R1.4928 CCC(C)Sc1c(cccc1N)C 62a_100000758301_100000684715 [1,1,0,0,0,0|1,1,0]=4 6840 B13R1.4928 CCC(C)Sc1c(cccc1O)C 62a_100000686692_100000758301 [1,1,0,0,0,0|1,1,0]=4 6841 B13R1.4928 CCC(C)Sc1c(cccc1O)C 62a_100000758301_100000686692 [1,1,0,0,0,0|1,1,0]=4 6842 B13R1.4928 CCC(C)Sc1c(ccnc1C)C 62a_100000758301_100012000501 [1,1,0,0,0,0|1,1,0]=4 6843 B13R1.4928 CCC(C)Sc1c(ccnc1C)C 62a_100012000501_100000758301 [1,1,0,0,0,0|1,1,0]=4 6844 B13R1.4928 CCC(C)Sc1c(cncc1C)C 62a_100000758301_100009817138 [1,1,0,0,0,0|1,1,0]=4 6845 B13R1.4928 CCC(C)Sc1c(cncc1C)C 62a_100009817138_100000758301 [1,1,0,0,0,0|1,1,0]=4 6846 B13R1.4928 CCN(C)Cc1c(cccc1C)C 2230a_100000225621_100000758300 [1,1,0,0,0,0|2,0,0]=4 6847 B13R1.4928 CCN(C)Cc1c(cccc1C)C 269982a_100000225621_100000758300 [1,1,0,0,0,0|2,0,0]=4 6848 B13R1.4928 COC(C)Sc1c(cccc1C)C 62a_100000033847_100009879195 [1,1,0,0,0,0|1,1,0]=4 6849 B13R1.4928 COC(C)Sc1c(cccc1C)C 62a_100009879195_100000033847 [1,1,0,0,0,0|1,1,0]=4 6850 B13R1.4928 Cc1cccc(c1NC(C)CO)C 34a_100000185769_100012180447 [1,1,0,0,0,0|2,0,0]=4 6851 B13R1.4928 Cc1cccc(c1OC(C)C#N)C 7a_100000210341_100000703298 [1,1,0,0,0,0|0,0,2]=4 6852 B13R1.4928 Cc1cccc(c1OC(C)CO)Br 34a_100009817157_100012180447 [1,1,0,0,0,0|2,0,0]=4 6853 B13R1.4928 Cc1cccc(c1OC(C)CO)Br 7a_100009817157_100012180447 [1,1,0,0,0,0|2,0,0]=4 6854 B13R1.4928 Cc1cccc(c1OC(C)CO)C 34a_100000210341_100012180447 [1,1,0,0,0,0|1,0,0]=3 6855 B13R1.4928 Cc1cccc(c1OC(C)CO)C 7a_100000210341_100012180447 [1,1,0,0,0,0|1,0,0]=3 6856 B13R1.4928 Cc1cccc(c1OC(C)CO)Cl 34a_100000033731_100012180447 [1,1,0,0,0,0|2,0,0]=4 6857 B13R1.4928 Cc1cccc(c1OC(C)CO)Cl 7a_100000033731_100012180447 [1,1,0,0,0,0|2,0,0]=4 6858 B13R1.4928 Cc1cccc(c1OC(C)CO)F 34a_100011659162_100012180447 [1,1,0,0,0,0|2,0,0]=4 6859 B13R1.4928 Cc1cccc(c1OC(C)CO)F 7a_100011659162_100012180447 [1,1,0,0,0,0|2,0,0]=4 6860 B13R1.4928 Cc1cccc(c1OC(C)CO)N 34a_100000756359_100012180447 [1,1,0,0,0,0|2,0,0]=4 6861 B13R1.4928 Cc1cccc(c1OC(C)CO)N 7a_100000756359_100012180447 [1,1,0,0,0,0|2,0,0]=4 6862 B13R1.4928 Cc1cccc(c1SC(C)CO)C 62a_100012180447_100000033847 [1,1,0,0,0,0|1,1,0]=4 6863 B13R1.4928 Cc1cccc(c1S[C@H](C)CO)C 62a_100000033847_100016084084 [1,1,0,0,0,0|1,1,0]=4 6864 B13R1.4928 Cc1cccc(c1S[C@H](C)CO)C 62a_100016084084_100000033847 [1,1,0,0,0,0|1,1,0]=4 6865 B13R1.4928 Cc1ccnc(c1OC(C)CO)C 34a_100011934651_100012180447 [1,1,0,0,0,0|2,0,0]=4 6866 B13R1.4928 Cc1ccnc(c1OC(C)CO)C 7a_100011934651_100012180447 [1,1,0,0,0,0|2,0,0]=4 6867 B13R1.8919 C#CCCNc1c(cccc1C)C 34a_100000185769_100000688953 [1,1,0,0,0,0|1,0,1]=4 6868 B13R1.8919 C#CCCOc1c(cccc1Br)C 34a_100009817157_100000688953 [1,1,0,0,0,0|1,0,1]=4 6869 B13R1.8919 C#CCCOc1c(cccc1Br)C 7a_100009817157_100000688953 [1,1,0,0,0,0|1,0,1]=4 6870 B13R1.8919 C#CCCOc1c(cccc1C)C 34a_100000210341_100000688953 [1,1,0,0,0,0|0,0,1]=3 6871 B13R1.8919 C#CCCOc1c(cccc1C)C 7a_100000210341_100000688953 [1,1,0,0,0,0|0,0,1]=3 6872 B13R1.8919 C#CCCOc1c(cccc1Cl)C 34a_100000033731_100000688953 [1,1,0,0,0,0|1,0,1]=4 6873 B13R1.8919 C#CCCOc1c(cccc1Cl)C 7a_100000033731_100000688953 [1,1,0,0,0,0|1,0,1]=4 6874 B13R1.8919 C#CCCOc1c(cccc1F)C 34a_100011659162_100000688953 [1,1,0,0,0,0|1,0,1]=4 6875 B13R1.8919 C#CCCOc1c(cccc1F)C 7a_100011659162_100000688953 [1,1,0,0,0,0|1,0,1]=4 6876 B13R1.8919 C#CCCOc1c(cccc1N)C 34a_100000756359_100000688953 [1,1,0,0,0,0|1,0,1]=4 6877 B13R1.8919 C#CCCOc1c(cccc1N)C 7a_100000756359_100000688953 [1,1,0,0,0,0|1,0,1]=4 6878 B13R1.8919 C#CCCOc1c(ccnc1C)C 34a_100011934651_100000688953 [1,1,0,0,0,0|1,0,1]=4 6879 B13R1.8919 C#CCCOc1c(ccnc1C)C 7a_100011934651_100000688953 [1,1,0,0,0,0|1,0,1]=4 6880 B13R1.8919 C#CCCSc1c(cccc1C)C 62a_100000033847_100000688953 [1,1,0,0,0,0|0,1,1]=4 6881 B13R1.8919 C#CCCSc1c(cccc1C)C 62a_100000688953_100000033847 [1,1,0,0,0,0|0,1,1]=4 6882 B13R1.8919 C#CCOCc1c(cccc1C)C 34a_100000210247_100000758300 [1,1,0,0,0,0|0,0,2]=4 6883 B13R1.8919 C#CCOCc1c(cccc1C)C 34a_100011933981_100000184674 [1,1,0,0,0,0|0,0,2]=4 6884 B13R1.8919 C#CCOCc1c(cccc1C)C 7a_100011933981_100000038162 [1,1,0,0,0,0|0,0,2]=4 6885 B13R1.8919 C/C=C/CNc1c(cccc1C)C 34a_100000185769_100102629194 [1,1,0,0,0,0|1,0,1]=4 6886 B13R1.8919 C/C=C/COc1c(cccc1Br)C 34a_100009817157_100102629194 [1,1,0,0,0,0|1,0,1]=4 6887 B13R1.8919 C/C=C/COc1c(cccc1Br)C 7a_100009817157_100102629194 [1,1,0,0,0,0|1,0,1]=4 6888 B13R1.8919 C/C=C/COc1c(cccc1C)C 34a_100000210341_100102629194 [1,1,0,0,0,0|0,0,1]=3 6889 B13R1.8919 C/C=C/COc1c(cccc1C)C 7a_100000210341_100102629194 [1,1,0,0,0,0|0,0,1]=3 6890 B13R1.8919 C/C=C/COc1c(cccc1Cl)C 34a_100000033731_100102629194 [1,1,0,0,0,0|1,0,1]=4 6891 B13R1.8919 C/C=C/COc1c(cccc1Cl)C 7a_100000033731_100102629194 [1,1,0,0,0,0|1,0,1]=4 6892 B13R1.8919 C/C=C/COc1c(cccc1F)C 34a_100011659162_100102629194 [1,1,0,0,0,0|1,0,1]=4 6893 B13R1.8919 C/C=C/COc1c(cccc1F)C 7a_100011659162_100102629194 [1,1,0,0,0,0|1,0,1]=4 6894 B13R1.8919 C/C=C/COc1c(cccc1N)C 34a_100000756359_100102629194 [1,1,0,0,0,0|1,0,1]=4 6895 B13R1.8919 C/C=C/COc1c(cccc1N)C 7a_100000756359_100102629194 [1,1,0,0,0,0|1,0,1]=4 6896 B13R1.8919 C/C=C/COc1c(ccnc1C)C 34a_100011934651_100102629194 [1,1,0,0,0,0|1,0,1]=4 6897 B13R1.8919 C/C=C/COc1c(ccnc1C)C 7a_100011934651_100102629194 [1,1,0,0,0,0|1,0,1]=4 6898 B13R1.8919 C/C=C/CSc1c(cccc1C)C 62a_100000033847_100102629194 [1,1,0,0,0,0|0,1,1]=4 6899 B13R1.8919 C/C=C/CSc1c(cccc1C)C 62a_100102629194_100000033847 [1,1,0,0,0,0|0,1,1]=4 6900 B13R1.8919 C=CCCNc1c(cccc1C)C 34a_100000185769_100000754431 [1,1,0,0,0,0|1,0,1]=4 6901 B13R1.8919 C=CCCOc1c(cccc1Br)C 34a_100009817157_100000754431 [1,1,0,0,0,0|1,0,1]=4 6902 B13R1.8919 C=CCCOc1c(cccc1Br)C 7a_100009817157_100000754431 [1,1,0,0,0,0|1,0,1]=4 6903 B13R1.8919 C=CCCOc1c(cccc1C)C 34a_100000210341_100000754431 [1,1,0,0,0,0|0,0,1]=3 6904 B13R1.8919 C=CCCOc1c(cccc1C)C 7a_100000210341_100000754431 [1,1,0,0,0,0|0,0,1]=3 6905 B13R1.8919 C=CCCOc1c(cccc1Cl)C 34a_100000033731_100000754431 [1,1,0,0,0,0|1,0,1]=4 6906 B13R1.8919 C=CCCOc1c(cccc1Cl)C 7a_100000033731_100000754431 [1,1,0,0,0,0|1,0,1]=4 6907 B13R1.8919 C=CCCOc1c(cccc1F)C 34a_100011659162_100000754431 [1,1,0,0,0,0|1,0,1]=4 6908 B13R1.8919 C=CCCOc1c(cccc1F)C 7a_100011659162_100000754431 [1,1,0,0,0,0|1,0,1]=4 6909 B13R1.8919 C=CCCOc1c(cccc1N)C 34a_100000756359_100000754431 [1,1,0,0,0,0|1,0,1]=4 6910 B13R1.8919 C=CCCOc1c(cccc1N)C 7a_100000756359_100000754431 [1,1,0,0,0,0|1,0,1]=4 6911 B13R1.8919 C=CCCOc1c(ccnc1C)C 34a_100011934651_100000754431 [1,1,0,0,0,0|1,0,1]=4 6912 B13R1.8919 C=CCCOc1c(ccnc1C)C 7a_100011934651_100000754431 [1,1,0,0,0,0|1,0,1]=4 6913 B13R1.8919 C=CCCSc1c(cccc1C)C 62a_100000033847_100000754431 [1,1,0,0,0,0|0,1,1]=4 6914 B13R1.8919 C=CCCSc1c(cccc1C)C 62a_100000754431_100000033847 [1,1,0,0,0,0|0,1,1]=4 6915 B13R1.8919 C=CCOCc1c(cccc1C)C 34a_100011933981_100015514636 [1,1,0,0,0,0|0,0,2]=4 6916 B13R1.8919 C=CCOCc1c(cccc1C)C 34a_200000210373_100000758300 [1,1,0,0,0,0|0,0,2]=4 6917 B13R1.8919 C=CCOCc1c(cccc1C)C 7a_100011933981_100015514636 [1,1,0,0,0,0|0,0,2]=4 6918 B13R1.8919 CC#CCNc1c(cccc1C)C 34a_100000185769_100000748600 [1,1,0,0,0,0|1,0,1]=4 6919 B13R1.8919 CC#CCOc1c(cccc1Br)C 34a_100009817157_100000748600 [1,1,0,0,0,0|1,0,1]=4 6920 B13R1.8919 CC#CCOc1c(cccc1Br)C 7a_100009817157_100000748600 [1,1,0,0,0,0|1,0,1]=4 6921 B13R1.8919 CC#CCOc1c(cccc1C)C 34a_100000210341_100000748600 [1,1,0,0,0,0|0,0,1]=3 6922 B13R1.8919 CC#CCOc1c(cccc1C)C 7a_100000210341_100000748600 [1,1,0,0,0,0|0,0,1]=3 6923 B13R1.8919 CC#CCOc1c(cccc1Cl)C 34a_100000033731_100000748600 [1,1,0,0,0,0|1,0,1]=4 6924 B13R1.8919 CC#CCOc1c(cccc1Cl)C 7a_100000033731_100000748600 [1,1,0,0,0,0|1,0,1]=4 6925 B13R1.8919 CC#CCOc1c(cccc1F)C 34a_100011659162_100000748600 [1,1,0,0,0,0|1,0,1]=4 6926 B13R1.8919 CC#CCOc1c(cccc1F)C 7a_100011659162_100000748600 [1,1,0,0,0,0|1,0,1]=4 6927 B13R1.8919 CC#CCOc1c(cccc1N)C 34a_100000756359_100000748600 [1,1,0,0,0,0|1,0,1]=4 6928 B13R1.8919 CC#CCOc1c(cccc1N)C 7a_100000756359_100000748600 [1,1,0,0,0,0|1,0,1]=4 6929 B13R1.8919 CC#CCOc1c(ccnc1C)C 34a_100011934651_100000748600 [1,1,0,0,0,0|1,0,1]=4 6930 B13R1.8919 CC#CCOc1c(ccnc1C)C 7a_100011934651_100000748600 [1,1,0,0,0,0|1,0,1]=4 6931 B13R1.8919 CC#CCSc1c(cccc1C)C 62a_100000033847_100000748600 [1,1,0,0,0,0|0,1,1]=4 6932 B13R1.8919 CC#CCSc1c(cccc1C)C 62a_100000748600_100000033847 [1,1,0,0,0,0|0,1,1]=4 6933 B13R1.8919 CC=CCNc1c(cccc1C)C 34a_100000185769_100000070051 [1,1,0,0,0,0|1,0,1]=4 6934 B13R1.8919 CC=CCOc1c(cccc1Br)C 34a_100009817157_100000070051 [1,1,0,0,0,0|1,0,1]=4 6935 B13R1.8919 CC=CCOc1c(cccc1Br)C 7a_100009817157_100000070051 [1,1,0,0,0,0|1,0,1]=4 6936 B13R1.8919 CC=CCOc1c(cccc1C)C 34a_100000210341_100000070051 [1,1,0,0,0,0|0,0,1]=3 6937 B13R1.8919 CC=CCOc1c(cccc1C)C 7a_100000210341_100000070051 [1,1,0,0,0,0|0,0,1]=3 6938 B13R1.8919 CC=CCOc1c(cccc1Cl)C 34a_100000033731_100000070051 [1,1,0,0,0,0|1,0,1]=4 6939 B13R1.8919 CC=CCOc1c(cccc1Cl)C 7a_100000033731_100000070051 [1,1,0,0,0,0|1,0,1]=4 6940 B13R1.8919 CC=CCOc1c(cccc1F)C 34a_100011659162_100000070051 [1,1,0,0,0,0|1,0,1]=4 6941 B13R1.8919 CC=CCOc1c(cccc1F)C 7a_100011659162_100000070051 [1,1,0,0,0,0|1,0,1]=4 6942 B13R1.8919 CC=CCOc1c(cccc1N)C 34a_100000756359_100000070051 [1,1,0,0,0,0|1,0,1]=4 6943 B13R1.8919 CC=CCOc1c(cccc1N)C 7a_100000756359_100000070051 [1,1,0,0,0,0|1,0,1]=4 6944 B13R1.8919 CC=CCOc1c(ccnc1C)C 34a_100011934651_100000070051 [1,1,0,0,0,0|1,0,1]=4 6945 B13R1.8919 CC=CCOc1c(ccnc1C)C 7a_100011934651_100000070051 [1,1,0,0,0,0|1,0,1]=4 6946 B13R1.8919 CC=CCSc1c(cccc1C)C 62a_100000033847_100000070051 [1,1,0,0,0,0|0,1,1]=4 6947 B13R1.8919 CC=CCSc1c(cccc1C)C 62a_100000070051_100000033847 [1,1,0,0,0,0|0,1,1]=4 6948 B13R1.8919 CCC=NNc1c(cccc1C)C 4a_100016987787_100000210100 [1,1,0,0,0,0|1,0,1]=4 6949 B13R1.8919 CCCC=Cc1c(cccc1C)C 271570a_100016258520_100000033847 [1,1,0,0,0,0|1,0,0]=3 6950 B13R1.8919 CCCC=Cc1c(cccc1Cl)C 271570a_100016258520_100000043165 [1,1,0,0,0,0|2,0,0]=4 6951 B13R1.8919 CCCC=Cc1c(cccc1F)C 271570a_100016258520_100012349962 [1,1,0,0,0,0|2,0,0]=4 6952 B13R1.8919 CCCC=Cc1c(cccc1N)C 271570a_100016258520_100000684715 [1,1,0,0,0,0|2,0,0]=4 6953 B13R1.8919 CCCC=Cc1c(cccc1O)C 271570a_100016258520_100000686692 [1,1,0,0,0,0|2,0,0]=4 6954 B13R1.8919 CCCC=Cc1c(ccnc1C)C 271570a_100016258520_100012000501 [1,1,0,0,0,0|2,0,0]=4 6955 B13R1.8919 CCCC=Cc1c(cncc1C)C 271570a_100016258520_100009817138 [1,1,0,0,0,0|2,0,0]=4 6956 B13R1.8919 CCCCNc1c(cccc1Br)C 34a_100011834072_100000210210 [1,1,0,0,0,0|2,0,0]=4 6957 B13R1.8919 CCCCNc1c(cccc1C)C 34a_100000185769_100000210210 [1,1,0,0,0,0|1,0,0]=3 6958 B13R1.8919 CCCCNc1c(cccc1Cl)C 34a_100000756524_100000210210 [1,1,0,0,0,0|2,0,0]=4 6959 B13R1.8919 CCCCNc1c(cccc1F)C 34a_100000766463_100000210210 [1,1,0,0,0,0|2,0,0]=4 6960 B13R1.8919 CCCCNc1c(cccc1O)C 34a_100000743429_100000210210 [1,1,0,0,0,0|2,0,0]=4 6961 B13R1.8919 CCCCOc1c(cccc1Br)Br 34a_100000736428_100000210210 [1,1,0,0,0,0|2,0,0]=4 6962 B13R1.8919 CCCCOc1c(cccc1Br)Br 7a_100000736428_100000210211 [1,1,0,0,0,0|2,0,0]=4 6963 B13R1.8919 CCCCOc1c(cccc1Br)C 34a_100009817157_100000210210 [1,1,0,0,0,0|1,0,0]=3 6964 B13R1.8919 CCCCOc1c(cccc1Br)C 7a_100009817157_100000210211 [1,1,0,0,0,0|1,0,0]=3 6965 B13R1.8919 CCCCOc1c(cccc1Br)Cl 34a_100010214474_100000210210 [1,1,0,0,0,0|2,0,0]=4 6966 B13R1.8919 CCCCOc1c(cccc1Br)Cl 7a_100010214474_100000210211 [1,1,0,0,0,0|2,0,0]=4 6967 B13R1.8919 CCCCOc1c(cccc1Br)F 34a_100009813666_100000210210 [1,1,0,0,0,0|2,0,0]=4 6968 B13R1.8919 CCCCOc1c(cccc1Br)F 7a_100009813666_100000210211 [1,1,0,0,0,0|2,0,0]=4 6969 B13R1.8919 CCCCOc1c(cccc1Br)N 34a_100011934915_100000210210 [1,1,0,0,0,0|2,0,0]=4 6970 B13R1.8919 CCCCOc1c(cccc1C)C 34a_100000210341_100000210210 [1,1,0,0,0,0|0,0,0]=2 6971 B13R1.8919 CCCCOc1c(cccc1C)C 7a_100000210341_100000210211 [1,1,0,0,0,0|0,0,0]=2 6972 B13R1.8919 CCCCOc1c(cccc1Cl)C 34a_100000033731_100000210210 [1,1,0,0,0,0|1,0,0]=3 6973 B13R1.8919 CCCCOc1c(cccc1Cl)C 7a_100000033731_100000210211 [1,1,0,0,0,0|1,0,0]=3 6974 B13R1.8919 CCCCOc1c(cccc1Cl)Cl 34a_100000211709_100000210210 [1,1,0,0,0,0|2,0,0]=4 6975 B13R1.8919 CCCCOc1c(cccc1Cl)Cl 7a_100000211709_100000210211 [1,1,0,0,0,0|2,0,0]=4 6976 B13R1.8919 CCCCOc1c(cccc1Cl)F 34a_100000694953_100000210210 [1,1,0,0,0,0|2,0,0]=4 6977 B13R1.8919 CCCCOc1c(cccc1Cl)F 7a_100000694953_100000210211 [1,1,0,0,0,0|2,0,0]=4 6978 B13R1.8919 CCCCOc1c(cccc1Cl)N 34a_100000754742_100000210210 [1,1,0,0,0,0|2,0,0]=4 6979 B13R1.8919 CCCCOc1c(cccc1F)C 34a_100011659162_100000210210 [1,1,0,0,0,0|1,0,0]=3 6980 B13R1.8919 CCCCOc1c(cccc1F)C 7a_100011659162_100000210211 [1,1,0,0,0,0|1,0,0]=3 6981 B13R1.8919 CCCCOc1c(cccc1F)F 34a_100000230165_100000210210 [1,1,0,0,0,0|2,0,0]=4 6982 B13R1.8919 CCCCOc1c(cccc1F)F 7a_100000230165_100000210211 [1,1,0,0,0,0|2,0,0]=4 6983 B13R1.8919 CCCCOc1c(cccc1F)N 34a_100011934987_100000210210 [1,1,0,0,0,0|2,0,0]=4 6984 B13R1.8919 CCCCOc1c(cccc1I)Br 34a_100010084509_100000210210 [1,1,0,0,0,0|2,0,0]=4 6985 B13R1.8919 CCCCOc1c(cccc1I)Br 7a_100010084509_100000210211 [1,1,0,0,0,0|2,0,0]=4 6986 B13R1.8919 CCCCOc1c(cccc1I)Cl 34a_100010202889_100000210210 [1,1,0,0,0,0|2,0,0]=4 6987 B13R1.8919 CCCCOc1c(cccc1I)Cl 7a_100010202889_100000210211 [1,1,0,0,0,0|2,0,0]=4 6988 B13R1.8919 CCCCOc1c(cccc1I)F 34a_100010186298_100000210210 [1,1,0,0,0,0|2,0,0]=4 6989 B13R1.8919 CCCCOc1c(cccc1I)F 7a_100010186298_100000210211 [1,1,0,0,0,0|2,0,0]=4 6990 B13R1.8919 CCCCOc1c(cccc1I)N 34a_100010084371_100000210210 [1,1,0,0,0,0|2,0,0]=4 6991 B13R1.8919 CCCCOc1c(cccc1N)C 34a_100000756359_100000210210 [1,1,0,0,0,0|1,0,0]=3 6992 B13R1.8919 CCCCOc1c(cccc1N)C 7a_100000756359_100000210211 [1,1,0,0,0,0|1,0,0]=3 6993 B13R1.8919 CCCCOc1c(cccc1N)N 34a_200016994477_100000210210 [1,1,0,0,0,0|2,0,0]=4 6994 B13R1.8919 CCCCOc1c(ccnc1C)C 34a_100011934651_100000210210 [1,1,0,0,0,0|1,0,0]=3 6995 B13R1.8919 CCCCOc1c(ccnc1C)C 7a_100011934651_100000210211 [1,1,0,0,0,0|1,0,0]=3 6996 B13R1.8919 CCCCOc1c(ccnc1Cl)C 34a_100000696282_100000210210 [1,1,0,0,0,0|2,0,0]=4 6997 B13R1.8919 CCCCOc1c(ccnc1Cl)C 7a_100000696282_100000210211 [1,1,0,0,0,0|2,0,0]=4 6998 B13R1.8919 CCCCOc1c(ncnc1C)C 34a_100009878406_100000210210 [1,1,0,0,0,0|2,0,0]=4 6999 B13R1.8919 CCCCOc1c(ncnc1C)C 7a_100009878406_100000210211 [1,1,0,0,0,0|2,0,0]=4 7000 B13R1.8919 CCCCOc1c(occc1=O)C 34a_100000031901_100000210210 [1,1,0,0,0,0|2,0,0]=4 7001 B13R1.8919 CCCCSc1c(cccc1Br)C 62a_100000210211_100010141302 [1,1,0,0,0,0|1,1,0]=4 7002 B13R1.8919 CCCCSc1c(cccc1Br)C 62a_100010141302_100000210210 [1,1,0,0,0,0|1,1,0]=4 7003 B13R1.8919 CCCCSc1c(cccc1C)C 62a_100000033847_100000210210 [1,1,0,0,0,0|0,1,0]=3 7004 B13R1.8919 CCCCSc1c(cccc1C)C 62a_100000210211_100000033847 [1,1,0,0,0,0|0,1,0]=3 7005 B13R1.8919 CCCCSc1c(cccc1Cl)C 62a_100000043165_100000210210 [1,1,0,0,0,0|1,1,0]=4 7006 B13R1.8919 CCCCSc1c(cccc1Cl)C 62a_100000210211_100000043165 [1,1,0,0,0,0|1,1,0]=4 7007 B13R1.8919 CCCCSc1c(cccc1F)C 62a_100000210211_100011218421 [1,1,0,0,0,0|1,1,0]=4 7008 B13R1.8919 CCCCSc1c(cccc1F)C 62a_100011218421_100000210210 [1,1,0,0,0,0|1,1,0]=4 7009 B13R1.8919 CCCCSc1c(cccc1N)C 62a_100000210211_100000684715 [1,1,0,0,0,0|1,1,0]=4 7010 B13R1.8919 CCCCSc1c(cccc1N)C 62a_100000684715_100000210210 [1,1,0,0,0,0|1,1,0]=4 7011 B13R1.8919 CCCCSc1c(cccc1O)C 62a_100000210211_100000686692 [1,1,0,0,0,0|1,1,0]=4 7012 B13R1.8919 CCCCSc1c(cccc1O)C 62a_100000686692_100000210210 [1,1,0,0,0,0|1,1,0]=4 7013 B13R1.8919 CCCCSc1c(ccnc1C)C 62a_100000210211_100012000501 [1,1,0,0,0,0|1,1,0]=4 7014 B13R1.8919 CCCCSc1c(ccnc1C)C 62a_100012000501_100000210210 [1,1,0,0,0,0|1,1,0]=4 7015 B13R1.8919 CCCCSc1c(cncc1C)C 62a_100000210211_100009817138 [1,1,0,0,0,0|1,1,0]=4 7016 B13R1.8919 CCCCSc1c(cncc1C)C 62a_100009817138_100000210210 [1,1,0,0,0,0|1,1,0]=4 7017 B13R1.8919 CCCNCc1c(cccc1Br)C 207a_100020643023_100009881667 [1,1,0,0,0,0|2,0,0]=4 7018 B13R1.8919 CCCNCc1c(cccc1Br)C 270004a_100020643023_100009881667 [1,1,0,0,0,0|2,0,0]=4 7019 B13R1.8919 CCCNCc1c(cccc1C)C 207a_100020643023_100000758299 [1,1,0,0,0,0|1,0,0]=3 7020 B13R1.8919 CCCNCc1c(cccc1C)C 270004a_100020643023_100000758299 [1,1,0,0,0,0|1,0,0]=3 7021 B13R1.8919 CCCNCc1c(cccc1C)C 34a_100000689800_100000210303 [1,1,0,0,0,0|1,0,0]=3 7022 B13R1.8919 CCCNCc1c(cccc1Cl)C 207a_100020643023_100000041122 [1,1,0,0,0,0|2,0,0]=4 7023 B13R1.8919 CCCNCc1c(cccc1Cl)C 270004a_100020643023_100000041122 [1,1,0,0,0,0|2,0,0]=4 7024 B13R1.8919 CCCNCc1c(cccc1F)C 207a_100020643023_100000069827 [1,1,0,0,0,0|2,0,0]=4 7025 B13R1.8919 CCCNCc1c(cccc1F)C 270004a_100020643023_100000069827 [1,1,0,0,0,0|2,0,0]=4 7026 B13R1.8919 CCCNCc1c(cccc1F)C 34a_100000762012_100000210303 [1,1,0,0,0,0|2,0,0]=4 7027 B13R1.8919 CCCOCc1c(cccc1Br)Br 34a_100010172814_100000210303 [1,1,0,0,0,0|2,0,0]=4 7028 B13R1.8919 CCCOCc1c(cccc1Br)Br 7a_100010172814_100000210303 [1,1,0,0,0,0|2,0,0]=4 7029 B13R1.8919 CCCOCc1c(cccc1Br)C 34a_100000210258_100010146847 [1,1,0,0,0,0|1,0,0]=3 7030 B13R1.8919 CCCOCc1c(cccc1Br)Cl 34a_100000210258_100010138402 [1,1,0,0,0,0|2,0,0]=4 7031 B13R1.8919 CCCOCc1c(cccc1Br)F 34a_100000210258_100012145669 [1,1,0,0,0,0|2,0,0]=4 7032 B13R1.8919 CCCOCc1c(cccc1Br)F 34a_100012355691_100000210303 [1,1,0,0,0,0|2,0,0]=4 7033 B13R1.8919 CCCOCc1c(cccc1Br)F 7a_100012355691_100000210303 [1,1,0,0,0,0|2,0,0]=4 7034 B13R1.8919 CCCOCc1c(cccc1Br)N 34a_100000747656_100000210303 [1,1,0,0,0,0|2,0,0]=4 7035 B13R1.8919 CCCOCc1c(cccc1C)C 34a_100000210258_100000758300 [1,1,0,0,0,0|0,0,0]=2 7036 B13R1.8919 CCCOCc1c(cccc1C)C 34a_100011933981_100000210303 [1,1,0,0,0,0|0,0,0]=2 7037 B13R1.8919 CCCOCc1c(cccc1C)C 7a_100011933981_100000210303 [1,1,0,0,0,0|0,0,0]=2 7038 B13R1.8919 CCCOCc1c(cccc1Cl)C 34a_100000082531_100000210303 [1,1,0,0,0,0|1,0,0]=3 7039 B13R1.8919 CCCOCc1c(cccc1Cl)C 7a_100000082531_100000210303 [1,1,0,0,0,0|1,0,0]=3 7040 B13R1.8919 CCCOCc1c(cccc1Cl)Cl 34a_100000210258_100000187851 [1,1,0,0,0,0|2,0,0]=4 7041 B13R1.8919 CCCOCc1c(cccc1Cl)Cl 34a_100000215722_100000210303 [1,1,0,0,0,0|2,0,0]=4 7042 B13R1.8919 CCCOCc1c(cccc1Cl)Cl 7a_100000215722_100000210303 [1,1,0,0,0,0|2,0,0]=4 7043 B13R1.8919 CCCOCc1c(cccc1Cl)F 34a_100000210258_100000187852 [1,1,0,0,0,0|2,0,0]=4 7044 B13R1.8919 CCCOCc1c(cccc1Cl)F 34a_100000215723_100000210303 [1,1,0,0,0,0|2,0,0]=4 7045 B13R1.8919 CCCOCc1c(cccc1Cl)F 7a_100000215723_100000210303 [1,1,0,0,0,0|2,0,0]=4 7046 B13R1.8919 CCCOCc1c(cccc1Cl)N 34a_100011916388_100000210303 [1,1,0,0,0,0|2,0,0]=4 7047 B13R1.8919 CCCOCc1c(cccc1F)C 34a_100000057874_100000210303 [1,1,0,0,0,0|1,0,0]=3 7048 B13R1.8919 CCCOCc1c(cccc1F)C 34a_100000210258_100009814554 [1,1,0,0,0,0|1,0,0]=3 7049 B13R1.8919 CCCOCc1c(cccc1F)C 7a_100000057874_100000210303 [1,1,0,0,0,0|1,0,0]=3 7050 B13R1.8919 CCCOCc1c(cccc1F)F 34a_100000210258_100000698325 [1,1,0,0,0,0|2,0,0]=4 7051 B13R1.8919 CCCOCc1c(cccc1F)F 34a_100000698215_100000210303 [1,1,0,0,0,0|2,0,0]=4 7052 B13R1.8919 CCCOCc1c(cccc1F)F 7a_100000698215_100000210303 [1,1,0,0,0,0|2,0,0]=4 7053 B13R1.8919 CCCOCc1c(cccc1F)N 34a_100011846719_100000210303 [1,1,0,0,0,0|2,0,0]=4 7054 B13R1.8919 CCCOCc1c(cccc1I)Br 34a_100000210258_100010146611 [1,1,0,0,0,0|2,0,0]=4 7055 B13R1.8919 CCCOCc1c(cccc1I)C 34a_100000210258_100010150146 [1,1,0,0,0,0|1,0,0]=3 7056 B13R1.8919 CCCOCc1c(cccc1I)F 34a_100000210258_100010149602 [1,1,0,0,0,0|2,0,0]=4 7057 B13R1.8919 CCCOCc1c(cccc1I)F 34a_100010214973_100000210303 [1,1,0,0,0,0|2,0,0]=4 7058 B13R1.8919 CCCOCc1c(cccc1I)F 7a_100010214973_100000210303 [1,1,0,0,0,0|2,0,0]=4 7059 B13R1.8919 CCCSCc1c(cccc1Br)C 62a_100000210303_100010146847 [1,1,0,0,0,0|1,1,0]=4 7060 B13R1.8919 CCCSCc1c(cccc1Br)C 62a_100010146847_100000210303 [1,1,0,0,0,0|1,1,0]=4 7061 B13R1.8919 CCCSCc1c(cccc1C)C 62a_100000210303_100000758300 [1,1,0,0,0,0|0,1,0]=3 7062 B13R1.8919 CCCSCc1c(cccc1C)C 62a_100000758300_100000210303 [1,1,0,0,0,0|0,1,0]=3 7063 B13R1.8919 CCCSCc1c(cccc1F)C 62a_100000210303_100009814554 [1,1,0,0,0,0|1,1,0]=4 7064 B13R1.8919 CCCSCc1c(cccc1F)C 62a_100009814554_100000210303 [1,1,0,0,0,0|1,1,0]=4 7065 B13R1.8919 CCCSCc1c(cccc1I)C 62a_100000210303_100010150146 [1,1,0,0,0,0|1,1,0]=4 7066 B13R1.8919 CCCSCc1c(cccc1I)C 62a_100010150146_100000210303 [1,1,0,0,0,0|1,1,0]=4 7067 B13R1.8919 CCNN=Cc1c(cccc1C)C 4a_100000756455_100000758299 [1,1,0,0,0,0|2,0,0]=4 7068 B13R1.8919 CCOC=Cc1c(cccc1C)C 271570a_100016256518_100000033847 [1,1,0,0,0,0|1,0,1]=4 7069 B13R1.8919 CCOCSc1c(cccc1Br)C 62a_100000739092_100010141302 [1,1,0,0,0,0|1,1,0]=4 7070 B13R1.8919 CCOCSc1c(cccc1Br)C 62a_100010141302_100000739092 [1,1,0,0,0,0|1,1,0]=4 7071 B13R1.8919 CCOCSc1c(cccc1C)C 62a_100000033847_100000739092 [1,1,0,0,0,0|0,1,0]=3 7072 B13R1.8919 CCOCSc1c(cccc1C)C 62a_100000739092_100000033847 [1,1,0,0,0,0|0,1,0]=3 7073 B13R1.8919 CCOCSc1c(cccc1Cl)C 62a_100000043165_100000739092 [1,1,0,0,0,0|1,1,0]=4 7074 B13R1.8919 CCOCSc1c(cccc1Cl)C 62a_100000739092_100000043165 [1,1,0,0,0,0|1,1,0]=4 7075 B13R1.8919 CCOCSc1c(cccc1F)C 62a_100000739092_100011218421 [1,1,0,0,0,0|1,1,0]=4 7076 B13R1.8919 CCOCSc1c(cccc1F)C 62a_100011218421_100000739092 [1,1,0,0,0,0|1,1,0]=4 7077 B13R1.8919 CCOCSc1c(cccc1N)C 62a_100000684715_100000739092 [1,1,0,0,0,0|1,1,0]=4 7078 B13R1.8919 CCOCSc1c(cccc1N)C 62a_100000739092_100000684715 [1,1,0,0,0,0|1,1,0]=4 7079 B13R1.8919 CCOCSc1c(cccc1O)C 62a_100000686692_100000739092 [1,1,0,0,0,0|1,1,0]=4 7080 B13R1.8919 CCOCSc1c(cccc1O)C 62a_100000739092_100000686692 [1,1,0,0,0,0|1,1,0]=4 7081 B13R1.8919 CCOCSc1c(ccnc1C)C 62a_100000739092_100012000501 [1,1,0,0,0,0|1,1,0]=4 7082 B13R1.8919 CCOCSc1c(ccnc1C)C 62a_100012000501_100000739092 [1,1,0,0,0,0|1,1,0]=4 7083 B13R1.8919 CCOCSc1c(cncc1C)C 62a_100000739092_100009817138 [1,1,0,0,0,0|1,1,0]=4 7084 B13R1.8919 CCOCSc1c(cncc1C)C 62a_100009817138_100000739092 [1,1,0,0,0,0|1,1,0]=4 7085 B13R1.8919 CNCCOc1c(cccc1C)C 2230a_100000740230_200000210301 [1,1,0,0,0,0|0,0,0]=2 7086 B13R1.8919 CNCCOc1c(cccc1C)C 2230a_106832991635_100000184555 [1,1,0,0,0,0|0,0,0]=2 7087 B13R1.8919 CNCCOc1c(cccc1C)C 34a_100000740230_200000210301 [1,1,0,0,0,0|0,0,0]=2 7088 B13R1.8919 CNCCOc1c(cccc1C)C 34a_100102657272_100000184555 [1,1,0,0,0,0|0,0,0]=2 7089 B13R1.8919 CNCCOc1c(cccc1C)C 7a_106832991635_100000184555 [1,1,0,0,0,0|0,0,0]=2 7090 B13R1.8919 CNCCOc1c(cccc1Cl)C 2230a_100015186626_200000210301 [1,1,0,0,0,0|1,0,0]=3 7091 B13R1.8919 CNCCOc1c(cccc1Cl)C 34a_100015186626_200000210301 [1,1,0,0,0,0|1,0,0]=3 7092 B13R1.8919 CNCCOc1c(cccc1Cl)Cl 2230a_106832991635_100000184560 [1,1,0,0,0,0|2,0,0]=4 7093 B13R1.8919 CNCCOc1c(cccc1Cl)Cl 34a_100102657272_100000184560 [1,1,0,0,0,0|2,0,0]=4 7094 B13R1.8919 CNCCOc1c(cccc1Cl)Cl 7a_106832991635_100000184560 [1,1,0,0,0,0|2,0,0]=4 7095 B13R1.8919 COCC=Cc1c(cccc1C)C 271570a_100016286323_100000033847 [1,1,0,0,0,0|1,0,1]=4 7096 B13R1.8919 COCCNc1c(cccc1Br)C 34a_100011834072_100011201679 [1,1,0,0,0,0|2,0,0]=4 7097 B13R1.8919 COCCNc1c(cccc1C)C 34a_100000185769_100011201679 [1,1,0,0,0,0|1,0,0]=3 7098 B13R1.8919 COCCNc1c(cccc1Cl)C 34a_100000756524_100011201679 [1,1,0,0,0,0|2,0,0]=4 7099 B13R1.8919 COCCNc1c(cccc1F)C 34a_100000766463_100011201679 [1,1,0,0,0,0|2,0,0]=4 7100 B13R1.8919 COCCNc1c(cccc1O)C 34a_100000743429_100011201679 [1,1,0,0,0,0|2,0,0]=4 7101 B13R1.8919 COCCOc1c(cccc1Br)Br 34a_100000736428_100011201679 [1,1,0,0,0,0|2,0,0]=4 7102 B13R1.8919 COCCOc1c(cccc1Br)Br 7a_100000736428_100000233755 [1,1,0,0,0,0|2,0,0]=4 7103 B13R1.8919 COCCOc1c(cccc1Br)C 34a_100009817157_100011201679 [1,1,0,0,0,0|1,0,0]=3 7104 B13R1.8919 COCCOc1c(cccc1Br)C 7a_100009817157_100000233755 [1,1,0,0,0,0|1,0,0]=3 7105 B13R1.8919 COCCOc1c(cccc1Br)Cl 34a_100010214474_100011201679 [1,1,0,0,0,0|2,0,0]=4 7106 B13R1.8919 COCCOc1c(cccc1Br)Cl 7a_100010214474_100000233755 [1,1,0,0,0,0|2,0,0]=4 7107 B13R1.8919 COCCOc1c(cccc1Br)F 34a_100009813666_100011201679 [1,1,0,0,0,0|2,0,0]=4 7108 B13R1.8919 COCCOc1c(cccc1Br)F 7a_100009813666_100000233755 [1,1,0,0,0,0|2,0,0]=4 7109 B13R1.8919 COCCOc1c(cccc1Br)N 34a_100011934915_100011201679 [1,1,0,0,0,0|2,0,0]=4 7110 B13R1.8919 COCCOc1c(cccc1C)C 34a_100000210341_100011201679 [1,1,0,0,0,0|0,0,0]=2 7111 B13R1.8919 COCCOc1c(cccc1C)C 34a_100138415774_100000184555 [1,1,0,0,0,0|0,0,0]=2 7112 B13R1.8919 COCCOc1c(cccc1C)C 7a_100000210341_100000233755 [1,1,0,0,0,0|0,0,0]=2 7113 B13R1.8919 COCCOc1c(cccc1Cl)C 34a_100000033731_100011201679 [1,1,0,0,0,0|1,0,0]=3 7114 B13R1.8919 COCCOc1c(cccc1Cl)C 7a_100000033731_100000233755 [1,1,0,0,0,0|1,0,0]=3 7115 B13R1.8919 COCCOc1c(cccc1Cl)Cl 34a_100000211709_100011201679 [1,1,0,0,0,0|2,0,0]=4 7116 B13R1.8919 COCCOc1c(cccc1Cl)Cl 34a_100138415774_100000184560 [1,1,0,0,0,0|2,0,0]=4 7117 B13R1.8919 COCCOc1c(cccc1Cl)Cl 34a_200011235770_200000210301 [1,1,0,0,0,0|2,0,0]=4 7118 B13R1.8919 COCCOc1c(cccc1Cl)Cl 7a_100000211709_100000233755 [1,1,0,0,0,0|2,0,0]=4 7119 B13R1.8919 COCCOc1c(cccc1Cl)Cl 7a_200011235770_200000210301 [1,1,0,0,0,0|2,0,0]=4 7120 B13R1.8919 COCCOc1c(cccc1Cl)F 34a_100000694953_100011201679 [1,1,0,0,0,0|2,0,0]=4 7121 B13R1.8919 COCCOc1c(cccc1Cl)F 7a_100000694953_100000233755 [1,1,0,0,0,0|2,0,0]=4 7122 B13R1.8919 COCCOc1c(cccc1Cl)N 34a_100000754742_100011201679 [1,1,0,0,0,0|2,0,0]=4 7123 B13R1.8919 COCCOc1c(cccc1F)C 34a_100011659162_100011201679 [1,1,0,0,0,0|1,0,0]=3 7124 B13R1.8919 COCCOc1c(cccc1F)C 7a_100011659162_100000233755 [1,1,0,0,0,0|1,0,0]=3 7125 B13R1.8919 COCCOc1c(cccc1F)F 34a_100000230165_100011201679 [1,1,0,0,0,0|2,0,0]=4 7126 B13R1.8919 COCCOc1c(cccc1F)F 7a_100000230165_100000233755 [1,1,0,0,0,0|2,0,0]=4 7127 B13R1.8919 COCCOc1c(cccc1F)N 34a_100011934987_100011201679 [1,1,0,0,0,0|2,0,0]=4 7128 B13R1.8919 COCCOc1c(cccc1I)Br 34a_100010084509_100011201679 [1,1,0,0,0,0|2,0,0]=4 7129 B13R1.8919 COCCOc1c(cccc1I)Br 7a_100010084509_100000233755 [1,1,0,0,0,0|2,0,0]=4 7130 B13R1.8919 COCCOc1c(cccc1I)Cl 34a_100010202889_100011201679 [1,1,0,0,0,0|2,0,0]=4 7131 B13R1.8919 COCCOc1c(cccc1I)Cl 7a_100010202889_100000233755 [1,1,0,0,0,0|2,0,0]=4 7132 B13R1.8919 COCCOc1c(cccc1I)F 34a_100010186298_100011201679 [1,1,0,0,0,0|2,0,0]=4 7133 B13R1.8919 COCCOc1c(cccc1I)F 7a_100010186298_100000233755 [1,1,0,0,0,0|2,0,0]=4 7134 B13R1.8919 COCCOc1c(cccc1I)N 34a_100010084371_100011201679 [1,1,0,0,0,0|2,0,0]=4 7135 B13R1.8919 COCCOc1c(cccc1N)C 34a_100000756359_100011201679 [1,1,0,0,0,0|1,0,0]=3 7136 B13R1.8919 COCCOc1c(cccc1N)C 7a_100000756359_100000233755 [1,1,0,0,0,0|1,0,0]=3 7137 B13R1.8919 COCCOc1c(cccc1N)N 34a_200016994477_100011201679 [1,1,0,0,0,0|2,0,0]=4 7138 B13R1.8919 COCCOc1c(ccnc1C)C 34a_100011934651_100011201679 [1,1,0,0,0,0|1,0,0]=3 7139 B13R1.8919 COCCOc1c(ccnc1C)C 7a_100011934651_100000233755 [1,1,0,0,0,0|1,0,0]=3 7140 B13R1.8919 COCCOc1c(ccnc1Cl)C 34a_100000696282_100011201679 [1,1,0,0,0,0|2,0,0]=4 7141 B13R1.8919 COCCOc1c(ccnc1Cl)C 7a_100000696282_100000233755 [1,1,0,0,0,0|2,0,0]=4 7142 B13R1.8919 COCCOc1c(ncnc1C)C 34a_100009878406_100011201679 [1,1,0,0,0,0|2,0,0]=4 7143 B13R1.8919 COCCOc1c(ncnc1C)C 7a_100009878406_100000233755 [1,1,0,0,0,0|2,0,0]=4 7144 B13R1.8919 COCCOc1c(occc1=O)C 34a_100000031901_100011201679 [1,1,0,0,0,0|2,0,0]=4 7145 B13R1.8919 COCCSc1c(cccc1Br)C 62a_100000233755_100010141302 [1,1,0,0,0,0|1,1,0]=4 7146 B13R1.8919 COCCSc1c(cccc1Br)C 62a_100010141302_100000233755 [1,1,0,0,0,0|1,1,0]=4 7147 B13R1.8919 COCCSc1c(cccc1C)C 34a_200000080753_200000210301 [1,1,0,0,0,0|0,1,0]=3 7148 B13R1.8919 COCCSc1c(cccc1C)C 62a_100000033847_100000233755 [1,1,0,0,0,0|0,1,0]=3 7149 B13R1.8919 COCCSc1c(cccc1C)C 62a_100000233755_100000033847 [1,1,0,0,0,0|0,1,0]=3 7150 B13R1.8919 COCCSc1c(cccc1C)C 7a_200000080753_200000210301 [1,1,0,0,0,0|0,1,0]=3 7151 B13R1.8919 COCCSc1c(cccc1Cl)C 62a_100000043165_100000233755 [1,1,0,0,0,0|1,1,0]=4 7152 B13R1.8919 COCCSc1c(cccc1Cl)C 62a_100000233755_100000043165 [1,1,0,0,0,0|1,1,0]=4 7153 B13R1.8919 COCCSc1c(cccc1F)C 62a_100000233755_100011218421 [1,1,0,0,0,0|1,1,0]=4 7154 B13R1.8919 COCCSc1c(cccc1F)C 62a_100011218421_100000233755 [1,1,0,0,0,0|1,1,0]=4 7155 B13R1.8919 COCCSc1c(cccc1N)C 62a_100000233755_100000684715 [1,1,0,0,0,0|1,1,0]=4 7156 B13R1.8919 COCCSc1c(cccc1N)C 62a_100000684715_100000233755 [1,1,0,0,0,0|1,1,0]=4 7157 B13R1.8919 COCCSc1c(cccc1O)C 62a_100000233755_100000686692 [1,1,0,0,0,0|1,1,0]=4 7158 B13R1.8919 COCCSc1c(cccc1O)C 62a_100000686692_100000233755 [1,1,0,0,0,0|1,1,0]=4 7159 B13R1.8919 COCCSc1c(ccnc1C)C 62a_100000233755_100012000501 [1,1,0,0,0,0|1,1,0]=4 7160 B13R1.8919 COCCSc1c(ccnc1C)C 62a_100012000501_100000233755 [1,1,0,0,0,0|1,1,0]=4 7161 B13R1.8919 COCCSc1c(cncc1C)C 62a_100000233755_100009817138 [1,1,0,0,0,0|1,1,0]=4 7162 B13R1.8919 COCCSc1c(cncc1C)C 62a_100009817138_100000233755 [1,1,0,0,0,0|1,1,0]=4 7163 B13R1.8919 COCSCc1c(cccc1C)C 62a_100000758300_100000766300 [1,1,0,0,0,0|1,1,0]=4 7164 B13R1.8919 COCSCc1c(cccc1C)C 62a_100000766300_100000758300 [1,1,0,0,0,0|1,1,0]=4 7165 B13R1.8919 CSCCNc1c(cccc1Br)C 34a_100011834072_100000212216 [1,1,0,0,0,0|2,0,0]=4 7166 B13R1.8919 CSCCNc1c(cccc1C)C 34a_100000185769_100000212216 [1,1,0,0,0,0|1,0,0]=3 7167 B13R1.8919 CSCCNc1c(cccc1Cl)C 34a_100000756524_100000212216 [1,1,0,0,0,0|2,0,0]=4 7168 B13R1.8919 CSCCNc1c(cccc1F)C 34a_100000766463_100000212216 [1,1,0,0,0,0|2,0,0]=4 7169 B13R1.8919 CSCCNc1c(cccc1O)C 34a_100000743429_100000212216 [1,1,0,0,0,0|2,0,0]=4 7170 B13R1.8919 CSCCOc1c(cccc1Br)Br 34a_100000736428_100000212216 [1,1,0,0,0,0|2,0,0]=4 7171 B13R1.8919 CSCCOc1c(cccc1Br)Br 7a_100000736428_100000212216 [1,1,0,0,0,0|2,0,0]=4 7172 B13R1.8919 CSCCOc1c(cccc1Br)C 34a_100009817157_100000212216 [1,1,0,0,0,0|1,0,0]=3 7173 B13R1.8919 CSCCOc1c(cccc1Br)C 7a_100009817157_100000212216 [1,1,0,0,0,0|1,0,0]=3 7174 B13R1.8919 CSCCOc1c(cccc1Br)Cl 34a_100010214474_100000212216 [1,1,0,0,0,0|2,0,0]=4 7175 B13R1.8919 CSCCOc1c(cccc1Br)Cl 7a_100010214474_100000212216 [1,1,0,0,0,0|2,0,0]=4 7176 B13R1.8919 CSCCOc1c(cccc1Br)F 34a_100009813666_100000212216 [1,1,0,0,0,0|2,0,0]=4 7177 B13R1.8919 CSCCOc1c(cccc1Br)F 7a_100009813666_100000212216 [1,1,0,0,0,0|2,0,0]=4 7178 B13R1.8919 CSCCOc1c(cccc1Br)N 34a_100011934915_100000212216 [1,1,0,0,0,0|2,0,0]=4 7179 B13R1.8919 CSCCOc1c(cccc1C)C 34a_100000210341_100000212216 [1,1,0,0,0,0|0,0,0]=2 7180 B13R1.8919 CSCCOc1c(cccc1C)C 62a_100000184555_200000210301 [1,1,0,0,0,0|0,0,0]=2 7181 B13R1.8919 CSCCOc1c(cccc1C)C 62a_200000210301_100000184555 [1,1,0,0,0,0|0,0,0]=2 7182 B13R1.8919 CSCCOc1c(cccc1C)C 7a_100000210341_100000212216 [1,1,0,0,0,0|0,0,0]=2 7183 B13R1.8919 CSCCOc1c(cccc1Cl)C 34a_100000033731_100000212216 [1,1,0,0,0,0|1,0,0]=3 7184 B13R1.8919 CSCCOc1c(cccc1Cl)C 7a_100000033731_100000212216 [1,1,0,0,0,0|1,0,0]=3 7185 B13R1.8919 CSCCOc1c(cccc1Cl)Cl 34a_100000211709_100000212216 [1,1,0,0,0,0|2,0,0]=4 7186 B13R1.8919 CSCCOc1c(cccc1Cl)Cl 62a_100000184560_200000210301 [1,1,0,0,0,0|2,0,0]=4 7187 B13R1.8919 CSCCOc1c(cccc1Cl)Cl 62a_200000210301_100000184560 [1,1,0,0,0,0|2,0,0]=4 7188 B13R1.8919 CSCCOc1c(cccc1Cl)Cl 7a_100000211709_100000212216 [1,1,0,0,0,0|2,0,0]=4 7189 B13R1.8919 CSCCOc1c(cccc1Cl)F 34a_100000694953_100000212216 [1,1,0,0,0,0|2,0,0]=4 7190 B13R1.8919 CSCCOc1c(cccc1Cl)F 7a_100000694953_100000212216 [1,1,0,0,0,0|2,0,0]=4 7191 B13R1.8919 CSCCOc1c(cccc1Cl)N 34a_100000754742_100000212216 [1,1,0,0,0,0|2,0,0]=4 7192 B13R1.8919 CSCCOc1c(cccc1F)C 34a_100011659162_100000212216 [1,1,0,0,0,0|1,0,0]=3 7193 B13R1.8919 CSCCOc1c(cccc1F)C 7a_100011659162_100000212216 [1,1,0,0,0,0|1,0,0]=3 7194 B13R1.8919 CSCCOc1c(cccc1F)F 34a_100000230165_100000212216 [1,1,0,0,0,0|2,0,0]=4 7195 B13R1.8919 CSCCOc1c(cccc1F)F 7a_100000230165_100000212216 [1,1,0,0,0,0|2,0,0]=4 7196 B13R1.8919 CSCCOc1c(cccc1F)N 34a_100011934987_100000212216 [1,1,0,0,0,0|2,0,0]=4 7197 B13R1.8919 CSCCOc1c(cccc1I)Br 34a_100010084509_100000212216 [1,1,0,0,0,0|2,0,0]=4 7198 B13R1.8919 CSCCOc1c(cccc1I)Br 7a_100010084509_100000212216 [1,1,0,0,0,0|2,0,0]=4 7199 B13R1.8919 CSCCOc1c(cccc1I)Cl 34a_100010202889_100000212216 [1,1,0,0,0,0|2,0,0]=4 7200 B13R1.8919 CSCCOc1c(cccc1I)Cl 7a_100010202889_100000212216 [1,1,0,0,0,0|2,0,0]=4 7201 B13R1.8919 CSCCOc1c(cccc1I)F 34a_100010186298_100000212216 [1,1,0,0,0,0|2,0,0]=4 7202 B13R1.8919 CSCCOc1c(cccc1I)F 7a_100010186298_100000212216 [1,1,0,0,0,0|2,0,0]=4 7203 B13R1.8919 CSCCOc1c(cccc1I)N 34a_100010084371_100000212216 [1,1,0,0,0,0|2,0,0]=4 7204 B13R1.8919 CSCCOc1c(cccc1N)C 34a_100000756359_100000212216 [1,1,0,0,0,0|1,0,0]=3 7205 B13R1.8919 CSCCOc1c(cccc1N)C 7a_100000756359_100000212216 [1,1,0,0,0,0|1,0,0]=3 7206 B13R1.8919 CSCCOc1c(cccc1N)N 34a_200016994477_100000212216 [1,1,0,0,0,0|2,0,0]=4 7207 B13R1.8919 CSCCOc1c(ccnc1C)C 34a_100011934651_100000212216 [1,1,0,0,0,0|1,0,0]=3 7208 B13R1.8919 CSCCOc1c(ccnc1C)C 7a_100011934651_100000212216 [1,1,0,0,0,0|1,0,0]=3 7209 B13R1.8919 CSCCOc1c(ccnc1Cl)C 34a_100000696282_100000212216 [1,1,0,0,0,0|2,0,0]=4 7210 B13R1.8919 CSCCOc1c(ccnc1Cl)C 7a_100000696282_100000212216 [1,1,0,0,0,0|2,0,0]=4 7211 B13R1.8919 CSCCOc1c(ncnc1C)C 34a_100009878406_100000212216 [1,1,0,0,0,0|2,0,0]=4 7212 B13R1.8919 CSCCOc1c(ncnc1C)C 7a_100009878406_100000212216 [1,1,0,0,0,0|2,0,0]=4 7213 B13R1.8919 CSCCOc1c(occc1=O)C 34a_100000031901_100000212216 [1,1,0,0,0,0|2,0,0]=4 7214 B13R1.8919 CSCCSc1c(cccc1Br)C 62a_100000212216_100010141302 [1,1,0,0,0,0|1,1,0]=4 7215 B13R1.8919 CSCCSc1c(cccc1Br)C 62a_100010141302_100000751147 [1,1,0,0,0,0|1,1,0]=4 7216 B13R1.8919 CSCCSc1c(cccc1C)C 62a_100000033847_100000751147 [1,1,0,0,0,0|0,1,0]=3 7217 B13R1.8919 CSCCSc1c(cccc1C)C 62a_100000212216_100000033847 [1,1,0,0,0,0|0,1,0]=3 7218 B13R1.8919 CSCCSc1c(cccc1Cl)C 62a_100000043165_100000751147 [1,1,0,0,0,0|1,1,0]=4 7219 B13R1.8919 CSCCSc1c(cccc1Cl)C 62a_100000212216_100000043165 [1,1,0,0,0,0|1,1,0]=4 7220 B13R1.8919 CSCCSc1c(cccc1F)C 62a_100000212216_100011218421 [1,1,0,0,0,0|1,1,0]=4 7221 B13R1.8919 CSCCSc1c(cccc1F)C 62a_100011218421_100000751147 [1,1,0,0,0,0|1,1,0]=4 7222 B13R1.8919 CSCCSc1c(cccc1N)C 62a_100000212216_100000684715 [1,1,0,0,0,0|1,1,0]=4 7223 B13R1.8919 CSCCSc1c(cccc1N)C 62a_100000684715_100000751147 [1,1,0,0,0,0|1,1,0]=4 7224 B13R1.8919 CSCCSc1c(cccc1O)C 62a_100000212216_100000686692 [1,1,0,0,0,0|1,1,0]=4 7225 B13R1.8919 CSCCSc1c(cccc1O)C 62a_100000686692_100000751147 [1,1,0,0,0,0|1,1,0]=4 7226 B13R1.8919 CSCCSc1c(ccnc1C)C 62a_100000212216_100012000501 [1,1,0,0,0,0|1,1,0]=4 7227 B13R1.8919 CSCCSc1c(ccnc1C)C 62a_100012000501_100000751147 [1,1,0,0,0,0|1,1,0]=4 7228 B13R1.8919 CSCCSc1c(cncc1C)C 62a_100000212216_100009817138 [1,1,0,0,0,0|1,1,0]=4 7229 B13R1.8919 CSCCSc1c(cncc1C)C 62a_100009817138_100000751147 [1,1,0,0,0,0|1,1,0]=4 7230 B13R1.8919 CSCNCc1c(cccc1C)C 34a_100000689800_100011218213 [1,1,0,0,0,0|2,0,0]=4 7231 B13R1.8919 CSCOCc1c(cccc1C)C 34a_100011933981_100011218213 [1,1,0,0,0,0|1,0,0]=3 7232 B13R1.8919 CSCOCc1c(cccc1Cl)C 34a_100000082531_100011218213 [1,1,0,0,0,0|2,0,0]=4 7233 B13R1.8919 CSCOCc1c(cccc1F)C 34a_100000057874_100011218213 [1,1,0,0,0,0|2,0,0]=4 7234 B13R1.8919 CSCSCc1c(cccc1C)C 62a_100000758300_100011218213 [1,1,0,0,0,0|1,1,0]=4 7235 B13R1.8919 CSCSCc1c(cccc1C)C 62a_100011218213_100000758300 [1,1,0,0,0,0|1,1,0]=4 7236 B13R1.8919 Cc1cccc(c1CNCCF)C 34a_100000689800_100011217306 [1,1,0,0,0,0|2,0,0]=4 7237 B13R1.8919 Cc1cccc(c1CNCCF)C 34a_100000724931_100000758300 [1,1,0,0,0,0|2,0,0]=4 7238 B13R1.8919 Cc1cccc(c1CNCCO)C 207a_100000210304_100000758299 [1,1,0,0,0,0|2,0,0]=4 7239 B13R1.8919 Cc1cccc(c1CNCCO)C 2230a_100016997473_100000758300 [1,1,0,0,0,0|2,0,0]=4 7240 B13R1.8919 Cc1cccc(c1CNCCO)C 270004a_100000210304_100000758299 [1,1,0,0,0,0|2,0,0]=4 7241 B13R1.8919 Cc1cccc(c1CNCCO)C 34a_100000689800_100000211926 [1,1,0,0,0,0|2,0,0]=4 7242 B13R1.8919 Cc1cccc(c1CNCCO)C 34a_100016990907_100000758300 [1,1,0,0,0,0|2,0,0]=4 7243 B13R1.8919 Cc1cccc(c1COCC#N)C 7a_100011933981_100011215382 [1,1,0,0,0,0|0,0,2]=4 7244 B13R1.8919 Cc1cccc(c1COCC=O)C 34a_100011933981_200009817547 [1,1,0,0,0,0|1,0,1]=4 7245 B13R1.8919 Cc1cccc(c1COCC=O)C 7a_100011933981_200015260668 [1,1,0,0,0,0|1,0,1]=4 7246 B13R1.8919 Cc1cccc(c1COCCBr)Br 34a_100000211926_100010146847 [1,1,0,0,0,0|2,0,0]=4 7247 B13R1.8919 Cc1cccc(c1COCCBr)C 34a_100000211926_100000758300 [1,1,0,0,0,0|1,0,0]=3 7248 B13R1.8919 Cc1cccc(c1COCCBr)F 34a_100000211926_100009814554 [1,1,0,0,0,0|2,0,0]=4 7249 B13R1.8919 Cc1cccc(c1COCCBr)I 34a_100000211926_100010150146 [1,1,0,0,0,0|2,0,0]=4 7250 B13R1.8919 Cc1cccc(c1COCCF)C 34a_100011933981_100011217306 [1,1,0,0,0,0|1,0,0]=3 7251 B13R1.8919 Cc1cccc(c1COCCF)C 7a_100011933981_100011217306 [1,1,0,0,0,0|1,0,0]=3 7252 B13R1.8919 Cc1cccc(c1COCCF)Cl 34a_100000082531_100011217306 [1,1,0,0,0,0|2,0,0]=4 7253 B13R1.8919 Cc1cccc(c1COCCF)Cl 7a_100000082531_100011217306 [1,1,0,0,0,0|2,0,0]=4 7254 B13R1.8919 Cc1cccc(c1COCCF)F 34a_100000057874_100011217306 [1,1,0,0,0,0|2,0,0]=4 7255 B13R1.8919 Cc1cccc(c1COCCF)F 7a_100000057874_100011217306 [1,1,0,0,0,0|2,0,0]=4 7256 B13R1.8919 Cc1cccc(c1COCCN)Br 34a_100000210304_100010146847 [1,1,0,0,0,0|1,0,0]=3 7257 B13R1.8919 Cc1cccc(c1COCCN)C 34a_100000210304_100000758300 [1,1,0,0,0,0|0,0,0]=2 7258 B13R1.8919 Cc1cccc(c1COCCN)F 34a_100000210304_100009814554 [1,1,0,0,0,0|1,0,0]=3 7259 B13R1.8919 Cc1cccc(c1COCCN)I 34a_100000210304_100010150146 [1,1,0,0,0,0|1,0,0]=3 7260 B13R1.8919 Cc1cccc(c1COCCO)C 34a_100011933981_100000211926 [1,1,0,0,0,0|1,0,0]=3 7261 B13R1.8919 Cc1cccc(c1COCCO)C 7a_100011933981_100000211926 [1,1,0,0,0,0|1,0,0]=3 7262 B13R1.8919 Cc1cccc(c1COCCO)Cl 34a_100000082531_100000211926 [1,1,0,0,0,0|2,0,0]=4 7263 B13R1.8919 Cc1cccc(c1COCCO)Cl 7a_100000082531_100000211926 [1,1,0,0,0,0|2,0,0]=4 7264 B13R1.8919 Cc1cccc(c1COCCO)F 34a_100000057874_100000211926 [1,1,0,0,0,0|2,0,0]=4 7265 B13R1.8919 Cc1cccc(c1COCCO)F 7a_100000057874_100000211926 [1,1,0,0,0,0|2,0,0]=4 7266 B13R1.8919 Cc1cccc(c1CSCCF)C 62a_100000758300_100011217306 [1,1,0,0,0,0|1,1,0]=4 7267 B13R1.8919 Cc1cccc(c1CSCCF)C 62a_100011217306_100000758300 [1,1,0,0,0,0|1,1,0]=4 7268 B13R1.8919 Cc1cccc(c1CSCCO)C 62a_100000211926_100000758300 [1,1,0,0,0,0|1,1,0]=4 7269 B13R1.8919 Cc1cccc(c1CSCCO)C 62a_100000758300_100000211926 [1,1,0,0,0,0|1,1,0]=4 7270 B13R1.8919 Cc1cccc(c1NCCCF)Br 34a_100011834072_100011934791 [1,1,0,0,0,0|2,0,0]=4 7271 B13R1.8919 Cc1cccc(c1NCCCF)C 34a_100000185769_100011934791 [1,1,0,0,0,0|1,0,0]=3 7272 B13R1.8919 Cc1cccc(c1NCCCF)Cl 34a_100000756524_100011934791 [1,1,0,0,0,0|2,0,0]=4 7273 B13R1.8919 Cc1cccc(c1NCCCF)F 34a_100000766463_100011934791 [1,1,0,0,0,0|2,0,0]=4 7274 B13R1.8919 Cc1cccc(c1NCCCF)O 34a_100000743429_100011934791 [1,1,0,0,0,0|2,0,0]=4 7275 B13R1.8919 Cc1cccc(c1NCCCO)Br 34a_100011834072_100000230001 [1,1,0,0,0,0|2,0,0]=4 7276 B13R1.8919 Cc1cccc(c1NCCCO)C 34a_100000185769_100000230001 [1,1,0,0,0,0|1,0,0]=3 7277 B13R1.8919 Cc1cccc(c1NCCCO)Cl 34a_100000756524_100000230001 [1,1,0,0,0,0|2,0,0]=4 7278 B13R1.8919 Cc1cccc(c1NCCCO)F 34a_100000766463_100000230001 [1,1,0,0,0,0|2,0,0]=4 7279 B13R1.8919 Cc1cccc(c1NCCCO)O 34a_100000743429_100000230001 [1,1,0,0,0,0|2,0,0]=4 7280 B13R1.8919 Cc1cccc(c1OCCC#N)Br 7a_100009817157_100000184422 [1,1,0,0,0,0|1,0,1]=4 7281 B13R1.8919 Cc1cccc(c1OCCC#N)C 7a_100000210341_100000184422 [1,1,0,0,0,0|0,0,1]=3 7282 B13R1.8919 Cc1cccc(c1OCCC#N)Cl 7a_100000033731_100000184422 [1,1,0,0,0,0|1,0,1]=4 7283 B13R1.8919 Cc1cccc(c1OCCC#N)F 7a_100011659162_100000184422 [1,1,0,0,0,0|1,0,1]=4 7284 B13R1.8919 Cc1cccc(c1OCCC#N)N 7a_100000756359_100000184422 [1,1,0,0,0,0|1,0,1]=4 7285 B13R1.8919 Cc1cccc(c1OCCCF)Br 34a_100009817157_100011934791 [1,1,0,0,0,0|1,0,0]=3 7286 B13R1.8919 Cc1cccc(c1OCCCF)Br 7a_100009817157_100011934791 [1,1,0,0,0,0|1,0,0]=3 7287 B13R1.8919 Cc1cccc(c1OCCCF)C 34a_100000210341_100011934791 [1,1,0,0,0,0|0,0,0]=2 7288 B13R1.8919 Cc1cccc(c1OCCCF)C 7a_100000210341_100011934791 [1,1,0,0,0,0|0,0,0]=2 7289 B13R1.8919 Cc1cccc(c1OCCCF)Cl 34a_100000033731_100011934791 [1,1,0,0,0,0|1,0,0]=3 7290 B13R1.8919 Cc1cccc(c1OCCCF)Cl 7a_100000033731_100011934791 [1,1,0,0,0,0|1,0,0]=3 7291 B13R1.8919 Cc1cccc(c1OCCCF)F 34a_100011659162_100011934791 [1,1,0,0,0,0|1,0,0]=3 7292 B13R1.8919 Cc1cccc(c1OCCCF)F 7a_100011659162_100011934791 [1,1,0,0,0,0|1,0,0]=3 7293 B13R1.8919 Cc1cccc(c1OCCCF)N 34a_100000756359_100011934791 [1,1,0,0,0,0|1,0,0]=3 7294 B13R1.8919 Cc1cccc(c1OCCCF)N 7a_100000756359_100011934791 [1,1,0,0,0,0|1,0,0]=3 7295 B13R1.8919 Cc1cccc(c1OCCCO)Br 34a_100009817157_100000230001 [1,1,0,0,0,0|1,0,0]=3 7296 B13R1.8919 Cc1cccc(c1OCCCO)Br 7a_100009817157_100011215043 [1,1,0,0,0,0|1,0,0]=3 7297 B13R1.8919 Cc1cccc(c1OCCCO)C 34a_100000210341_100000230001 [1,1,0,0,0,0|0,0,0]=2 7298 B13R1.8919 Cc1cccc(c1OCCCO)C 7a_100000210341_100011215043 [1,1,0,0,0,0|0,0,0]=2 7299 B13R1.8919 Cc1cccc(c1OCCCO)Cl 34a_100000033731_100000230001 [1,1,0,0,0,0|1,0,0]=3 7300 B13R1.8919 Cc1cccc(c1OCCCO)Cl 7a_100000033731_100011215043 [1,1,0,0,0,0|1,0,0]=3 7301 B13R1.8919 Cc1cccc(c1OCCCO)F 34a_100011659162_100000230001 [1,1,0,0,0,0|1,0,0]=3 7302 B13R1.8919 Cc1cccc(c1OCCCO)F 7a_100011659162_100011215043 [1,1,0,0,0,0|1,0,0]=3 7303 B13R1.8919 Cc1cccc(c1OCCCO)N 34a_100000756359_100000230001 [1,1,0,0,0,0|1,0,0]=3 7304 B13R1.8919 Cc1cccc(c1OCCCO)N 7a_100000756359_100011215043 [1,1,0,0,0,0|1,0,0]=3 7305 B13R1.8919 Cc1cccc(c1OCCN[13CH3])C 2230a_100000740230_200025704644 [1,1,0,0,0,0|0,0,0]=2 7306 B13R1.8919 Cc1cccc(c1OCCN[13CH3])C 34a_100000740230_200025704644 [1,1,0,0,0,0|0,0,0]=2 7307 B13R1.8919 Cc1cccc(c1OCCN[13CH3])Cl 2230a_100015186626_200025704644 [1,1,0,0,0,0|1,0,0]=3 7308 B13R1.8919 Cc1cccc(c1OCCN[13CH3])Cl 34a_100015186626_200025704644 [1,1,0,0,0,0|1,0,0]=3 7309 B13R1.8919 Cc1cccc(c1OCCS[13CH3])C 62a_100000184555_200025704644 [1,1,0,0,0,0|0,0,0]=2 7310 B13R1.8919 Cc1cccc(c1OCCS[13CH3])C 62a_200025704644_100000184555 [1,1,0,0,0,0|0,0,0]=2 7311 B13R1.8919 Cc1cccc(c1SCCC#N)C 62a_100000033847_100011215226 [1,1,0,0,0,0|0,1,1]=4 7312 B13R1.8919 Cc1cccc(c1SCCC#N)C 62a_100011215226_100000033847 [1,1,0,0,0,0|0,1,1]=4 7313 B13R1.8919 Cc1cccc(c1SCCCF)Br 62a_100010141302_100011934791 [1,1,0,0,0,0|1,1,0]=4 7314 B13R1.8919 Cc1cccc(c1SCCCF)Br 62a_100011934791_100010141302 [1,1,0,0,0,0|1,1,0]=4 7315 B13R1.8919 Cc1cccc(c1SCCCF)C 62a_100000033847_100011934791 [1,1,0,0,0,0|0,1,0]=3 7316 B13R1.8919 Cc1cccc(c1SCCCF)C 62a_100011934791_100000033847 [1,1,0,0,0,0|0,1,0]=3 7317 B13R1.8919 Cc1cccc(c1SCCCF)Cl 62a_100000043165_100011934791 [1,1,0,0,0,0|1,1,0]=4 7318 B13R1.8919 Cc1cccc(c1SCCCF)Cl 62a_100011934791_100000043165 [1,1,0,0,0,0|1,1,0]=4 7319 B13R1.8919 Cc1cccc(c1SCCCF)F 62a_100011218421_100011934791 [1,1,0,0,0,0|1,1,0]=4 7320 B13R1.8919 Cc1cccc(c1SCCCF)F 62a_100011934791_100011218421 [1,1,0,0,0,0|1,1,0]=4 7321 B13R1.8919 Cc1cccc(c1SCCCF)N 62a_100000684715_100011934791 [1,1,0,0,0,0|1,1,0]=4 7322 B13R1.8919 Cc1cccc(c1SCCCF)N 62a_100011934791_100000684715 [1,1,0,0,0,0|1,1,0]=4 7323 B13R1.8919 Cc1cccc(c1SCCCF)O 62a_100000686692_100011934791 [1,1,0,0,0,0|1,1,0]=4 7324 B13R1.8919 Cc1cccc(c1SCCCF)O 62a_100011934791_100000686692 [1,1,0,0,0,0|1,1,0]=4 7325 B13R1.8919 Cc1cccc(c1SCCCO)Br 62a_100010141302_100011215043 [1,1,0,0,0,0|1,1,0]=4 7326 B13R1.8919 Cc1cccc(c1SCCCO)Br 62a_100011215043_100010141302 [1,1,0,0,0,0|1,1,0]=4 7327 B13R1.8919 Cc1cccc(c1SCCCO)C 62a_100000033847_100011215043 [1,1,0,0,0,0|0,1,0]=3 7328 B13R1.8919 Cc1cccc(c1SCCCO)C 62a_100011215043_100000033847 [1,1,0,0,0,0|0,1,0]=3 7329 B13R1.8919 Cc1cccc(c1SCCCO)Cl 62a_100000043165_100011215043 [1,1,0,0,0,0|1,1,0]=4 7330 B13R1.8919 Cc1cccc(c1SCCCO)Cl 62a_100011215043_100000043165 [1,1,0,0,0,0|1,1,0]=4 7331 B13R1.8919 Cc1cccc(c1SCCCO)F 62a_100011215043_100011218421 [1,1,0,0,0,0|1,1,0]=4 7332 B13R1.8919 Cc1cccc(c1SCCCO)F 62a_100011218421_100011215043 [1,1,0,0,0,0|1,1,0]=4 7333 B13R1.8919 Cc1cccc(c1SCCCO)N 62a_100000684715_100011215043 [1,1,0,0,0,0|1,1,0]=4 7334 B13R1.8919 Cc1cccc(c1SCCCO)N 62a_100011215043_100000684715 [1,1,0,0,0,0|1,1,0]=4 7335 B13R1.8919 Cc1cccc(c1SCCCO)O 62a_100000686692_100011215043 [1,1,0,0,0,0|1,1,0]=4 7336 B13R1.8919 Cc1cccc(c1SCCCO)O 62a_100011215043_100000686692 [1,1,0,0,0,0|1,1,0]=4 7337 B13R1.8919 Cc1cccc(c1SCCO[13CH3])C 34a_200000080753_200025704644 [1,1,0,0,0,0|0,1,0]=3 7338 B13R1.8919 Cc1cccc(c1SCCO[13CH3])C 7a_200000080753_200025704644 [1,1,0,0,0,0|0,1,0]=3 7339 B13R1.8919 Cc1ccnc(c1OCCC#N)C 7a_100011934651_100000184422 [1,1,0,0,0,0|1,0,1]=4 7340 B13R1.8919 Cc1ccnc(c1OCCCF)C 34a_100011934651_100011934791 [1,1,0,0,0,0|1,0,0]=3 7341 B13R1.8919 Cc1ccnc(c1OCCCF)C 7a_100011934651_100011934791 [1,1,0,0,0,0|1,0,0]=3 7342 B13R1.8919 Cc1ccnc(c1OCCCF)Cl 34a_100000696282_100011934791 [1,1,0,0,0,0|2,0,0]=4 7343 B13R1.8919 Cc1ccnc(c1OCCCF)Cl 7a_100000696282_100011934791 [1,1,0,0,0,0|2,0,0]=4 7344 B13R1.8919 Cc1ccnc(c1OCCCO)C 34a_100011934651_100000230001 [1,1,0,0,0,0|1,0,0]=3 7345 B13R1.8919 Cc1ccnc(c1OCCCO)C 7a_100011934651_100011215043 [1,1,0,0,0,0|1,0,0]=3 7346 B13R1.8919 Cc1ccnc(c1OCCCO)Cl 34a_100000696282_100000230001 [1,1,0,0,0,0|2,0,0]=4 7347 B13R1.8919 Cc1ccnc(c1OCCCO)Cl 7a_100000696282_100011215043 [1,1,0,0,0,0|2,0,0]=4 7348 B13R1.8919 Cc1ccnc(c1SCCCF)C 62a_100011934791_100012000501 [1,1,0,0,0,0|1,1,0]=4 7349 B13R1.8919 Cc1ccnc(c1SCCCF)C 62a_100012000501_100011934791 [1,1,0,0,0,0|1,1,0]=4 7350 B13R1.8919 Cc1ccnc(c1SCCCO)C 62a_100011215043_100012000501 [1,1,0,0,0,0|1,1,0]=4 7351 B13R1.8919 Cc1ccnc(c1SCCCO)C 62a_100012000501_100011215043 [1,1,0,0,0,0|1,1,0]=4 7352 B13R1.8919 Cc1cncc(c1SCCCF)C 62a_100009817138_100011934791 [1,1,0,0,0,0|1,1,0]=4 7353 B13R1.8919 Cc1cncc(c1SCCCF)C 62a_100011934791_100009817138 [1,1,0,0,0,0|1,1,0]=4 7354 B13R1.8919 Cc1cncc(c1SCCCO)C 62a_100009817138_100011215043 [1,1,0,0,0,0|1,1,0]=4 7355 B13R1.8919 Cc1cncc(c1SCCCO)C 62a_100011215043_100009817138 [1,1,0,0,0,0|1,1,0]=4 7356 B13R1.8919 Cc1ncnc(c1OCCCF)C 34a_100009878406_100011934791 [1,1,0,0,0,0|2,0,0]=4 7357 B13R1.8919 Cc1ncnc(c1OCCCF)C 7a_100009878406_100011934791 [1,1,0,0,0,0|2,0,0]=4 7358 B13R1.8919 Cc1ncnc(c1OCCCO)C 34a_100009878406_100000230001 [1,1,0,0,0,0|2,0,0]=4 7359 B13R1.8919 Cc1ncnc(c1OCCCO)C 7a_100009878406_100011215043 [1,1,0,0,0,0|2,0,0]=4 7360 B13R1.8919 Cc1occc(=O)c1OCCCF 34a_100000031901_100011934791 [1,1,0,0,0,0|2,0,0]=4 7361 B13R1.8919 Cc1occc(=O)c1OCCCO 34a_100000031901_100000230001 [1,1,0,0,0,0|2,0,0]=4 7362 B13R1.8919 FCCCOc1c(cccc1Br)Br 34a_100000736428_100011934791 [1,1,0,0,0,0|2,0,0]=4 7363 B13R1.8919 FCCCOc1c(cccc1Br)Br 7a_100000736428_100011934791 [1,1,0,0,0,0|2,0,0]=4 7364 B13R1.8919 FCCCOc1c(cccc1Br)Cl 34a_100010214474_100011934791 [1,1,0,0,0,0|2,0,0]=4 7365 B13R1.8919 FCCCOc1c(cccc1Br)Cl 7a_100010214474_100011934791 [1,1,0,0,0,0|2,0,0]=4 7366 B13R1.8919 FCCCOc1c(cccc1Br)F 34a_100009813666_100011934791 [1,1,0,0,0,0|2,0,0]=4 7367 B13R1.8919 FCCCOc1c(cccc1Br)F 7a_100009813666_100011934791 [1,1,0,0,0,0|2,0,0]=4 7368 B13R1.8919 FCCCOc1c(cccc1Cl)Cl 34a_100000211709_100011934791 [1,1,0,0,0,0|2,0,0]=4 7369 B13R1.8919 FCCCOc1c(cccc1Cl)Cl 7a_100000211709_100011934791 [1,1,0,0,0,0|2,0,0]=4 7370 B13R1.8919 FCCCOc1c(cccc1Cl)F 34a_100000694953_100011934791 [1,1,0,0,0,0|2,0,0]=4 7371 B13R1.8919 FCCCOc1c(cccc1Cl)F 7a_100000694953_100011934791 [1,1,0,0,0,0|2,0,0]=4 7372 B13R1.8919 FCCCOc1c(cccc1F)F 34a_100000230165_100011934791 [1,1,0,0,0,0|2,0,0]=4 7373 B13R1.8919 FCCCOc1c(cccc1F)F 7a_100000230165_100011934791 [1,1,0,0,0,0|2,0,0]=4 7374 B13R1.8919 FCCCOc1c(cccc1I)Br 34a_100010084509_100011934791 [1,1,0,0,0,0|2,0,0]=4 7375 B13R1.8919 FCCCOc1c(cccc1I)Br 7a_100010084509_100011934791 [1,1,0,0,0,0|2,0,0]=4 7376 B13R1.8919 FCCCOc1c(cccc1I)Cl 34a_100010202889_100011934791 [1,1,0,0,0,0|2,0,0]=4 7377 B13R1.8919 FCCCOc1c(cccc1I)Cl 7a_100010202889_100011934791 [1,1,0,0,0,0|2,0,0]=4 7378 B13R1.8919 FCCCOc1c(cccc1I)F 34a_100010186298_100011934791 [1,1,0,0,0,0|2,0,0]=4 7379 B13R1.8919 FCCCOc1c(cccc1I)F 7a_100010186298_100011934791 [1,1,0,0,0,0|2,0,0]=4 7380 B13R1.8919 NCCOCc1c(cccc1Br)Cl 34a_100000210304_100010138402 [1,1,0,0,0,0|2,0,0]=4 7381 B13R1.8919 NCCOCc1c(cccc1Br)F 34a_100000210304_100012145669 [1,1,0,0,0,0|2,0,0]=4 7382 B13R1.8919 NCCOCc1c(cccc1Cl)Cl 34a_100000210304_100000187851 [1,1,0,0,0,0|2,0,0]=4 7383 B13R1.8919 NCCOCc1c(cccc1Cl)F 34a_100000210304_100000187852 [1,1,0,0,0,0|2,0,0]=4 7384 B13R1.8919 NCCOCc1c(cccc1F)F 34a_100000210304_100000698325 [1,1,0,0,0,0|2,0,0]=4 7385 B13R1.8919 NCCOCc1c(cccc1I)Br 34a_100000210304_100010146611 [1,1,0,0,0,0|2,0,0]=4 7386 B13R1.8919 NCCOCc1c(cccc1I)F 34a_100000210304_100010149602 [1,1,0,0,0,0|2,0,0]=4 7387 B13R1.8919 Nc1cccc(c1OCCCF)Br 34a_100011934915_100011934791 [1,1,0,0,0,0|2,0,0]=4 7388 B13R1.8919 Nc1cccc(c1OCCCF)Cl 34a_100000754742_100011934791 [1,1,0,0,0,0|2,0,0]=4 7389 B13R1.8919 Nc1cccc(c1OCCCF)F 34a_100011934987_100011934791 [1,1,0,0,0,0|2,0,0]=4 7390 B13R1.8919 Nc1cccc(c1OCCCF)I 34a_100010084371_100011934791 [1,1,0,0,0,0|2,0,0]=4 7391 B13R1.8919 Nc1cccc(c1OCCCF)N 34a_200016994477_100011934791 [1,1,0,0,0,0|2,0,0]=4 7392 B13R1.8919 Nc1cccc(c1OCCCO)Br 34a_100011934915_100000230001 [1,1,0,0,0,0|2,0,0]=4 7393 B13R1.8919 Nc1cccc(c1OCCCO)Cl 34a_100000754742_100000230001 [1,1,0,0,0,0|2,0,0]=4 7394 B13R1.8919 Nc1cccc(c1OCCCO)F 34a_100011934987_100000230001 [1,1,0,0,0,0|2,0,0]=4 7395 B13R1.8919 Nc1cccc(c1OCCCO)I 34a_100010084371_100000230001 [1,1,0,0,0,0|2,0,0]=4 7396 B13R1.8919 Nc1cccc(c1OCCCO)N 34a_200016994477_100000230001 [1,1,0,0,0,0|2,0,0]=4 7397 B13R1.8919 OCCCOc1c(cccc1Br)Br 34a_100000736428_100000230001 [1,1,0,0,0,0|2,0,0]=4 7398 B13R1.8919 OCCCOc1c(cccc1Br)Br 7a_100000736428_100011215043 [1,1,0,0,0,0|2,0,0]=4 7399 B13R1.8919 OCCCOc1c(cccc1Br)Cl 34a_100010214474_100000230001 [1,1,0,0,0,0|2,0,0]=4 7400 B13R1.8919 OCCCOc1c(cccc1Br)Cl 7a_100010214474_100011215043 [1,1,0,0,0,0|2,0,0]=4 7401 B13R1.8919 OCCCOc1c(cccc1Br)F 34a_100009813666_100000230001 [1,1,0,0,0,0|2,0,0]=4 7402 B13R1.8919 OCCCOc1c(cccc1Br)F 7a_100009813666_100011215043 [1,1,0,0,0,0|2,0,0]=4 7403 B13R1.8919 OCCCOc1c(cccc1Cl)Cl 34a_100000211709_100000230001 [1,1,0,0,0,0|2,0,0]=4 7404 B13R1.8919 OCCCOc1c(cccc1Cl)Cl 7a_100000211709_100011215043 [1,1,0,0,0,0|2,0,0]=4 7405 B13R1.8919 OCCCOc1c(cccc1Cl)F 34a_100000694953_100000230001 [1,1,0,0,0,0|2,0,0]=4 7406 B13R1.8919 OCCCOc1c(cccc1Cl)F 7a_100000694953_100011215043 [1,1,0,0,0,0|2,0,0]=4 7407 B13R1.8919 OCCCOc1c(cccc1F)F 34a_100000230165_100000230001 [1,1,0,0,0,0|2,0,0]=4 7408 B13R1.8919 OCCCOc1c(cccc1F)F 7a_100000230165_100011215043 [1,1,0,0,0,0|2,0,0]=4 7409 B13R1.8919 OCCCOc1c(cccc1I)Br 34a_100010084509_100000230001 [1,1,0,0,0,0|2,0,0]=4 7410 B13R1.8919 OCCCOc1c(cccc1I)Br 7a_100010084509_100011215043 [1,1,0,0,0,0|2,0,0]=4 7411 B13R1.8919 OCCCOc1c(cccc1I)Cl 34a_100010202889_100000230001 [1,1,0,0,0,0|2,0,0]=4 7412 B13R1.8919 OCCCOc1c(cccc1I)Cl 7a_100010202889_100011215043 [1,1,0,0,0,0|2,0,0]=4 7413 B13R1.8919 OCCCOc1c(cccc1I)F 34a_100010186298_100000230001 [1,1,0,0,0,0|2,0,0]=4 7414 B13R1.8919 OCCCOc1c(cccc1I)F 7a_100010186298_100011215043 [1,1,0,0,0,0|2,0,0]=4 7415 B13R1.8919 [13CH3]OCCOc1c(cccc1Cl)Cl 34a_200011235770_200025704644 [1,1,0,0,0,0|2,0,0]=4 7416 B13R1.8919 [13CH3]OCCOc1c(cccc1Cl)Cl 7a_200011235770_200025704644 [1,1,0,0,0,0|2,0,0]=4 7417 B13R1.8919 [13CH3]SCCOc1c(cccc1Cl)Cl 62a_100000184560_200025704644 [1,1,0,0,0,0|2,0,0]=4 7418 B13R1.8919 [13CH3]SCCOc1c(cccc1Cl)Cl 62a_200025704644_100000184560 [1,1,0,0,0,0|2,0,0]=4 7419 B13R1.885 Cc1c(ccc(c1OC(C)C)Br)Cl 34a_200010391122_100000210206 [0,1,0,0,1,0|2,0,0]=4 7420 B13R1.885 Cc1c(ccc(c1OC(C)C)Br)Cl 7a_200010391122_100000210206 [0,1,0,0,1,0|2,0,0]=4 7421 B13R1.885 Cc1c(ccc(c1OC(C)C)Br)F 34a_200010391124_100000210206 [0,1,0,0,1,0|2,0,0]=4 7422 B13R1.885 Cc1c(ccc(c1OC(C)C)Br)F 7a_200010391124_100000210206 [0,1,0,0,1,0|2,0,0]=4 7423 B13R1.885 Cc1ccc(c(c1C)NC(C)C)C 2230a_100000117417_100000210206 [0,1,0,0,1,0|2,0,0]=4 7424 B13R1.885 Cc1ccc(c(c1C)NC(C)C)C 34a_100000117417_100000210206 [0,1,0,0,1,0|2,0,0]=4 7425 B13R1.885 Cc1ccc(c(c1C)NC(C)C)C 7a_100000117417_100000210206 [0,1,0,0,1,0|2,0,0]=4 7426 B13R1.885 Cc1ccc(c(c1C)OC(C)C)C 34a_100000211305_100000210206 [0,1,0,0,1,0|1,0,0]=3 7427 B13R1.885 Cc1ccc(c(c1C)OC(C)C)C 7a_100000211305_100000210206 [0,1,0,0,1,0|1,0,0]=3 7428 B13R1.885 Cc1ccc(c(c1NC(C)C)C)Br 34a_200010074581_100000210206 [0,1,0,0,1,0|2,0,0]=4 7429 B13R1.885 Cc1ccc(c(c1NC(C)C)C)Cl 2230a_200020642106_100000210206 [0,1,0,0,1,0|2,0,0]=4 7430 B13R1.885 Cc1ccc(c(c1NC(C)C)C)Cl 34a_200020642106_100000210206 [0,1,0,0,1,0|2,0,0]=4 7431 B13R1.885 Cc1ccc(c(c1NC(C)C)C)I 34a_200010115591_100000210206 [0,1,0,0,1,0|2,0,0]=4 7432 B13R1.885 Cc1ccc(c(c1OC(C)C)Cl)N 34a_100000036876_100000210206 [0,1,0,0,1,0|2,0,0]=4 7433 B13R1.885 Cc1ccc(c(c1OC(C)C)Cl)N 7a_100000036876_100000210206 [0,1,0,0,1,0|2,0,0]=4 7434 B13R1.885 Cc1ccc(c(c1SC(C)C)C)F 62a_100000210206_100011068659 [0,1,0,0,1,0|1,1,0]=4 7435 B13R1.885 Cc1ccc(c(c1SC(C)C)C)F 62a_100011068659_100000210206 [0,1,0,0,1,0|1,1,0]=4 7436 B13R1.885 Cc1ccc(c(c1SC(C)C)C)N 62a_100000210206_106354213274 [0,1,0,0,1,0|1,1,0]=4 7437 B13R1.885 Cc1ccc(c(c1SC(C)C)C)N 62a_106354213274_100000210206 [0,1,0,0,1,0|1,1,0]=4 7438 B13R1.885 Cc1ccc(c(c1SC(C)C)C)O 62a_100000210206_100010659238 [0,1,0,0,1,0|1,1,0]=4 7439 B13R1.885 Cc1ccc(c(c1SC(C)C)C)O 62a_100010659238_100000210206 [0,1,0,0,1,0|1,1,0]=4 7440 B13R1.2135 CC(C)Oc1c(cccc1CO)F 34a_100011997349_100000210206 [0,1,0,0,1,0|2,0,0]=4 7441 B13R1.2135 CC(C)Oc1c(cccc1CO)F 7a_100011997349_100000210206 [0,1,0,0,1,0|2,0,0]=4 7442 B13R1.2135 CC(C)Oc1c(cccc1N[13CH3])Cl 2230a_100000757678_200025704644 [0,1,0,0,1,0|2,0,0]=4 7443 B13R1.2135 CC(C)Oc1c(cccc1N[13CH3])Cl 34a_100000757678_200025704644 [0,1,0,0,1,0|2,0,0]=4 7444 B13R1.2135 CC(C)Oc1c(cccc1S[13CH3])F 62a_200010078528_200025704644 [0,1,0,0,1,0|2,0,0]=4 7445 B13R1.2135 CC(C)Oc1c(cccc1S[13CH3])F 62a_200025704644_200010078528 [0,1,0,0,1,0|2,0,0]=4 7446 B13R1.2135 CCc1cccc(c1NC(C)C)C 2230a_100000210048_100000210206 [0,1,0,0,1,0|2,0,0]=4 7447 B13R1.2135 CCc1cccc(c1NC(C)C)C 34a_100000210048_100000210206 [0,1,0,0,1,0|2,0,0]=4 7448 B13R1.2135 CCc1cccc(c1NC(C)C)C 7a_100000210048_100000210206 [0,1,0,0,1,0|2,0,0]=4 7449 B13R1.2135 CCc1cccc(c1OC(C)C)Br 34a_200010001580_100000210206 [0,1,0,0,1,0|2,0,0]=4 7450 B13R1.2135 CCc1cccc(c1OC(C)C)Br 7a_200010001580_100000210206 [0,1,0,0,1,0|2,0,0]=4 7451 B13R1.2135 CCc1cccc(c1OC(C)C)C 34a_100000034007_100000210206 [0,1,0,0,1,0|1,0,0]=3 7452 B13R1.2135 CCc1cccc(c1OC(C)C)C 7a_100000034007_100000210206 [0,1,0,0,1,0|1,0,0]=3 7453 B13R1.2135 CCc1cccc(c1SC(C)C)C 62a_100000036235_100000210206 [0,1,0,0,1,0|1,1,0]=4 7454 B13R1.2135 CCc1cccc(c1SC(C)C)C 62a_100000210206_100000036235 [0,1,0,0,1,0|1,1,0]=4 7455 B13R1.2135 CNc1cccc(c1OC(C)C)Cl 2230a_100000757678_200000210301 [0,1,0,0,1,0|2,0,0]=4 7456 B13R1.2135 CNc1cccc(c1OC(C)C)Cl 34a_100000757678_200000210301 [0,1,0,0,1,0|2,0,0]=4 7457 B13R1.2135 COc1cccc(c1CN(C)C)C 270004a_100102631434_100000050978 [0,1,0,0,1,0|2,0,0]=4 7458 B13R1.2135 COc1cccc(c1NC(C)C)C 2230a_100000758225_100000210206 [0,1,0,0,1,0|2,0,0]=4 7459 B13R1.2135 COc1cccc(c1NC(C)C)C 34a_100000758225_100000210206 [0,1,0,0,1,0|2,0,0]=4 7460 B13R1.2135 COc1cccc(c1OC(C)C)Br 34a_100000686866_100000210206 [0,1,0,0,1,0|2,0,0]=4 7461 B13R1.2135 COc1cccc(c1OC(C)C)C 34a_100011219253_100000210206 [0,1,0,0,1,0|1,0,0]=3 7462 B13R1.2135 COc1cccc(c1OC(C)C)C 7a_100011219253_100000210206 [0,1,0,0,1,0|1,0,0]=3 7463 B13R1.2135 COc1cccc(c1OC(C)C)Cl 34a_100009851661_100000210206 [0,1,0,0,1,0|2,0,0]=4 7464 B13R1.2135 COc1cccc(c1OC(C)C)Cl 7a_100009851661_100000210206 [0,1,0,0,1,0|2,0,0]=4 7465 B13R1.2135 COc1cccc(c1OC(C)C)F 34a_100000036725_100000210206 [0,1,0,0,1,0|2,0,0]=4 7466 B13R1.2135 COc1cccc(c1OC(C)C)F 7a_100000036725_100000210206 [0,1,0,0,1,0|2,0,0]=4 7467 B13R1.2135 COc1cccc(c1OC(C)C)N 34a_100000123586_100000210206 [0,1,0,0,1,0|2,0,0]=4 7468 B13R1.2135 COc1cccc(c1SC(C)C)C 62a_100000210206_100010191535 [0,1,0,0,1,0|1,1,0]=4 7469 B13R1.2135 COc1cccc(c1SC(C)C)C 62a_100010191535_100000210206 [0,1,0,0,1,0|1,1,0]=4 7470 B13R1.2135 CSc1cccc(c1OC(C)C)F 62a_200000210301_200010078528 [0,1,0,0,1,0|2,0,0]=4 7471 B13R1.2135 CSc1cccc(c1OC(C)C)F 62a_200010078528_200000210301 [0,1,0,0,1,0|2,0,0]=4 7472 B13R1.2135 CSc1cccc(c1OC(F)F)C 62a_100010232499_200000210301 [0,1,0,0,1,0|2,0,0]=4 7473 B13R1.2135 CSc1cccc(c1OC(F)F)C 62a_200000210301_100010232499 [0,1,0,0,1,0|2,0,0]=4 7474 B13R1.2135 Cc1cccc(c1NC(C)C)CO 34a_100011215590_100000210206 [0,1,0,0,1,0|2,0,0]=4 7475 B13R1.2135 Cc1cccc(c1OC(C)C)C#N 34a_100011659161_100000210206 [0,1,0,0,1,0|1,0,1]=4 7476 B13R1.2135 Cc1cccc(c1OC(C)C)C#N 7a_100011659161_100000210206 [0,1,0,0,1,0|1,0,1]=4 7477 B13R1.2135 Cc1cccc(c1OC(C)C)CN 34a_100020639391_100000210206 [0,1,0,0,1,0|1,0,0]=3 7478 B13R1.2135 Cc1cccc(c1OC(F)F)S[13CH3] 62a_100010232499_200025704644 [0,1,0,0,1,0|2,0,0]=4 7479 B13R1.2135 Cc1cccc(c1OC(F)F)S[13CH3] 62a_200025704644_100010232499 [0,1,0,0,1,0|2,0,0]=4 7480 B13R1.2135 Cc1cccc(c1SC(C)C)CO 62a_100000210206_100011659289 [0,1,0,0,1,0|1,1,0]=4 7481 B13R1.2135 Cc1cccc(c1SC(C)C)CO 62a_100011659289_100000210206 [0,1,0,0,1,0|1,1,0]=4 7482 B13R1.2808 CC(=O)Cc1c(cc(cc1C)C)C 1458a_100000070787_100000749405 [0,1,0,0,1,0|1,0,1]=4 7483 B13R1.2808 CC(=O)Cc1c(cc(cc1C)C)C 1458a_100000696705_200000210301 [0,1,0,0,1,0|1,0,1]=4 7484 B13R1.2808 CC(=O)Oc1c(cc(cc1C)O)C 271570a_203496583355_200009816532 [0,1,0,0,1,0|1,0,1]=4 7485 B13R1.2808 Cc1cc(c(c(c1)Br)OC(C)C)C 34a_100011934984_100000210206 [0,1,0,0,1,0|2,0,0]=4 7486 B13R1.2808 Cc1cc(c(c(c1)Br)OC(C)C)C 7a_100011934984_100000210206 [0,1,0,0,1,0|2,0,0]=4 7487 B13R1.2808 Cc1cc(c(c(c1)C)CC(=O)[13CH3])C 1458a_100000696705_200025704644 [0,1,0,0,1,0|1,0,1]=4 7488 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)C)C 2230a_100102631434_100000749405 [0,1,0,0,1,0|2,0,0]=4 7489 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)C)C 2230a_103437849314_200000210301 [0,1,0,0,1,0|2,0,0]=4 7490 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)C)C 269982a_100102631434_100000749405 [0,1,0,0,1,0|2,0,0]=4 7491 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)C)C 269982a_103437849314_200000210301 [0,1,0,0,1,0|2,0,0]=4 7492 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)C)C 270004a_100102631434_100000211105 [0,1,0,0,1,0|2,0,0]=4 7493 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)C)C 34a_103437849314_200000210301 [0,1,0,0,1,0|2,0,0]=4 7494 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)[13CH3])C 2230a_103437849314_200025704644 [0,1,0,0,1,0|2,0,0]=4 7495 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)[13CH3])C 269982a_103437849314_200025704644 [0,1,0,0,1,0|2,0,0]=4 7496 B13R1.2808 Cc1cc(c(c(c1)C)CN(C)[13CH3])C 34a_103437849314_200025704644 [0,1,0,0,1,0|2,0,0]=4 7497 B13R1.2808 Cc1cc(c(c(c1)C)NC(C)C)C 34a_100000210045_100000210206 [0,1,0,0,1,0|2,0,0]=4 7498 B13R1.2808 Cc1cc(c(c(c1)C)NC(C)C)C 7a_100000210045_100000210206 [0,1,0,0,1,0|2,0,0]=4 7499 B13R1.2808 Cc1cc(c(c(c1)C)OC(C)C)C 34a_100000212074_100000210206 [0,1,0,0,1,0|1,0,0]=3 7500 B13R1.2808 Cc1cc(c(c(c1)C)OC(C)C)C 7a_100000212074_100000210206 [0,1,0,0,1,0|1,0,0]=3 7501 B13R1.2808 Cc1cc(c(c(c1)C)SC(C)C)C 62a_100000210206_100011204320 [0,1,0,0,1,0|1,1,0]=4 7502 B13R1.2808 Cc1cc(c(c(c1)C)SC(C)C)C 62a_100011204320_100000210206 [0,1,0,0,1,0|1,1,0]=4 7503 B13R1.2808 Cc1cc(c(c(c1)N)OC(C)C)C 34a_100011216242_100000210206 [0,1,0,0,1,0|2,0,0]=4 7504 B13R1.2808 Cc1cc(c(c(c1)N)OC(C)C)C 7a_100011216242_100000210206 [0,1,0,0,1,0|2,0,0]=4 7505 B13R1.2808 Cc1cc(cc(c1CN(C)C)C)Br 270004a_100102631434_100010238521 [0,1,0,0,1,0|2,0,0]=4 7506 B13R1.2808 Cc1cc(cc(c1CN(C)C)C)Cl 270004a_100102631434_100000693520 [0,1,0,0,1,0|2,0,0]=4 7507 B13R1.2808 Cc1cc(cc(c1CN(C)C)C)F 270004a_100102631434_100012179923 [0,1,0,0,1,0|2,0,0]=4 7508 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)Br 34a_100000737279_100000210206 [0,1,0,0,1,0|2,0,0]=4 7509 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)Br 7a_100000737279_100000210206 [0,1,0,0,1,0|2,0,0]=4 7510 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)Cl 34a_100000692879_100000210206 [0,1,0,0,1,0|2,0,0]=4 7511 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)Cl 7a_100000692879_100000210206 [0,1,0,0,1,0|2,0,0]=4 7512 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)F 34a_100011290887_100000210206 [0,1,0,0,1,0|2,0,0]=4 7513 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)F 7a_100011290887_100000210206 [0,1,0,0,1,0|2,0,0]=4 7514 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)I 7a_100011356821_100000210206 [0,1,0,0,1,0|2,0,0]=4 7515 B13R1.2808 Cc1cc(cc(c1NC(C)C)C)O 34a_100011934200_100000210206 [0,1,0,0,1,0|2,0,0]=4 7516 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)Br 34a_100000186369_100000210206 [0,1,0,0,1,0|2,0,0]=4 7517 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)Br 7a_100000186369_100000210206 [0,1,0,0,1,0|2,0,0]=4 7518 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)Cl 34a_100012337756_100000210206 [0,1,0,0,1,0|2,0,0]=4 7519 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)Cl 7a_100012337756_100000210206 [0,1,0,0,1,0|2,0,0]=4 7520 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)I 34a_100010982682_100000210206 [0,1,0,0,1,0|2,0,0]=4 7521 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)I 7a_100010982682_100000210206 [0,1,0,0,1,0|2,0,0]=4 7522 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)N 34a_100010064301_100000210206 [0,1,0,0,1,0|2,0,0]=4 7523 B13R1.2808 Cc1cc(cc(c1OC(C)C)Br)N 7a_100010064301_100000210206 [0,1,0,0,1,0|2,0,0]=4 7524 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)Br 34a_100000187306_100000210206 [0,1,0,0,1,0|1,0,0]=3 7525 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)Br 7a_100000187306_100000210206 [0,1,0,0,1,0|1,0,0]=3 7526 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)Cl 34a_100000211519_100000210206 [0,1,0,0,1,0|1,0,0]=3 7527 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)Cl 7a_100000211519_100000210206 [0,1,0,0,1,0|1,0,0]=3 7528 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)F 34a_100000081862_100000210206 [0,1,0,0,1,0|1,0,0]=3 7529 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)F 7a_100000081862_100000210206 [0,1,0,0,1,0|1,0,0]=3 7530 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)I 34a_100011216129_100000210206 [0,1,0,0,1,0|1,0,0]=3 7531 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)I 7a_100011216129_100000210206 [0,1,0,0,1,0|1,0,0]=3 7532 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)N 34a_100000703291_100000210206 [0,1,0,0,1,0|1,0,0]=3 7533 B13R1.2808 Cc1cc(cc(c1OC(C)C)C)N 7a_100000703291_100000210206 [0,1,0,0,1,0|1,0,0]=3 7534 B13R1.2808 Cc1cc(cc(c1OC(C)C)Cl)Br 34a_100000211485_100000210206 [0,1,0,0,1,0|2,0,0]=4 7535 B13R1.2808 Cc1cc(cc(c1OC(C)C)Cl)Br 7a_100000211485_100000210206 [0,1,0,0,1,0|2,0,0]=4 7536 B13R1.2808 Cc1cc(cc(c1OC(C)C)Cl)Cl 34a_100011218458_100000210206 [0,1,0,0,1,0|2,0,0]=4 7537 B13R1.2808 Cc1cc(cc(c1OC(C)C)Cl)Cl 7a_100011218458_100000210206 [0,1,0,0,1,0|2,0,0]=4 7538 B13R1.2808 Cc1cc(cc(c1OC(C)C)Cl)I 34a_200015900153_100000210206 [0,1,0,0,1,0|2,0,0]=4 7539 B13R1.2808 Cc1cc(cc(c1OC(C)C)Cl)I 7a_200015900153_100000210206 [0,1,0,0,1,0|2,0,0]=4 7540 B13R1.2808 Cc1cc(cc(c1OC(C)C)I)Cl 34a_100012343667_100000210206 [0,1,0,0,1,0|2,0,0]=4 7541 B13R1.2808 Cc1cc(cc(c1OC(C)C)I)Cl 7a_100012343667_100000210206 [0,1,0,0,1,0|2,0,0]=4 7542 B13R1.2808 Cc1cc(cc(c1OC(C)C)N)Br 34a_100011825904_100000210206 [0,1,0,0,1,0|2,0,0]=4 7543 B13R1.2808 Cc1cc(cc(c1OC(C)C)N)Br 7a_100011825904_100000210206 [0,1,0,0,1,0|2,0,0]=4 7544 B13R1.2808 Cc1cc(cc(c1OC(C)C)N)F 34a_100000130126_100000210206 [0,1,0,0,1,0|2,0,0]=4 7545 B13R1.2808 Cc1cc(cc(c1OC(C)C)N)F 7a_100000130126_100000210206 [0,1,0,0,1,0|2,0,0]=4 7546 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)Br 62a_100000210206_100009814048 [0,1,0,0,1,0|1,1,0]=4 7547 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)Br 62a_100009814048_100000210206 [0,1,0,0,1,0|1,1,0]=4 7548 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)Cl 62a_100000210206_100010244930 [0,1,0,0,1,0|1,1,0]=4 7549 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)Cl 62a_100010244930_100000210206 [0,1,0,0,1,0|1,1,0]=4 7550 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)F 62a_100000210206_100012356666 [0,1,0,0,1,0|1,1,0]=4 7551 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)F 62a_100012356666_100000210206 [0,1,0,0,1,0|1,1,0]=4 7552 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)N 62a_100000210206_100000215964 [0,1,0,0,1,0|1,1,0]=4 7553 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)N 62a_100000215964_100000210206 [0,1,0,0,1,0|1,1,0]=4 7554 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)O 62a_100000210206_100000243743 [0,1,0,0,1,0|1,1,0]=4 7555 B13R1.2808 Cc1cc(cc(c1SC(C)C)C)O 62a_100000243743_100000210206 [0,1,0,0,1,0|1,1,0]=4 7556 B13R1.3788 Cc1cccc(c1NC(C)(C)C)C 34a_100000185769_100000210625 [0,1,0,0,1,0|2,0,0]=4 7557 B13R1.3788 Cc1cccc(c1OC(C)(C)C)Br 34a_100009817157_100000210625 [0,1,0,0,1,0|2,0,0]=4 7558 B13R1.3788 Cc1cccc(c1OC(C)(C)C)C 34a_100000210341_100000210625 [0,1,0,0,1,0|1,0,0]=3 7559 B13R1.3788 Cc1cccc(c1OC(C)(C)C)Cl 34a_100000033731_100000210625 [0,1,0,0,1,0|2,0,0]=4 7560 B13R1.3788 Cc1cccc(c1OC(C)(C)C)F 34a_100011659162_100000210625 [0,1,0,0,1,0|2,0,0]=4 7561 B13R1.3788 Cc1cccc(c1OC(C)(C)C)N 34a_100000756359_100000210625 [0,1,0,0,1,0|2,0,0]=4 7562 B13R1.3788 Cc1cccc(c1OC(F)(F)F)C 34a_100000210341_200103152311 [0,1,0,0,1,0|2,0,0]=4 7563 B13R1.3788 Cc1cccc(c1OC(F)(F)F)C 7a_100000210341_200000243211 [0,1,0,0,1,0|2,0,0]=4 7564 B13R1.3788 Cc1cccc(c1SC(C)(C)C)C 62a_100000033847_100000211941 [0,1,0,0,1,0|1,1,0]=4 7565 B13R1.3788 Cc1cccc(c1SC(C)(C)C)C 62a_100000211941_100000033847 [0,1,0,0,1,0|1,1,0]=4 7566 B13R1.3788 Cc1ccnc(c1OC(C)(C)C)C 34a_100011934651_100000210625 [0,1,0,0,1,0|2,0,0]=4 7567 B13R1.3789 Cc1cccc(c1C(=O)C(C)C)C 1458a_100000758298_100000210206 [0,1,0,0,1,0|1,0,1]=4 7568 B13R1.3789 Cc1cccc(c1N(C)C(C)C)C 2230a_100011645471_100000210206 [0,1,0,0,1,0|2,0,0]=4 7569 B13R1.3789 Cc1cccc(c1N(C)C(C)C)C 269982a_100011645471_100000210206 [0,1,0,0,1,0|2,0,0]=4 7570 B13R1.3789 Cc1cccc(c1N(C)C(C)C)C 34a_100011645471_100000210206 [0,1,0,0,1,0|2,0,0]=4 7571 B15R1.1575 C=C(C)CCOc1c(cccc1CC)C 34a_100000034007_100000730704 [0,1,0,0,0,1|1,0,1]=4 7572 B15R1.1575 C=C(C)CCOc1c(cccc1CC)C 7a_100000034007_100000730704 [0,1,0,0,0,1|1,0,1]=4 7573 B15R1.1575 C=C(C)CCOc1c(cccc1CN)C 34a_100020639391_100000730704 [0,1,0,0,0,1|1,0,1]=4 7574 B15R1.1575 C=C(C)CCOc1c(cccc1OC)C 34a_100011219253_100000730704 [0,1,0,0,0,1|1,0,1]=4 7575 B15R1.1575 C=C(C)CCOc1c(cccc1OC)C 7a_100011219253_100000730704 [0,1,0,0,0,1|1,0,1]=4 7576 B15R1.1575 CC(=CCOc1c(cccc1CN)C)C 34a_100020639391_100000761012 [0,1,0,0,0,1|1,0,1]=4 7577 B15R1.1575 CC(=O)OCOc1c(cccc1CN)C 34a_100020639391_100009813279 [0,1,0,0,0,1|1,0,1]=4 7578 B15R1.1575 CC(C)CCOc1c(cccc1CO)F 34a_100011997349_100000210312 [0,1,0,0,0,1|2,0,0]=4 7579 B15R1.1575 CC(C)CCOc1c(cccc1CO)F 7a_100011997349_100000210626 [0,1,0,0,0,1|2,0,0]=4 7580 B15R1.1575 CC(C)OCOc1c(cccc1CO)F 34a_100011997349_100000709892 [0,1,0,0,0,1|2,0,0]=4 7581 B15R1.1575 CC(O)CCOc1c(cccc1CO)F 34a_100011997349_100012276601 [0,1,0,0,0,1|2,0,0]=4 7582 B15R1.1575 CC(O)CCOc1c(cccc1CO)F 7a_100011997349_100012276601 [0,1,0,0,0,1|2,0,0]=4 7583 B15R1.1575 CCc1cccc(c1C=CCC(C)C)C 271570a_100016259101_100000036235 [0,1,0,0,0,1|2,0,0]=4 7584 B15R1.1575 CCc1cccc(c1NCCC(C)C)C 2230a_100000210048_100000210312 [0,1,0,0,0,1|2,0,0]=4 7585 B15R1.1575 CCc1cccc(c1NCCC(C)C)C 34a_100000210048_100000210312 [0,1,0,0,0,1|2,0,0]=4 7586 B15R1.1575 CCc1cccc(c1NCCC(C)C)C 7a_100000210048_100000210626 [0,1,0,0,0,1|2,0,0]=4 7587 B15R1.1575 CCc1cccc(c1NCCC(C)O)C 2230a_100000210048_100012276601 [0,1,0,0,0,1|2,0,0]=4 7588 B15R1.1575 CCc1cccc(c1NCCC(C)O)C 34a_100000210048_100012276601 [0,1,0,0,0,1|2,0,0]=4 7589 B15R1.1575 CCc1cccc(c1NCCC(C)O)C 7a_100000210048_100012276601 [0,1,0,0,0,1|2,0,0]=4 7590 B15R1.1575 CCc1cccc(c1NCOC(C)C)C 2230a_100000210048_100000709892 [0,1,0,0,0,1|2,0,0]=4 7591 B15R1.1575 CCc1cccc(c1NCOC(C)C)C 34a_100000210048_100000709892 [0,1,0,0,0,1|2,0,0]=4 7592 B15R1.1575 CCc1cccc(c1OCC=C(C)C)C 34a_100000034007_100000761012 [0,1,0,0,0,1|1,0,1]=4 7593 B15R1.1575 CCc1cccc(c1OCC=C(C)C)C 7a_100000034007_100000761012 [0,1,0,0,0,1|1,0,1]=4 7594 B15R1.1575 CCc1cccc(c1OCCC(=O)C)C 7a_100000034007_100000053229 [0,1,0,0,0,1|1,0,1]=4 7595 B15R1.1575 CCc1cccc(c1OCCC(=O)N)C 34a_100000034007_100000731001 [0,1,0,0,0,1|1,0,1]=4 7596 B15R1.1575 CCc1cccc(c1OCCC(=O)N)C 7a_100000034007_100000744528 [0,1,0,0,0,1|1,0,1]=4 7597 B15R1.1575 CCc1cccc(c1OCCC(C)C)Br 34a_200010001580_100000210312 [0,1,0,0,0,1|2,0,0]=4 7598 B15R1.1575 CCc1cccc(c1OCCC(C)C)Br 7a_200010001580_100000210626 [0,1,0,0,0,1|2,0,0]=4 7599 B15R1.1575 CCc1cccc(c1OCCC(C)C)C 34a_100000034007_100000210312 [0,1,0,0,0,1|1,0,0]=3 7600 B15R1.1575 CCc1cccc(c1OCCC(C)C)C 7a_100000034007_100000210626 [0,1,0,0,0,1|1,0,0]=3 7601 B15R1.1575 CCc1cccc(c1OCCC(C)O)Br 34a_200010001580_100012276601 [0,1,0,0,0,1|2,0,0]=4 7602 B15R1.1575 CCc1cccc(c1OCCC(C)O)Br 7a_200010001580_100012276601 [0,1,0,0,0,1|2,0,0]=4 7603 B15R1.1575 CCc1cccc(c1OCCC(C)O)C 34a_100000034007_100012276601 [0,1,0,0,0,1|1,0,0]=3 7604 B15R1.1575 CCc1cccc(c1OCCC(C)O)C 7a_100000034007_100012276601 [0,1,0,0,0,1|1,0,0]=3 7605 B15R1.1575 CCc1cccc(c1OCCN(C)C)C 7a_100000034007_100000755713 [0,1,0,0,0,1|2,0,0]=4 7606 B15R1.1575 CCc1cccc(c1OCOC(=O)C)C 34a_100000034007_100009813279 [0,1,0,0,0,1|1,0,1]=4 7607 B15R1.1575 CCc1cccc(c1OCOC(C)C)Br 34a_200010001580_100000709892 [0,1,0,0,0,1|2,0,0]=4 7608 B15R1.1575 CCc1cccc(c1OCOC(C)C)C 34a_100000034007_100000709892 [0,1,0,0,0,1|1,0,0]=3 7609 B15R1.1575 CCc1cccc(c1SCCC(C)C)C 62a_100000036235_100000210312 [0,1,0,0,0,1|1,1,0]=4 7610 B15R1.1575 CCc1cccc(c1SCCC(C)C)C 62a_100000210312_100000036235 [0,1,0,0,0,1|1,1,0]=4 7611 B15R1.1575 CCc1cccc(c1SCCC(C)O)C 62a_100000036235_100012276601 [0,1,0,0,0,1|1,1,0]=4 7612 B15R1.1575 CCc1cccc(c1SCCC(C)O)C 62a_100012276601_100000036235 [0,1,0,0,0,1|1,1,0]=4 7613 B15R1.1575 CCc1cccc(c1SCOC(C)C)C 62a_100000036235_100000709892 [0,1,0,0,0,1|1,1,0]=4 7614 B15R1.1575 CCc1cccc(c1SCOC(C)C)C 62a_100000709892_100000036235 [0,1,0,0,0,1|1,1,0]=4 7615 B15R1.1575 COc1cccc(c1CNCC(C)C)C 207a_100000210953_100000050978 [0,1,0,0,0,1|2,0,0]=4 7616 B15R1.1575 COc1cccc(c1CNCC(C)C)C 270004a_100000210953_100000050978 [0,1,0,0,0,1|2,0,0]=4 7617 B15R1.1575 COc1cccc(c1CNCC(C)O)C 207a_100000210904_100000050978 [0,1,0,0,0,1|2,0,0]=4 7618 B15R1.1575 COc1cccc(c1CNCC(C)O)C 270004a_100000210904_100000050978 [0,1,0,0,0,1|2,0,0]=4 7619 B15R1.1575 COc1cccc(c1COCC(C)Br)Cl 34a_100012180447_100012349678 [0,1,0,0,0,1|2,0,0]=4 7620 B15R1.1575 COc1cccc(c1COCC(C)Br)F 34a_100012180447_100011216731 [0,1,0,0,0,1|2,0,0]=4 7621 B15R1.1575 COc1cccc(c1COCC(C)C)Cl 34a_100000210257_100012349678 [0,1,0,0,0,1|2,0,0]=4 7622 B15R1.1575 COc1cccc(c1COCC(C)C)F 34a_100000210257_100011216731 [0,1,0,0,0,1|2,0,0]=4 7623 B15R1.1575 COc1cccc(c1COCC(C)C)F 34a_100011216733_100000210624 [0,1,0,0,0,1|2,0,0]=4 7624 B15R1.1575 COc1cccc(c1COCC(C)C)F 7a_100011216733_100000210760 [0,1,0,0,0,1|2,0,0]=4 7625 B15R1.1575 COc1cccc(c1COCC(C)F)Cl 34a_100015925927_100012349678 [0,1,0,0,0,1|2,0,0]=4 7626 B15R1.1575 COc1cccc(c1COCC(C)F)F 34a_100015925927_100011216731 [0,1,0,0,0,1|2,0,0]=4 7627 B15R1.1575 COc1cccc(c1COCC(C)O)F 34a_100011216733_100011218427 [0,1,0,0,0,1|2,0,0]=4 7628 B15R1.1575 COc1cccc(c1COCC(C)O)F 7a_100011216733_100011218427 [0,1,0,0,0,1|2,0,0]=4 7629 B15R1.1575 COc1cccc(c1COC[C@@H](C)Cl)Cl 34a_100016084084_100012349678 [0,1,0,0,0,1|2,0,0]=4 7630 B15R1.1575 COc1cccc(c1COC[C@@H](C)Cl)F 34a_100016084084_100011216731 [0,1,0,0,0,1|2,0,0]=4 7631 B15R1.1575 COc1cccc(c1COC[C@@H](C)N)Cl 34a_100000737577_100012349678 [0,1,0,0,0,1|1,0,0]=3 7632 B15R1.1575 COc1cccc(c1COC[C@@H](C)N)F 34a_100000737577_100011216731 [0,1,0,0,0,1|1,0,0]=3 7633 B15R1.1575 COc1cccc(c1COC[C@@H](C)O)F 34a_100011216733_100009817552 [0,1,0,0,0,1|2,0,0]=4 7634 B15R1.1575 COc1cccc(c1COC[C@@H](C)O)F 7a_100011216733_100009817552 [0,1,0,0,0,1|2,0,0]=4 7635 B15R1.1575 COc1cccc(c1NCCC(C)C)C 2230a_100000758225_100000210312 [0,1,0,0,0,1|2,0,0]=4 7636 B15R1.1575 COc1cccc(c1NCCC(C)C)C 34a_100000758225_100000210312 [0,1,0,0,0,1|2,0,0]=4 7637 B15R1.1575 COc1cccc(c1NCCC(C)O)C 2230a_100000758225_100012276601 [0,1,0,0,0,1|2,0,0]=4 7638 B15R1.1575 COc1cccc(c1NCCC(C)O)C 34a_100000758225_100012276601 [0,1,0,0,0,1|2,0,0]=4 7639 B15R1.1575 COc1cccc(c1NCOC(C)C)C 2230a_100000758225_100000709892 [0,1,0,0,0,1|2,0,0]=4 7640 B15R1.1575 COc1cccc(c1NCOC(C)C)C 34a_100000758225_100000709892 [0,1,0,0,0,1|2,0,0]=4 7641 B15R1.1575 COc1cccc(c1OCC=C(C)C)C 34a_100011219253_100000761012 [0,1,0,0,0,1|1,0,1]=4 7642 B15R1.1575 COc1cccc(c1OCC=C(C)C)C 7a_100011219253_100000761012 [0,1,0,0,0,1|1,0,1]=4 7643 B15R1.1575 COc1cccc(c1OCCC(=O)C)C 7a_100011219253_100000053229 [0,1,0,0,0,1|1,0,1]=4 7644 B15R1.1575 COc1cccc(c1OCCC(=O)N)C 34a_100011219253_100000731001 [0,1,0,0,0,1|1,0,1]=4 7645 B15R1.1575 COc1cccc(c1OCCC(=O)N)C 7a_100011219253_100000744528 [0,1,0,0,0,1|1,0,1]=4 7646 B15R1.1575 COc1cccc(c1OCCC(C)C)Br 34a_100000686866_100000210312 [0,1,0,0,0,1|2,0,0]=4 7647 B15R1.1575 COc1cccc(c1OCCC(C)C)C 34a_100011219253_100000210312 [0,1,0,0,0,1|1,0,0]=3 7648 B15R1.1575 COc1cccc(c1OCCC(C)C)C 7a_100011219253_100000210626 [0,1,0,0,0,1|1,0,0]=3 7649 B15R1.1575 COc1cccc(c1OCCC(C)C)Cl 34a_100009851661_100000210312 [0,1,0,0,0,1|2,0,0]=4 7650 B15R1.1575 COc1cccc(c1OCCC(C)C)Cl 7a_100009851661_100000210626 [0,1,0,0,0,1|2,0,0]=4 7651 B15R1.1575 COc1cccc(c1OCCC(C)C)F 34a_100000036725_100000210312 [0,1,0,0,0,1|2,0,0]=4 7652 B15R1.1575 COc1cccc(c1OCCC(C)C)F 7a_100000036725_100000210626 [0,1,0,0,0,1|2,0,0]=4 7653 B15R1.1575 COc1cccc(c1OCCC(C)C)N 34a_100000123586_100000210312 [0,1,0,0,0,1|2,0,0]=4 7654 B15R1.1575 COc1cccc(c1OCCC(C)O)Br 34a_100000686866_100012276601 [0,1,0,0,0,1|2,0,0]=4 7655 B15R1.1575 COc1cccc(c1OCCC(C)O)C 34a_100011219253_100012276601 [0,1,0,0,0,1|1,0,0]=3 7656 B15R1.1575 COc1cccc(c1OCCC(C)O)C 7a_100011219253_100012276601 [0,1,0,0,0,1|1,0,0]=3 7657 B15R1.1575 COc1cccc(c1OCCC(C)O)Cl 34a_100009851661_100012276601 [0,1,0,0,0,1|2,0,0]=4 7658 B15R1.1575 COc1cccc(c1OCCC(C)O)Cl 7a_100009851661_100012276601 [0,1,0,0,0,1|2,0,0]=4 7659 B15R1.1575 COc1cccc(c1OCCC(C)O)F 34a_100000036725_100012276601 [0,1,0,0,0,1|2,0,0]=4 7660 B15R1.1575 COc1cccc(c1OCCC(C)O)F 7a_100000036725_100012276601 [0,1,0,0,0,1|2,0,0]=4 7661 B15R1.1575 COc1cccc(c1OCCC(C)O)N 34a_100000123586_100012276601 [0,1,0,0,0,1|2,0,0]=4 7662 B15R1.1575 COc1cccc(c1OCCN(C)C)C 7a_100011219253_100000755713 [0,1,0,0,0,1|2,0,0]=4 7663 B15R1.1575 COc1cccc(c1OCOC(=O)C)C 34a_100011219253_100009813279 [0,1,0,0,0,1|1,0,1]=4 7664 B15R1.1575 COc1cccc(c1OCOC(C)C)Br 34a_100000686866_100000709892 [0,1,0,0,0,1|2,0,0]=4 7665 B15R1.1575 COc1cccc(c1OCOC(C)C)C 34a_100011219253_100000709892 [0,1,0,0,0,1|1,0,0]=3 7666 B15R1.1575 COc1cccc(c1OCOC(C)C)Cl 34a_100009851661_100000709892 [0,1,0,0,0,1|2,0,0]=4 7667 B15R1.1575 COc1cccc(c1OCOC(C)C)F 34a_100000036725_100000709892 [0,1,0,0,0,1|2,0,0]=4 7668 B15R1.1575 COc1cccc(c1OCOC(C)C)N 34a_100000123586_100000709892 [0,1,0,0,0,1|2,0,0]=4 7669 B15R1.1575 COc1cccc(c1SCCC(C)C)C 62a_100000210312_100010191535 [0,1,0,0,0,1|1,1,0]=4 7670 B15R1.1575 COc1cccc(c1SCCC(C)C)C 62a_100010191535_100000210312 [0,1,0,0,0,1|1,1,0]=4 7671 B15R1.1575 COc1cccc(c1SCCC(C)O)C 62a_100010191535_100012276601 [0,1,0,0,0,1|1,1,0]=4 7672 B15R1.1575 COc1cccc(c1SCCC(C)O)C 62a_100012276601_100010191535 [0,1,0,0,0,1|1,1,0]=4 7673 B15R1.1575 COc1cccc(c1SCOC(C)C)C 62a_100000709892_100010191535 [0,1,0,0,0,1|1,1,0]=4 7674 B15R1.1575 COc1cccc(c1SCOC(C)C)C 62a_100010191535_100000709892 [0,1,0,0,0,1|1,1,0]=4 7675 B15R1.1575 C[C@@H](N)COCc1c(cccc1C#N)Br 34a_100000737577_100010145454 [0,1,0,0,0,1|1,0,1]=4 7676 B15R1.1575 C[C@@H](N)COCc1c(cccc1C#N)Cl 34a_100000737577_100010254528 [0,1,0,0,0,1|1,0,1]=4 7677 B15R1.1575 C[C@@H](N)COCc1c(cccc1C#N)F 34a_100000737577_100010254529 [0,1,0,0,0,1|1,0,1]=4 7678 B15R1.1575 C[C@@H](N)COCc1c(cccc1C=O)F 34a_100000737577_100010132767 [0,1,0,0,0,1|1,0,1]=4 7679 B15R1.1575 Cc1cccc(c1C=CCC(C)C)CO 271570a_100016259101_100011659289 [0,1,0,0,0,1|2,0,0]=4 7680 B15R1.1575 Cc1cccc(c1NCCC(C)C)CO 34a_100011215590_100000210312 [0,1,0,0,0,1|2,0,0]=4 7681 B15R1.1575 Cc1cccc(c1NCCC(C)O)CO 34a_100011215590_100012276601 [0,1,0,0,0,1|2,0,0]=4 7682 B15R1.1575 Cc1cccc(c1NCOC(C)C)CO 34a_100011215590_100000709892 [0,1,0,0,0,1|2,0,0]=4 7683 B15R1.1575 Cc1cccc(c1OCCC(=O)N)CN 34a_100020639391_100000731001 [0,1,0,0,0,1|1,0,1]=4 7684 B15R1.1575 Cc1cccc(c1OCCC(C)C)C#N 34a_100011659161_100000210312 [0,1,0,0,0,1|1,0,1]=4 7685 B15R1.1575 Cc1cccc(c1OCCC(C)C)C#N 7a_100011659161_100000210626 [0,1,0,0,0,1|1,0,1]=4 7686 B15R1.1575 Cc1cccc(c1OCCC(C)C)CN 34a_100020639391_100000210312 [0,1,0,0,0,1|1,0,0]=3 7687 B15R1.1575 Cc1cccc(c1OCCC(C)O)C#N 34a_100011659161_100012276601 [0,1,0,0,0,1|1,0,1]=4 7688 B15R1.1575 Cc1cccc(c1OCCC(C)O)C#N 7a_100011659161_100012276601 [0,1,0,0,0,1|1,0,1]=4 7689 B15R1.1575 Cc1cccc(c1OCCC(C)O)CN 34a_100020639391_100012276601 [0,1,0,0,0,1|1,0,0]=3 7690 B15R1.1575 Cc1cccc(c1OCOC(C)C)C#N 34a_100011659161_100000709892 [0,1,0,0,0,1|1,0,1]=4 7691 B15R1.1575 Cc1cccc(c1OCOC(C)C)CN 34a_100020639391_100000709892 [0,1,0,0,0,1|1,0,0]=3 7692 B15R1.1575 Cc1cccc(c1SCCC(C)C)CO 62a_100000210312_100011659289 [0,1,0,0,0,1|1,1,0]=4 7693 B15R1.1575 Cc1cccc(c1SCCC(C)C)CO 62a_100011659289_100000210312 [0,1,0,0,0,1|1,1,0]=4 7694 B15R1.1575 Cc1cccc(c1SCCC(C)O)CO 62a_100011659289_100012276601 [0,1,0,0,0,1|1,1,0]=4 7695 B15R1.1575 Cc1cccc(c1SCCC(C)O)CO 62a_100012276601_100011659289 [0,1,0,0,0,1|1,1,0]=4 7696 B15R1.1575 Cc1cccc(c1SCOC(C)C)CO 62a_100000709892_100011659289 [0,1,0,0,0,1|1,1,0]=4 7697 B15R1.1575 Cc1cccc(c1SCOC(C)C)CO 62a_100011659289_100000709892 [0,1,0,0,0,1|1,1,0]=4 7698 B15R1.6616 CC(=O)C(=O)COc1c(cccc1C)C 34a_100000210341_100011261029 [0,1,0,0,0,1|1,0,1]=4 7699 B15R1.6616 CC(=O)C(C)OCc1c(cccc1C)C 34a_100000212229_100000758300 [0,1,0,0,0,1|1,0,1]=4 7700 B15R1.6616 CC(=O)C(C)OCc1c(cccc1C)C 7a_100011933981_100000179758 [0,1,0,0,0,1|1,0,1]=4 7701 B15R1.6616 Cc1cccc(c1CCC(=O)C(C)C)C 1458a_200011998103_100000210206 [0,1,0,0,0,1|2,0,0]=4 7702 B15R1.6616 Cc1cccc(c1CNC(C)C(C)C)C 207a_100000211541_100000758299 [0,1,0,0,0,1|2,0,0]=4 7703 B15R1.6616 Cc1cccc(c1CNC(C)C(C)C)C 2230a_100000211541_100000758300 [0,1,0,0,0,1|2,0,0]=4 7704 B15R1.6616 Cc1cccc(c1CNC(C)C(C)C)C 270004a_100000211541_100000758299 [0,1,0,0,0,1|2,0,0]=4 7705 B15R1.6616 Cc1cccc(c1COC(C)C(=O)N)C 34a_100011933981_100000702099 [0,1,0,0,0,1|1,0,1]=4 7706 B15R1.6616 Cc1cccc(c1COC(C)C(=O)N)C 7a_100011933981_100000702099 [0,1,0,0,0,1|1,0,1]=4 7707 B15R1.6616 Cc1cccc(c1COC(C)C(C)C)Br 7a_100000748068_100010146847 [0,1,0,0,0,1|2,0,0]=4 7708 B15R1.6616 Cc1cccc(c1COC(C)C(C)C)C 7a_100000748068_100000758300 [0,1,0,0,0,1|1,0,0]=3 7709 B15R1.6616 Cc1cccc(c1COC(C)C(C)C)F 7a_100000748068_100009814554 [0,1,0,0,0,1|2,0,0]=4 7710 B15R1.6616 Cc1cccc(c1COC(C)C(C)C)I 7a_100000748068_100010150146 [0,1,0,0,0,1|2,0,0]=4 7711 B15R1.6616 Cc1cccc(c1COC(F)C(=O)N)C 34a_100011933981_100009813875 [0,1,0,0,0,1|1,0,1]=4 7712 B15R1.6616 Cc1cccc(c1COC(F)C(=O)N)C 7a_100011933981_100009813875 [0,1,0,0,0,1|1,0,1]=4 7713 B15R1.6616 Cc1cccc(c1CO[C@H](C)C(=O)N)C 34a_100000731257_100000758300 [0,1,0,0,0,1|1,0,1]=4 7714 B15R1.6616 Cc1cccc(c1CO[C@H](C)C(=O)N)C 7a_100000731257_100000758300 [0,1,0,0,0,1|1,0,1]=4 7715 B15R1.6616 Cc1cccc(c1NCC(=O)C(C)C)C 34a_100000185769_100000753385 [0,1,0,0,0,1|2,0,0]=4 7716 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)Br 34a_100009817157_100000753385 [0,1,0,0,0,1|2,0,0]=4 7717 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)Br 7a_100009817157_100000753385 [0,1,0,0,0,1|2,0,0]=4 7718 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)C 1458a_100000184085_100000210206 [0,1,0,0,0,1|1,0,0]=3 7719 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)C 34a_100000210341_100000753385 [0,1,0,0,0,1|1,0,0]=3 7720 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)C 7a_100000210341_100000753385 [0,1,0,0,0,1|1,0,0]=3 7721 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)Cl 34a_100000033731_100000753385 [0,1,0,0,0,1|2,0,0]=4 7722 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)Cl 7a_100000033731_100000753385 [0,1,0,0,0,1|2,0,0]=4 7723 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)F 34a_100011659162_100000753385 [0,1,0,0,0,1|2,0,0]=4 7724 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)F 7a_100011659162_100000753385 [0,1,0,0,0,1|2,0,0]=4 7725 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)N 34a_100000756359_100000753385 [0,1,0,0,0,1|2,0,0]=4 7726 B15R1.6616 Cc1cccc(c1OCC(=O)C(C)C)N 7a_100000756359_100000753385 [0,1,0,0,0,1|2,0,0]=4 7727 B15R1.6616 Cc1cccc(c1OCC(=O)N(C)C)C 11a_100102631434_100000184085 [0,1,0,0,0,1|2,0,0]=4 7728 B15R1.6616 Cc1cccc(c1OCC(=O)N(C)C)C 1626a_100102631434_100000184085 [0,1,0,0,0,1|2,0,0]=4 7729 B15R1.6616 Cc1cccc(c1OCC(=O)N(C)C)C 240690a_100102631434_100000184085 [0,1,0,0,0,1|2,0,0]=4 7730 B15R1.6616 Cc1cccc(c1OCC(=O)N(C)C)C 34a_100000210341_100000692301 [0,1,0,0,0,1|2,0,0]=4 7731 B15R1.6616 Cc1cccc(c1OCC(=O)N(C)C)C 527a_100102631434_100000184085 [0,1,0,0,0,1|2,0,0]=4 7732 B15R1.6616 Cc1cccc(c1OCC(=O)N(C)C)C 7a_100000210341_100000692301 [0,1,0,0,0,1|2,0,0]=4 7733 B15R1.6616 Cc1cccc(c1OCC(C)N(C)C)C 270004a_100102631434_100011343208 [0,1,0,0,0,1|2,0,0]=4 7734 B15R1.6616 Cc1cccc(c1SCC(=O)C(C)C)C 62a_100000033847_100000753385 [0,1,0,0,0,1|1,1,0]=4 7735 B15R1.6616 Cc1cccc(c1SCC(=O)C(C)C)C 62a_100000753385_100000033847 [0,1,0,0,0,1|1,1,0]=4 7736 B15R1.6616 Cc1ccnc(c1OCC(=O)C(C)C)C 34a_100011934651_100000753385 [0,1,0,0,0,1|2,0,0]=4 7737 B15R1.6616 Cc1ccnc(c1OCC(=O)C(C)C)C 7a_100011934651_100000753385 [0,1,0,0,0,1|2,0,0]=4 7738 B15R1.8287 Cc1cccc(c1CC(=O)CC(C)C)C 1458a_100000210554_100000758300 [0,1,0,0,0,1|2,0,0]=4 7739 B15R1.8287 Cc1cccc(c1CC(=O)CC(C)C)C 1458a_100000689862_100000210624 [0,1,0,0,0,1|2,0,0]=4 7740 B15R1.8287 Cc1cccc(c1CC(=O)CC(C)O)C 1458a_100000689862_100011218427 [0,1,0,0,0,1|2,0,0]=4 7741 B15R1.8287 Cc1cccc(c1CC(=O)C[C@@H](C)O)C 1458a_100011933948_100000758300 [0,1,0,0,0,1|2,0,0]=4 7742 B15R1.8287 Cc1cccc(c1CN(C)CC(C)C)C 2230a_100000747067_100000758300 [0,1,0,0,0,1|2,0,0]=4 7743 B15R1.8287 Cc1cccc(c1CN(C)CC(C)C)C 269982a_100000747067_100000758300 [0,1,0,0,0,1|2,0,0]=4 7744 B15R1.8287 Cc1cccc(c1CN(C)CC(C)C)C 270004a_100000747067_100000758299 [0,1,0,0,0,1|2,0,0]=4 7745 B15R1.8287 Cc1cccc(c1CN(C)CC(C)O)C 2230a_100000227577_100000758300 [0,1,0,0,0,1|2,0,0]=4 7746 B15R1.8287 Cc1cccc(c1CN(C)CC(C)O)C 269982a_100000227577_100000758300 [0,1,0,0,0,1|2,0,0]=4 7747 B15R1.8287 Cc1cccc(c1CN(C)CC(C)O)C 270004a_100000227577_100000758299 [0,1,0,0,0,1|2,0,0]=4 7748 B15R1.8287 Cc1cccc(c1NC(=O)CC(C)C)C 11a_100000185769_100000210554 [0,1,0,0,0,1|2,0,0]=4 7749 B15R1.8287 Cc1cccc(c1NC(=O)CC(C)C)C 1626a_100000185769_100000210554 [0,1,0,0,0,1|2,0,0]=4 7750 B15R1.8287 Cc1cccc(c1NC(=O)CC(C)C)C 22a_100000185769_100000210554 [0,1,0,0,0,1|2,0,0]=4 7751 B15R1.8287 Cc1cccc(c1NC(=O)C[C@@H](C)O)C 22a_100000185769_100011933948 [0,1,0,0,0,1|2,0,0]=4 7752 B15R1.8287 Cc1cccc(c1NC(C)CC(C)C)C 34a_100000185769_100000731052 [0,1,0,0,0,1|2,0,0]=4 7753 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)Br 34a_100009817157_100000731052 [0,1,0,0,0,1|2,0,0]=4 7754 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)Br 7a_100009817157_100000731052 [0,1,0,0,0,1|2,0,0]=4 7755 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)C 34a_100000210341_100000731052 [0,1,0,0,0,1|1,0,0]=3 7756 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)C 7a_100000210341_100000731052 [0,1,0,0,0,1|1,0,0]=3 7757 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)Cl 34a_100000033731_100000731052 [0,1,0,0,0,1|2,0,0]=4 7758 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)Cl 7a_100000033731_100000731052 [0,1,0,0,0,1|2,0,0]=4 7759 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)F 34a_100011659162_100000731052 [0,1,0,0,0,1|2,0,0]=4 7760 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)F 7a_100011659162_100000731052 [0,1,0,0,0,1|2,0,0]=4 7761 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)N 34a_100000756359_100000731052 [0,1,0,0,0,1|2,0,0]=4 7762 B15R1.8287 Cc1cccc(c1OC(C)CC(C)C)N 7a_100000756359_100000731052 [0,1,0,0,0,1|2,0,0]=4 7763 B15R1.8287 Cc1cccc(c1SC(C)CC(C)C)C 62a_100000033847_100000731052 [0,1,0,0,0,1|1,1,0]=4 7764 B15R1.8287 Cc1cccc(c1SC(C)CC(C)C)C 62a_100000731052_100000033847 [0,1,0,0,0,1|1,1,0]=4 7765 B15R1.8287 Cc1ccnc(c1OC(C)CC(C)C)C 34a_100011934651_100000731052 [0,1,0,0,0,1|2,0,0]=4 7766 B15R1.8287 Cc1ccnc(c1OC(C)CC(C)C)C 7a_100011934651_100000731052 [0,1,0,0,0,1|2,0,0]=4 7767 B15R1.8291 Cc1cccc(c1CNCC(C)(C)C)C 207a_100000743828_100000758299 [0,1,0,0,0,1|2,0,0]=4 7768 B15R1.8291 Cc1cccc(c1CNCC(C)(C)C)C 2230a_100000743828_100000758300 [0,1,0,0,0,1|2,0,0]=4 7769 B15R1.8291 Cc1cccc(c1CNCC(C)(C)C)C 270004a_100000689800_100011204126 [0,1,0,0,0,1|2,0,0]=4 7770 B15R1.8291 Cc1cccc(c1CNCC(C)(C)C)C 270004a_100000743828_100000758299 [0,1,0,0,0,1|2,0,0]=4 7771 B15R1.8291 Cc1cccc(c1CNCC(C)(C)C)C 34a_100000689800_100011219605 [0,1,0,0,0,1|2,0,0]=4 7772 B15R1.8291 Cc1cccc(c1CNCC(C)(C)F)C 207a_100020643315_100000758299 [0,1,0,0,0,1|2,0,0]=4 7773 B15R1.8291 Cc1cccc(c1CNCC(C)(C)F)C 2230a_100020643315_100000758300 [0,1,0,0,0,1|2,0,0]=4 7774 B15R1.8291 Cc1cccc(c1CNCC(C)(C)F)C 270004a_100020643315_100000758299 [0,1,0,0,0,1|2,0,0]=4 7775 B15R1.8291 Cc1cccc(c1CNCC(C)(C)F)C 34a_100000689800_100011997219 [0,1,0,0,0,1|2,0,0]=4 7776 B15R1.8291 Cc1cccc(c1CNCC(C)(C)O)C 207a_100000751335_100000758299 [0,1,0,0,0,1|2,0,0]=4 7777 B15R1.8291 Cc1cccc(c1CNCC(C)(C)O)C 2230a_100000751335_100000758300 [0,1,0,0,0,1|2,0,0]=4 7778 B15R1.8291 Cc1cccc(c1CNCC(C)(C)O)C 270004a_100000751335_100000758299 [0,1,0,0,0,1|2,0,0]=4 7779 B15R1.8291 Cc1cccc(c1CNCC(C)(C)O)C 34a_100000689800_100000764493 [0,1,0,0,0,1|2,0,0]=4 7780 B15R1.8291 Cc1cccc(c1CNCC(C)(F)F)C 207a_100000731000_100000758299 [0,1,0,0,0,1|2,0,0]=4 7781 B15R1.8291 Cc1cccc(c1CNCC(C)(F)F)C 270004a_100000731000_100000758299 [0,1,0,0,0,1|2,0,0]=4 7782 B15R1.8291 Cc1cccc(c1COCC(C)(C)C)C 34a_100011933981_100011219605 [0,1,0,0,0,1|1,0,0]=3 7783 B15R1.8291 Cc1cccc(c1COCC(C)(C)C)Cl 34a_100000082531_100011219605 [0,1,0,0,0,1|2,0,0]=4 7784 B15R1.8291 Cc1cccc(c1COCC(C)(C)C)F 34a_100000057874_100011219605 [0,1,0,0,0,1|2,0,0]=4 7785 B15R1.8291 Cc1cccc(c1COCC(C)(C)F)Br 34a_100000716592_100010146847 [0,1,0,0,0,1|2,0,0]=4 7786 B15R1.8291 Cc1cccc(c1COCC(C)(C)F)C 34a_100000716592_100000758300 [0,1,0,0,0,1|1,0,0]=3 7787 B15R1.8291 Cc1cccc(c1COCC(C)(C)F)C 34a_100011933981_100011997219 [0,1,0,0,0,1|1,0,0]=3 7788 B15R1.8291 Cc1cccc(c1COCC(C)(C)F)Cl 34a_100000082531_100011997219 [0,1,0,0,0,1|2,0,0]=4 7789 B15R1.8291 Cc1cccc(c1COCC(C)(C)F)F 34a_100000057874_100011997219 [0,1,0,0,0,1|2,0,0]=4 7790 B15R1.8291 Cc1cccc(c1COCC(C)(C)F)F 34a_100000716592_100009814554 [0,1,0,0,0,1|2,0,0]=4 7791 B15R1.8291 Cc1cccc(c1COCC(C)(C)F)I 34a_100000716592_100010150146 [0,1,0,0,0,1|2,0,0]=4 7792 B15R1.8291 Cc1cccc(c1COCC(C)(C)O)C 34a_100011933981_100000764493 [0,1,0,0,0,1|1,0,0]=3 7793 B15R1.8291 Cc1cccc(c1COCC(C)(C)O)C 7a_100011933981_100000764493 [0,1,0,0,0,1|1,0,0]=3 7794 B15R1.8291 Cc1cccc(c1COCC(C)(C)O)Cl 34a_100000082531_100000764493 [0,1,0,0,0,1|2,0,0]=4 7795 B15R1.8291 Cc1cccc(c1COCC(C)(C)O)Cl 7a_100000082531_100000764493 [0,1,0,0,0,1|2,0,0]=4 7796 B15R1.8291 Cc1cccc(c1COCC(C)(C)O)F 34a_100000057874_100000764493 [0,1,0,0,0,1|2,0,0]=4 7797 B15R1.8291 Cc1cccc(c1COCC(C)(C)O)F 7a_100000057874_100000764493 [0,1,0,0,0,1|2,0,0]=4 7798 B15R1.8291 Cc1cccc(c1COCC(C)(F)F)Br 34a_100000068830_100010146847 [0,1,0,0,0,1|2,0,0]=4 7799 B15R1.8291 Cc1cccc(c1COCC(C)(F)F)C 34a_100000068830_100000758300 [0,1,0,0,0,1|1,0,0]=3 7800 B15R1.8291 Cc1cccc(c1COCC(C)(F)F)F 34a_100000068830_100009814554 [0,1,0,0,0,1|2,0,0]=4 7801 B15R1.8291 Cc1cccc(c1COCC(C)(F)F)I 34a_100000068830_100010150146 [0,1,0,0,0,1|2,0,0]=4 7802 B15R1.8291 Cc1cccc(c1COCC(F)(F)Br)C 34a_100011217949_100000758300 [0,1,0,0,0,1|2,0,0]=4 7803 B15R1.8291 Cc1cccc(c1COCC(F)(F)Cl)C 34a_100000734434_100000758300 [0,1,0,0,0,1|2,0,0]=4 7804 B15R1.8291 Cc1cccc(c1COCC(F)(F)F)C 34a_100000210435_100000758300 [0,1,0,0,0,1|2,0,0]=4 7805 B15R1.8291 Cc1cccc(c1COC[Si](C)(C)C)C 7a_100011933981_100000233785 [0,1,0,0,0,1|1,1,0]=4 7806 B15R1.8291 Cc1cccc(c1CSCC(C)(C)C)C 62a_100000758300_100011219605 [0,1,0,0,0,1|1,1,0]=4 7807 B15R1.8291 Cc1cccc(c1CSCC(C)(C)C)C 62a_100011219605_100000758300 [0,1,0,0,0,1|1,1,0]=4 7808 B15R1.8291 Cc1cccc(c1CSCC(C)(C)F)C 62a_100000758300_100011997219 [0,1,0,0,0,1|1,1,0]=4 7809 B15R1.8291 Cc1cccc(c1CSCC(C)(C)F)C 62a_100011997219_100000758300 [0,1,0,0,0,1|1,1,0]=4 7810 B15R1.8291 Cc1cccc(c1CSCC(C)(C)O)C 62a_100000758300_100000764493 [0,1,0,0,0,1|1,1,0]=4 7811 B15R1.8291 Cc1cccc(c1CSCC(C)(C)O)C 62a_100000764493_100000758300 [0,1,0,0,0,1|1,1,0]=4 7812 B15R1.8291 Cc1cccc(c1NCCC(C)(C)C)C 34a_100000185769_100000755188 [0,1,0,0,0,1|2,0,0]=4 7813 B15R1.8291 Cc1cccc(c1NCCC(C)(C)O)C 34a_100000185769_100000702414 [0,1,0,0,0,1|2,0,0]=4 7814 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)Br 34a_100009817157_100000755188 [0,1,0,0,0,1|2,0,0]=4 7815 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)Br 7a_100009817157_100000755188 [0,1,0,0,0,1|2,0,0]=4 7816 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)C 34a_100000210341_100000755188 [0,1,0,0,0,1|1,0,0]=3 7817 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)C 7a_100000210341_100000755188 [0,1,0,0,0,1|1,0,0]=3 7818 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)Cl 34a_100000033731_100000755188 [0,1,0,0,0,1|2,0,0]=4 7819 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)Cl 7a_100000033731_100000755188 [0,1,0,0,0,1|2,0,0]=4 7820 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)F 34a_100011659162_100000755188 [0,1,0,0,0,1|2,0,0]=4 7821 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)F 7a_100011659162_100000755188 [0,1,0,0,0,1|2,0,0]=4 7822 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)N 34a_100000756359_100000755188 [0,1,0,0,0,1|2,0,0]=4 7823 B15R1.8291 Cc1cccc(c1OCCC(C)(C)C)N 7a_100000756359_100000755188 [0,1,0,0,0,1|2,0,0]=4 7824 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)Br 34a_100009817157_100000702414 [0,1,0,0,0,1|2,0,0]=4 7825 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)Br 7a_100009817157_100000702414 [0,1,0,0,0,1|2,0,0]=4 7826 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)C 34a_100000210341_100000702414 [0,1,0,0,0,1|1,0,0]=3 7827 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)C 7a_100000210341_100000702414 [0,1,0,0,0,1|1,0,0]=3 7828 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)Cl 34a_100000033731_100000702414 [0,1,0,0,0,1|2,0,0]=4 7829 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)Cl 7a_100000033731_100000702414 [0,1,0,0,0,1|2,0,0]=4 7830 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)F 34a_100011659162_100000702414 [0,1,0,0,0,1|2,0,0]=4 7831 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)F 7a_100011659162_100000702414 [0,1,0,0,0,1|2,0,0]=4 7832 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)N 34a_100000756359_100000702414 [0,1,0,0,0,1|2,0,0]=4 7833 B15R1.8291 Cc1cccc(c1OCCC(C)(C)O)N 7a_100000756359_100000702414 [0,1,0,0,0,1|2,0,0]=4 7834 B15R1.8291 Cc1cccc(c1OCCC(F)(F)F)C 34a_100000210341_100011219754 [0,1,0,0,0,1|2,0,0]=4 7835 B15R1.8291 Cc1cccc(c1OCCC(F)(F)F)C 7a_100000210341_100011219754 [0,1,0,0,0,1|2,0,0]=4 7836 B15R1.8291 Cc1cccc(c1OCCS(=O)(=O)C)C 34a_100000210341_100000731031 [0,1,0,0,0,1|2,0,0]=4 7837 B15R1.8291 Cc1cccc(c1OCCS(=O)(=O)C)C 7a_100000210341_100000230027 [0,1,0,0,0,1|2,0,0]=4 7838 B15R1.8291 Cc1cccc(c1OCC[N+](C)(C)C)C 34a_100000210341_100000085578 [0,1,0,0,0,1|2,0,0]=4 7839 B15R1.8291 Cc1cccc(c1OCC[N+](C)(C)C)C 7a_100000210341_100000085578 [0,1,0,0,0,1|2,0,0]=4 7840 B15R1.8291 Cc1cccc(c1OCC[Si](C)(C)C)C 34a_100000210341_200000733723 [0,1,0,0,0,1|1,1,0]=4 7841 B15R1.8291 Cc1cccc(c1OCC[Si](C)(C)C)C 7a_100000210341_200000733723 [0,1,0,0,0,1|1,1,0]=4 7842 B15R1.8291 Cc1cccc(c1SCCC(C)(C)C)C 62a_100000033847_100000755188 [0,1,0,0,0,1|1,1,0]=4 7843 B15R1.8291 Cc1cccc(c1SCCC(C)(C)C)C 62a_100000755188_100000033847 [0,1,0,0,0,1|1,1,0]=4 7844 B15R1.8291 Cc1cccc(c1SCCC(C)(C)O)C 62a_100000033847_100000702414 [0,1,0,0,0,1|1,1,0]=4 7845 B15R1.8291 Cc1cccc(c1SCCC(C)(C)O)C 62a_100000702414_100000033847 [0,1,0,0,0,1|1,1,0]=4 7846 B15R1.8291 Cc1ccnc(c1OCCC(C)(C)C)C 34a_100011934651_100000755188 [0,1,0,0,0,1|2,0,0]=4 7847 B15R1.8291 Cc1ccnc(c1OCCC(C)(C)C)C 7a_100011934651_100000755188 [0,1,0,0,0,1|2,0,0]=4 7848 B15R1.8291 Cc1ccnc(c1OCCC(C)(C)O)C 34a_100011934651_100000702414 [0,1,0,0,0,1|2,0,0]=4 7849 B15R1.8291 Cc1ccnc(c1OCCC(C)(C)O)C 7a_100011934651_100000702414 [0,1,0,0,0,1|2,0,0]=4 7850 B15R1.8312 C=C(C)COC(C)c1c(cccc1C)C 34a_200000695261_100000748629 [0,1,0,0,0,1|1,0,1]=4 7851 B15R1.8312 C=C(C)COC(C)c1c(cccc1C)C 7a_200000695261_100000748629 [0,1,0,0,0,1|1,0,1]=4 7852 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)C)C 1458a_100000758298_100000210312 [0,1,0,0,0,1|2,0,0]=4 7853 B15R1.8312 Cc1cccc(c1C(=O)CCC(C)O)C 1458a_100000758298_100012276601 [0,1,0,0,0,1|2,0,0]=4 7854 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 11a_100000210953_100000758298 [0,1,0,0,0,1|2,0,0]=4 7855 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 1626a_100000210953_100000758298 [0,1,0,0,0,1|2,0,0]=4 7856 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)C)C 240690a_100000210953_100000758298 [0,1,0,0,0,1|2,0,0]=4 7857 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)C 11a_100000210904_100000758298 [0,1,0,0,0,1|2,0,0]=4 7858 B15R1.8312 Cc1cccc(c1C(=O)NCC(C)O)C 240690a_100000210904_100000758298 [0,1,0,0,0,1|2,0,0]=4 7859 B15R1.8312 Cc1cccc(c1C(C)OCC(=O)N)C 34a_200000695261_100000187820 [0,1,0,0,0,1|1,0,1]=4 7860 B15R1.8312 Cc1cccc(c1C(C)OCC(=O)N)C 7a_200000695261_100000187820 [0,1,0,0,0,1|1,0,1]=4 7861 B15R1.8312 Cc1cccc(c1C(C)OCC(C)C)C 34a_200000695261_100000210624 [0,1,0,0,0,1|1,0,0]=3 7862 B15R1.8312 Cc1cccc(c1C(C)OCC(C)C)C 7a_200000695261_100000210760 [0,1,0,0,0,1|1,0,0]=3 7863 B15R1.8312 Cc1cccc(c1C(C)OCC(C)O)C 34a_200000695261_100011218427 [0,1,0,0,0,1|1,0,0]=3 7864 B15R1.8312 Cc1cccc(c1C(C)OCC(C)O)C 7a_200000695261_100011218427 [0,1,0,0,0,1|1,0,0]=3 7865 B15R1.8312 Cc1cccc(c1C(C)OCC(F)F)C 34a_200000695261_100011934356 [0,1,0,0,0,1|2,0,0]=4 7866 B15R1.8312 Cc1cccc(c1C(C)OCC(F)F)C 7a_200000695261_100011934356 [0,1,0,0,0,1|2,0,0]=4 7867 B15R1.8312 Cc1cccc(c1C(C)OC[C@@H](C)O)C 34a_200000695261_100009817552 [0,1,0,0,0,1|1,0,0]=3 7868 B15R1.8312 Cc1cccc(c1C(C)OC[C@@H](C)O)C 7a_200000695261_100009817552 [0,1,0,0,0,1|1,0,0]=3 7869 B15R1.8312 Cc1cccc(c1N(C)CCC(C)C)C 2230a_100011645471_100000210312 [0,1,0,0,0,1|2,0,0]=4 7870 B15R1.8312 Cc1cccc(c1N(C)CCC(C)C)C 269982a_100011645471_100000210312 [0,1,0,0,0,1|2,0,0]=4 7871 B15R1.8312 Cc1cccc(c1N(C)CCC(C)C)C 34a_100011645471_100000210312 [0,1,0,0,0,1|2,0,0]=4 7872 B15R1.8312 Cc1cccc(c1N(C)CCC(C)O)C 2230a_100011645471_100012276601 [0,1,0,0,0,1|2,0,0]=4 7873 B15R1.8312 Cc1cccc(c1N(C)CCC(C)O)C 269982a_100011645471_100012276601 [0,1,0,0,0,1|2,0,0]=4 7874 B15R1.8312 Cc1cccc(c1N(C)CCC(C)O)C 34a_100011645471_100012276601 [0,1,0,0,0,1|2,0,0]=4 7875 B15R1.8312 Cc1cccc(c1N(C)COC(C)C)C 2230a_100011645471_100000709892 [0,1,0,0,0,1|2,0,0]=4 7876 B15R1.8312 Cc1cccc(c1N(C)COC(C)C)C 269982a_100011645471_100000709892 [0,1,0,0,0,1|2,0,0]=4 7877 B15R1.8312 Cc1cccc(c1N(C)COC(C)C)C 34a_100011645471_100000709892 [0,1,0,0,0,1|2,0,0]=4 7878 B15R1.8312 Cc1cccc(c1[C@H](C)NCC(C)C)C 2230a_100016987977_100000210760 [0,1,0,0,0,1|2,0,0]=4 7879 B15R1.8312 Cc1cccc(c1[C@H](C)NCC(C)C)C 270004a_100016987977_100000210432 [0,1,0,0,0,1|2,0,0]=4 7880 B15R1.8312 Cc1cccc(c1[C@H](C)NCC(C)C)C 34a_100016987977_100000210624 [0,1,0,0,0,1|2,0,0]=4 7881 B15R1.8312 Cc1cccc(c1[C@H](C)NCC(C)O)C 2230a_100016987977_100011218427 [0,1,0,0,0,1|2,0,0]=4 7882 B15R1.8312 Cc1cccc(c1[C@H](C)NCC(C)O)C 34a_100016987977_100011218427 [0,1,0,0,0,1|2,0,0]=4 7883 B15R1.8312 Cc1cccc(c1[C@H](C)NC[C@@H](C)O)C 2230a_100016987977_100009817552 [0,1,0,0,0,1|2,0,0]=4 7884 B15R1.8312 Cc1cccc(c1[C@H](C)NC[C@@H](C)O)C 34a_100016987977_100009817552 [0,1,0,0,0,1|2,0,0]=4 7885 B15R1.23305 C=C(C)CCOc1c(ccc(c1C)C)C 34a_100000211305_100000730704 [0,1,0,0,0,1|1,0,1]=4 7886 B15R1.23305 C=C(C)CCOc1c(ccc(c1C)C)C 7a_100000211305_100000730704 [0,1,0,0,0,1|1,0,1]=4 7887 B15R1.23305 CC(=CCOc1c(ccc(c1C)C)C)C 34a_100000211305_100000761012 [0,1,0,0,0,1|1,0,1]=4 7888 B15R1.23305 CC(=CCOc1c(ccc(c1C)C)C)C 7a_100000211305_100000761012 [0,1,0,0,0,1|1,0,1]=4 7889 B15R1.23305 CC(=O)CCOc1c(ccc(c1C)C)C 7a_100000211305_100000053229 [0,1,0,0,0,1|1,0,1]=4 7890 B15R1.23305 CC(=O)OCOc1c(ccc(c1C)C)C 34a_100000211305_100009813279 [0,1,0,0,0,1|1,0,1]=4 7891 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1Br)Cl)F 34a_100000737577_100011099539 [0,1,0,0,0,1|2,0,0]=4 7892 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1Cl)F)F 34a_100000737577_100009813715 [0,1,0,0,0,1|2,0,0]=4 7893 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1F)Br)Cl 34a_100000737577_100010993448 [0,1,0,0,0,1|2,0,0]=4 7894 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1F)Cl)Br 34a_100000737577_100011071994 [0,1,0,0,0,1|2,0,0]=4 7895 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1F)Cl)Cl 34a_100000737577_100009814555 [0,1,0,0,0,1|2,0,0]=4 7896 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1F)Cl)F 34a_100000737577_100009813610 [0,1,0,0,0,1|2,0,0]=4 7897 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1F)F)Br 34a_100000737577_100011070584 [0,1,0,0,0,1|2,0,0]=4 7898 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1F)F)Cl 34a_100000737577_100010381632 [0,1,0,0,0,1|2,0,0]=4 7899 B15R1.23305 C[C@@H](N)COCc1c(ccc(c1F)F)F 34a_100000737577_100009813269 [0,1,0,0,0,1|2,0,0]=4 7900 B15R1.23305 Cc1c(ccc(c1OCCC(C)C)Br)Cl 34a_200010391122_100000210312 [0,1,0,0,0,1|2,0,0]=4 7901 B15R1.23305 Cc1c(ccc(c1OCCC(C)C)Br)Cl 7a_200010391122_100000210626 [0,1,0,0,0,1|2,0,0]=4 7902 B15R1.23305 Cc1c(ccc(c1OCCC(C)C)Br)F 34a_200010391124_100000210312 [0,1,0,0,0,1|2,0,0]=4 7903 B15R1.23305 Cc1c(ccc(c1OCCC(C)C)Br)F 7a_200010391124_100000210626 [0,1,0,0,0,1|2,0,0]=4 7904 B15R1.23305 Cc1c(ccc(c1OCCC(C)O)Br)Cl 34a_200010391122_100012276601 [0,1,0,0,0,1|2,0,0]=4 7905 B15R1.23305 Cc1c(ccc(c1OCCC(C)O)Br)Cl 7a_200010391122_100012276601 [0,1,0,0,0,1|2,0,0]=4 7906 B15R1.23305 Cc1c(ccc(c1OCCC(C)O)Br)F 34a_200010391124_100012276601 [0,1,0,0,0,1|2,0,0]=4 7907 B15R1.23305 Cc1c(ccc(c1OCCC(C)O)Br)F 7a_200010391124_100012276601 [0,1,0,0,0,1|2,0,0]=4 7908 B15R1.23305 Cc1c(ccc(c1OCOC(C)C)Br)Cl 34a_200010391122_100000709892 [0,1,0,0,0,1|2,0,0]=4 7909 B15R1.23305 Cc1c(ccc(c1OCOC(C)C)Br)F 34a_200010391124_100000709892 [0,1,0,0,0,1|2,0,0]=4 7910 B15R1.23305 Cc1ccc(c(c1C)NCCC(C)C)C 2230a_100000117417_100000210312 [0,1,0,0,0,1|2,0,0]=4 7911 B15R1.23305 Cc1ccc(c(c1C)NCCC(C)C)C 34a_100000117417_100000210312 [0,1,0,0,0,1|2,0,0]=4 7912 B15R1.23305 Cc1ccc(c(c1C)NCCC(C)C)C 7a_100000117417_100000210626 [0,1,0,0,0,1|2,0,0]=4 7913 B15R1.23305 Cc1ccc(c(c1C)NCCC(C)O)C 2230a_100000117417_100012276601 [0,1,0,0,0,1|2,0,0]=4 7914 B15R1.23305 Cc1ccc(c(c1C)NCCC(C)O)C 34a_100000117417_100012276601 [0,1,0,0,0,1|2,0,0]=4 7915 B15R1.23305 Cc1ccc(c(c1C)NCCC(C)O)C 7a_100000117417_100012276601 [0,1,0,0,0,1|2,0,0]=4 7916 B15R1.23305 Cc1ccc(c(c1C)NCOC(C)C)C 2230a_100000117417_100000709892 [0,1,0,0,0,1|2,0,0]=4 7917 B15R1.23305 Cc1ccc(c(c1C)NCOC(C)C)C 34a_100000117417_100000709892 [0,1,0,0,0,1|2,0,0]=4 7918 B15R1.23305 Cc1ccc(c(c1C)OCCC(=O)N)C 34a_100000211305_100000731001 [0,1,0,0,0,1|1,0,1]=4 7919 B15R1.23305 Cc1ccc(c(c1C)OCCC(=O)N)C 7a_100000211305_100000744528 [0,1,0,0,0,1|1,0,1]=4 7920 B15R1.23305 Cc1ccc(c(c1C)OCCC(C)C)C 34a_100000211305_100000210312 [0,1,0,0,0,1|1,0,0]=3 7921 B15R1.23305 Cc1ccc(c(c1C)OCCC(C)C)C 7a_100000211305_100000210626 [0,1,0,0,0,1|1,0,0]=3 7922 B15R1.23305 Cc1ccc(c(c1C)OCCC(C)O)C 34a_100000211305_100012276601 [0,1,0,0,0,1|1,0,0]=3 7923 B15R1.23305 Cc1ccc(c(c1C)OCCC(C)O)C 7a_100000211305_100012276601 [0,1,0,0,0,1|1,0,0]=3 7924 B15R1.23305 Cc1ccc(c(c1C)OCCN(C)C)C 2230a_100011271454_200000210301 [0,1,0,0,0,1|2,0,0]=4 7925 B15R1.23305 Cc1ccc(c(c1C)OCCN(C)C)C 269982a_100011271454_200000210301 [0,1,0,0,0,1|2,0,0]=4 7926 B15R1.23305 Cc1ccc(c(c1C)OCCN(C)C)C 34a_100011271454_200000210301 [0,1,0,0,0,1|2,0,0]=4 7927 B15R1.23305 Cc1ccc(c(c1C)OCCN(C)C)C 7a_100000211305_100000755713 [0,1,0,0,0,1|2,0,0]=4 7928 B15R1.23305 Cc1ccc(c(c1C)OCCN(C)[13CH3])C 2230a_100011271454_200025704644 [0,1,0,0,0,1|2,0,0]=4 7929 B15R1.23305 Cc1ccc(c(c1C)OCCN(C)[13CH3])C 269982a_100011271454_200025704644 [0,1,0,0,0,1|2,0,0]=4 7930 B15R1.23305 Cc1ccc(c(c1C)OCCN(C)[13CH3])C 34a_100011271454_200025704644 [0,1,0,0,0,1|2,0,0]=4 7931 B15R1.23305 Cc1ccc(c(c1C)OCOC(C)C)C 34a_100000211305_100000709892 [0,1,0,0,0,1|1,0,0]=3 7932 B15R1.23305 Cc1ccc(c(c1C=CCC(C)C)C)F 271570a_100016259101_100011068659 [0,1,0,0,0,1|2,0,0]=4 7933 B15R1.23305 Cc1ccc(c(c1C=CCC(C)C)C)N 271570a_100016259101_106354213274 [0,1,0,0,0,1|2,0,0]=4 7934 B15R1.23305 Cc1ccc(c(c1C=CCC(C)C)C)O 271570a_100016259101_100010659238 [0,1,0,0,0,1|2,0,0]=4 7935 B15R1.23305 Cc1ccc(c(c1Cl)COC[C@@H](C)N)Cl 34a_100000737577_200010220899 [0,1,0,0,0,1|2,0,0]=4 7936 B15R1.23305 Cc1ccc(c(c1Cl)COC[C@@H](C)N)F 34a_100000737577_100009813558 [0,1,0,0,0,1|2,0,0]=4 7937 B15R1.23305 Cc1ccc(c(c1F)COC[C@@H](C)N)Cl 34a_100000737577_100009813557 [0,1,0,0,0,1|2,0,0]=4 7938 B15R1.23305 Cc1ccc(c(c1F)COC[C@@H](C)N)F 34a_100000737577_100011217880 [0,1,0,0,0,1|2,0,0]=4 7939 B15R1.23305 Cc1ccc(c(c1NCCC(C)C)C)Br 34a_200010074581_100000210312 [0,1,0,0,0,1|2,0,0]=4 7940 B15R1.23305 Cc1ccc(c(c1NCCC(C)C)C)Cl 2230a_200020642106_100000210312 [0,1,0,0,0,1|2,0,0]=4 7941 B15R1.23305 Cc1ccc(c(c1NCCC(C)C)C)Cl 34a_200020642106_100000210312 [0,1,0,0,0,1|2,0,0]=4 7942 B15R1.23305 Cc1ccc(c(c1NCCC(C)C)C)I 34a_200010115591_100000210312 [0,1,0,0,0,1|2,0,0]=4 7943 B15R1.23305 Cc1ccc(c(c1NCCC(C)O)C)Br 34a_200010074581_100012276601 [0,1,0,0,0,1|2,0,0]=4 7944 B15R1.23305 Cc1ccc(c(c1NCCC(C)O)C)Cl 2230a_200020642106_100012276601 [0,1,0,0,0,1|2,0,0]=4 7945 B15R1.23305 Cc1ccc(c(c1NCCC(C)O)C)Cl 34a_200020642106_100012276601 [0,1,0,0,0,1|2,0,0]=4 7946 B15R1.23305 Cc1ccc(c(c1NCCC(C)O)C)I 34a_200010115591_100012276601 [0,1,0,0,0,1|2,0,0]=4 7947 B15R1.23305 Cc1ccc(c(c1NCOC(C)C)C)Br 34a_200010074581_100000709892 [0,1,0,0,0,1|2,0,0]=4 7948 B15R1.23305 Cc1ccc(c(c1NCOC(C)C)C)Cl 2230a_200020642106_100000709892 [0,1,0,0,0,1|2,0,0]=4 7949 B15R1.23305 Cc1ccc(c(c1NCOC(C)C)C)Cl 34a_200020642106_100000709892 [0,1,0,0,0,1|2,0,0]=4 7950 B15R1.23305 Cc1ccc(c(c1NCOC(C)C)C)I 34a_200010115591_100000709892 [0,1,0,0,0,1|2,0,0]=4 7951 B15R1.23305 Cc1ccc(c(c1OCCC(C)C)Cl)N 34a_100000036876_100000210312 [0,1,0,0,0,1|2,0,0]=4 7952 B15R1.23305 Cc1ccc(c(c1OCCC(C)C)Cl)N 7a_100000036876_100000210626 [0,1,0,0,0,1|2,0,0]=4 7953 B15R1.23305 Cc1ccc(c(c1OCCC(C)O)Cl)N 34a_100000036876_100012276601 [0,1,0,0,0,1|2,0,0]=4 7954 B15R1.23305 Cc1ccc(c(c1OCCC(C)O)Cl)N 7a_100000036876_100012276601 [0,1,0,0,0,1|2,0,0]=4 7955 B15R1.23305 Cc1ccc(c(c1OCOC(C)C)Cl)N 34a_100000036876_100000709892 [0,1,0,0,0,1|2,0,0]=4 7956 B15R1.23305 Cc1ccc(c(c1SCCC(C)C)C)F 62a_100000210312_100011068659 [0,1,0,0,0,1|1,1,0]=4 7957 B15R1.23305 Cc1ccc(c(c1SCCC(C)C)C)F 62a_100011068659_100000210312 [0,1,0,0,0,1|1,1,0]=4 7958 B15R1.23305 Cc1ccc(c(c1SCCC(C)C)C)N 62a_100000210312_106354213274 [0,1,0,0,0,1|1,1,0]=4 7959 B15R1.23305 Cc1ccc(c(c1SCCC(C)C)C)N 62a_106354213274_100000210312 [0,1,0,0,0,1|1,1,0]=4 7960 B15R1.23305 Cc1ccc(c(c1SCCC(C)C)C)O 62a_100000210312_100010659238 [0,1,0,0,0,1|1,1,0]=4 7961 B15R1.23305 Cc1ccc(c(c1SCCC(C)C)C)O 62a_100010659238_100000210312 [0,1,0,0,0,1|1,1,0]=4 7962 B15R1.23305 Cc1ccc(c(c1SCCC(C)O)C)F 62a_100011068659_100012276601 [0,1,0,0,0,1|1,1,0]=4 7963 B15R1.23305 Cc1ccc(c(c1SCCC(C)O)C)F 62a_100012276601_100011068659 [0,1,0,0,0,1|1,1,0]=4 7964 B15R1.23305 Cc1ccc(c(c1SCCC(C)O)C)N 62a_100012276601_106354213274 [0,1,0,0,0,1|1,1,0]=4 7965 B15R1.23305 Cc1ccc(c(c1SCCC(C)O)C)N 62a_106354213274_100012276601 [0,1,0,0,0,1|1,1,0]=4 7966 B15R1.23305 Cc1ccc(c(c1SCCC(C)O)C)O 62a_100010659238_100012276601 [0,1,0,0,0,1|1,1,0]=4 7967 B15R1.23305 Cc1ccc(c(c1SCCC(C)O)C)O 62a_100012276601_100010659238 [0,1,0,0,0,1|1,1,0]=4 7968 B15R1.23305 Cc1ccc(c(c1SCOC(C)C)C)F 62a_100000709892_100011068659 [0,1,0,0,0,1|1,1,0]=4 7969 B15R1.23305 Cc1ccc(c(c1SCOC(C)C)C)F 62a_100011068659_100000709892 [0,1,0,0,0,1|1,1,0]=4 7970 B15R1.23305 Cc1ccc(c(c1SCOC(C)C)C)N 62a_100000709892_106354213274 [0,1,0,0,0,1|1,1,0]=4 7971 B15R1.23305 Cc1ccc(c(c1SCOC(C)C)C)N 62a_106354213274_100000709892 [0,1,0,0,0,1|1,1,0]=4 7972 B15R1.23305 Cc1ccc(c(c1SCOC(C)C)C)O 62a_100000709892_100010659238 [0,1,0,0,0,1|1,1,0]=4 7973 B15R1.23305 Cc1ccc(c(c1SCOC(C)C)C)O 62a_100010659238_100000709892 [0,1,0,0,0,1|1,1,0]=4 7974 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)Br)C 34a_100000187306_100000730704 [0,1,0,0,0,1|1,0,1]=4 7975 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)Br)C 7a_100000187306_100000730704 [0,1,0,0,0,1|1,0,1]=4 7976 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)C)C 34a_100000212074_100000730704 [0,1,0,0,0,1|1,0,1]=4 7977 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)C)C 7a_100000212074_100000730704 [0,1,0,0,0,1|1,0,1]=4 7978 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)Cl)C 34a_100000211519_100000730704 [0,1,0,0,0,1|1,0,1]=4 7979 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)Cl)C 7a_100000211519_100000730704 [0,1,0,0,0,1|1,0,1]=4 7980 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)F)C 34a_100000081862_100000730704 [0,1,0,0,0,1|1,0,1]=4 7981 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)F)C 7a_100000081862_100000730704 [0,1,0,0,0,1|1,0,1]=4 7982 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)I)C 34a_100011216129_100000730704 [0,1,0,0,0,1|1,0,1]=4 7983 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)I)C 7a_100011216129_100000730704 [0,1,0,0,0,1|1,0,1]=4 7984 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)N)C 34a_100000703291_100000730704 [0,1,0,0,0,1|1,0,1]=4 7985 B15R1.25387 C=C(C)CCOc1c(cc(cc1C)N)C 7a_100000703291_100000730704 [0,1,0,0,0,1|1,0,1]=4 7986 B15R1.25387 C=C(C)COCc1c(cc(cc1C)Br)C 34a_100010128451_100000748629 [0,1,0,0,0,1|1,0,1]=4 7987 B15R1.25387 C=C(C)COCc1c(cc(cc1C)Br)C 7a_100010128451_100000748629 [0,1,0,0,0,1|1,0,1]=4 7988 B15R1.25387 C=C(C)COCc1c(cc(cc1C)C)C 34a_100000210245_100000749405 [0,1,0,0,0,1|1,0,1]=4 7989 B15R1.25387 C=C(C)COCc1c(cc(cc1C)C)C 34a_100011215277_100000748629 [0,1,0,0,0,1|1,0,1]=4 7990 B15R1.25387 C=C(C)COCc1c(cc(cc1C)C)C 7a_100011215277_100000748629 [0,1,0,0,0,1|1,0,1]=4 7991 B15R1.25387 CC(=CCOc1c(cc(cc1C)Br)C)C 34a_100000187306_100000761012 [0,1,0,0,0,1|1,0,1]=4 7992 B15R1.25387 CC(=CCOc1c(cc(cc1C)Br)C)C 7a_100000187306_100000761012 [0,1,0,0,0,1|1,0,1]=4 7993 B15R1.25387 CC(=CCOc1c(cc(cc1C)C)C)C 34a_100000212074_100000761012 [0,1,0,0,0,1|1,0,1]=4 7994 B15R1.25387 CC(=CCOc1c(cc(cc1C)C)C)C 7a_100000212074_100000761012 [0,1,0,0,0,1|1,0,1]=4 7995 B15R1.25387 CC(=CCOc1c(cc(cc1C)Cl)C)C 34a_100000211519_100000761012 [0,1,0,0,0,1|1,0,1]=4 7996 B15R1.25387 CC(=CCOc1c(cc(cc1C)Cl)C)C 7a_100000211519_100000761012 [0,1,0,0,0,1|1,0,1]=4 7997 B15R1.25387 CC(=CCOc1c(cc(cc1C)F)C)C 34a_100000081862_100000761012 [0,1,0,0,0,1|1,0,1]=4 7998 B15R1.25387 CC(=CCOc1c(cc(cc1C)F)C)C 7a_100000081862_100000761012 [0,1,0,0,0,1|1,0,1]=4 7999 B15R1.25387 CC(=CCOc1c(cc(cc1C)I)C)C 34a_100011216129_100000761012 [0,1,0,0,0,1|1,0,1]=4 8000 B15R1.25387 CC(=CCOc1c(cc(cc1C)I)C)C 7a_100011216129_100000761012 [0,1,0,0,0,1|1,0,1]=4 8001 B15R1.25387 CC(=CCOc1c(cc(cc1C)N)C)C 34a_100000703291_100000761012 [0,1,0,0,0,1|1,0,1]=4 8002 B15R1.25387 CC(=CCOc1c(cc(cc1C)N)C)C 7a_100000703291_100000761012 [0,1,0,0,0,1|1,0,1]=4 8003 B15R1.25387 CC(=O)CCOc1c(cc(cc1C)Br)C 7a_100000187306_100000053229 [0,1,0,0,0,1|1,0,1]=4 8004 B15R1.25387 CC(=O)CCOc1c(cc(cc1C)C)C 7a_100000212074_100000053229 [0,1,0,0,0,1|1,0,1]=4 8005 B15R1.25387 CC(=O)CCOc1c(cc(cc1C)Cl)C 7a_100000211519_100000053229 [0,1,0,0,0,1|1,0,1]=4 8006 B15R1.25387 CC(=O)CCOc1c(cc(cc1C)F)C 7a_100000081862_100000053229 [0,1,0,0,0,1|1,0,1]=4 8007 B15R1.25387 CC(=O)CCOc1c(cc(cc1C)I)C 7a_100011216129_100000053229 [0,1,0,0,0,1|1,0,1]=4 8008 B15R1.25387 CC(=O)CCOc1c(cc(cc1C)N)C 7a_100000703291_100000053229 [0,1,0,0,0,1|1,0,1]=4 8009 B15R1.25387 CC(=O)COCc1c(cc(cc1C)C)C 34a_100000211253_100000749405 [0,1,0,0,0,1|1,0,1]=4 8010 B15R1.25387 CC(=O)OCOc1c(cc(cc1C)Br)C 34a_100000187306_100009813279 [0,1,0,0,0,1|1,0,1]=4 8011 B15R1.25387 CC(=O)OCOc1c(cc(cc1C)C)C 34a_100000212074_100009813279 [0,1,0,0,0,1|1,0,1]=4 8012 B15R1.25387 CC(=O)OCOc1c(cc(cc1C)Cl)C 34a_100000211519_100009813279 [0,1,0,0,0,1|1,0,1]=4 8013 B15R1.25387 CC(=O)OCOc1c(cc(cc1C)F)C 34a_100000081862_100009813279 [0,1,0,0,0,1|1,0,1]=4 8014 B15R1.25387 CC(=O)OCOc1c(cc(cc1C)I)C 34a_100011216129_100009813279 [0,1,0,0,0,1|1,0,1]=4 8015 B15R1.25387 CC(=O)OCOc1c(cc(cc1C)N)C 34a_100000703291_100009813279 [0,1,0,0,0,1|1,0,1]=4 8016 B15R1.25387 C[C@@H](N)COCc1c(cc(cc1Br)F)F 34a_100000737577_100015786123 [0,1,0,0,0,1|2,0,0]=4 8017 B15R1.25387 C[C@@H](N)COCc1c(cc(cc1Cl)Cl)Cl 34a_100000737577_100012339996 [0,1,0,0,0,1|2,0,0]=4 8018 B15R1.25387 C[C@@H](N)COCc1c(cc(cc1F)Br)F 34a_100000737577_100012355225 [0,1,0,0,0,1|2,0,0]=4 8019 B15R1.25387 C[C@@H](N)COCc1c(cc(cc1F)Cl)F 34a_100000737577_100009813723 [0,1,0,0,0,1|2,0,0]=4 8020 B15R1.25387 C[C@@H](N)COCc1c(cc(cc1F)F)F 34a_100000737577_100011216150 [0,1,0,0,0,1|2,0,0]=4 8021 B15R1.25387 Cc1cc(c(c(c1)Br)OCCC(C)C)C 34a_100011934984_100000210312 [0,1,0,0,0,1|2,0,0]=4 8022 B15R1.25387 Cc1cc(c(c(c1)Br)OCCC(C)C)C 7a_100011934984_100000210626 [0,1,0,0,0,1|2,0,0]=4 8023 B15R1.25387 Cc1cc(c(c(c1)Br)OCCC(C)O)C 34a_100011934984_100012276601 [0,1,0,0,0,1|2,0,0]=4 8024 B15R1.25387 Cc1cc(c(c(c1)Br)OCCC(C)O)C 7a_100011934984_100012276601 [0,1,0,0,0,1|2,0,0]=4 8025 B15R1.25387 Cc1cc(c(c(c1)Br)OCOC(C)C)C 34a_100011934984_100000709892 [0,1,0,0,0,1|2,0,0]=4 8026 B15R1.25387 Cc1cc(c(c(c1)C)C=CCC(C)C)C 271570a_100016259101_100011204320 [0,1,0,0,0,1|2,0,0]=4 8027 B15R1.25387 Cc1cc(c(c(c1)C)CCNC(C)C)C 2230a_100000692091_100000210206 [0,1,0,0,0,1|2,0,0]=4 8028 B15R1.25387 Cc1cc(c(c(c1)C)CCNC(C)C)C 34a_100000692091_100000210206 [0,1,0,0,0,1|2,0,0]=4 8029 B15R1.25387 Cc1cc(c(c(c1)C)CCOC(C)C)C 34a_100011216341_100000210206 [0,1,0,0,0,1|2,0,0]=4 8030 B15R1.25387 Cc1cc(c(c(c1)C)CCOC(C)C)C 7a_100011216341_100000210206 [0,1,0,0,0,1|2,0,0]=4 8031 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)C)C 207a_100000210953_100000211105 [0,1,0,0,0,1|2,0,0]=4 8032 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)C)C 2230a_100000210953_100000749405 [0,1,0,0,0,1|2,0,0]=4 8033 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)C)C 2230a_100000737526_100000210760 [0,1,0,0,0,1|2,0,0]=4 8034 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)C)C 270004a_100000210953_100000211105 [0,1,0,0,0,1|2,0,0]=4 8035 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)C)C 270004a_100000737526_100000210432 [0,1,0,0,0,1|2,0,0]=4 8036 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)C)C 34a_100000210953_100000749405 [0,1,0,0,0,1|2,0,0]=4 8037 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)C)C 34a_100000737526_100000210624 [0,1,0,0,0,1|2,0,0]=4 8038 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)O)C 207a_100000210904_100000211105 [0,1,0,0,0,1|2,0,0]=4 8039 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)O)C 2230a_100000210904_100000749405 [0,1,0,0,0,1|2,0,0]=4 8040 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)O)C 2230a_100000737526_100011218427 [0,1,0,0,0,1|2,0,0]=4 8041 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)O)C 270004a_100000210904_100000211105 [0,1,0,0,0,1|2,0,0]=4 8042 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)O)C 34a_100000210904_100000749405 [0,1,0,0,0,1|2,0,0]=4 8043 B15R1.25387 Cc1cc(c(c(c1)C)CNCC(C)O)C 34a_100000737526_100011218427 [0,1,0,0,0,1|2,0,0]=4 8044 B15R1.25387 Cc1cc(c(c(c1)C)CNC[C@@H](C)O)C 2230a_100000737526_100009817552 [0,1,0,0,0,1|2,0,0]=4 8045 B15R1.25387 Cc1cc(c(c(c1)C)CNC[C@@H](C)O)C 34a_100000737526_100009817552 [0,1,0,0,0,1|2,0,0]=4 8046 B15R1.25387 Cc1cc(c(c(c1)C)COCC(=O)N)C 34a_100011215277_100000187820 [0,1,0,0,0,1|1,0,1]=4 8047 B15R1.25387 Cc1cc(c(c(c1)C)COCC(=O)N)C 7a_100011215277_100000187820 [0,1,0,0,0,1|1,0,1]=4 8048 B15R1.25387 Cc1cc(c(c(c1)C)COCC(C)Br)C 34a_100012180447_100000749405 [0,1,0,0,0,1|1,0,0]=3 8049 B15R1.25387 Cc1cc(c(c(c1)C)COCC(C)C)C 34a_100000210257_100000749405 [0,1,0,0,0,1|1,0,0]=3 8050 B15R1.25387 Cc1cc(c(c(c1)C)COCC(C)C)C 34a_100011215277_100000210624 [0,1,0,0,0,1|1,0,0]=3 8051 B15R1.25387 Cc1cc(c(c(c1)C)COCC(C)C)C 7a_100011215277_100000210760 [0,1,0,0,0,1|1,0,0]=3 8052 B15R1.25387 Cc1cc(c(c(c1)C)COCC(C)F)C 34a_100015925927_100000749405 [0,1,0,0,0,1|1,0,0]=3 8053 B15R1.25387 Cc1cc(c(c(c1)C)COCC(C)O)C 34a_100011215277_100011218427 [0,1,0,0,0,1|1,0,0]=3 8054 B15R1.25387 Cc1cc(c(c(c1)C)COCC(C)O)C 7a_100011215277_100011218427 [0,1,0,0,0,1|1,0,0]=3 8055 B15R1.25387 Cc1cc(c(c(c1)C)COCC(F)F)C 34a_100000743014_100000749405 [0,1,0,0,0,1|2,0,0]=4 8056 B15R1.25387 Cc1cc(c(c(c1)C)COCC(F)F)C 34a_100011215277_100011934356 [0,1,0,0,0,1|2,0,0]=4 8057 B15R1.25387 Cc1cc(c(c(c1)C)COCC(F)F)C 7a_100011215277_100011934356 [0,1,0,0,0,1|2,0,0]=4 8058 B15R1.25387 Cc1cc(c(c(c1)C)COC[C@@H](C)Cl)C 34a_100016084084_100000749405 [0,1,0,0,0,1|1,0,0]=3 8059 B15R1.25387 Cc1cc(c(c(c1)C)COC[C@@H](C)N)C 34a_100000737577_100000749405 [0,1,0,0,0,1|0,0,0]=2 8060 B15R1.25387 Cc1cc(c(c(c1)C)COC[C@@H](C)O)C 34a_100011215277_100009817552 [0,1,0,0,0,1|1,0,0]=3 8061 B15R1.25387 Cc1cc(c(c(c1)C)COC[C@@H](C)O)C 7a_100011215277_100009817552 [0,1,0,0,0,1|1,0,0]=3 8062 B15R1.25387 Cc1cc(c(c(c1)C)CSCC(C)C)C 62a_100000210624_100000749405 [0,1,0,0,0,1|1,1,0]=4 8063 B15R1.25387 Cc1cc(c(c(c1)C)CSCC(C)C)C 62a_100000749405_100000210760 [0,1,0,0,0,1|1,1,0]=4 8064 B15R1.25387 Cc1cc(c(c(c1)C)CSCC(C)O)C 62a_100000749405_100011218427 [0,1,0,0,0,1|1,1,0]=4 8065 B15R1.25387 Cc1cc(c(c(c1)C)CSCC(C)O)C 62a_100011218427_100000749405 [0,1,0,0,0,1|1,1,0]=4 8066 B15R1.25387 Cc1cc(c(c(c1)C)CSC[C@@H](C)O)C 62a_100000749405_100009817552 [0,1,0,0,0,1|1,1,0]=4 8067 B15R1.25387 Cc1cc(c(c(c1)C)CSC[C@@H](C)O)C 62a_100009817552_100000749405 [0,1,0,0,0,1|1,1,0]=4 8068 B15R1.25387 Cc1cc(c(c(c1)C)NCCC(C)C)C 34a_100000210045_100000210312 [0,1,0,0,0,1|2,0,0]=4 8069 B15R1.25387 Cc1cc(c(c(c1)C)NCCC(C)C)C 7a_100000210045_100000210626 [0,1,0,0,0,1|2,0,0]=4 8070 B15R1.25387 Cc1cc(c(c(c1)C)NCCC(C)O)C 34a_100000210045_100012276601 [0,1,0,0,0,1|2,0,0]=4 8071 B15R1.25387 Cc1cc(c(c(c1)C)NCCC(C)O)C 7a_100000210045_100012276601 [0,1,0,0,0,1|2,0,0]=4 8072 B15R1.25387 Cc1cc(c(c(c1)C)NCOC(C)C)C 34a_100000210045_100000709892 [0,1,0,0,0,1|2,0,0]=4 8073 B15R1.25387 Cc1cc(c(c(c1)C)OCCC(=O)N)C 34a_100000212074_100000731001 [0,1,0,0,0,1|1,0,1]=4 8074 B15R1.25387 Cc1cc(c(c(c1)C)OCCC(=O)N)C 7a_100000212074_100000744528 [0,1,0,0,0,1|1,0,1]=4 8075 B15R1.25387 Cc1cc(c(c(c1)C)OCCC(C)C)C 34a_100000212074_100000210312 [0,1,0,0,0,1|1,0,0]=3 8076 B15R1.25387 Cc1cc(c(c(c1)C)OCCC(C)C)C 7a_100000212074_100000210626 [0,1,0,0,0,1|1,0,0]=3 8077 B15R1.25387 Cc1cc(c(c(c1)C)OCCC(C)O)C 34a_100000212074_100012276601 [0,1,0,0,0,1|1,0,0]=3 8078 B15R1.25387 Cc1cc(c(c(c1)C)OCCC(C)O)C 7a_100000212074_100012276601 [0,1,0,0,0,1|1,0,0]=3 8079 B15R1.25387 Cc1cc(c(c(c1)C)OCCN(C)C)C 2230a_100011430977_200000210301 [0,1,0,0,0,1|2,0,0]=4 8080 B15R1.25387 Cc1cc(c(c(c1)C)OCCN(C)C)C 269982a_100011430977_200000210301 [0,1,0,0,0,1|2,0,0]=4 8081 B15R1.25387 Cc1cc(c(c(c1)C)OCCN(C)C)C 34a_100011430977_200000210301 [0,1,0,0,0,1|2,0,0]=4 8082 B15R1.25387 Cc1cc(c(c(c1)C)OCCN(C)C)C 7a_100000212074_100000755713 [0,1,0,0,0,1|2,0,0]=4 8083 B15R1.25387 Cc1cc(c(c(c1)C)OCCN(C)[13CH3])C 2230a_100011430977_200025704644 [0,1,0,0,0,1|2,0,0]=4 8084 B15R1.25387 Cc1cc(c(c(c1)C)OCCN(C)[13CH3])C 269982a_100011430977_200025704644 [0,1,0,0,0,1|2,0,0]=4 8085 B15R1.25387 Cc1cc(c(c(c1)C)OCCN(C)[13CH3])C 34a_100011430977_200025704644 [0,1,0,0,0,1|2,0,0]=4 8086 B15R1.25387 Cc1cc(c(c(c1)C)OCOC(C)C)C 34a_100000212074_100000709892 [0,1,0,0,0,1|1,0,0]=3 8087 B15R1.25387 Cc1cc(c(c(c1)C)SCCC(C)C)C 62a_100000210312_100011204320 [0,1,0,0,0,1|1,1,0]=4 8088 B15R1.25387 Cc1cc(c(c(c1)C)SCCC(C)C)C 62a_100011204320_100000210312 [0,1,0,0,0,1|1,1,0]=4 8089 B15R1.25387 Cc1cc(c(c(c1)C)SCCC(C)O)C 62a_100011204320_100012276601 [0,1,0,0,0,1|1,1,0]=4 8090 B15R1.25387 Cc1cc(c(c(c1)C)SCCC(C)O)C 62a_100012276601_100011204320 [0,1,0,0,0,1|1,1,0]=4 8091 B15R1.25387 Cc1cc(c(c(c1)C)SCOC(C)C)C 62a_100000709892_100011204320 [0,1,0,0,0,1|1,1,0]=4 8092 B15R1.25387 Cc1cc(c(c(c1)C)SCOC(C)C)C 62a_100011204320_100000709892 [0,1,0,0,0,1|1,1,0]=4 8093 B15R1.25387 Cc1cc(c(c(c1)N)OCCC(C)C)C 34a_100011216242_100000210312 [0,1,0,0,0,1|2,0,0]=4 8094 B15R1.25387 Cc1cc(c(c(c1)N)OCCC(C)C)C 7a_100011216242_100000210626 [0,1,0,0,0,1|2,0,0]=4 8095 B15R1.25387 Cc1cc(c(c(c1)N)OCCC(C)O)C 34a_100011216242_100012276601 [0,1,0,0,0,1|2,0,0]=4 8096 B15R1.25387 Cc1cc(c(c(c1)N)OCCC(C)O)C 7a_100011216242_100012276601 [0,1,0,0,0,1|2,0,0]=4 8097 B15R1.25387 Cc1cc(c(c(c1)N)OCOC(C)C)C 34a_100011216242_100000709892 [0,1,0,0,0,1|2,0,0]=4 8098 B15R1.25387 Cc1cc(cc(c1C=CCC(C)C)C)Br 271570a_100016259101_100009814048 [0,1,0,0,0,1|2,0,0]=4 8099 B15R1.25387 Cc1cc(cc(c1C=CCC(C)C)C)Cl 271570a_100016259101_100010244930 [0,1,0,0,0,1|2,0,0]=4 8100 B15R1.25387 Cc1cc(cc(c1C=CCC(C)C)C)F 271570a_100016259101_100012356666 [0,1,0,0,0,1|2,0,0]=4 8101 B15R1.25387 Cc1cc(cc(c1C=CCC(C)C)C)O 271570a_100016259101_100000243743 [0,1,0,0,0,1|2,0,0]=4 8102 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)Br 207a_100000210953_100010238521 [0,1,0,0,0,1|2,0,0]=4 8103 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)Br 26a_100000210953_100000187306 [0,1,0,0,0,1|2,0,0]=4 8104 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)Br 270004a_100000210953_100010238521 [0,1,0,0,0,1|2,0,0]=4 8105 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)Cl 207a_100000210953_100000693520 [0,1,0,0,0,1|2,0,0]=4 8106 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)Cl 270004a_100000210953_100000693520 [0,1,0,0,0,1|2,0,0]=4 8107 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)F 207a_100000210953_100012179923 [0,1,0,0,0,1|2,0,0]=4 8108 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)F 270004a_100000210953_100012179923 [0,1,0,0,0,1|2,0,0]=4 8109 B15R1.25387 Cc1cc(cc(c1CNCC(C)C)C)O 207a_100000210953_100011827661 [0,1,0,0,0,1|2,0,0]=4 8110 B15R1.25387 Cc1cc(cc(c1CNCC(C)O)C)Br 207a_100000210904_100010238521 [0,1,0,0,0,1|2,0,0]=4 8111 B15R1.25387 Cc1cc(cc(c1CNCC(C)O)C)Br 270004a_100000210904_100010238521 [0,1,0,0,0,1|2,0,0]=4 8112 B15R1.25387 Cc1cc(cc(c1CNCC(C)O)C)Cl 207a_100000210904_100000693520 [0,1,0,0,0,1|2,0,0]=4 8113 B15R1.25387 Cc1cc(cc(c1CNCC(C)O)C)Cl 270004a_100000210904_100000693520 [0,1,0,0,0,1|2,0,0]=4 8114 B15R1.25387 Cc1cc(cc(c1CNCC(C)O)C)F 207a_100000210904_100012179923 [0,1,0,0,0,1|2,0,0]=4 8115 B15R1.25387 Cc1cc(cc(c1CNCC(C)O)C)F 270004a_100000210904_100012179923 [0,1,0,0,0,1|2,0,0]=4 8116 B15R1.25387 Cc1cc(cc(c1CNCC(C)O)C)O 207a_100000210904_100011827661 [0,1,0,0,0,1|2,0,0]=4 8117 B15R1.25387 Cc1cc(cc(c1COCC(=O)N)C)Br 34a_100010128451_100000187820 [0,1,0,0,0,1|1,0,1]=4 8118 B15R1.25387 Cc1cc(cc(c1COCC(=O)N)C)Br 7a_100010128451_100000187820 [0,1,0,0,0,1|1,0,1]=4 8119 B15R1.25387 Cc1cc(cc(c1COCC(C)C)C)Br 34a_100010128451_100000210624 [0,1,0,0,0,1|1,0,0]=3 8120 B15R1.25387 Cc1cc(cc(c1COCC(C)C)C)Br 7a_100010128451_100000210760 [0,1,0,0,0,1|1,0,0]=3 8121 B15R1.25387 Cc1cc(cc(c1COCC(C)O)C)Br 34a_100010128451_100011218427 [0,1,0,0,0,1|1,0,0]=3 8122 B15R1.25387 Cc1cc(cc(c1COCC(C)O)C)Br 7a_100010128451_100011218427 [0,1,0,0,0,1|1,0,0]=3 8123 B15R1.25387 Cc1cc(cc(c1COCC(F)F)C)Br 34a_100010128451_100011934356 [0,1,0,0,0,1|2,0,0]=4 8124 B15R1.25387 Cc1cc(cc(c1COCC(F)F)C)Br 7a_100010128451_100011934356 [0,1,0,0,0,1|2,0,0]=4 8125 B15R1.25387 Cc1cc(cc(c1COC[C@@H](C)O)C)Br 34a_100010128451_100009817552 [0,1,0,0,0,1|1,0,0]=3 8126 B15R1.25387 Cc1cc(cc(c1COC[C@@H](C)O)C)Br 7a_100010128451_100009817552 [0,1,0,0,0,1|1,0,0]=3 8127 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)Br 34a_100000737279_100000210312 [0,1,0,0,0,1|2,0,0]=4 8128 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)Br 7a_100000737279_100000210626 [0,1,0,0,0,1|2,0,0]=4 8129 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)Cl 34a_100000692879_100000210312 [0,1,0,0,0,1|2,0,0]=4 8130 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)Cl 7a_100000692879_100000210626 [0,1,0,0,0,1|2,0,0]=4 8131 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)F 34a_100011290887_100000210312 [0,1,0,0,0,1|2,0,0]=4 8132 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)F 7a_100011290887_100000210626 [0,1,0,0,0,1|2,0,0]=4 8133 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)I 7a_100011356821_100000210626 [0,1,0,0,0,1|2,0,0]=4 8134 B15R1.25387 Cc1cc(cc(c1NCCC(C)C)C)O 34a_100011934200_100000210312 [0,1,0,0,0,1|2,0,0]=4 8135 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)Br 34a_100000737279_100012276601 [0,1,0,0,0,1|2,0,0]=4 8136 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)Br 7a_100000737279_100012276601 [0,1,0,0,0,1|2,0,0]=4 8137 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)Cl 34a_100000692879_100012276601 [0,1,0,0,0,1|2,0,0]=4 8138 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)Cl 7a_100000692879_100012276601 [0,1,0,0,0,1|2,0,0]=4 8139 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)F 34a_100011290887_100012276601 [0,1,0,0,0,1|2,0,0]=4 8140 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)F 7a_100011290887_100012276601 [0,1,0,0,0,1|2,0,0]=4 8141 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)I 7a_100011356821_100012276601 [0,1,0,0,0,1|2,0,0]=4 8142 B15R1.25387 Cc1cc(cc(c1NCCC(C)O)C)O 34a_100011934200_100012276601 [0,1,0,0,0,1|2,0,0]=4 8143 B15R1.25387 Cc1cc(cc(c1NCOC(C)C)C)Br 34a_100000737279_100000709892 [0,1,0,0,0,1|2,0,0]=4 8144 B15R1.25387 Cc1cc(cc(c1NCOC(C)C)C)Cl 34a_100000692879_100000709892 [0,1,0,0,0,1|2,0,0]=4 8145 B15R1.25387 Cc1cc(cc(c1NCOC(C)C)C)F 34a_100011290887_100000709892 [0,1,0,0,0,1|2,0,0]=4 8146 B15R1.25387 Cc1cc(cc(c1NCOC(C)C)C)O 34a_100011934200_100000709892 [0,1,0,0,0,1|2,0,0]=4 8147 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)Br 34a_100000187306_100000731001 [0,1,0,0,0,1|1,0,1]=4 8148 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)Br 7a_100000187306_100000744528 [0,1,0,0,0,1|1,0,1]=4 8149 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)Cl 34a_100000211519_100000731001 [0,1,0,0,0,1|1,0,1]=4 8150 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)Cl 7a_100000211519_100000744528 [0,1,0,0,0,1|1,0,1]=4 8151 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)F 34a_100000081862_100000731001 [0,1,0,0,0,1|1,0,1]=4 8152 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)F 7a_100000081862_100000744528 [0,1,0,0,0,1|1,0,1]=4 8153 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)I 34a_100011216129_100000731001 [0,1,0,0,0,1|1,0,1]=4 8154 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)I 7a_100011216129_100000744528 [0,1,0,0,0,1|1,0,1]=4 8155 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)N 34a_100000703291_100000731001 [0,1,0,0,0,1|1,0,1]=4 8156 B15R1.25387 Cc1cc(cc(c1OCCC(=O)N)C)N 7a_100000703291_100000744528 [0,1,0,0,0,1|1,0,1]=4 8157 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)Br 34a_100000186369_100000210312 [0,1,0,0,0,1|2,0,0]=4 8158 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)Br 7a_100000186369_100000210626 [0,1,0,0,0,1|2,0,0]=4 8159 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)Cl 34a_100012337756_100000210312 [0,1,0,0,0,1|2,0,0]=4 8160 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)Cl 7a_100012337756_100000210626 [0,1,0,0,0,1|2,0,0]=4 8161 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)I 34a_100010982682_100000210312 [0,1,0,0,0,1|2,0,0]=4 8162 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)I 7a_100010982682_100000210626 [0,1,0,0,0,1|2,0,0]=4 8163 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)N 34a_100010064301_100000210312 [0,1,0,0,0,1|2,0,0]=4 8164 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Br)N 7a_100010064301_100000210626 [0,1,0,0,0,1|2,0,0]=4 8165 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)Br 34a_100000187306_100000210312 [0,1,0,0,0,1|1,0,0]=3 8166 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)Br 7a_100000187306_100000210626 [0,1,0,0,0,1|1,0,0]=3 8167 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)Cl 34a_100000211519_100000210312 [0,1,0,0,0,1|1,0,0]=3 8168 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)Cl 7a_100000211519_100000210626 [0,1,0,0,0,1|1,0,0]=3 8169 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)F 34a_100000081862_100000210312 [0,1,0,0,0,1|1,0,0]=3 8170 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)F 7a_100000081862_100000210626 [0,1,0,0,0,1|1,0,0]=3 8171 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)I 34a_100011216129_100000210312 [0,1,0,0,0,1|1,0,0]=3 8172 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)I 7a_100011216129_100000210626 [0,1,0,0,0,1|1,0,0]=3 8173 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)N 34a_100000703291_100000210312 [0,1,0,0,0,1|1,0,0]=3 8174 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)C)N 7a_100000703291_100000210626 [0,1,0,0,0,1|1,0,0]=3 8175 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Cl)Br 34a_100000211485_100000210312 [0,1,0,0,0,1|2,0,0]=4 8176 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Cl)Br 7a_100000211485_100000210626 [0,1,0,0,0,1|2,0,0]=4 8177 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Cl)Cl 34a_100011218458_100000210312 [0,1,0,0,0,1|2,0,0]=4 8178 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Cl)Cl 7a_100011218458_100000210626 [0,1,0,0,0,1|2,0,0]=4 8179 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Cl)I 34a_200015900153_100000210312 [0,1,0,0,0,1|2,0,0]=4 8180 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)Cl)I 7a_200015900153_100000210626 [0,1,0,0,0,1|2,0,0]=4 8181 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)I)Cl 34a_100012343667_100000210312 [0,1,0,0,0,1|2,0,0]=4 8182 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)I)Cl 7a_100012343667_100000210626 [0,1,0,0,0,1|2,0,0]=4 8183 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)N)Br 34a_100011825904_100000210312 [0,1,0,0,0,1|2,0,0]=4 8184 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)N)Br 7a_100011825904_100000210626 [0,1,0,0,0,1|2,0,0]=4 8185 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)N)F 34a_100000130126_100000210312 [0,1,0,0,0,1|2,0,0]=4 8186 B15R1.25387 Cc1cc(cc(c1OCCC(C)C)N)F 7a_100000130126_100000210626 [0,1,0,0,0,1|2,0,0]=4 8187 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)Br 34a_100000186369_100012276601 [0,1,0,0,0,1|2,0,0]=4 8188 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)Br 7a_100000186369_100012276601 [0,1,0,0,0,1|2,0,0]=4 8189 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)Cl 34a_100012337756_100012276601 [0,1,0,0,0,1|2,0,0]=4 8190 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)Cl 7a_100012337756_100012276601 [0,1,0,0,0,1|2,0,0]=4 8191 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)I 34a_100010982682_100012276601 [0,1,0,0,0,1|2,0,0]=4 8192 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)I 7a_100010982682_100012276601 [0,1,0,0,0,1|2,0,0]=4 8193 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)N 34a_100010064301_100012276601 [0,1,0,0,0,1|2,0,0]=4 8194 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Br)N 7a_100010064301_100012276601 [0,1,0,0,0,1|2,0,0]=4 8195 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)Br 34a_100000187306_100012276601 [0,1,0,0,0,1|1,0,0]=3 8196 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)Br 7a_100000187306_100012276601 [0,1,0,0,0,1|1,0,0]=3 8197 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)Cl 34a_100000211519_100012276601 [0,1,0,0,0,1|1,0,0]=3 8198 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)Cl 7a_100000211519_100012276601 [0,1,0,0,0,1|1,0,0]=3 8199 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)F 34a_100000081862_100012276601 [0,1,0,0,0,1|1,0,0]=3 8200 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)F 7a_100000081862_100012276601 [0,1,0,0,0,1|1,0,0]=3 8201 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)I 34a_100011216129_100012276601 [0,1,0,0,0,1|1,0,0]=3 8202 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)I 7a_100011216129_100012276601 [0,1,0,0,0,1|1,0,0]=3 8203 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)N 34a_100000703291_100012276601 [0,1,0,0,0,1|1,0,0]=3 8204 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)C)N 7a_100000703291_100012276601 [0,1,0,0,0,1|1,0,0]=3 8205 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Cl)Br 34a_100000211485_100012276601 [0,1,0,0,0,1|2,0,0]=4 8206 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Cl)Br 7a_100000211485_100012276601 [0,1,0,0,0,1|2,0,0]=4 8207 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Cl)Cl 34a_100011218458_100012276601 [0,1,0,0,0,1|2,0,0]=4 8208 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Cl)Cl 7a_100011218458_100012276601 [0,1,0,0,0,1|2,0,0]=4 8209 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Cl)I 34a_200015900153_100012276601 [0,1,0,0,0,1|2,0,0]=4 8210 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)Cl)I 7a_200015900153_100012276601 [0,1,0,0,0,1|2,0,0]=4 8211 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)I)Cl 34a_100012343667_100012276601 [0,1,0,0,0,1|2,0,0]=4 8212 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)I)Cl 7a_100012343667_100012276601 [0,1,0,0,0,1|2,0,0]=4 8213 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)N)Br 34a_100011825904_100012276601 [0,1,0,0,0,1|2,0,0]=4 8214 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)N)Br 7a_100011825904_100012276601 [0,1,0,0,0,1|2,0,0]=4 8215 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)N)F 34a_100000130126_100012276601 [0,1,0,0,0,1|2,0,0]=4 8216 B15R1.25387 Cc1cc(cc(c1OCCC(C)O)N)F 7a_100000130126_100012276601 [0,1,0,0,0,1|2,0,0]=4 8217 B15R1.25387 Cc1cc(cc(c1OCCN(C)C)C)Br 7a_100000187306_100000755713 [0,1,0,0,0,1|2,0,0]=4 8218 B15R1.25387 Cc1cc(cc(c1OCCN(C)C)C)Cl 7a_100000211519_100000755713 [0,1,0,0,0,1|2,0,0]=4 8219 B15R1.25387 Cc1cc(cc(c1OCCN(C)C)C)F 7a_100000081862_100000755713 [0,1,0,0,0,1|2,0,0]=4 8220 B15R1.25387 Cc1cc(cc(c1OCCN(C)C)C)I 7a_100011216129_100000755713 [0,1,0,0,0,1|2,0,0]=4 8221 B15R1.25387 Cc1cc(cc(c1OCCN(C)C)C)N 7a_100000703291_100000755713 [0,1,0,0,0,1|2,0,0]=4 8222 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)Br)Br 34a_100000186369_100000709892 [0,1,0,0,0,1|2,0,0]=4 8223 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)Br)Cl 34a_100012337756_100000709892 [0,1,0,0,0,1|2,0,0]=4 8224 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)Br)I 34a_100010982682_100000709892 [0,1,0,0,0,1|2,0,0]=4 8225 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)Br)N 34a_100010064301_100000709892 [0,1,0,0,0,1|2,0,0]=4 8226 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)C)Br 34a_100000187306_100000709892 [0,1,0,0,0,1|1,0,0]=3 8227 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)C)Cl 34a_100000211519_100000709892 [0,1,0,0,0,1|1,0,0]=3 8228 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)C)F 34a_100000081862_100000709892 [0,1,0,0,0,1|1,0,0]=3 8229 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)C)I 34a_100011216129_100000709892 [0,1,0,0,0,1|1,0,0]=3 8230 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)C)N 34a_100000703291_100000709892 [0,1,0,0,0,1|1,0,0]=3 8231 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)Cl)Br 34a_100000211485_100000709892 [0,1,0,0,0,1|2,0,0]=4 8232 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)Cl)Cl 34a_100011218458_100000709892 [0,1,0,0,0,1|2,0,0]=4 8233 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)Cl)I 34a_200015900153_100000709892 [0,1,0,0,0,1|2,0,0]=4 8234 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)I)Cl 34a_100012343667_100000709892 [0,1,0,0,0,1|2,0,0]=4 8235 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)N)Br 34a_100011825904_100000709892 [0,1,0,0,0,1|2,0,0]=4 8236 B15R1.25387 Cc1cc(cc(c1OCOC(C)C)N)F 34a_100000130126_100000709892 [0,1,0,0,0,1|2,0,0]=4 8237 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)Br 62a_100000210312_100009814048 [0,1,0,0,0,1|1,1,0]=4 8238 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)Br 62a_100009814048_100000210312 [0,1,0,0,0,1|1,1,0]=4 8239 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)Cl 62a_100000210312_100010244930 [0,1,0,0,0,1|1,1,0]=4 8240 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)Cl 62a_100010244930_100000210312 [0,1,0,0,0,1|1,1,0]=4 8241 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)F 62a_100000210312_100012356666 [0,1,0,0,0,1|1,1,0]=4 8242 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)F 62a_100012356666_100000210312 [0,1,0,0,0,1|1,1,0]=4 8243 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)N 62a_100000210312_100000215964 [0,1,0,0,0,1|1,1,0]=4 8244 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)N 62a_100000215964_100000210312 [0,1,0,0,0,1|1,1,0]=4 8245 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)O 62a_100000210312_100000243743 [0,1,0,0,0,1|1,1,0]=4 8246 B15R1.25387 Cc1cc(cc(c1SCCC(C)C)C)O 62a_100000243743_100000210312 [0,1,0,0,0,1|1,1,0]=4 8247 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)Br 62a_100009814048_100012276601 [0,1,0,0,0,1|1,1,0]=4 8248 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)Br 62a_100012276601_100009814048 [0,1,0,0,0,1|1,1,0]=4 8249 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)Cl 62a_100010244930_100012276601 [0,1,0,0,0,1|1,1,0]=4 8250 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)Cl 62a_100012276601_100010244930 [0,1,0,0,0,1|1,1,0]=4 8251 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)F 62a_100012276601_100012356666 [0,1,0,0,0,1|1,1,0]=4 8252 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)F 62a_100012356666_100012276601 [0,1,0,0,0,1|1,1,0]=4 8253 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)N 62a_100000215964_100012276601 [0,1,0,0,0,1|1,1,0]=4 8254 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)N 62a_100012276601_100000215964 [0,1,0,0,0,1|1,1,0]=4 8255 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)O 62a_100000243743_100012276601 [0,1,0,0,0,1|1,1,0]=4 8256 B15R1.25387 Cc1cc(cc(c1SCCC(C)O)C)O 62a_100012276601_100000243743 [0,1,0,0,0,1|1,1,0]=4 8257 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)Br 62a_100000709892_100009814048 [0,1,0,0,0,1|1,1,0]=4 8258 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)Br 62a_100009814048_100000709892 [0,1,0,0,0,1|1,1,0]=4 8259 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)Cl 62a_100000709892_100010244930 [0,1,0,0,0,1|1,1,0]=4 8260 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)Cl 62a_100010244930_100000709892 [0,1,0,0,0,1|1,1,0]=4 8261 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)F 62a_100000709892_100012356666 [0,1,0,0,0,1|1,1,0]=4 8262 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)F 62a_100012356666_100000709892 [0,1,0,0,0,1|1,1,0]=4 8263 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)N 62a_100000215964_100000709892 [0,1,0,0,0,1|1,1,0]=4 8264 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)N 62a_100000709892_100000215964 [0,1,0,0,0,1|1,1,0]=4 8265 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)O 62a_100000243743_100000709892 [0,1,0,0,0,1|1,1,0]=4 8266 B15R1.25387 Cc1cc(cc(c1SCOC(C)C)C)O 62a_100000709892_100000243743 [0,1,0,0,0,1|1,1,0]=4 8267 B15R1.42427 C=CC(C)COCc1c(cccc1Br)C 34a_100011215527_100010146847 [0,1,0,0,0,1|2,0,0]=4 8268 B15R1.42427 C=CC(C)COCc1c(cccc1Br)C 7a_100011215527_100010146847 [0,1,0,0,0,1|2,0,0]=4 8269 B15R1.42427 C=CC(C)COCc1c(cccc1C)C 34a_100011215527_100000758300 [0,1,0,0,0,1|1,0,0]=3 8270 B15R1.42427 C=CC(C)COCc1c(cccc1C)C 7a_100011215527_100000758300 [0,1,0,0,0,1|1,0,0]=3 8271 B15R1.42427 C=CC(C)COCc1c(cccc1F)C 34a_100011215527_100009814554 [0,1,0,0,0,1|2,0,0]=4 8272 B15R1.42427 C=CC(C)COCc1c(cccc1F)C 7a_100011215527_100009814554 [0,1,0,0,0,1|2,0,0]=4 8273 B15R1.42427 C=CC(C)COCc1c(cccc1I)C 34a_100011215527_100010150146 [0,1,0,0,0,1|2,0,0]=4 8274 B15R1.42427 C=CC(C)COCc1c(cccc1I)C 7a_100011215527_100010150146 [0,1,0,0,0,1|2,0,0]=4 8275 B15R1.42427 C=CC(O)COCc1c(cccc1C)C 34a_100011933981_100000730141 [0,1,0,0,0,1|1,0,1]=4 8276 B15R1.42427 C=CC(O)COCc1c(cccc1C)C 7a_100011933981_100000730141 [0,1,0,0,0,1|1,0,1]=4 8277 B15R1.42427 C=C[C@H](N)COCc1c(cccc1Br)C 34a_100016989147_100010146847 [0,1,0,0,0,1|1,0,1]=4 8278 B15R1.42427 C=C[C@H](N)COCc1c(cccc1C)C 34a_100016989147_100000758300 [0,1,0,0,0,1|0,0,1]=3 8279 B15R1.42427 C=C[C@H](N)COCc1c(cccc1F)C 34a_100016989147_100009814554 [0,1,0,0,0,1|1,0,1]=4 8280 B15R1.42427 C=C[C@H](N)COCc1c(cccc1I)C 34a_100016989147_100010150146 [0,1,0,0,0,1|1,0,1]=4 8281 B15R1.42427 CC(CN)COCc1c(cccc1Br)Cl 34a_100000744482_100010138402 [0,1,0,0,0,1|2,0,0]=4 8282 B15R1.42427 CC(CN)COCc1c(cccc1Br)F 34a_100000744482_100012145669 [0,1,0,0,0,1|2,0,0]=4 8283 B15R1.42427 CC(CN)COCc1c(cccc1Cl)Cl 34a_100000744482_100000187851 [0,1,0,0,0,1|2,0,0]=4 8284 B15R1.42427 CC(CN)COCc1c(cccc1Cl)F 34a_100000744482_100000187852 [0,1,0,0,0,1|2,0,0]=4 8285 B15R1.42427 CC(CN)COCc1c(cccc1F)F 34a_100000744482_100000698325 [0,1,0,0,0,1|2,0,0]=4 8286 B15R1.42427 CC(CN)COCc1c(cccc1I)Br 34a_100000744482_100010146611 [0,1,0,0,0,1|2,0,0]=4 8287 B15R1.42427 CC(CN)COCc1c(cccc1I)F 34a_100000744482_100010149602 [0,1,0,0,0,1|2,0,0]=4 8288 B15R1.42427 CCC(=O)CCOc1c(cccc1C)C 1458a_100000210414_100000184555 [0,1,0,0,0,1|1,0,1]=4 8289 B15R1.42427 CCC(=O)CCOc1c(cccc1C)C 1458a_200000738035_100000210202 [0,1,0,0,0,1|1,0,1]=4 8290 B15R1.42427 CCC(=O)COCc1c(cccc1C)C 34a_100000725409_100000758300 [0,1,0,0,0,1|1,0,1]=4 8291 B15R1.42427 CCC(=O)COCc1c(cccc1C)C 7a_100011933981_100000747405 [0,1,0,0,0,1|1,0,1]=4 8292 B15R1.42427 CCC(C)CNCc1c(cccc1C)C 207a_100020588543_100000758299 [0,1,0,0,0,1|2,0,0]=4 8293 B15R1.42427 CCC(C)CNCc1c(cccc1C)C 2230a_100020588543_100000758300 [0,1,0,0,0,1|2,0,0]=4 8294 B15R1.42427 CCC(C)CNCc1c(cccc1C)C 270004a_100000689800_100000243153 [0,1,0,0,0,1|2,0,0]=4 8295 B15R1.42427 CCC(C)CNCc1c(cccc1C)C 270004a_100020588543_100000758299 [0,1,0,0,0,1|2,0,0]=4 8296 B15R1.42427 CCC(C)CNCc1c(cccc1C)C 34a_100000689800_100000748023 [0,1,0,0,0,1|2,0,0]=4 8297 B15R1.42427 CCC(C)COCc1c(cccc1C)C 34a_100011933981_100000748023 [0,1,0,0,0,1|1,0,0]=3 8298 B15R1.42427 CCC(C)COCc1c(cccc1C)C 7a_100011933981_100000748023 [0,1,0,0,0,1|1,0,0]=3 8299 B15R1.42427 CCC(C)COCc1c(cccc1Cl)C 34a_100000082531_100000748023 [0,1,0,0,0,1|2,0,0]=4 8300 B15R1.42427 CCC(C)COCc1c(cccc1Cl)C 7a_100000082531_100000748023 [0,1,0,0,0,1|2,0,0]=4 8301 B15R1.42427 CCC(C)COCc1c(cccc1F)C 34a_100000057874_100000748023 [0,1,0,0,0,1|2,0,0]=4 8302 B15R1.42427 CCC(C)COCc1c(cccc1F)C 7a_100000057874_100000748023 [0,1,0,0,0,1|2,0,0]=4 8303 B15R1.42427 CCC(C)CSCc1c(cccc1C)C 62a_100000748023_100000758300 [0,1,0,0,0,1|1,1,0]=4 8304 B15R1.42427 CCC(C)CSCc1c(cccc1C)C 62a_100000758300_100000748023 [0,1,0,0,0,1|1,1,0]=4 8305 B15R1.42427 CCC(O)CNCc1c(cccc1C)C 207a_100011218483_100000758299 [0,1,0,0,0,1|2,0,0]=4 8306 B15R1.42427 CCC(O)CNCc1c(cccc1C)C 2230a_100011218483_100000758300 [0,1,0,0,0,1|2,0,0]=4 8307 B15R1.42427 CCC(O)CNCc1c(cccc1C)C 270004a_100011218483_100000758299 [0,1,0,0,0,1|2,0,0]=4 8308 B15R1.42427 CCC(O)CNCc1c(cccc1C)C 34a_100000689800_100011218378 [0,1,0,0,0,1|2,0,0]=4 8309 B15R1.42427 CCC(O)COCc1c(cccc1C)C 34a_100011933981_100011218378 [0,1,0,0,0,1|1,0,0]=3 8310 B15R1.42427 CCC(O)COCc1c(cccc1C)C 7a_100011933981_100011218378 [0,1,0,0,0,1|1,0,0]=3 8311 B15R1.42427 CCC(O)COCc1c(cccc1Cl)C 34a_100000082531_100011218378 [0,1,0,0,0,1|2,0,0]=4 8312 B15R1.42427 CCC(O)COCc1c(cccc1Cl)C 7a_100000082531_100011218378 [0,1,0,0,0,1|2,0,0]=4 8313 B15R1.42427 CCC(O)COCc1c(cccc1F)C 34a_100000057874_100011218378 [0,1,0,0,0,1|2,0,0]=4 8314 B15R1.42427 CCC(O)COCc1c(cccc1F)C 7a_100000057874_100011218378 [0,1,0,0,0,1|2,0,0]=4 8315 B15R1.42427 CCC(O)CSCc1c(cccc1C)C 62a_100000758300_100011218378 [0,1,0,0,0,1|1,1,0]=4 8316 B15R1.42427 CCC(O)CSCc1c(cccc1C)C 62a_100011218378_100000758300 [0,1,0,0,0,1|1,1,0]=4 8317 B15R1.42427 CCN(C)CCOc1c(cccc1C)C 2230a_100000225621_100000184555 [0,1,0,0,0,1|2,0,0]=4 8318 B15R1.42427 CCN(C)CCOc1c(cccc1C)C 2230a_100015185059_200000210301 [0,1,0,0,0,1|2,0,0]=4 8319 B15R1.42427 CCN(C)CCOc1c(cccc1C)C 269982a_100000225621_100000184555 [0,1,0,0,0,1|2,0,0]=4 8320 B15R1.42427 CCN(C)CCOc1c(cccc1C)C 269982a_100015185059_200000210301 [0,1,0,0,0,1|2,0,0]=4 8321 B15R1.42427 CCN(C)CCOc1c(cccc1C)C 34a_100015185059_200000210301 [0,1,0,0,0,1|2,0,0]=4 8322 B15R1.42427 CCN([13CH3])CCOc1c(cccc1C)C 2230a_100015185059_200025704644 [0,1,0,0,0,1|2,0,0]=4 8323 B15R1.42427 CCN([13CH3])CCOc1c(cccc1C)C 269982a_100015185059_200025704644 [0,1,0,0,0,1|2,0,0]=4 8324 B15R1.42427 CCN([13CH3])CCOc1c(cccc1C)C 34a_100015185059_200025704644 [0,1,0,0,0,1|2,0,0]=4 8325 B15R1.42427 CC[C@H](C)CNCc1c(cccc1C)C 34a_100000689800_100009816398 [0,1,0,0,0,1|2,0,0]=4 8326 B15R1.42427 CC[C@H](C)COCc1c(cccc1Br)C 7a_100009816381_100010146847 [0,1,0,0,0,1|2,0,0]=4 8327 B15R1.42427 CC[C@H](C)COCc1c(cccc1C)C 34a_100011933981_100009816398 [0,1,0,0,0,1|1,0,0]=3 8328 B15R1.42427 CC[C@H](C)COCc1c(cccc1C)C 7a_100009816381_100000758300 [0,1,0,0,0,1|1,0,0]=3 8329 B15R1.42427 CC[C@H](C)COCc1c(cccc1C)C 7a_100011933981_100009816398 [0,1,0,0,0,1|1,0,0]=3 8330 B15R1.42427 CC[C@H](C)COCc1c(cccc1Cl)C 34a_100000082531_100009816398 [0,1,0,0,0,1|2,0,0]=4 8331 B15R1.42427 CC[C@H](C)COCc1c(cccc1Cl)C 7a_100000082531_100009816398 [0,1,0,0,0,1|2,0,0]=4 8332 B15R1.42427 CC[C@H](C)COCc1c(cccc1F)C 34a_100000057874_100009816398 [0,1,0,0,0,1|2,0,0]=4 8333 B15R1.42427 CC[C@H](C)COCc1c(cccc1F)C 7a_100000057874_100009816398 [0,1,0,0,0,1|2,0,0]=4 8334 B15R1.42427 CC[C@H](C)COCc1c(cccc1F)C 7a_100009816381_100009814554 [0,1,0,0,0,1|2,0,0]=4 8335 B15R1.42427 CC[C@H](C)COCc1c(cccc1I)C 7a_100009816381_100010150146 [0,1,0,0,0,1|2,0,0]=4 8336 B15R1.42427 CC[C@H](C)CSCc1c(cccc1C)C 62a_100000758300_100009816398 [0,1,0,0,0,1|1,1,0]=4 8337 B15R1.42427 CC[C@H](C)CSCc1c(cccc1C)C 62a_100009816398_100000758300 [0,1,0,0,0,1|1,1,0]=4 8338 B15R1.42427 CNC(=O)CCOc1c(cccc1C)C 11a_106832991635_200000738035 [0,1,0,0,0,1|1,0,1]=4 8339 B15R1.42427 CNC(=O)CCOc1c(cccc1C)C 1626a_100102657272_200000738035 [0,1,0,0,0,1|1,0,1]=4 8340 B15R1.42427 CNC(=O)CCOc1c(cccc1C)C 240690a_100102657272_200000738035 [0,1,0,0,0,1|1,0,1]=4 8341 B15R1.42427 CNC(=O)CCOc1c(cccc1C)C 34a_100000210341_100012179268 [0,1,0,0,0,1|1,0,1]=4 8342 B15R1.42427 CNC(=O)CCOc1c(cccc1C)C 7a_100000210341_100000737683 [0,1,0,0,0,1|1,0,1]=4 8343 B15R1.42427 CNC(=O)COCc1c(cccc1C)C 34a_100000750040_100000758300 [0,1,0,0,0,1|1,0,1]=4 8344 B15R1.42427 CNC(=O)COCc1c(cccc1C)C 34a_100011933981_100000183359 [0,1,0,0,0,1|1,0,1]=4 8345 B15R1.42427 CNC(=O)COCc1c(cccc1C)C 7a_100011933981_100000183359 [0,1,0,0,0,1|1,0,1]=4 8346 B15R1.42427 COC(=O)CCOc1c(cccc1C)C 34a_100000210341_100000742370 [0,1,0,0,0,1|1,0,1]=4 8347 B15R1.42427 COC(=O)CCOc1c(cccc1C)C 7a_100000210341_100000204255 [0,1,0,0,0,1|1,0,1]=4 8348 B15R1.42427 COC(=O)COCc1c(cccc1C)C 34a_100011933981_100000747449 [0,1,0,0,0,1|1,0,1]=4 8349 B15R1.42427 COC(=O)COCc1c(cccc1C)C 7a_100011933981_100000747449 [0,1,0,0,0,1|1,0,1]=4 8350 B15R1.42427 COC(C)COCc1c(cccc1Br)C 34a_100000690652_100010146847 [0,1,0,0,0,1|2,0,0]=4 8351 B15R1.42427 COC(C)COCc1c(cccc1C)C 34a_100000690652_100000758300 [0,1,0,0,0,1|1,0,0]=3 8352 B15R1.42427 COC(C)COCc1c(cccc1F)C 34a_100000690652_100009814554 [0,1,0,0,0,1|2,0,0]=4 8353 B15R1.42427 COC(C)COCc1c(cccc1I)C 34a_100000690652_100010150146 [0,1,0,0,0,1|2,0,0]=4 8354 B15R1.42427 CO[C@H](C)CNCc1c(cccc1C)C 207a_100020591295_100000758299 [0,1,0,0,0,1|2,0,0]=4 8355 B15R1.42427 CO[C@H](C)CNCc1c(cccc1C)C 2230a_100020591295_100000758300 [0,1,0,0,0,1|2,0,0]=4 8356 B15R1.42427 CO[C@H](C)CNCc1c(cccc1C)C 270004a_100020591295_100000758299 [0,1,0,0,0,1|2,0,0]=4 8357 B15R1.42427 Cc1cccc(c1CNCC(C)CO)C 207a_100000744482_100000758299 [0,1,0,0,0,1|2,0,0]=4 8358 B15R1.42427 Cc1cccc(c1CNCC(C)CO)C 34a_100000744482_100000758300 [0,1,0,0,0,1|2,0,0]=4 8359 B15R1.42427 Cc1cccc(c1CNCC(O)CO)C 34a_100000689800_100011219619 [0,1,0,0,0,1|2,0,0]=4 8360 B15R1.42427 Cc1cccc(c1CNC[C@@H](C)CO)C 34a_100000689800_100000059175 [0,1,0,0,0,1|2,0,0]=4 8361 B15R1.42427 Cc1cccc(c1CNC[C@@H](F)CO)C 207a_100015665980_100000758299 [0,1,0,0,0,1|2,0,0]=4 8362 B15R1.42427 Cc1cccc(c1CNC[C@@H](F)CO)C 270004a_100015665980_100000758299 [0,1,0,0,0,1|2,0,0]=4 8363 B15R1.42427 Cc1cccc(c1CNC[C@@H](F)CO)C 34a_100015665980_100000758300 [0,1,0,0,0,1|2,0,0]=4 8364 B15R1.42427 Cc1cccc(c1CNC[C@@H](O)CF)C 34a_100000689800_100015614560 [0,1,0,0,0,1|2,0,0]=4 8365 B15R1.42427 Cc1cccc(c1CNC[C@@H](O)CO)C 34a_100000689800_100009815848 [0,1,0,0,0,1|2,0,0]=4 8366 B15R1.42427 Cc1cccc(c1CNC[C@H](O)CO)C 207a_100020644852_100000758299 [0,1,0,0,0,1|2,0,0]=4 8367 B15R1.42427 Cc1cccc(c1CNC[C@H](O)CO)C 2230a_100020644852_100000758300 [0,1,0,0,0,1|2,0,0]=4 8368 B15R1.42427 Cc1cccc(c1COCC(C)CN)Br 34a_100000744482_100010146847 [0,1,0,0,0,1|1,0,0]=3 8369 B15R1.42427 Cc1cccc(c1COCC(C)CN)C 34a_100000744482_100000758300 [0,1,0,0,0,1|0,0,0]=2 8370 B15R1.42427 Cc1cccc(c1COCC(C)CN)F 34a_100000744482_100009814554 [0,1,0,0,0,1|1,0,0]=3 8371 B15R1.42427 Cc1cccc(c1COCC(C)CN)I 34a_100000744482_100010150146 [0,1,0,0,0,1|1,0,0]=3 8372 B15R1.42427 Cc1cccc(c1COCC(Cl)CCl)Br 34a_100000033668_100010146847 [0,1,0,0,0,1|2,0,0]=4 8373 B15R1.42427 Cc1cccc(c1COCC(Cl)CCl)C 34a_100000033668_100000758300 [0,1,0,0,0,1|1,0,0]=3 8374 B15R1.42427 Cc1cccc(c1COCC(Cl)CCl)F 34a_100000033668_100009814554 [0,1,0,0,0,1|2,0,0]=4 8375 B15R1.42427 Cc1cccc(c1COCC(Cl)CCl)I 34a_100000033668_100010150146 [0,1,0,0,0,1|2,0,0]=4 8376 B15R1.42427 Cc1cccc(c1COCC(O)CO)C 34a_100011933981_100011219619 [0,1,0,0,0,1|1,0,0]=3 8377 B15R1.42427 Cc1cccc(c1COCC(O)CO)C 7a_100011933981_100011219619 [0,1,0,0,0,1|1,0,0]=3 8378 B15R1.42427 Cc1cccc(c1COCC(O)CO)Cl 34a_100000082531_100011219619 [0,1,0,0,0,1|2,0,0]=4 8379 B15R1.42427 Cc1cccc(c1COCC(O)CO)Cl 7a_100000082531_100011219619 [0,1,0,0,0,1|2,0,0]=4 8380 B15R1.42427 Cc1cccc(c1COCC(O)CO)F 34a_100000057874_100011219619 [0,1,0,0,0,1|2,0,0]=4 8381 B15R1.42427 Cc1cccc(c1COCC(O)CO)F 7a_100000057874_100011219619 [0,1,0,0,0,1|2,0,0]=4 8382 B15R1.42427 Cc1cccc(c1COC[C@@H](C)CO)C 34a_100011933981_100000059175 [0,1,0,0,0,1|1,0,0]=3 8383 B15R1.42427 Cc1cccc(c1COC[C@@H](C)CO)C 7a_100011933981_100000059175 [0,1,0,0,0,1|1,0,0]=3 8384 B15R1.42427 Cc1cccc(c1COC[C@@H](C)CO)Cl 34a_100000082531_100000059175 [0,1,0,0,0,1|2,0,0]=4 8385 B15R1.42427 Cc1cccc(c1COC[C@@H](C)CO)Cl 7a_100000082531_100000059175 [0,1,0,0,0,1|2,0,0]=4 8386 B15R1.42427 Cc1cccc(c1COC[C@@H](C)CO)F 34a_100000057874_100000059175 [0,1,0,0,0,1|2,0,0]=4 8387 B15R1.42427 Cc1cccc(c1COC[C@@H](C)CO)F 7a_100000057874_100000059175 [0,1,0,0,0,1|2,0,0]=4 8388 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CF)C 34a_100011933981_100015614560 [0,1,0,0,0,1|1,0,0]=3 8389 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CF)C 7a_100011933981_100015614560 [0,1,0,0,0,1|1,0,0]=3 8390 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CF)Cl 34a_100000082531_100015614560 [0,1,0,0,0,1|2,0,0]=4 8391 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CF)Cl 7a_100000082531_100015614560 [0,1,0,0,0,1|2,0,0]=4 8392 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CF)F 34a_100000057874_100015614560 [0,1,0,0,0,1|2,0,0]=4 8393 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CF)F 7a_100000057874_100015614560 [0,1,0,0,0,1|2,0,0]=4 8394 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CO)C 34a_100011933981_100009815848 [0,1,0,0,0,1|1,0,0]=3 8395 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CO)C 7a_100011933981_100009815848 [0,1,0,0,0,1|1,0,0]=3 8396 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CO)Cl 34a_100000082531_100009815848 [0,1,0,0,0,1|2,0,0]=4 8397 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CO)Cl 7a_100000082531_100009815848 [0,1,0,0,0,1|2,0,0]=4 8398 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CO)F 34a_100000057874_100009815848 [0,1,0,0,0,1|2,0,0]=4 8399 B15R1.42427 Cc1cccc(c1COC[C@@H](O)CO)F 7a_100000057874_100009815848 [0,1,0,0,0,1|2,0,0]=4 8400 B15R1.42427 Cc1cccc(c1COC[C@H](F)CN)Br 34a_100015665980_100010146847 [0,1,0,0,0,1|2,0,0]=4 8401 B15R1.42427 Cc1cccc(c1COC[C@H](F)CN)C 34a_100015665980_100000758300 [0,1,0,0,0,1|1,0,0]=3 8402 B15R1.42427 Cc1cccc(c1COC[C@H](F)CN)F 34a_100015665980_100009814554 [0,1,0,0,0,1|2,0,0]=4 8403 B15R1.42427 Cc1cccc(c1COC[C@H](F)CN)I 34a_100015665980_100010150146 [0,1,0,0,0,1|2,0,0]=4 8404 B15R1.42427 Cc1cccc(c1CSCC(O)CO)C 62a_100000758300_100011219619 [0,1,0,0,0,1|1,1,0]=4 8405 B15R1.42427 Cc1cccc(c1CSCC(O)CO)C 62a_100011219619_100000758300 [0,1,0,0,0,1|1,1,0]=4 8406 B15R1.42427 Cc1cccc(c1CSC[C@@H](C)CO)C 62a_100000059175_100000758300 [0,1,0,0,0,1|1,1,0]=4 8407 B15R1.42427 Cc1cccc(c1CSC[C@@H](C)CO)C 62a_100000758300_100000059175 [0,1,0,0,0,1|1,1,0]=4 8408 B15R1.42427 Cc1cccc(c1CSC[C@@H](O)CF)C 62a_100000758300_100015614560 [0,1,0,0,0,1|1,1,0]=4 8409 B15R1.42427 Cc1cccc(c1CSC[C@@H](O)CF)C 62a_100015614560_100000758300 [0,1,0,0,0,1|1,1,0]=4 8410 B15R1.42427 Cc1cccc(c1CSC[C@@H](O)CO)C 62a_100000758300_100009815848 [0,1,0,0,0,1|1,1,0]=4 8411 B15R1.42427 Cc1cccc(c1CSC[C@@H](O)CO)C 62a_100009815848_100000758300 [0,1,0,0,0,1|1,1,0]=4 8412 B15R1.42427 Cc1cccc(c1OCCC(=O)CF)C 1458a_200000738035_100015361967 [0,1,0,0,0,1|1,0,1]=4 8413 B15R1.42427 Cc1cccc(c1OCCC(=O)CO)C 1458a_100000210174_100000184555 [0,1,0,0,0,1|1,0,1]=4 8414 B15R1.441 C=C(C)COc1c(cc(cc1CC)Br)C 34a_100010659108_100000748629 [0,2,0,0,0,0|1,0,1]=4 8415 B15R1.441 C=C(C)COc1c(cc(cc1CC)Br)C 7a_100010659108_100000748629 [0,2,0,0,0,0|1,0,1]=4 8416 B15R1.441 CC(C)COc1c(cc(cc1CBr)Br)Br 34a_200009814416_100000210624 [0,2,0,0,0,0|2,0,0]=4 8417 B15R1.441 CC(C)COc1c(cc(cc1CBr)Br)Br 7a_200009814416_100000210760 [0,2,0,0,0,0|2,0,0]=4 8418 B15R1.441 CC(C)COc1c(cc(cc1CO)Cl)Br 34a_100009812756_100000210624 [0,2,0,0,0,0|2,0,0]=4 8419 B15R1.441 CC(C)COc1c(cc(cc1CO)Cl)Br 7a_100009812756_100000210760 [0,2,0,0,0,0|2,0,0]=4 8420 B15R1.441 CC(O)COc1c(cc(cc1CBr)Br)Br 34a_200009814416_100011218427 [0,2,0,0,0,0|2,0,0]=4 8421 B15R1.441 CC(O)COc1c(cc(cc1CBr)Br)Br 7a_200009814416_100011218427 [0,2,0,0,0,0|2,0,0]=4 8422 B15R1.441 CC(O)COc1c(cc(cc1CO)Cl)Br 34a_100009812756_100011218427 [0,2,0,0,0,0|2,0,0]=4 8423 B15R1.441 CC(O)COc1c(cc(cc1CO)Cl)Br 7a_100009812756_100011218427 [0,2,0,0,0,0|2,0,0]=4 8424 B15R1.441 CCc1cc(cc(c1NCC(C)C)C)Br 2230a_200000186424_100000210760 [0,2,0,0,0,0|2,0,0]=4 8425 B15R1.441 CCc1cc(cc(c1NCC(C)C)C)Br 34a_200000186424_100000210624 [0,2,0,0,0,0|2,0,0]=4 8426 B15R1.441 CCc1cc(cc(c1NCC(C)C)C)Br 7a_200000186424_100000210760 [0,2,0,0,0,0|2,0,0]=4 8427 B15R1.441 CCc1cc(cc(c1NCC(C)O)C)Br 2230a_200000186424_100011218427 [0,2,0,0,0,0|2,0,0]=4 8428 B15R1.441 CCc1cc(cc(c1NCC(C)O)C)Br 34a_200000186424_100011218427 [0,2,0,0,0,0|2,0,0]=4 8429 B15R1.441 CCc1cc(cc(c1NCC(C)O)C)Br 7a_200000186424_100011218427 [0,2,0,0,0,0|2,0,0]=4 8430 B15R1.441 CCc1cc(cc(c1NC[C@@H](C)O)C)Br 2230a_200000186424_100009817552 [0,2,0,0,0,0|2,0,0]=4 8431 B15R1.441 CCc1cc(cc(c1NC[C@@H](C)O)C)Br 34a_200000186424_100009817552 [0,2,0,0,0,0|2,0,0]=4 8432 B15R1.441 CCc1cc(cc(c1NC[C@@H](C)O)C)Br 7a_200000186424_100009817552 [0,2,0,0,0,0|2,0,0]=4 8433 B15R1.441 CCc1cc(cc(c1OCC(=O)N)C)Br 34a_100010659108_100000187820 [0,2,0,0,0,0|1,0,1]=4 8434 B15R1.441 CCc1cc(cc(c1OCC(=O)N)C)Br 7a_100010659108_100000187820 [0,2,0,0,0,0|1,0,1]=4 8435 B15R1.441 CCc1cc(cc(c1OCC(C)C)C)Br 34a_100010659108_100000210624 [0,2,0,0,0,0|1,0,0]=3 8436 B15R1.441 CCc1cc(cc(c1OCC(C)C)C)Br 7a_100010659108_100000210760 [0,2,0,0,0,0|1,0,0]=3 8437 B15R1.441 CCc1cc(cc(c1OCC(C)O)C)Br 34a_100010659108_100011218427 [0,2,0,0,0,0|1,0,0]=3 8438 B15R1.441 CCc1cc(cc(c1OCC(C)O)C)Br 7a_100010659108_100011218427 [0,2,0,0,0,0|1,0,0]=3 8439 B15R1.441 CCc1cc(cc(c1OCC(F)F)C)Br 34a_100010659108_100011934356 [0,2,0,0,0,0|2,0,0]=4 8440 B15R1.441 CCc1cc(cc(c1OCC(F)F)C)Br 7a_100010659108_100011934356 [0,2,0,0,0,0|2,0,0]=4 8441 B15R1.441 CCc1cc(cc(c1OC[C@@H](C)O)C)Br 34a_100010659108_100009817552 [0,2,0,0,0,0|1,0,0]=3 8442 B15R1.441 CCc1cc(cc(c1OC[C@@H](C)O)C)Br 7a_100010659108_100009817552 [0,2,0,0,0,0|1,0,0]=3 8443 B15R1.441 COc1cc(cc(c1NCC(C)C)C)Br 34a_100000741850_100000210624 [0,2,0,0,0,0|2,0,0]=4 8444 B15R1.441 COc1cc(cc(c1NCC(C)O)C)Br 34a_100000741850_100011218427 [0,2,0,0,0,0|2,0,0]=4 8445 B15R1.441 COc1cc(cc(c1NC[C@@H](C)O)C)Br 34a_100000741850_100009817552 [0,2,0,0,0,0|2,0,0]=4 8446 B15R1.441 COc1cc(cc(c1OCC(C)C)Br)F 34a_200010391102_100000210624 [0,2,0,0,0,0|2,0,0]=4 8447 B15R1.441 COc1cc(cc(c1OCC(C)C)Br)F 7a_200010391102_100000210760 [0,2,0,0,0,0|2,0,0]=4 8448 B15R1.441 COc1cc(cc(c1OCC(C)O)Br)F 34a_200010391102_100011218427 [0,2,0,0,0,0|2,0,0]=4 8449 B15R1.441 COc1cc(cc(c1OCC(C)O)Br)F 7a_200010391102_100011218427 [0,2,0,0,0,0|2,0,0]=4 8450 B15R1.441 COc1cc(cc(c1OC[C@@H](C)O)Br)F 34a_200010391102_100009817552 [0,2,0,0,0,0|2,0,0]=4 8451 B15R1.441 COc1cc(cc(c1OC[C@@H](C)O)Br)F 7a_200010391102_100009817552 [0,2,0,0,0,0|2,0,0]=4 8452 B15R1.441 CSc1cc(cc(c1OCC(=O)N)C)C 62a_200000210301_200010173088 [0,2,0,0,0,0|1,0,1]=4 8453 B15R1.441 CSc1cc(cc(c1OCC(=O)N)C)C 62a_200010173088_200000210301 [0,2,0,0,0,0|1,0,1]=4 8454 B15R1.441 C[C@@H](O)COc1c(cc(cc1CBr)Br)Br 34a_200009814416_100009817552 [0,2,0,0,0,0|2,0,0]=4 8455 B15R1.441 C[C@@H](O)COc1c(cc(cc1CBr)Br)Br 7a_200009814416_100009817552 [0,2,0,0,0,0|2,0,0]=4 8456 B15R1.441 C[C@@H](O)COc1c(cc(cc1CO)Cl)Br 34a_100009812756_100009817552 [0,2,0,0,0,0|2,0,0]=4 8457 B15R1.441 C[C@@H](O)COc1c(cc(cc1CO)Cl)Br 7a_100009812756_100009817552 [0,2,0,0,0,0|2,0,0]=4 8458 B15R1.441 Cc1cc(c(c(c1)S[13CH3])OCC(=O)N)C 62a_200010173088_200025704644 [0,2,0,0,0,0|1,0,1]=4 8459 B15R1.441 Cc1cc(c(c(c1)S[13CH3])OCC(=O)N)C 62a_200025704644_200010173088 [0,2,0,0,0,0|1,0,1]=4 8460 B15R1.441 Cc1cc(cc(c1OCC(C)C)C#N)Br 34a_100010195408_100000210624 [0,2,0,0,0,0|1,0,1]=4 8461 B15R1.441 Cc1cc(cc(c1OCC(C)C)C#N)Br 7a_100010195408_100000210760 [0,2,0,0,0,0|1,0,1]=4 8462 B15R1.441 Cc1cc(cc(c1OCC(C)O)C#N)Br 34a_100010195408_100011218427 [0,2,0,0,0,0|1,0,1]=4 8463 B15R1.441 Cc1cc(cc(c1OCC(C)O)C#N)Br 7a_100010195408_100011218427 [0,2,0,0,0,0|1,0,1]=4 8464 B15R1.441 Cc1cc(cc(c1OC[C@@H](C)O)C#N)Br 34a_100010195408_100009817552 [0,2,0,0,0,0|1,0,1]=4 8465 B15R1.441 Cc1cc(cc(c1OC[C@@H](C)O)C#N)Br 7a_100010195408_100009817552 [0,2,0,0,0,0|1,0,1]=4 8466 B15R1.1573 CCc1cccc(c1[C@@H](N)CC(C)C)C 271570a_100015190218_100000036235 [0,2,0,0,0,0|2,0,0]=4 8467 B15R1.1573 COc1cccc(c1C(=O)CC(C)C)C 1458a_100000066212_100000210624 [0,2,0,0,0,0|2,0,0]=4 8468 B15R1.1573 COc1cccc(c1C(=O)CC(C)O)C 1458a_100000066212_100011218427 [0,2,0,0,0,0|2,0,0]=4 8469 B15R1.1573 Cc1cccc(c1[C@@H](N)CC(C)C)CO 271570a_100015190218_100011659289 [0,2,0,0,0,0|2,0,0]=4 8470 B15R1.1576 CC(C)(C)COc1c(cccc1CO)F 34a_100011997349_100011219605 [0,2,0,0,0,0|2,0,0]=4 8471 B15R1.1576 CC(C)(F)COc1c(cccc1CO)F 34a_100011997349_100011997219 [0,2,0,0,0,0|2,0,0]=4 8472 B15R1.1576 CC(C)(O)COc1c(cccc1CO)F 34a_100011997349_100000764493 [0,2,0,0,0,0|2,0,0]=4 8473 B15R1.1576 CC(C)(O)COc1c(cccc1CO)F 7a_100011997349_100000764493 [0,2,0,0,0,0|2,0,0]=4 8474 B15R1.1576 CCc1cccc(c1NCC(C)(C)C)C 34a_100000210048_100011219605 [0,2,0,0,0,0|2,0,0]=4 8475 B15R1.1576 CCc1cccc(c1NCC(C)(C)F)C 34a_100000210048_100011997219 [0,2,0,0,0,0|2,0,0]=4 8476 B15R1.1576 CCc1cccc(c1NCC(C)(C)O)C 34a_100000210048_100000764493 [0,2,0,0,0,0|2,0,0]=4 8477 B15R1.1576 CCc1cccc(c1NCC(C)(C)O)C 7a_100000210048_100000764493 [0,2,0,0,0,0|2,0,0]=4 8478 B15R1.1576 CCc1cccc(c1OCC(C)(C)C)Br 34a_200010001580_100011219605 [0,2,0,0,0,0|2,0,0]=4 8479 B15R1.1576 CCc1cccc(c1OCC(C)(C)C)C 34a_100000034007_100011219605 [0,2,0,0,0,0|1,0,0]=3 8480 B15R1.1576 CCc1cccc(c1OCC(C)(C)F)Br 34a_200010001580_100011997219 [0,2,0,0,0,0|2,0,0]=4 8481 B15R1.1576 CCc1cccc(c1OCC(C)(C)F)C 34a_100000034007_100011997219 [0,2,0,0,0,0|1,0,0]=3 8482 B15R1.1576 CCc1cccc(c1OCC(C)(C)O)Br 34a_200010001580_100000764493 [0,2,0,0,0,0|2,0,0]=4 8483 B15R1.1576 CCc1cccc(c1OCC(C)(C)O)Br 7a_200010001580_100000764493 [0,2,0,0,0,0|2,0,0]=4 8484 B15R1.1576 CCc1cccc(c1OCC(C)(C)O)C 34a_100000034007_100000764493 [0,2,0,0,0,0|1,0,0]=3 8485 B15R1.1576 CCc1cccc(c1OCC(C)(C)O)C 7a_100000034007_100000764493 [0,2,0,0,0,0|1,0,0]=3 8486 B15R1.1576 CCc1cccc(c1OC[Si](C)(C)C)C 7a_100000034007_100000233785 [0,2,0,0,0,0|1,1,0]=4 8487 B15R1.1576 CCc1cccc(c1SCC(C)(C)C)C 62a_100000036235_100011219605 [0,2,0,0,0,0|1,1,0]=4 8488 B15R1.1576 CCc1cccc(c1SCC(C)(C)C)C 62a_100011219605_100000036235 [0,2,0,0,0,0|1,1,0]=4 8489 B15R1.1576 CCc1cccc(c1SCC(C)(C)F)C 62a_100000036235_100011997219 [0,2,0,0,0,0|1,1,0]=4 8490 B15R1.1576 CCc1cccc(c1SCC(C)(C)F)C 62a_100011997219_100000036235 [0,2,0,0,0,0|1,1,0]=4 8491 B15R1.1576 CCc1cccc(c1SCC(C)(C)O)C 62a_100000036235_100000764493 [0,2,0,0,0,0|1,1,0]=4 8492 B15R1.1576 CCc1cccc(c1SCC(C)(C)O)C 62a_100000764493_100000036235 [0,2,0,0,0,0|1,1,0]=4 8493 B15R1.1576 COc1cccc(c1NCC(C)(C)C)C 34a_100000758225_100011219605 [0,2,0,0,0,0|2,0,0]=4 8494 B15R1.1576 COc1cccc(c1NCC(C)(C)F)C 34a_100000758225_100011997219 [0,2,0,0,0,0|2,0,0]=4 8495 B15R1.1576 COc1cccc(c1NCC(C)(C)O)C 34a_100000758225_100000764493 [0,2,0,0,0,0|2,0,0]=4 8496 B15R1.1576 COc1cccc(c1OCC(C)(C)C)Br 34a_100000686866_100011219605 [0,2,0,0,0,0|2,0,0]=4 8497 B15R1.1576 COc1cccc(c1OCC(C)(C)C)C 34a_100011219253_100011219605 [0,2,0,0,0,0|1,0,0]=3 8498 B15R1.1576 COc1cccc(c1OCC(C)(C)C)Cl 34a_100009851661_100011219605 [0,2,0,0,0,0|2,0,0]=4 8499 B15R1.1576 COc1cccc(c1OCC(C)(C)C)F 34a_100000036725_100011219605 [0,2,0,0,0,0|2,0,0]=4 8500 B15R1.1576 COc1cccc(c1OCC(C)(C)C)N 34a_100000123586_100011219605 [0,2,0,0,0,0|2,0,0]=4 8501 B15R1.1576 COc1cccc(c1OCC(C)(C)F)Br 34a_100000686866_100011997219 [0,2,0,0,0,0|2,0,0]=4 8502 B15R1.1576 COc1cccc(c1OCC(C)(C)F)C 34a_100011219253_100011997219 [0,2,0,0,0,0|1,0,0]=3 8503 B15R1.1576 COc1cccc(c1OCC(C)(C)F)Cl 34a_100009851661_100011997219 [0,2,0,0,0,0|2,0,0]=4 8504 B15R1.1576 COc1cccc(c1OCC(C)(C)F)F 34a_100000036725_100011997219 [0,2,0,0,0,0|2,0,0]=4 8505 B15R1.1576 COc1cccc(c1OCC(C)(C)F)N 34a_100000123586_100011997219 [0,2,0,0,0,0|2,0,0]=4 8506 B15R1.1576 COc1cccc(c1OCC(C)(C)O)Br 34a_100000686866_100000764493 [0,2,0,0,0,0|2,0,0]=4 8507 B15R1.1576 COc1cccc(c1OCC(C)(C)O)C 34a_100011219253_100000764493 [0,2,0,0,0,0|1,0,0]=3 8508 B15R1.1576 COc1cccc(c1OCC(C)(C)O)C 7a_100011219253_100000764493 [0,2,0,0,0,0|1,0,0]=3 8509 B15R1.1576 COc1cccc(c1OCC(C)(C)O)Cl 34a_100009851661_100000764493 [0,2,0,0,0,0|2,0,0]=4 8510 B15R1.1576 COc1cccc(c1OCC(C)(C)O)Cl 7a_100009851661_100000764493 [0,2,0,0,0,0|2,0,0]=4 8511 B15R1.1576 COc1cccc(c1OCC(C)(C)O)F 34a_100000036725_100000764493 [0,2,0,0,0,0|2,0,0]=4 8512 B15R1.1576 COc1cccc(c1OCC(C)(C)O)F 7a_100000036725_100000764493 [0,2,0,0,0,0|2,0,0]=4 8513 B15R1.1576 COc1cccc(c1OCC(C)(C)O)N 34a_100000123586_100000764493 [0,2,0,0,0,0|2,0,0]=4 8514 B15R1.1576 COc1cccc(c1OC[Si](C)(C)C)C 7a_100011219253_100000233785 [0,2,0,0,0,0|1,1,0]=4 8515 B15R1.1576 COc1cccc(c1SCC(C)(C)C)C 62a_100010191535_100011219605 [0,2,0,0,0,0|1,1,0]=4 8516 B15R1.1576 COc1cccc(c1SCC(C)(C)C)C 62a_100011219605_100010191535 [0,2,0,0,0,0|1,1,0]=4 8517 B15R1.1576 COc1cccc(c1SCC(C)(C)F)C 62a_100010191535_100011997219 [0,2,0,0,0,0|1,1,0]=4 8518 B15R1.1576 COc1cccc(c1SCC(C)(C)F)C 62a_100011997219_100010191535 [0,2,0,0,0,0|1,1,0]=4 8519 B15R1.1576 COc1cccc(c1SCC(C)(C)O)C 62a_100000764493_100010191535 [0,2,0,0,0,0|1,1,0]=4 8520 B15R1.1576 COc1cccc(c1SCC(C)(C)O)C 62a_100010191535_100000764493 [0,2,0,0,0,0|1,1,0]=4 8521 B15R1.1576 Cc1cccc(c1NCC(C)(C)C)CO 34a_100011215590_100011219605 [0,2,0,0,0,0|2,0,0]=4 8522 B15R1.1576 Cc1cccc(c1NCC(C)(C)F)CO 34a_100011215590_100011997219 [0,2,0,0,0,0|2,0,0]=4 8523 B15R1.1576 Cc1cccc(c1NCC(C)(C)O)CO 34a_100011215590_100000764493 [0,2,0,0,0,0|2,0,0]=4 8524 B15R1.1576 Cc1cccc(c1OCC(C)(C)C)C#N 34a_100011659161_100011219605 [0,2,0,0,0,0|1,0,1]=4 8525 B15R1.1576 Cc1cccc(c1OCC(C)(C)C)CN 34a_100020639391_100011219605 [0,2,0,0,0,0|1,0,0]=3 8526 B15R1.1576 Cc1cccc(c1OCC(C)(C)F)C#N 34a_100011659161_100011997219 [0,2,0,0,0,0|1,0,1]=4 8527 B15R1.1576 Cc1cccc(c1OCC(C)(C)F)CN 34a_100020639391_100011997219 [0,2,0,0,0,0|1,0,0]=3 8528 B15R1.1576 Cc1cccc(c1OCC(C)(C)O)C#N 34a_100011659161_100000764493 [0,2,0,0,0,0|1,0,1]=4 8529 B15R1.1576 Cc1cccc(c1OCC(C)(C)O)C#N 7a_100011659161_100000764493 [0,2,0,0,0,0|1,0,1]=4 8530 B15R1.1576 Cc1cccc(c1OCC(C)(C)O)CN 34a_100020639391_100000764493 [0,2,0,0,0,0|1,0,0]=3 8531 B15R1.1576 Cc1cccc(c1SCC(C)(C)C)CO 62a_100011219605_100011659289 [0,2,0,0,0,0|1,1,0]=4 8532 B15R1.1576 Cc1cccc(c1SCC(C)(C)C)CO 62a_100011659289_100011219605 [0,2,0,0,0,0|1,1,0]=4 8533 B15R1.1576 Cc1cccc(c1SCC(C)(C)F)CO 62a_100011659289_100011997219 [0,2,0,0,0,0|1,1,0]=4 8534 B15R1.1576 Cc1cccc(c1SCC(C)(C)F)CO 62a_100011997219_100011659289 [0,2,0,0,0,0|1,1,0]=4 8535 B15R1.1576 Cc1cccc(c1SCC(C)(C)O)CO 62a_100000764493_100011659289 [0,2,0,0,0,0|1,1,0]=4 8536 B15R1.1576 Cc1cccc(c1SCC(C)(C)O)CO 62a_100011659289_100000764493 [0,2,0,0,0,0|1,1,0]=4 8537 B15R1.1605 CCc1cccc(c1OC(C)C(=O)C)C 7a_100000034007_100000179758 [0,2,0,0,0,0|1,0,1]=4 8538 B15R1.1605 CCc1cccc(c1OC(C)C(=O)N)C 34a_100000034007_100000702099 [0,2,0,0,0,0|1,0,1]=4 8539 B15R1.1605 CCc1cccc(c1OC(C)C(=O)N)C 7a_100000034007_100000702099 [0,2,0,0,0,0|1,0,1]=4 8540 B15R1.1605 CCc1cccc(c1OC(F)C(=O)N)C 34a_100000034007_100009813875 [0,2,0,0,0,0|1,0,1]=4 8541 B15R1.1605 CCc1cccc(c1OC(F)C(=O)N)C 7a_100000034007_100009813875 [0,2,0,0,0,0|1,0,1]=4 8542 B15R1.1605 COc1cccc(c1OC(C)C(=O)C)C 7a_100011219253_100000179758 [0,2,0,0,0,0|1,0,1]=4 8543 B15R1.1605 COc1cccc(c1OC(C)C(=O)N)C 34a_100011219253_100000702099 [0,2,0,0,0,0|1,0,1]=4 8544 B15R1.1605 COc1cccc(c1OC(C)C(=O)N)C 7a_100011219253_100000702099 [0,2,0,0,0,0|1,0,1]=4 8545 B15R1.1605 COc1cccc(c1OC(F)C(=O)N)C 34a_100011219253_100009813875 [0,2,0,0,0,0|1,0,1]=4 8546 B15R1.1605 COc1cccc(c1OC(F)C(=O)N)C 7a_100011219253_100009813875 [0,2,0,0,0,0|1,0,1]=4 8547 B15R1.1605 Cc1cccc(c1OC(C)C(=O)N)CN 34a_100020639391_100000702099 [0,2,0,0,0,0|1,0,1]=4 8548 B15R1.1605 Cc1cccc(c1OC(F)C(=O)N)CN 34a_100020639391_100009813875 [0,2,0,0,0,0|1,0,1]=4 8549 B15R1.1645 C=C(C)COc1c(cccc1CC)CC 34a_100000078057_100000748629 [0,2,0,0,0,0|1,0,1]=4 8550 B15R1.1645 C=C(C)COc1c(cccc1CC)CC 7a_100000078057_100000748629 [0,2,0,0,0,0|1,0,1]=4 8551 B15R1.1645 C=C(C)COc1c(cccc1OC)CO 34a_100011218668_100000748629 [0,2,0,0,0,0|1,0,1]=4 8552 B15R1.1645 C=C(C)COc1c(cccc1OC)OC 34a_100000211025_100000748629 [0,2,0,0,0,0|1,0,1]=4 8553 B15R1.1645 CCc1cccc(c1NCC(C)C)CC 2230a_100000211307_100000210760 [0,2,0,0,0,0|2,0,0]=4 8554 B15R1.1645 CCc1cccc(c1NCC(C)C)CC 34a_100000211307_100000210624 [0,2,0,0,0,0|2,0,0]=4 8555 B15R1.1645 CCc1cccc(c1NCC(C)C)CC 7a_100000211307_100000210760 [0,2,0,0,0,0|2,0,0]=4 8556 B15R1.1645 CCc1cccc(c1NCC(C)O)CC 2230a_100000211307_100011218427 [0,2,0,0,0,0|2,0,0]=4 8557 B15R1.1645 CCc1cccc(c1NCC(C)O)CC 34a_100000211307_100011218427 [0,2,0,0,0,0|2,0,0]=4 8558 B15R1.1645 CCc1cccc(c1NCC(C)O)CC 7a_100000211307_100011218427 [0,2,0,0,0,0|2,0,0]=4 8559 B15R1.1645 CCc1cccc(c1NC[C@@H](C)O)CC 2230a_100000211307_100009817552 [0,2,0,0,0,0|2,0,0]=4 8560 B15R1.1645 CCc1cccc(c1NC[C@@H](C)O)CC 34a_100000211307_100009817552 [0,2,0,0,0,0|2,0,0]=4 8561 B15R1.1645 CCc1cccc(c1NC[C@@H](C)O)CC 7a_100000211307_100009817552 [0,2,0,0,0,0|2,0,0]=4 8562 B15R1.1645 CCc1cccc(c1OCC(=O)N)CC 34a_100000078057_100000187820 [0,2,0,0,0,0|1,0,1]=4 8563 B15R1.1645 CCc1cccc(c1OCC(=O)N)CC 7a_100000078057_100000187820 [0,2,0,0,0,0|1,0,1]=4 8564 B15R1.1645 CCc1cccc(c1OCC(C)C)CC 34a_100000078057_100000210624 [0,2,0,0,0,0|1,0,0]=3 8565 B15R1.1645 CCc1cccc(c1OCC(C)C)CC 7a_100000078057_100000210760 [0,2,0,0,0,0|1,0,0]=3 8566 B15R1.1645 CCc1cccc(c1OCC(C)O)CC 34a_100000078057_100011218427 [0,2,0,0,0,0|1,0,0]=3 8567 B15R1.1645 CCc1cccc(c1OCC(C)O)CC 7a_100000078057_100011218427 [0,2,0,0,0,0|1,0,0]=3 8568 B15R1.1645 CCc1cccc(c1OCC(F)F)CC 34a_100000078057_100011934356 [0,2,0,0,0,0|2,0,0]=4 8569 B15R1.1645 CCc1cccc(c1OCC(F)F)CC 7a_100000078057_100011934356 [0,2,0,0,0,0|2,0,0]=4 8570 B15R1.1645 CCc1cccc(c1OC[C@@H](C)O)CC 34a_100000078057_100009817552 [0,2,0,0,0,0|1,0,0]=3 8571 B15R1.1645 CCc1cccc(c1OC[C@@H](C)O)CC 7a_100000078057_100009817552 [0,2,0,0,0,0|1,0,0]=3 8572 B15R1.1645 CCc1cccc(c1SCC(C)C)CC 62a_100000210624_100010212195 [0,2,0,0,0,0|1,1,0]=4 8573 B15R1.1645 CCc1cccc(c1SCC(C)C)CC 62a_100010212195_100000210760 [0,2,0,0,0,0|1,1,0]=4 8574 B15R1.1645 CCc1cccc(c1SCC(C)O)CC 62a_100010212195_100011218427 [0,2,0,0,0,0|1,1,0]=4 8575 B15R1.1645 CCc1cccc(c1SCC(C)O)CC 62a_100011218427_100010212195 [0,2,0,0,0,0|1,1,0]=4 8576 B15R1.1645 CCc1cccc(c1SC[C@@H](C)O)CC 62a_100009817552_100010212195 [0,2,0,0,0,0|1,1,0]=4 8577 B15R1.1645 CCc1cccc(c1SC[C@@H](C)O)CC 62a_100010212195_100009817552 [0,2,0,0,0,0|1,1,0]=4 8578 B15R1.1645 COc1cccc(c1NCC(C)C)CO 34a_100011999522_100000210624 [0,2,0,0,0,0|2,0,0]=4 8579 B15R1.1645 COc1cccc(c1NCC(C)C)OC 2230a_100011218430_100000210760 [0,2,0,0,0,0|2,0,0]=4 8580 B15R1.1645 COc1cccc(c1NCC(C)C)OC 34a_100011218430_100000210624 [0,2,0,0,0,0|2,0,0]=4 8581 B15R1.1645 COc1cccc(c1NCC(C)C)SC 2230a_200012283368_100000210760 [0,2,0,0,0,0|2,0,0]=4 8582 B15R1.1645 COc1cccc(c1NCC(C)C)SC 34a_200012283368_100000210624 [0,2,0,0,0,0|2,0,0]=4 8583 B15R1.1645 COc1cccc(c1NCC(C)O)CO 34a_100011999522_100011218427 [0,2,0,0,0,0|2,0,0]=4 8584 B15R1.1645 COc1cccc(c1NCC(C)O)OC 2230a_100011218430_100011218427 [0,2,0,0,0,0|2,0,0]=4 8585 B15R1.1645 COc1cccc(c1NCC(C)O)OC 34a_100011218430_100011218427 [0,2,0,0,0,0|2,0,0]=4 8586 B15R1.1645 COc1cccc(c1NCC(C)O)SC 2230a_200012283368_100011218427 [0,2,0,0,0,0|2,0,0]=4 8587 B15R1.1645 COc1cccc(c1NCC(C)O)SC 34a_200012283368_100011218427 [0,2,0,0,0,0|2,0,0]=4 8588 B15R1.1645 COc1cccc(c1NC[C@@H](C)O)CO 34a_100011999522_100009817552 [0,2,0,0,0,0|2,0,0]=4 8589 B15R1.1645 COc1cccc(c1NC[C@@H](C)O)OC 2230a_100011218430_100009817552 [0,2,0,0,0,0|2,0,0]=4 8590 B15R1.1645 COc1cccc(c1NC[C@@H](C)O)OC 34a_100011218430_100009817552 [0,2,0,0,0,0|2,0,0]=4 8591 B15R1.1645 COc1cccc(c1NC[C@@H](C)O)SC 2230a_200012283368_100009817552 [0,2,0,0,0,0|2,0,0]=4 8592 B15R1.1645 COc1cccc(c1NC[C@@H](C)O)SC 34a_200012283368_100009817552 [0,2,0,0,0,0|2,0,0]=4 8593 B15R1.1645 COc1cccc(c1OCC(=O)C)OC 1458a_200011194241_200000210301 [0,2,0,0,0,0|1,0,1]=4 8594 B15R1.1645 COc1cccc(c1OCC(=O)N)CO 34a_100011218668_100000187820 [0,2,0,0,0,0|1,0,1]=4 8595 B15R1.1645 COc1cccc(c1OCC(=O)N)OC 34a_100000211025_100000187820 [0,2,0,0,0,0|1,0,1]=4 8596 B15R1.1645 COc1cccc(c1OCC(=O)[13CH3])OC 1458a_200011194241_200025704644 [0,2,0,0,0,0|1,0,1]=4 8597 B15R1.1645 COc1cccc(c1OCC(C)C)C#N 34a_100011934230_100000210624 [0,2,0,0,0,0|1,0,1]=4 8598 B15R1.1645 COc1cccc(c1OCC(C)C)CO 34a_100011218668_100000210624 [0,2,0,0,0,0|1,0,0]=3 8599 B15R1.1645 COc1cccc(c1OCC(C)C)OC 34a_100000211025_100000210624 [0,2,0,0,0,0|1,0,0]=3 8600 B15R1.1645 COc1cccc(c1OCC(C)O)C#N 34a_100011934230_100011218427 [0,2,0,0,0,0|1,0,1]=4 8601 B15R1.1645 COc1cccc(c1OCC(C)O)CO 34a_100011218668_100011218427 [0,2,0,0,0,0|1,0,0]=3 8602 B15R1.1645 COc1cccc(c1OCC(C)O)OC 34a_100000211025_100011218427 [0,2,0,0,0,0|1,0,0]=3 8603 B15R1.1645 COc1cccc(c1OCC(F)F)CO 34a_100011218668_100011934356 [0,2,0,0,0,0|2,0,0]=4 8604 B15R1.1645 COc1cccc(c1OCC(F)F)OC 34a_100000211025_100011934356 [0,2,0,0,0,0|2,0,0]=4 8605 B15R1.1645 COc1cccc(c1OC[C@@H](C)O)C#N 34a_100011934230_100009817552 [0,2,0,0,0,0|1,0,1]=4 8606 B15R1.1645 COc1cccc(c1OC[C@@H](C)O)CO 34a_100011218668_100009817552 [0,2,0,0,0,0|1,0,0]=3 8607 B15R1.1645 COc1cccc(c1OC[C@@H](C)O)OC 34a_100000211025_100009817552 [0,2,0,0,0,0|1,0,0]=3 8608 B15R1.1645 COc1cccc(c1SCC(C)C)CO 62a_100000210624_100010236476 [0,2,0,0,0,0|1,1,0]=4 8609 B15R1.1645 COc1cccc(c1SCC(C)C)CO 62a_100010236476_100000210760 [0,2,0,0,0,0|1,1,0]=4 8610 B15R1.1645 COc1cccc(c1SCC(C)C)OC 62a_100000210624_100000690108 [0,2,0,0,0,0|1,1,0]=4 8611 B15R1.1645 COc1cccc(c1SCC(C)C)OC 62a_100000690108_100000210760 [0,2,0,0,0,0|1,1,0]=4 8612 B15R1.1645 COc1cccc(c1SCC(C)O)CO 62a_100010236476_100011218427 [0,2,0,0,0,0|1,1,0]=4 8613 B15R1.1645 COc1cccc(c1SCC(C)O)CO 62a_100011218427_100010236476 [0,2,0,0,0,0|1,1,0]=4 8614 B15R1.1645 COc1cccc(c1SCC(C)O)OC 62a_100000690108_100011218427 [0,2,0,0,0,0|1,1,0]=4 8615 B15R1.1645 COc1cccc(c1SCC(C)O)OC 62a_100011218427_100000690108 [0,2,0,0,0,0|1,1,0]=4 8616 B15R1.1645 COc1cccc(c1SC[C@@H](C)O)CO 62a_100009817552_100010236476 [0,2,0,0,0,0|1,1,0]=4 8617 B15R1.1645 COc1cccc(c1SC[C@@H](C)O)CO 62a_100010236476_100009817552 [0,2,0,0,0,0|1,1,0]=4 8618 B15R1.1645 COc1cccc(c1SC[C@@H](C)O)OC 62a_100000690108_100009817552 [0,2,0,0,0,0|1,1,0]=4 8619 B15R1.1645 COc1cccc(c1SC[C@@H](C)O)OC 62a_100009817552_100000690108 [0,2,0,0,0,0|1,1,0]=4 8620 B15R1.1646 C=CC(O)COc1c(cccc1CC)C 34a_100000034007_100000730141 [0,2,0,0,0,0|1,0,1]=4 8621 B15R1.1646 C=CC(O)COc1c(cccc1CC)C 7a_100000034007_100000730141 [0,2,0,0,0,0|1,0,1]=4 8622 B15R1.1646 C=CC(O)COc1c(cccc1CN)C 34a_100020639391_100000730141 [0,2,0,0,0,0|1,0,1]=4 8623 B15R1.1646 C=CC(O)COc1c(cccc1OC)C 34a_100011219253_100000730141 [0,2,0,0,0,0|1,0,1]=4 8624 B15R1.1646 C=CC(O)COc1c(cccc1OC)C 7a_100011219253_100000730141 [0,2,0,0,0,0|1,0,1]=4 8625 B15R1.1646 CCC(=O)COc1c(cccc1CC)C 7a_100000034007_100000747405 [0,2,0,0,0,0|1,0,1]=4 8626 B15R1.1646 CCC(=O)COc1c(cccc1OC)C 7a_100011219253_100000747405 [0,2,0,0,0,0|1,0,1]=4 8627 B15R1.1646 CCC(C)CNc1c(cccc1CO)C 34a_100011215590_100000748023 [0,2,0,0,0,0|2,0,0]=4 8628 B15R1.1646 CCC(C)CNc1c(cccc1OC)C 2230a_100000758225_100000748023 [0,2,0,0,0,0|2,0,0]=4 8629 B15R1.1646 CCC(C)CNc1c(cccc1OC)C 34a_100000758225_100000748023 [0,2,0,0,0,0|2,0,0]=4 8630 B15R1.1646 CCC(C)COc1c(cccc1C#N)C 34a_100011659161_100000748023 [0,2,0,0,0,0|1,0,1]=4 8631 B15R1.1646 CCC(C)COc1c(cccc1C#N)C 7a_100011659161_100000748023 [0,2,0,0,0,0|1,0,1]=4 8632 B15R1.1646 CCC(C)COc1c(cccc1CN)C 34a_100020639391_100000748023 [0,2,0,0,0,0|1,0,0]=3 8633 B15R1.1646 CCC(C)COc1c(cccc1CO)F 34a_100011997349_100000748023 [0,2,0,0,0,0|2,0,0]=4 8634 B15R1.1646 CCC(C)COc1c(cccc1CO)F 7a_100011997349_100000748023 [0,2,0,0,0,0|2,0,0]=4 8635 B15R1.1646 CCC(C)COc1c(cccc1OC)Br 34a_100000686866_100000748023 [0,2,0,0,0,0|2,0,0]=4 8636 B15R1.1646 CCC(C)COc1c(cccc1OC)C 34a_100011219253_100000748023 [0,2,0,0,0,0|1,0,0]=3 8637 B15R1.1646 CCC(C)COc1c(cccc1OC)C 7a_100011219253_100000748023 [0,2,0,0,0,0|1,0,0]=3 8638 B15R1.1646 CCC(C)COc1c(cccc1OC)Cl 34a_100009851661_100000748023 [0,2,0,0,0,0|2,0,0]=4 8639 B15R1.1646 CCC(C)COc1c(cccc1OC)Cl 7a_100009851661_100000748023 [0,2,0,0,0,0|2,0,0]=4 8640 B15R1.1646 CCC(C)COc1c(cccc1OC)F 34a_100000036725_100000748023 [0,2,0,0,0,0|2,0,0]=4 8641 B15R1.1646 CCC(C)COc1c(cccc1OC)F 7a_100000036725_100000748023 [0,2,0,0,0,0|2,0,0]=4 8642 B15R1.1646 CCC(C)COc1c(cccc1OC)N 34a_100000123586_100000748023 [0,2,0,0,0,0|2,0,0]=4 8643 B15R1.1646 CCC(C)CSc1c(cccc1CO)C 62a_100000748023_100011659289 [0,2,0,0,0,0|1,1,0]=4 8644 B15R1.1646 CCC(C)CSc1c(cccc1CO)C 62a_100011659289_100000748023 [0,2,0,0,0,0|1,1,0]=4 8645 B15R1.1646 CCC(C)CSc1c(cccc1OC)C 62a_100000748023_100010191535 [0,2,0,0,0,0|1,1,0]=4 8646 B15R1.1646 CCC(C)CSc1c(cccc1OC)C 62a_100010191535_100000748023 [0,2,0,0,0,0|1,1,0]=4 8647 B15R1.1646 CCC(O)CNc1c(cccc1CO)C 34a_100011215590_100011218378 [0,2,0,0,0,0|2,0,0]=4 8648 B15R1.1646 CCC(O)CNc1c(cccc1OC)C 2230a_100000758225_100011218378 [0,2,0,0,0,0|2,0,0]=4 8649 B15R1.1646 CCC(O)CNc1c(cccc1OC)C 34a_100000758225_100011218378 [0,2,0,0,0,0|2,0,0]=4 8650 B15R1.1646 CCC(O)COc1c(cccc1C#N)C 34a_100011659161_100011218378 [0,2,0,0,0,0|1,0,1]=4 8651 B15R1.1646 CCC(O)COc1c(cccc1C#N)C 7a_100011659161_100011218378 [0,2,0,0,0,0|1,0,1]=4 8652 B15R1.1646 CCC(O)COc1c(cccc1CN)C 34a_100020639391_100011218378 [0,2,0,0,0,0|1,0,0]=3 8653 B15R1.1646 CCC(O)COc1c(cccc1CO)F 34a_100011997349_100011218378 [0,2,0,0,0,0|2,0,0]=4 8654 B15R1.1646 CCC(O)COc1c(cccc1CO)F 7a_100011997349_100011218378 [0,2,0,0,0,0|2,0,0]=4 8655 B15R1.1646 CCC(O)COc1c(cccc1OC)Br 34a_100000686866_100011218378 [0,2,0,0,0,0|2,0,0]=4 8656 B15R1.1646 CCC(O)COc1c(cccc1OC)C 34a_100011219253_100011218378 [0,2,0,0,0,0|1,0,0]=3 8657 B15R1.1646 CCC(O)COc1c(cccc1OC)C 7a_100011219253_100011218378 [0,2,0,0,0,0|1,0,0]=3 8658 B15R1.1646 CCC(O)COc1c(cccc1OC)Cl 34a_100009851661_100011218378 [0,2,0,0,0,0|2,0,0]=4 8659 B15R1.1646 CCC(O)COc1c(cccc1OC)Cl 7a_100009851661_100011218378 [0,2,0,0,0,0|2,0,0]=4 8660 B15R1.1646 CCC(O)COc1c(cccc1OC)F 34a_100000036725_100011218378 [0,2,0,0,0,0|2,0,0]=4 8661 B15R1.1646 CCC(O)COc1c(cccc1OC)F 7a_100000036725_100011218378 [0,2,0,0,0,0|2,0,0]=4 8662 B15R1.1646 CCC(O)COc1c(cccc1OC)N 34a_100000123586_100011218378 [0,2,0,0,0,0|2,0,0]=4 8663 B15R1.1646 CCC(O)CSc1c(cccc1CO)C 62a_100011218378_100011659289 [0,2,0,0,0,0|1,1,0]=4 8664 B15R1.1646 CCC(O)CSc1c(cccc1CO)C 62a_100011659289_100011218378 [0,2,0,0,0,0|1,1,0]=4 8665 B15R1.1646 CCC(O)CSc1c(cccc1OC)C 62a_100010191535_100011218378 [0,2,0,0,0,0|1,1,0]=4 8666 B15R1.1646 CCC(O)CSc1c(cccc1OC)C 62a_100011218378_100010191535 [0,2,0,0,0,0|1,1,0]=4 8667 B15R1.1646 CC[C@H](C)CNc1c(cccc1CO)C 34a_100011215590_100009816398 [0,2,0,0,0,0|2,0,0]=4 8668 B15R1.1646 CC[C@H](C)CNc1c(cccc1OC)C 2230a_100000758225_100009816398 [0,2,0,0,0,0|2,0,0]=4 8669 B15R1.1646 CC[C@H](C)CNc1c(cccc1OC)C 34a_100000758225_100009816398 [0,2,0,0,0,0|2,0,0]=4 8670 B15R1.1646 CC[C@H](C)COc1c(cccc1C#N)C 34a_100011659161_100009816398 [0,2,0,0,0,0|1,0,1]=4 8671 B15R1.1646 CC[C@H](C)COc1c(cccc1C#N)C 7a_100011659161_100009816398 [0,2,0,0,0,0|1,0,1]=4 8672 B15R1.1646 CC[C@H](C)COc1c(cccc1CN)C 34a_100020639391_100009816398 [0,2,0,0,0,0|1,0,0]=3 8673 B15R1.1646 CC[C@H](C)COc1c(cccc1CO)F 34a_100011997349_100009816398 [0,2,0,0,0,0|2,0,0]=4 8674 B15R1.1646 CC[C@H](C)COc1c(cccc1CO)F 7a_100011997349_100009816398 [0,2,0,0,0,0|2,0,0]=4 8675 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)Br 34a_100000686866_100009816398 [0,2,0,0,0,0|2,0,0]=4 8676 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)C 34a_100011219253_100009816398 [0,2,0,0,0,0|1,0,0]=3 8677 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)C 7a_100011219253_100009816398 [0,2,0,0,0,0|1,0,0]=3 8678 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)Cl 34a_100009851661_100009816398 [0,2,0,0,0,0|2,0,0]=4 8679 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)Cl 7a_100009851661_100009816398 [0,2,0,0,0,0|2,0,0]=4 8680 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)F 34a_100000036725_100009816398 [0,2,0,0,0,0|2,0,0]=4 8681 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)F 7a_100000036725_100009816398 [0,2,0,0,0,0|2,0,0]=4 8682 B15R1.1646 CC[C@H](C)COc1c(cccc1OC)N 34a_100000123586_100009816398 [0,2,0,0,0,0|2,0,0]=4 8683 B15R1.1646 CC[C@H](C)CSc1c(cccc1CO)C 62a_100009816398_100011659289 [0,2,0,0,0,0|1,1,0]=4 8684 B15R1.1646 CC[C@H](C)CSc1c(cccc1CO)C 62a_100011659289_100009816398 [0,2,0,0,0,0|1,1,0]=4 8685 B15R1.1646 CC[C@H](C)CSc1c(cccc1OC)C 62a_100009816398_100010191535 [0,2,0,0,0,0|1,1,0]=4 8686 B15R1.1646 CC[C@H](C)CSc1c(cccc1OC)C 62a_100010191535_100009816398 [0,2,0,0,0,0|1,1,0]=4 8687 B15R1.1646 CCc1cccc(c1NCC(C)CC)C 2230a_100000210048_100000748023 [0,2,0,0,0,0|2,0,0]=4 8688 B15R1.1646 CCc1cccc(c1NCC(C)CC)C 34a_100000210048_100000748023 [0,2,0,0,0,0|2,0,0]=4 8689 B15R1.1646 CCc1cccc(c1NCC(C)CC)C 7a_100000210048_100000748023 [0,2,0,0,0,0|2,0,0]=4 8690 B15R1.1646 CCc1cccc(c1NCC(O)CC)C 2230a_100000210048_100011218378 [0,2,0,0,0,0|2,0,0]=4 8691 B15R1.1646 CCc1cccc(c1NCC(O)CC)C 34a_100000210048_100011218378 [0,2,0,0,0,0|2,0,0]=4 8692 B15R1.1646 CCc1cccc(c1NCC(O)CC)C 7a_100000210048_100011218378 [0,2,0,0,0,0|2,0,0]=4 8693 B15R1.1646 CCc1cccc(c1NCC(O)CO)C 2230a_100000210048_100011219619 [0,2,0,0,0,0|2,0,0]=4 8694 B15R1.1646 CCc1cccc(c1NCC(O)CO)C 34a_100000210048_100011219619 [0,2,0,0,0,0|2,0,0]=4 8695 B15R1.1646 CCc1cccc(c1NCC(O)CO)C 7a_100000210048_100011219619 [0,2,0,0,0,0|2,0,0]=4 8696 B15R1.1646 CCc1cccc(c1NC[C@@H](C)CC)C 2230a_100000210048_100009816398 [0,2,0,0,0,0|2,0,0]=4 8697 B15R1.1646 CCc1cccc(c1NC[C@@H](C)CC)C 34a_100000210048_100009816398 [0,2,0,0,0,0|2,0,0]=4 8698 B15R1.1646 CCc1cccc(c1NC[C@@H](C)CC)C 7a_100000210048_100009816398 [0,2,0,0,0,0|2,0,0]=4 8699 B15R1.1646 CCc1cccc(c1NC[C@@H](C)CO)C 2230a_100000210048_100000059175 [0,2,0,0,0,0|2,0,0]=4 8700 B15R1.1646 CCc1cccc(c1NC[C@@H](C)CO)C 34a_100000210048_100000059175 [0,2,0,0,0,0|2,0,0]=4 8701 B15R1.1646 CCc1cccc(c1NC[C@@H](C)CO)C 7a_100000210048_100000059175 [0,2,0,0,0,0|2,0,0]=4 8702 B15R1.1646 CCc1cccc(c1NC[C@@H](O)CF)C 2230a_100000210048_100015614560 [0,2,0,0,0,0|2,0,0]=4 8703 B15R1.1646 CCc1cccc(c1NC[C@@H](O)CF)C 34a_100000210048_100015614560 [0,2,0,0,0,0|2,0,0]=4 8704 B15R1.1646 CCc1cccc(c1NC[C@@H](O)CF)C 7a_100000210048_100015614560 [0,2,0,0,0,0|2,0,0]=4 8705 B15R1.1646 CCc1cccc(c1NC[C@@H](O)CO)C 2230a_100000210048_100009815848 [0,2,0,0,0,0|2,0,0]=4 8706 B15R1.1646 CCc1cccc(c1NC[C@@H](O)CO)C 34a_100000210048_100009815848 [0,2,0,0,0,0|2,0,0]=4 8707 B15R1.1646 CCc1cccc(c1NC[C@@H](O)CO)C 7a_100000210048_100009815848 [0,2,0,0,0,0|2,0,0]=4 8708 B15R1.1646 CCc1cccc(c1OCC(=O)NC)C 34a_100000034007_100000183359 [0,2,0,0,0,0|1,0,1]=4 8709 B15R1.1646 CCc1cccc(c1OCC(=O)NC)C 7a_100000034007_100000183359 [0,2,0,0,0,0|1,0,1]=4 8710 B15R1.1646 CCc1cccc(c1OCC(=O)OC)C 34a_100000034007_100000747449 [0,2,0,0,0,0|1,0,1]=4 8711 B15R1.1646 CCc1cccc(c1OCC(=O)OC)C 7a_100000034007_100000747449 [0,2,0,0,0,0|1,0,1]=4 8712 B15R1.1646 CCc1cccc(c1OCC(C)CC)Br 34a_200010001580_100000748023 [0,2,0,0,0,0|2,0,0]=4 8713 B15R1.1646 CCc1cccc(c1OCC(C)CC)Br 7a_200010001580_100000748023 [0,2,0,0,0,0|2,0,0]=4 8714 B15R1.1646 CCc1cccc(c1OCC(C)CC)C 34a_100000034007_100000748023 [0,2,0,0,0,0|1,0,0]=3 8715 B15R1.1646 CCc1cccc(c1OCC(C)CC)C 7a_100000034007_100000748023 [0,2,0,0,0,0|1,0,0]=3 8716 B15R1.1646 CCc1cccc(c1OCC(O)CC)Br 34a_200010001580_100011218378 [0,2,0,0,0,0|2,0,0]=4 8717 B15R1.1646 CCc1cccc(c1OCC(O)CC)Br 7a_200010001580_100011218378 [0,2,0,0,0,0|2,0,0]=4 8718 B15R1.1646 CCc1cccc(c1OCC(O)CC)C 34a_100000034007_100011218378 [0,2,0,0,0,0|1,0,0]=3 8719 B15R1.1646 CCc1cccc(c1OCC(O)CC)C 7a_100000034007_100011218378 [0,2,0,0,0,0|1,0,0]=3 8720 B15R1.1646 CCc1cccc(c1OCC(O)CO)Br 34a_200010001580_100011219619 [0,2,0,0,0,0|2,0,0]=4 8721 B15R1.1646 CCc1cccc(c1OCC(O)CO)Br 7a_200010001580_100011219619 [0,2,0,0,0,0|2,0,0]=4 8722 B15R1.1646 CCc1cccc(c1OCC(O)CO)C 34a_100000034007_100011219619 [0,2,0,0,0,0|1,0,0]=3 8723 B15R1.1646 CCc1cccc(c1OCC(O)CO)C 7a_100000034007_100011219619 [0,2,0,0,0,0|1,0,0]=3 8724 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CC)Br 34a_200010001580_100009816398 [0,2,0,0,0,0|2,0,0]=4 8725 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CC)Br 7a_200010001580_100009816398 [0,2,0,0,0,0|2,0,0]=4 8726 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CC)C 34a_100000034007_100009816398 [0,2,0,0,0,0|1,0,0]=3 8727 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CC)C 7a_100000034007_100009816398 [0,2,0,0,0,0|1,0,0]=3 8728 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CO)Br 34a_200010001580_100000059175 [0,2,0,0,0,0|2,0,0]=4 8729 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CO)Br 7a_200010001580_100000059175 [0,2,0,0,0,0|2,0,0]=4 8730 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CO)C 34a_100000034007_100000059175 [0,2,0,0,0,0|1,0,0]=3 8731 B15R1.1646 CCc1cccc(c1OC[C@@H](C)CO)C 7a_100000034007_100000059175 [0,2,0,0,0,0|1,0,0]=3 8732 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CF)Br 34a_200010001580_100015614560 [0,2,0,0,0,0|2,0,0]=4 8733 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CF)Br 7a_200010001580_100015614560 [0,2,0,0,0,0|2,0,0]=4 8734 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CF)C 34a_100000034007_100015614560 [0,2,0,0,0,0|1,0,0]=3 8735 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CF)C 7a_100000034007_100015614560 [0,2,0,0,0,0|1,0,0]=3 8736 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CO)Br 34a_200010001580_100009815848 [0,2,0,0,0,0|2,0,0]=4 8737 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CO)Br 7a_200010001580_100009815848 [0,2,0,0,0,0|2,0,0]=4 8738 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CO)C 34a_100000034007_100009815848 [0,2,0,0,0,0|1,0,0]=3 8739 B15R1.1646 CCc1cccc(c1OC[C@@H](O)CO)C 7a_100000034007_100009815848 [0,2,0,0,0,0|1,0,0]=3 8740 B15R1.1646 CCc1cccc(c1SCC(C)CC)C 62a_100000036235_100000748023 [0,2,0,0,0,0|1,1,0]=4 8741 B15R1.1646 CCc1cccc(c1SCC(C)CC)C 62a_100000748023_100000036235 [0,2,0,0,0,0|1,1,0]=4 8742 B15R1.1646 CCc1cccc(c1SCC(O)CC)C 62a_100000036235_100011218378 [0,2,0,0,0,0|1,1,0]=4 8743 B15R1.1646 CCc1cccc(c1SCC(O)CC)C 62a_100011218378_100000036235 [0,2,0,0,0,0|1,1,0]=4 8744 B15R1.1646 CCc1cccc(c1SCC(O)CO)C 62a_100000036235_100011219619 [0,2,0,0,0,0|1,1,0]=4 8745 B15R1.1646 CCc1cccc(c1SCC(O)CO)C 62a_100011219619_100000036235 [0,2,0,0,0,0|1,1,0]=4 8746 B15R1.1646 CCc1cccc(c1SC[C@@H](C)CC)C 62a_100000036235_100009816398 [0,2,0,0,0,0|1,1,0]=4 8747 B15R1.1646 CCc1cccc(c1SC[C@@H](C)CC)C 62a_100009816398_100000036235 [0,2,0,0,0,0|1,1,0]=4 8748 B15R1.1646 CCc1cccc(c1SC[C@@H](C)CO)C 62a_100000036235_100000059175 [0,2,0,0,0,0|1,1,0]=4 8749 B15R1.1646 CCc1cccc(c1SC[C@@H](C)CO)C 62a_100000059175_100000036235 [0,2,0,0,0,0|1,1,0]=4 8750 B15R1.1646 CCc1cccc(c1SC[C@@H](O)CF)C 62a_100000036235_100015614560 [0,2,0,0,0,0|1,1,0]=4 8751 B15R1.1646 CCc1cccc(c1SC[C@@H](O)CF)C 62a_100015614560_100000036235 [0,2,0,0,0,0|1,1,0]=4 8752 B15R1.1646 CCc1cccc(c1SC[C@@H](O)CO)C 62a_100000036235_100009815848 [0,2,0,0,0,0|1,1,0]=4 8753 B15R1.1646 CCc1cccc(c1SC[C@@H](O)CO)C 62a_100009815848_100000036235 [0,2,0,0,0,0|1,1,0]=4 8754 B15R1.1646 CNC(=O)COc1c(cccc1CN)C 34a_100020639391_100000183359 [0,2,0,0,0,0|1,0,1]=4 8755 B15R1.1646 CNC(=O)COc1c(cccc1OC)C 34a_100011219253_100000183359 [0,2,0,0,0,0|1,0,1]=4 8756 B15R1.1646 CNC(=O)COc1c(cccc1OC)C 7a_100011219253_100000183359 [0,2,0,0,0,0|1,0,1]=4 8757 B15R1.1646 COC(=O)COc1c(cccc1CN)C 34a_100020639391_100000747449 [0,2,0,0,0,0|1,0,1]=4 8758 B15R1.1646 COC(=O)COc1c(cccc1OC)C 34a_100011219253_100000747449 [0,2,0,0,0,0|1,0,1]=4 8759 B15R1.1646 COC(=O)COc1c(cccc1OC)C 7a_100011219253_100000747449 [0,2,0,0,0,0|1,0,1]=4 8760 B15R1.1646 COc1cccc(c1NCC(O)CO)C 2230a_100000758225_100011219619 [0,2,0,0,0,0|2,0,0]=4 8761 B15R1.1646 COc1cccc(c1NCC(O)CO)C 34a_100000758225_100011219619 [0,2,0,0,0,0|2,0,0]=4 8762 B15R1.1646 COc1cccc(c1NC[C@@H](C)CO)C 2230a_100000758225_100000059175 [0,2,0,0,0,0|2,0,0]=4 8763 B15R1.1646 COc1cccc(c1NC[C@@H](C)CO)C 34a_100000758225_100000059175 [0,2,0,0,0,0|2,0,0]=4 8764 B15R1.1646 COc1cccc(c1NC[C@@H](O)CF)C 2230a_100000758225_100015614560 [0,2,0,0,0,0|2,0,0]=4 8765 B15R1.1646 COc1cccc(c1NC[C@@H](O)CF)C 34a_100000758225_100015614560 [0,2,0,0,0,0|2,0,0]=4 8766 B15R1.1646 COc1cccc(c1NC[C@@H](O)CO)C 2230a_100000758225_100009815848 [0,2,0,0,0,0|2,0,0]=4 8767 B15R1.1646 COc1cccc(c1NC[C@@H](O)CO)C 34a_100000758225_100009815848 [0,2,0,0,0,0|2,0,0]=4 8768 B15R1.1646 COc1cccc(c1OCC(O)CO)Br 34a_100000686866_100011219619 [0,2,0,0,0,0|2,0,0]=4 8769 B15R1.1646 COc1cccc(c1OCC(O)CO)C 34a_100011219253_100011219619 [0,2,0,0,0,0|1,0,0]=3 8770 B15R1.1646 COc1cccc(c1OCC(O)CO)C 7a_100011219253_100011219619 [0,2,0,0,0,0|1,0,0]=3 8771 B15R1.1646 COc1cccc(c1OCC(O)CO)Cl 34a_100009851661_100011219619 [0,2,0,0,0,0|2,0,0]=4 8772 B15R1.1646 COc1cccc(c1OCC(O)CO)Cl 7a_100009851661_100011219619 [0,2,0,0,0,0|2,0,0]=4 8773 B15R1.1646 COc1cccc(c1OCC(O)CO)F 34a_100000036725_100011219619 [0,2,0,0,0,0|2,0,0]=4 8774 B15R1.1646 COc1cccc(c1OCC(O)CO)F 7a_100000036725_100011219619 [0,2,0,0,0,0|2,0,0]=4 8775 B15R1.1646 COc1cccc(c1OCC(O)CO)N 34a_100000123586_100011219619 [0,2,0,0,0,0|2,0,0]=4 8776 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)Br 34a_100000686866_100000059175 [0,2,0,0,0,0|2,0,0]=4 8777 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)C 34a_100011219253_100000059175 [0,2,0,0,0,0|1,0,0]=3 8778 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)C 7a_100011219253_100000059175 [0,2,0,0,0,0|1,0,0]=3 8779 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)Cl 34a_100009851661_100000059175 [0,2,0,0,0,0|2,0,0]=4 8780 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)Cl 7a_100009851661_100000059175 [0,2,0,0,0,0|2,0,0]=4 8781 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)F 34a_100000036725_100000059175 [0,2,0,0,0,0|2,0,0]=4 8782 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)F 7a_100000036725_100000059175 [0,2,0,0,0,0|2,0,0]=4 8783 B15R1.1646 COc1cccc(c1OC[C@@H](C)CO)N 34a_100000123586_100000059175 [0,2,0,0,0,0|2,0,0]=4 8784 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)Br 34a_100000686866_100015614560 [0,2,0,0,0,0|2,0,0]=4 8785 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)C 34a_100011219253_100015614560 [0,2,0,0,0,0|1,0,0]=3 8786 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)C 7a_100011219253_100015614560 [0,2,0,0,0,0|1,0,0]=3 8787 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)Cl 34a_100009851661_100015614560 [0,2,0,0,0,0|2,0,0]=4 8788 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)Cl 7a_100009851661_100015614560 [0,2,0,0,0,0|2,0,0]=4 8789 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)F 34a_100000036725_100015614560 [0,2,0,0,0,0|2,0,0]=4 8790 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)F 7a_100000036725_100015614560 [0,2,0,0,0,0|2,0,0]=4 8791 B15R1.1646 COc1cccc(c1OC[C@@H](O)CF)N 34a_100000123586_100015614560 [0,2,0,0,0,0|2,0,0]=4 8792 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)Br 34a_100000686866_100009815848 [0,2,0,0,0,0|2,0,0]=4 8793 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)C 34a_100011219253_100009815848 [0,2,0,0,0,0|1,0,0]=3 8794 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)C 7a_100011219253_100009815848 [0,2,0,0,0,0|1,0,0]=3 8795 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)Cl 34a_100009851661_100009815848 [0,2,0,0,0,0|2,0,0]=4 8796 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)Cl 7a_100009851661_100009815848 [0,2,0,0,0,0|2,0,0]=4 8797 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)F 34a_100000036725_100009815848 [0,2,0,0,0,0|2,0,0]=4 8798 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)F 7a_100000036725_100009815848 [0,2,0,0,0,0|2,0,0]=4 8799 B15R1.1646 COc1cccc(c1OC[C@@H](O)CO)N 34a_100000123586_100009815848 [0,2,0,0,0,0|2,0,0]=4 8800 B15R1.1646 COc1cccc(c1SCC(O)CO)C 62a_100010191535_100011219619 [0,2,0,0,0,0|1,1,0]=4 8801 B15R1.1646 COc1cccc(c1SCC(O)CO)C 62a_100011219619_100010191535 [0,2,0,0,0,0|1,1,0]=4 8802 B15R1.1646 COc1cccc(c1SC[C@@H](C)CO)C 62a_100000059175_100010191535 [0,2,0,0,0,0|1,1,0]=4 8803 B15R1.1646 COc1cccc(c1SC[C@@H](C)CO)C 62a_100010191535_100000059175 [0,2,0,0,0,0|1,1,0]=4 8804 B15R1.1646 COc1cccc(c1SC[C@@H](O)CF)C 62a_100010191535_100015614560 [0,2,0,0,0,0|1,1,0]=4 8805 B15R1.1646 COc1cccc(c1SC[C@@H](O)CF)C 62a_100015614560_100010191535 [0,2,0,0,0,0|1,1,0]=4 8806 B15R1.1646 COc1cccc(c1SC[C@@H](O)CO)C 62a_100009815848_100010191535 [0,2,0,0,0,0|1,1,0]=4 8807 B15R1.1646 COc1cccc(c1SC[C@@H](O)CO)C 62a_100010191535_100009815848 [0,2,0,0,0,0|1,1,0]=4 8808 B15R1.1646 C[C@@H](CO)COc1c(cccc1CO)F 34a_100011997349_100000059175 [0,2,0,0,0,0|2,0,0]=4 8809 B15R1.1646 C[C@@H](CO)COc1c(cccc1CO)F 7a_100011997349_100000059175 [0,2,0,0,0,0|2,0,0]=4 8810 B15R1.1646 Cc1cccc(c1NCC(O)CO)CO 34a_100011215590_100011219619 [0,2,0,0,0,0|2,0,0]=4 8811 B15R1.1646 Cc1cccc(c1NC[C@@H](C)CO)CO 34a_100011215590_100000059175 [0,2,0,0,0,0|2,0,0]=4 8812 B15R1.1646 Cc1cccc(c1NC[C@@H](O)CF)CO 34a_100011215590_100015614560 [0,2,0,0,0,0|2,0,0]=4 8813 B15R1.1646 Cc1cccc(c1NC[C@@H](O)CO)CO 34a_100011215590_100009815848 [0,2,0,0,0,0|2,0,0]=4 8814 B15R1.1646 Cc1cccc(c1OCC(O)CO)C#N 34a_100011659161_100011219619 [0,2,0,0,0,0|1,0,1]=4 8815 B15R1.1646 Cc1cccc(c1OCC(O)CO)C#N 7a_100011659161_100011219619 [0,2,0,0,0,0|1,0,1]=4 8816 B15R1.1646 Cc1cccc(c1OCC(O)CO)CN 34a_100020639391_100011219619 [0,2,0,0,0,0|1,0,0]=3 8817 B15R1.1646 Cc1cccc(c1OC[C@@H](C)CO)C#N 34a_100011659161_100000059175 [0,2,0,0,0,0|1,0,1]=4 8818 B15R1.1646 Cc1cccc(c1OC[C@@H](C)CO)C#N 7a_100011659161_100000059175 [0,2,0,0,0,0|1,0,1]=4 8819 B15R1.1646 Cc1cccc(c1OC[C@@H](C)CO)CN 34a_100020639391_100000059175 [0,2,0,0,0,0|1,0,0]=3 8820 B15R1.1646 Cc1cccc(c1OC[C@@H](O)CF)C#N 34a_100011659161_100015614560 [0,2,0,0,0,0|1,0,1]=4 8821 B15R1.1646 Cc1cccc(c1OC[C@@H](O)CF)C#N 7a_100011659161_100015614560 [0,2,0,0,0,0|1,0,1]=4 8822 B15R1.1646 Cc1cccc(c1OC[C@@H](O)CF)CN 34a_100020639391_100015614560 [0,2,0,0,0,0|1,0,0]=3 8823 B15R1.1646 Cc1cccc(c1OC[C@@H](O)CO)C#N 34a_100011659161_100009815848 [0,2,0,0,0,0|1,0,1]=4 8824 B15R1.1646 Cc1cccc(c1OC[C@@H](O)CO)C#N 7a_100011659161_100009815848 [0,2,0,0,0,0|1,0,1]=4 8825 B15R1.1646 Cc1cccc(c1OC[C@@H](O)CO)CN 34a_100020639391_100009815848 [0,2,0,0,0,0|1,0,0]=3 8826 B15R1.1646 Cc1cccc(c1SCC(O)CO)CO 62a_100011219619_100011659289 [0,2,0,0,0,0|1,1,0]=4 8827 B15R1.1646 Cc1cccc(c1SCC(O)CO)CO 62a_100011659289_100011219619 [0,2,0,0,0,0|1,1,0]=4 8828 B15R1.1646 Cc1cccc(c1SC[C@@H](C)CO)CO 62a_100000059175_100011659289 [0,2,0,0,0,0|1,1,0]=4 8829 B15R1.1646 Cc1cccc(c1SC[C@@H](C)CO)CO 62a_100011659289_100000059175 [0,2,0,0,0,0|1,1,0]=4 8830 B15R1.1646 Cc1cccc(c1SC[C@@H](O)CF)CO 62a_100011659289_100015614560 [0,2,0,0,0,0|1,1,0]=4 8831 B15R1.1646 Cc1cccc(c1SC[C@@H](O)CF)CO 62a_100015614560_100011659289 [0,2,0,0,0,0|1,1,0]=4 8832 B15R1.1646 Cc1cccc(c1SC[C@@H](O)CO)CO 62a_100009815848_100011659289 [0,2,0,0,0,0|1,1,0]=4 8833 B15R1.1646 Cc1cccc(c1SC[C@@H](O)CO)CO 62a_100011659289_100009815848 [0,2,0,0,0,0|1,1,0]=4 8834 B15R1.1646 OCc1cccc(c1OCC(O)CO)F 34a_100011997349_100011219619 [0,2,0,0,0,0|2,0,0]=4 8835 B15R1.1646 OCc1cccc(c1OCC(O)CO)F 7a_100011997349_100011219619 [0,2,0,0,0,0|2,0,0]=4 8836 B15R1.1646 OCc1cccc(c1OC[C@@H](O)CF)F 34a_100011997349_100015614560 [0,2,0,0,0,0|2,0,0]=4 8837 B15R1.1646 OCc1cccc(c1OC[C@@H](O)CF)F 7a_100011997349_100015614560 [0,2,0,0,0,0|2,0,0]=4 8838 B15R1.1646 OCc1cccc(c1OC[C@@H](O)CO)F 34a_100011997349_100009815848 [0,2,0,0,0,0|2,0,0]=4 8839 B15R1.1646 OCc1cccc(c1OC[C@@H](O)CO)F 7a_100011997349_100009815848 [0,2,0,0,0,0|2,0,0]=4 8840 B15R1.5216 COc1c(ccc(c1OCC(C)C)F)Br 34a_200010167157_100000210624 [0,2,0,0,0,0|2,0,0]=4 8841 B15R1.5216 COc1c(ccc(c1OCC(C)C)F)F 34a_100000118042_100000210624 [0,2,0,0,0,0|2,0,0]=4 8842 B15R1.5216 COc1c(ccc(c1OCC(C)C)F)F 7a_100000118042_100000210760 [0,2,0,0,0,0|2,0,0]=4 8843 B15R1.5216 COc1c(ccc(c1OCC(C)O)F)Br 34a_200010167157_100011218427 [0,2,0,0,0,0|2,0,0]=4 8844 B15R1.5216 COc1c(ccc(c1OCC(C)O)F)F 34a_100000118042_100011218427 [0,2,0,0,0,0|2,0,0]=4 8845 B15R1.5216 COc1c(ccc(c1OCC(C)O)F)F 7a_100000118042_100011218427 [0,2,0,0,0,0|2,0,0]=4 8846 B15R1.5216 COc1c(ccc(c1OC[C@@H](C)O)F)Br 34a_200010167157_100009817552 [0,2,0,0,0,0|2,0,0]=4 8847 B15R1.5216 COc1c(ccc(c1OC[C@@H](C)O)F)F 34a_100000118042_100009817552 [0,2,0,0,0,0|2,0,0]=4 8848 B15R1.5216 COc1c(ccc(c1OC[C@@H](C)O)F)F 7a_100000118042_100009817552 [0,2,0,0,0,0|2,0,0]=4 8849 B15R1.5216 Cc1ccc(c(c1SCC(C)C)CO)F 62a_100000210624_100010365568 [0,2,0,0,0,0|1,1,0]=4 8850 B15R1.5216 Cc1ccc(c(c1SCC(C)C)CO)F 62a_100010365568_100000210760 [0,2,0,0,0,0|1,1,0]=4 8851 B15R1.5216 Cc1ccc(c(c1SCC(C)O)CO)F 62a_100010365568_100011218427 [0,2,0,0,0,0|1,1,0]=4 8852 B15R1.5216 Cc1ccc(c(c1SCC(C)O)CO)F 62a_100011218427_100010365568 [0,2,0,0,0,0|1,1,0]=4 8853 B15R1.5216 Cc1ccc(c(c1SC[C@@H](C)O)CO)F 62a_100009817552_100010365568 [0,2,0,0,0,0|1,1,0]=4 8854 B15R1.5216 Cc1ccc(c(c1SC[C@@H](C)O)CO)F 62a_100010365568_100009817552 [0,2,0,0,0,0|1,1,0]=4 8855 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)C 34a_100009847209_100000748629 [0,2,0,0,0,0|1,0,1]=4 8856 B15R1.6620 C=C(C)COc1c(cccc1C(=O)C)C 7a_100009847209_100000748629 [0,2,0,0,0,0|1,0,1]=4 8857 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)C 34a_100009847209_100000187820 [0,2,0,0,0,0|1,0,1]=4 8858 B15R1.6620 CC(=O)c1cccc(c1OCC(=O)N)C 7a_100009847209_100000187820 [0,2,0,0,0,0|1,0,1]=4 8859 B15R1.6620 CC(=O)c1cccc(c1OCC(C)C)C 34a_100009847209_100000210624 [0,2,0,0,0,0|1,0,0]=3 8860 B15R1.6620 CC(=O)c1cccc(c1OCC(C)C)C 7a_100009847209_100000210760 [0,2,0,0,0,0|1,0,0]=3 8861 B15R1.6620 CC(=O)c1cccc(c1OCC(C)C)Cl 34a_100000043392_100000210624 [0,2,0,0,0,0|2,0,0]=4 8862 B15R1.6620 CC(=O)c1cccc(c1OCC(C)C)Cl 7a_100000043392_100000210760 [0,2,0,0,0,0|2,0,0]=4 8863 B15R1.6620 CC(=O)c1cccc(c1OCC(C)C)F 34a_100011246037_100000210624 [0,2,0,0,0,0|2,0,0]=4 8864 B15R1.6620 CC(=O)c1cccc(c1OCC(C)C)F 7a_100011246037_100000210760 [0,2,0,0,0,0|2,0,0]=4 8865 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)C 34a_100009847209_100011218427 [0,2,0,0,0,0|1,0,0]=3 8866 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)C 7a_100009847209_100011218427 [0,2,0,0,0,0|1,0,0]=3 8867 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)Cl 34a_100000043392_100011218427 [0,2,0,0,0,0|2,0,0]=4 8868 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)Cl 7a_100000043392_100011218427 [0,2,0,0,0,0|2,0,0]=4 8869 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)F 34a_100011246037_100011218427 [0,2,0,0,0,0|2,0,0]=4 8870 B15R1.6620 CC(=O)c1cccc(c1OCC(C)O)F 7a_100011246037_100011218427 [0,2,0,0,0,0|2,0,0]=4 8871 B15R1.6620 CC(=O)c1cccc(c1OCC(F)F)C 34a_100009847209_100011934356 [0,2,0,0,0,0|2,0,0]=4 8872 B15R1.6620 CC(=O)c1cccc(c1OCC(F)F)C 7a_100009847209_100011934356 [0,2,0,0,0,0|2,0,0]=4 8873 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)C 34a_100009847209_100009817552 [0,2,0,0,0,0|1,0,0]=3 8874 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)C 7a_100009847209_100009817552 [0,2,0,0,0,0|1,0,0]=3 8875 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)Cl 34a_100000043392_100009817552 [0,2,0,0,0,0|2,0,0]=4 8876 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)Cl 7a_100000043392_100009817552 [0,2,0,0,0,0|2,0,0]=4 8877 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)F 34a_100011246037_100009817552 [0,2,0,0,0,0|2,0,0]=4 8878 B15R1.6620 CC(=O)c1cccc(c1OC[C@@H](C)O)F 7a_100011246037_100009817552 [0,2,0,0,0,0|2,0,0]=4 8879 B15R1.6620 Cc1cccc(c1NCC(C)C)C(C)C 2230a_100138557336_100000210760 [0,2,0,0,0,0|2,0,0]=4 8880 B15R1.6620 Cc1cccc(c1NCC(C)C)C(C)C 34a_100138557336_100000210624 [0,2,0,0,0,0|2,0,0]=4 8881 B15R1.6620 Cc1cccc(c1NCC(C)C)C(C)C 7a_100138557336_100000210760 [0,2,0,0,0,0|2,0,0]=4 8882 B15R1.6620 Cc1cccc(c1NCC(C)O)C(C)C 2230a_100138557336_100011218427 [0,2,0,0,0,0|2,0,0]=4 8883 B15R1.6620 Cc1cccc(c1NCC(C)O)C(C)C 34a_100138557336_100011218427 [0,2,0,0,0,0|2,0,0]=4 8884 B15R1.6620 Cc1cccc(c1NCC(C)O)C(C)C 7a_100138557336_100011218427 [0,2,0,0,0,0|2,0,0]=4 8885 B15R1.6620 Cc1cccc(c1NC[C@@H](C)O)C(C)C 2230a_100138557336_100009817552 [0,2,0,0,0,0|2,0,0]=4 8886 B15R1.6620 Cc1cccc(c1NC[C@@H](C)O)C(C)C 34a_100138557336_100009817552 [0,2,0,0,0,0|2,0,0]=4 8887 B15R1.6620 Cc1cccc(c1NC[C@@H](C)O)C(C)C 7a_100138557336_100009817552 [0,2,0,0,0,0|2,0,0]=4 8888 B15R1.6620 Cc1cccc(c1OCC(C)C)[N+](=O)[O-] 34a_100000763257_100000210624 [0,2,0,0,0,0|2,0,0]=4 8889 B15R1.6620 Cc1cccc(c1OCC(C)C)[N+](=O)[O-] 7a_100000763257_100000210760 [0,2,0,0,0,0|2,0,0]=4 8890 B15R1.6620 Cc1cccc(c1OCC(C)O)[N+](=O)[O-] 34a_100000763257_100011218427 [0,2,0,0,0,0|2,0,0]=4 8891 B15R1.6620 Cc1cccc(c1OCC(C)O)[N+](=O)[O-] 7a_100000763257_100011218427 [0,2,0,0,0,0|2,0,0]=4 8892 B15R1.6620 Cc1cccc(c1OC[C@@H](C)O)[N+](=O)[O-] 34a_100000763257_100009817552 [0,2,0,0,0,0|2,0,0]=4 8893 B15R1.6620 Cc1cccc(c1OC[C@@H](C)O)[N+](=O)[O-] 7a_100000763257_100009817552 [0,2,0,0,0,0|2,0,0]=4 8894 B15R1.7637 C=CCc1cccc(c1OCC(=C)C)C 34a_200011218211_100000748629 [0,2,0,0,0,0|1,0,1]=4 8895 B15R1.7637 C=CCc1cccc(c1OCC(=C)C)C 7a_200011218211_100000748629 [0,2,0,0,0,0|1,0,1]=4 8896 B15R1.7637 C=CCc1cccc(c1OCC(=O)N)C 34a_200011218211_100000187820 [0,2,0,0,0,0|1,0,1]=4 8897 B15R1.7637 C=CCc1cccc(c1OCC(=O)N)C 7a_200011218211_100000187820 [0,2,0,0,0,0|1,0,1]=4 8898 B15R1.7637 C=CCc1cccc(c1OCC(C)C)C 34a_200011218211_100000210624 [0,2,0,0,0,0|1,0,0]=3 8899 B15R1.7637 C=CCc1cccc(c1OCC(C)C)C 7a_200011218211_100000210760 [0,2,0,0,0,0|1,0,0]=3 8900 B15R1.7637 C=CCc1cccc(c1OCC(C)O)C 34a_200011218211_100011218427 [0,2,0,0,0,0|1,0,0]=3 8901 B15R1.7637 C=CCc1cccc(c1OCC(C)O)C 7a_200011218211_100011218427 [0,2,0,0,0,0|1,0,0]=3 8902 B15R1.7637 C=CCc1cccc(c1OCC(F)F)C 34a_200011218211_100011934356 [0,2,0,0,0,0|2,0,0]=4 8903 B15R1.7637 C=CCc1cccc(c1OCC(F)F)C 7a_200011218211_100011934356 [0,2,0,0,0,0|2,0,0]=4 8904 B15R1.7637 C=CCc1cccc(c1OC[C@@H](C)O)C 34a_200011218211_100009817552 [0,2,0,0,0,0|1,0,0]=3 8905 B15R1.7637 C=CCc1cccc(c1OC[C@@H](C)O)C 7a_200011218211_100009817552 [0,2,0,0,0,0|1,0,0]=3 8906 B15R1.7637 Cc1cccc(c1SCC(C)C)CC#N 62a_100000210624_100010147024 [0,2,0,0,0,0|1,1,0]=4 8907 B15R1.7637 Cc1cccc(c1SCC(C)C)CC#N 62a_100010147024_100000210760 [0,2,0,0,0,0|1,1,0]=4 8908 B15R1.7637 Cc1cccc(c1SCC(C)O)CC#N 62a_100010147024_100011218427 [0,2,0,0,0,0|1,1,0]=4 8909 B15R1.7637 Cc1cccc(c1SCC(C)O)CC#N 62a_100011218427_100010147024 [0,2,0,0,0,0|1,1,0]=4 8910 B15R1.7637 Cc1cccc(c1SC[C@@H](C)O)CC#N 62a_100009817552_100010147024 [0,2,0,0,0,0|1,1,0]=4 8911 B15R1.7637 Cc1cccc(c1SC[C@@H](C)O)CC#N 62a_100010147024_100009817552 [0,2,0,0,0,0|1,1,0]=4 8912 B15R1.13085 COc1ccc(c(c1OCC(C)C)F)F 34a_100000062125_100000210624 [0,2,0,0,0,0|2,0,0]=4 8913 B15R1.13085 COc1ccc(c(c1OCC(C)C)F)F 7a_100000062125_100000210760 [0,2,0,0,0,0|2,0,0]=4 8914 B15R1.13085 COc1ccc(c(c1OCC(C)O)F)F 34a_100000062125_100011218427 [0,2,0,0,0,0|2,0,0]=4 8915 B15R1.13085 COc1ccc(c(c1OCC(C)O)F)F 7a_100000062125_100011218427 [0,2,0,0,0,0|2,0,0]=4 8916 B15R1.13085 COc1ccc(c(c1OC[C@@H](C)O)F)F 34a_100000062125_100009817552 [0,2,0,0,0,0|2,0,0]=4 8917 B15R1.13085 COc1ccc(c(c1OC[C@@H](C)O)F)F 7a_100000062125_100009817552 [0,2,0,0,0,0|2,0,0]=4 8918 B15R1.702 C=C(C)COc1c(cc(cc1C)C#N)C 34a_100000189350_100000748629 [0,2,0,0,0,0|1,0,1]=4 8919 B15R1.702 C=C(C)COc1c(cc(cc1C)C#N)C 7a_100000189350_100000748629 [0,2,0,0,0,0|1,0,1]=4 8920 B15R1.702 C=C(C)COc1c(cc(cc1C)CO)C 34a_100000189000_100000748629 [0,2,0,0,0,0|1,0,1]=4 8921 B15R1.702 C=C(C)COc1c(cc(cc1C)CO)C 7a_100000189000_100000748629 [0,2,0,0,0,0|1,0,1]=4 8922 B15R1.702 C=C(C)COc1c(cc(cc1C)N=O)C 34a_100000703954_100000748629 [0,2,0,0,0,0|1,0,1]=4 8923 B15R1.702 C=C(C)COc1c(cc(cc1C)N=O)C 7a_100000703954_100000748629 [0,2,0,0,0,0|1,0,1]=4 8924 B15R1.702 C=C(C)COc1c(cc(cc1C)OC)C 34a_100010658422_100000748629 [0,2,0,0,0,0|1,0,1]=4 8925 B15R1.702 C=C(C)COc1c(cc(cc1C)OC)C 7a_100010658422_100000748629 [0,2,0,0,0,0|1,0,1]=4 8926 B15R1.702 COc1cc(c(c(c1)C)NCC(C)C)C 34a_100009848961_100000210624 [0,2,0,0,0,0|2,0,0]=4 8927 B15R1.702 COc1cc(c(c(c1)C)NCC(C)O)C 34a_100009848961_100011218427 [0,2,0,0,0,0|2,0,0]=4 8928 B15R1.702 COc1cc(c(c(c1)C)NC[C@@H](C)O)C 34a_100009848961_100009817552 [0,2,0,0,0,0|2,0,0]=4 8929 B15R1.702 COc1cc(c(c(c1)C)OCC(=O)N)C 34a_100010658422_100000187820 [0,2,0,0,0,0|1,0,1]=4 8930 B15R1.702 COc1cc(c(c(c1)C)OCC(=O)N)C 7a_100010658422_100000187820 [0,2,0,0,0,0|1,0,1]=4 8931 B15R1.702 COc1cc(c(c(c1)C)OCC(C)C)C 34a_100010658422_100000210624 [0,2,0,0,0,0|1,0,0]=3 8932 B15R1.702 COc1cc(c(c(c1)C)OCC(C)C)C 7a_100010658422_100000210760 [0,2,0,0,0,0|1,0,0]=3 8933 B15R1.702 COc1cc(c(c(c1)C)OCC(C)O)C 34a_100010658422_100011218427 [0,2,0,0,0,0|1,0,0]=3 8934 B15R1.702 COc1cc(c(c(c1)C)OCC(C)O)C 7a_100010658422_100011218427 [0,2,0,0,0,0|1,0,0]=3 8935 B15R1.702 COc1cc(c(c(c1)C)OCC(F)F)C 34a_100010658422_100011934356 [0,2,0,0,0,0|2,0,0]=4 8936 B15R1.702 COc1cc(c(c(c1)C)OCC(F)F)C 7a_100010658422_100011934356 [0,2,0,0,0,0|2,0,0]=4 8937 B15R1.702 COc1cc(c(c(c1)C)OC[C@@H](C)O)C 34a_100010658422_100009817552 [0,2,0,0,0,0|1,0,0]=3 8938 B15R1.702 COc1cc(c(c(c1)C)OC[C@@H](C)O)C 7a_100010658422_100009817552 [0,2,0,0,0,0|1,0,0]=3 8939 B15R1.702 COc1cc(c(c(c1)C)SCC(C)C)C 62a_100000210624_100012160682 [0,2,0,0,0,0|1,1,0]=4 8940 B15R1.702 COc1cc(c(c(c1)C)SCC(C)C)C 62a_100012160682_100000210760 [0,2,0,0,0,0|1,1,0]=4 8941 B15R1.702 COc1cc(c(c(c1)C)SCC(C)O)C 62a_100011218427_100012160682 [0,2,0,0,0,0|1,1,0]=4 8942 B15R1.702 COc1cc(c(c(c1)C)SCC(C)O)C 62a_100012160682_100011218427 [0,2,0,0,0,0|1,1,0]=4 8943 B15R1.702 COc1cc(c(c(c1)C)SC[C@@H](C)O)C 62a_100009817552_100012160682 [0,2,0,0,0,0|1,1,0]=4 8944 B15R1.702 COc1cc(c(c(c1)C)SC[C@@H](C)O)C 62a_100012160682_100009817552 [0,2,0,0,0,0|1,1,0]=4 8945 B15R1.702 Cc1cc(cc(c1NCC(C)C)C)C#N 34a_100000068765_100000210624 [0,2,0,0,0,0|2,0,0]=4 8946 B15R1.702 Cc1cc(cc(c1NCC(C)C)C)C#N 7a_100000068765_100000210760 [0,2,0,0,0,0|2,0,0]=4 8947 B15R1.702 Cc1cc(cc(c1NCC(C)O)C)C#N 34a_100000068765_100011218427 [0,2,0,0,0,0|2,0,0]=4 8948 B15R1.702 Cc1cc(cc(c1NCC(C)O)C)C#N 7a_100000068765_100011218427 [0,2,0,0,0,0|2,0,0]=4 8949 B15R1.702 Cc1cc(cc(c1NC[C@@H](C)O)C)C#N 34a_100000068765_100009817552 [0,2,0,0,0,0|2,0,0]=4 8950 B15R1.702 Cc1cc(cc(c1NC[C@@H](C)O)C)C#N 7a_100000068765_100009817552 [0,2,0,0,0,0|2,0,0]=4 8951 B15R1.702 Cc1cc(cc(c1OCC(=O)N)C)C#N 34a_100000189350_100000187820 [0,2,0,0,0,0|1,0,1]=4 8952 B15R1.702 Cc1cc(cc(c1OCC(=O)N)C)C#N 7a_100000189350_100000187820 [0,2,0,0,0,0|1,0,1]=4 8953 B15R1.702 Cc1cc(cc(c1OCC(=O)N)C)CO 34a_100000189000_100000187820 [0,2,0,0,0,0|1,0,1]=4 8954 B15R1.702 Cc1cc(cc(c1OCC(=O)N)C)CO 7a_100000189000_100000187820 [0,2,0,0,0,0|1,0,1]=4 8955 B15R1.702 Cc1cc(cc(c1OCC(=O)N)C)N=O 34a_100000703954_100000187820 [0,2,0,0,0,0|1,0,1]=4 8956 B15R1.702 Cc1cc(cc(c1OCC(=O)N)C)N=O 7a_100000703954_100000187820 [0,2,0,0,0,0|1,0,1]=4 8957 B15R1.702 Cc1cc(cc(c1OCC(C)C)C)C#N 34a_100000189350_100000210624 [0,2,0,0,0,0|1,0,0]=3 8958 B15R1.702 Cc1cc(cc(c1OCC(C)C)C)C#N 7a_100000189350_100000210760 [0,2,0,0,0,0|1,0,0]=3 8959 B15R1.702 Cc1cc(cc(c1OCC(C)C)C)CO 34a_100000189000_100000210624 [0,2,0,0,0,0|1,0,0]=3 8960 B15R1.702 Cc1cc(cc(c1OCC(C)C)C)CO 7a_100000189000_100000210760 [0,2,0,0,0,0|1,0,0]=3 8961 B15R1.702 Cc1cc(cc(c1OCC(C)C)C)N=O 34a_100000703954_100000210624 [0,2,0,0,0,0|1,0,0]=3 8962 B15R1.702 Cc1cc(cc(c1OCC(C)C)C)N=O 7a_100000703954_100000210760 [0,2,0,0,0,0|1,0,0]=3 8963 B15R1.702 Cc1cc(cc(c1OCC(C)C)Cl)C#N 34a_200000089643_100000210624 [0,2,0,0,0,0|2,0,0]=4 8964 B15R1.702 Cc1cc(cc(c1OCC(C)C)Cl)C#N 7a_200000089643_100000210760 [0,2,0,0,0,0|2,0,0]=4 8965 B15R1.702 Cc1cc(cc(c1OCC(C)O)C)C#N 34a_100000189350_100011218427 [0,2,0,0,0,0|1,0,0]=3 8966 B15R1.702 Cc1cc(cc(c1OCC(C)O)C)C#N 7a_100000189350_100011218427 [0,2,0,0,0,0|1,0,0]=3 8967 B15R1.702 Cc1cc(cc(c1OCC(C)O)C)CO 34a_100000189000_100011218427 [0,2,0,0,0,0|1,0,0]=3 8968 B15R1.702 Cc1cc(cc(c1OCC(C)O)C)CO 7a_100000189000_100011218427 [0,2,0,0,0,0|1,0,0]=3 8969 B15R1.702 Cc1cc(cc(c1OCC(C)O)C)N=O 34a_100000703954_100011218427 [0,2,0,0,0,0|1,0,0]=3 8970 B15R1.702 Cc1cc(cc(c1OCC(C)O)C)N=O 7a_100000703954_100011218427 [0,2,0,0,0,0|1,0,0]=3 8971 B15R1.702 Cc1cc(cc(c1OCC(C)O)Cl)C#N 34a_200000089643_100011218427 [0,2,0,0,0,0|2,0,0]=4 8972 B15R1.702 Cc1cc(cc(c1OCC(C)O)Cl)C#N 7a_200000089643_100011218427 [0,2,0,0,0,0|2,0,0]=4 8973 B15R1.702 Cc1cc(cc(c1OCC(F)F)C)C#N 34a_100000189350_100011934356 [0,2,0,0,0,0|2,0,0]=4 8974 B15R1.702 Cc1cc(cc(c1OCC(F)F)C)C#N 7a_100000189350_100011934356 [0,2,0,0,0,0|2,0,0]=4 8975 B15R1.702 Cc1cc(cc(c1OCC(F)F)C)CO 34a_100000189000_100011934356 [0,2,0,0,0,0|2,0,0]=4 8976 B15R1.702 Cc1cc(cc(c1OCC(F)F)C)CO 7a_100000189000_100011934356 [0,2,0,0,0,0|2,0,0]=4 8977 B15R1.702 Cc1cc(cc(c1OCC(F)F)C)N=O 34a_100000703954_100011934356 [0,2,0,0,0,0|2,0,0]=4 8978 B15R1.702 Cc1cc(cc(c1OCC(F)F)C)N=O 7a_100000703954_100011934356 [0,2,0,0,0,0|2,0,0]=4 8979 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)C)C#N 34a_100000189350_100009817552 [0,2,0,0,0,0|1,0,0]=3 8980 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)C)C#N 7a_100000189350_100009817552 [0,2,0,0,0,0|1,0,0]=3 8981 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)C)CO 34a_100000189000_100009817552 [0,2,0,0,0,0|1,0,0]=3 8982 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)C)CO 7a_100000189000_100009817552 [0,2,0,0,0,0|1,0,0]=3 8983 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)C)N=O 34a_100000703954_100009817552 [0,2,0,0,0,0|1,0,0]=3 8984 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)C)N=O 7a_100000703954_100009817552 [0,2,0,0,0,0|1,0,0]=3 8985 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)Cl)C#N 34a_200000089643_100009817552 [0,2,0,0,0,0|2,0,0]=4 8986 B15R1.702 Cc1cc(cc(c1OC[C@@H](C)O)Cl)C#N 7a_200000089643_100009817552 [0,2,0,0,0,0|2,0,0]=4 8987 B15R1.702 Cc1cc(cc(c1SCC(C)C)C)C#N 62a_100000210624_100000707521 [0,2,0,0,0,0|1,1,0]=4 8988 B15R1.702 Cc1cc(cc(c1SCC(C)C)C)C=O 62a_100000210624_100012353953 [0,2,0,0,0,0|1,1,0]=4 8989 B15R1.702 Cc1cc(cc(c1SCC(C)C)C)C=O 62a_100012353953_100000210760 [0,2,0,0,0,0|1,1,0]=4 8990 B15R1.702 Cc1cc(cc(c1SCC(C)C)C)CO 62a_100000210624_100012339607 [0,2,0,0,0,0|1,1,0]=4 8991 B15R1.702 Cc1cc(cc(c1SCC(C)C)C)CO 62a_100012339607_100000210760 [0,2,0,0,0,0|1,1,0]=4 8992 B15R1.702 Cc1cc(cc(c1SCC(C)O)C)C#N 62a_100011218427_100000707521 [0,2,0,0,0,0|1,1,0]=4 8993 B15R1.702 Cc1cc(cc(c1SCC(C)O)C)C=O 62a_100011218427_100012353953 [0,2,0,0,0,0|1,1,0]=4 8994 B15R1.702 Cc1cc(cc(c1SCC(C)O)C)C=O 62a_100012353953_100011218427 [0,2,0,0,0,0|1,1,0]=4 8995 B15R1.702 Cc1cc(cc(c1SCC(C)O)C)CO 62a_100011218427_100012339607 [0,2,0,0,0,0|1,1,0]=4 8996 B15R1.702 Cc1cc(cc(c1SCC(C)O)C)CO 62a_100012339607_100011218427 [0,2,0,0,0,0|1,1,0]=4 8997 B15R1.702 Cc1cc(cc(c1SC[C@@H](C)O)C)C#N 62a_100009817552_100000707521 [0,2,0,0,0,0|1,1,0]=4 8998 B15R1.702 Cc1cc(cc(c1SC[C@@H](C)O)C)C=O 62a_100009817552_100012353953 [0,2,0,0,0,0|1,1,0]=4 8999 B15R1.702 Cc1cc(cc(c1SC[C@@H](C)O)C)C=O 62a_100012353953_100009817552 [0,2,0,0,0,0|1,1,0]=4 9000 B15R1.702 Cc1cc(cc(c1SC[C@@H](C)O)C)CO 62a_100009817552_100012339607 [0,2,0,0,0,0|1,1,0]=4 9001 B15R1.702 Cc1cc(cc(c1SC[C@@H](C)O)C)CO 62a_100012339607_100009817552 [0,2,0,0,0,0|1,1,0]=4 9002 B15R1.3552 CC(=O)C(C)Oc1c(cc(cc1C)Br)C 7a_100000187306_100000179758 [0,2,0,0,0,0|1,0,1]=4 9003 B15R1.3552 CC(=O)C(C)Oc1c(cc(cc1C)C)C 7a_100000212074_100000179758 [0,2,0,0,0,0|1,0,1]=4 9004 B15R1.3552 CC(=O)C(C)Oc1c(cc(cc1C)Cl)C 7a_100000211519_100000179758 [0,2,0,0,0,0|1,0,1]=4 9005 B15R1.3552 CC(=O)C(C)Oc1c(cc(cc1C)F)C 7a_100000081862_100000179758 [0,2,0,0,0,0|1,0,1]=4 9006 B15R1.3552 CC(=O)C(C)Oc1c(cc(cc1C)I)C 7a_100011216129_100000179758 [0,2,0,0,0,0|1,0,1]=4 9007 B15R1.3552 CC(=O)C(C)Oc1c(cc(cc1C)N)C 7a_100000703291_100000179758 [0,2,0,0,0,0|1,0,1]=4 9008 B15R1.3552 Cc1cc(c(c(c1)C)OC(C)C(=O)N)C 34a_100000212074_100000702099 [0,2,0,0,0,0|1,0,1]=4 9009 B15R1.3552 Cc1cc(c(c(c1)C)OC(C)C(=O)N)C 7a_100000212074_100000702099 [0,2,0,0,0,0|1,0,1]=4 9010 B15R1.3552 Cc1cc(c(c(c1)C)OC(F)C(=O)N)C 34a_100000212074_100009813875 [0,2,0,0,0,0|1,0,1]=4 9011 B15R1.3552 Cc1cc(c(c(c1)C)OC(F)C(=O)N)C 7a_100000212074_100009813875 [0,2,0,0,0,0|1,0,1]=4 9012 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)Br 34a_100000187306_100000702099 [0,2,0,0,0,0|1,0,1]=4 9013 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)Br 7a_100000187306_100000702099 [0,2,0,0,0,0|1,0,1]=4 9014 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)Cl 34a_100000211519_100000702099 [0,2,0,0,0,0|1,0,1]=4 9015 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)Cl 7a_100000211519_100000702099 [0,2,0,0,0,0|1,0,1]=4 9016 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)F 34a_100000081862_100000702099 [0,2,0,0,0,0|1,0,1]=4 9017 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)F 7a_100000081862_100000702099 [0,2,0,0,0,0|1,0,1]=4 9018 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)I 34a_100011216129_100000702099 [0,2,0,0,0,0|1,0,1]=4 9019 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)I 7a_100011216129_100000702099 [0,2,0,0,0,0|1,0,1]=4 9020 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)N 34a_100000703291_100000702099 [0,2,0,0,0,0|1,0,1]=4 9021 B15R1.3552 Cc1cc(cc(c1OC(C)C(=O)N)C)N 7a_100000703291_100000702099 [0,2,0,0,0,0|1,0,1]=4 9022 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)Br 34a_100000187306_100009813875 [0,2,0,0,0,0|1,0,1]=4 9023 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)Br 7a_100000187306_100009813875 [0,2,0,0,0,0|1,0,1]=4 9024 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)Cl 34a_100000211519_100009813875 [0,2,0,0,0,0|1,0,1]=4 9025 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)Cl 7a_100000211519_100009813875 [0,2,0,0,0,0|1,0,1]=4 9026 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)F 34a_100000081862_100009813875 [0,2,0,0,0,0|1,0,1]=4 9027 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)F 7a_100000081862_100009813875 [0,2,0,0,0,0|1,0,1]=4 9028 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)I 34a_100011216129_100009813875 [0,2,0,0,0,0|1,0,1]=4 9029 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)I 7a_100011216129_100009813875 [0,2,0,0,0,0|1,0,1]=4 9030 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)N 34a_100000703291_100009813875 [0,2,0,0,0,0|1,0,1]=4 9031 B15R1.3552 Cc1cc(cc(c1OC(F)C(=O)N)C)N 7a_100000703291_100009813875 [0,2,0,0,0,0|1,0,1]=4 9032 B15R1.3553 Cc1cc(c(c(c1)C)C(=O)CC(C)C)C 1458a_100000211658_100000210624 [0,2,0,0,0,0|2,0,0]=4 9033 B15R1.3553 Cc1cc(c(c(c1)C)C(=O)CC(C)O)C 1458a_100000211658_100011218427 [0,2,0,0,0,0|2,0,0]=4 9034 B15R1.3553 Cc1cc(c(c(c1)C)N(C)CC(C)C)C 2230a_200011806176_100000210760 [0,2,0,0,0,0|2,0,0]=4 9035 B15R1.3553 Cc1cc(c(c(c1)C)N(C)CC(C)C)C 269982a_200011806176_100000210624 [0,2,0,0,0,0|2,0,0]=4 9036 B15R1.3553 Cc1cc(c(c(c1)C)N(C)CC(C)C)C 34a_200011806176_100000210624 [0,2,0,0,0,0|2,0,0]=4 9037 B15R1.3553 Cc1cc(c(c(c1)C)N(C)CC(C)O)C 2230a_200011806176_100011218427 [0,2,0,0,0,0|2,0,0]=4 9038 B15R1.3553 Cc1cc(c(c(c1)C)N(C)CC(C)O)C 269982a_200011806176_100011218427 [0,2,0,0,0,0|2,0,0]=4 9039 B15R1.3553 Cc1cc(c(c(c1)C)N(C)CC(C)O)C 34a_200011806176_100011218427 [0,2,0,0,0,0|2,0,0]=4 9040 B15R1.3553 Cc1cc(c(c(c1)C)N(C)C[C@@H](C)O)C 2230a_200011806176_100009817552 [0,2,0,0,0,0|2,0,0]=4 9041 B15R1.3553 Cc1cc(c(c(c1)C)N(C)C[C@@H](C)O)C 269982a_200011806176_100009817552 [0,2,0,0,0,0|2,0,0]=4 9042 B15R1.3553 Cc1cc(c(c(c1)C)N(C)C[C@@H](C)O)C 34a_200011806176_100009817552 [0,2,0,0,0,0|2,0,0]=4 9043 B15R1.3553 Cc1cc(c(c(c1)C)[C@@H](N)CC(C)C)C 271570a_100015190218_100011204320 [0,2,0,0,0,0|2,0,0]=4 9044 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)C)C)Br 1458a_100000739581_100000210624 [0,2,0,0,0,0|2,0,0]=4 9045 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)C)C)Cl 1458a_100000088873_100000210624 [0,2,0,0,0,0|2,0,0]=4 9046 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)C)C)F 1458a_100012017201_100000210624 [0,2,0,0,0,0|2,0,0]=4 9047 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)C)C)O 1458a_100000066486_100000210624 [0,2,0,0,0,0|2,0,0]=4 9048 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)O)C)Br 1458a_100000739581_100011218427 [0,2,0,0,0,0|2,0,0]=4 9049 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)O)C)Cl 1458a_100000088873_100011218427 [0,2,0,0,0,0|2,0,0]=4 9050 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)O)C)F 1458a_100012017201_100011218427 [0,2,0,0,0,0|2,0,0]=4 9051 B15R1.3553 Cc1cc(cc(c1C(=O)CC(C)O)C)O 1458a_100000066486_100011218427 [0,2,0,0,0,0|2,0,0]=4 9052 B15R1.3553 Cc1cc(cc(c1[C@@H](N)CC(C)C)C)Br 271570a_100015190218_100009814048 [0,2,0,0,0,0|2,0,0]=4 9053 B15R1.3553 Cc1cc(cc(c1[C@@H](N)CC(C)C)C)Cl 271570a_100015190218_100010244930 [0,2,0,0,0,0|2,0,0]=4 9054 B15R1.3553 Cc1cc(cc(c1[C@@H](N)CC(C)C)C)F 271570a_100015190218_100012356666 [0,2,0,0,0,0|2,0,0]=4 9055 B15R1.3553 Cc1cc(cc(c1[C@@H](N)CC(C)C)C)O 271570a_100015190218_100000243743 [0,2,0,0,0,0|2,0,0]=4 9056 B15R1.25367 C=C(C)COc1c(cc(c(c1C)C)Br)C 34a_200012339818_100000748629 [0,2,0,0,0,0|1,0,1]=4 9057 B15R1.25367 C=C(C)COc1c(cc(c(c1C)C)Br)C 7a_200012339818_100000748629 [0,2,0,0,0,0|1,0,1]=4 9058 B15R1.25367 Cc1cc(c(c(c1Br)C)NCC(C)C)C 2230a_100011215665_100000210760 [0,2,0,0,0,0|2,0,0]=4 9059 B15R1.25367 Cc1cc(c(c(c1Br)C)NCC(C)C)C 34a_100011215665_100000210624 [0,2,0,0,0,0|2,0,0]=4 9060 B15R1.25367 Cc1cc(c(c(c1Br)C)NCC(C)C)C 7a_100011215665_100000210760 [0,2,0,0,0,0|2,0,0]=4 9061 B15R1.25367 Cc1cc(c(c(c1Br)C)NCC(C)O)C 2230a_100011215665_100011218427 [0,2,0,0,0,0|2,0,0]=4 9062 B15R1.25367 Cc1cc(c(c(c1Br)C)NCC(C)O)C 34a_100011215665_100011218427 [0,2,0,0,0,0|2,0,0]=4 9063 B15R1.25367 Cc1cc(c(c(c1Br)C)NCC(C)O)C 7a_100011215665_100011218427 [0,2,0,0,0,0|2,0,0]=4 9064 B15R1.25367 Cc1cc(c(c(c1Br)C)NC[C@@H](C)O)C 2230a_100011215665_100009817552 [0,2,0,0,0,0|2,0,0]=4 9065 B15R1.25367 Cc1cc(c(c(c1Br)C)NC[C@@H](C)O)C 34a_100011215665_100009817552 [0,2,0,0,0,0|2,0,0]=4 9066 B15R1.25367 Cc1cc(c(c(c1Br)C)NC[C@@H](C)O)C 7a_100011215665_100009817552 [0,2,0,0,0,0|2,0,0]=4 9067 B15R1.25367 Cc1cc(c(c(c1F)C)SCC(C)C)C 62a_100000210624_100010738083 [0,2,0,0,0,0|1,1,0]=4 9068 B15R1.25367 Cc1cc(c(c(c1F)C)SCC(C)C)C 62a_100010738083_100000210760 [0,2,0,0,0,0|1,1,0]=4 9069 B15R1.25367 Cc1cc(c(c(c1F)C)SCC(C)O)C 62a_100010738083_100011218427 [0,2,0,0,0,0|1,1,0]=4 9070 B15R1.25367 Cc1cc(c(c(c1F)C)SCC(C)O)C 62a_100011218427_100010738083 [0,2,0,0,0,0|1,1,0]=4 9071 B15R1.25367 Cc1cc(c(c(c1F)C)SC[C@@H](C)O)C 62a_100009817552_100010738083 [0,2,0,0,0,0|1,1,0]=4 9072 B15R1.25367 Cc1cc(c(c(c1F)C)SC[C@@H](C)O)C 62a_100010738083_100009817552 [0,2,0,0,0,0|1,1,0]=4 9073 B15R1.25367 Cc1cc(c(c(c1N)C)SCC(C)C)C 62a_100000210624_100011215665 [0,2,0,0,0,0|1,1,0]=4 9074 B15R1.25367 Cc1cc(c(c(c1N)C)SCC(C)C)C 62a_100011215665_100000210760 [0,2,0,0,0,0|1,1,0]=4 9075 B15R1.25367 Cc1cc(c(c(c1N)C)SCC(C)O)C 62a_100011215665_100011218427 [0,2,0,0,0,0|1,1,0]=4 9076 B15R1.25367 Cc1cc(c(c(c1N)C)SCC(C)O)C 62a_100011218427_100011215665 [0,2,0,0,0,0|1,1,0]=4 9077 B15R1.25367 Cc1cc(c(c(c1N)C)SC[C@@H](C)O)C 62a_100009817552_100011215665 [0,2,0,0,0,0|1,1,0]=4 9078 B15R1.25367 Cc1cc(c(c(c1N)C)SC[C@@H](C)O)C 62a_100011215665_100009817552 [0,2,0,0,0,0|1,1,0]=4 9079 B15R1.25367 Cc1cc(c(c(c1OCC(=O)N)C)C)Br 34a_200012339818_100000187820 [0,2,0,0,0,0|1,0,1]=4 9080 B15R1.25367 Cc1cc(c(c(c1OCC(=O)N)C)C)Br 7a_200012339818_100000187820 [0,2,0,0,0,0|1,0,1]=4 9081 B15R1.25367 Cc1cc(c(c(c1OCC(C)C)C)C)Br 34a_200012339818_100000210624 [0,2,0,0,0,0|1,0,0]=3 9082 B15R1.25367 Cc1cc(c(c(c1OCC(C)C)C)C)Br 7a_200012339818_100000210760 [0,2,0,0,0,0|1,0,0]=3 9083 B15R1.25367 Cc1cc(c(c(c1OCC(C)O)C)C)Br 34a_200012339818_100011218427 [0,2,0,0,0,0|1,0,0]=3 9084 B15R1.25367 Cc1cc(c(c(c1OCC(C)O)C)C)Br 7a_200012339818_100011218427 [0,2,0,0,0,0|1,0,0]=3 9085 B15R1.25367 Cc1cc(c(c(c1OCC(F)F)C)C)Br 34a_200012339818_100011934356 [0,2,0,0,0,0|2,0,0]=4 9086 B15R1.25367 Cc1cc(c(c(c1OCC(F)F)C)C)Br 7a_200012339818_100011934356 [0,2,0,0,0,0|2,0,0]=4 9087 B15R1.25367 Cc1cc(c(c(c1OC[C@@H](C)O)C)C)Br 34a_200012339818_100009817552 [0,2,0,0,0,0|1,0,0]=3 9088 B15R1.25367 Cc1cc(c(c(c1OC[C@@H](C)O)C)C)Br 7a_200012339818_100009817552 [0,2,0,0,0,0|1,0,0]=3 9089 B15R1.25367 Cc1cc(c(c(c1SCC(C)C)C)C)O 62a_100000210624_100000730119 [0,2,0,0,0,0|1,1,0]=4 9090 B15R1.25367 Cc1cc(c(c(c1SCC(C)C)C)C)O 62a_100000730119_100000210760 [0,2,0,0,0,0|1,1,0]=4 9091 B15R1.25367 Cc1cc(c(c(c1SCC(C)O)C)C)O 62a_100000730119_100011218427 [0,2,0,0,0,0|1,1,0]=4 9092 B15R1.25367 Cc1cc(c(c(c1SCC(C)O)C)C)O 62a_100011218427_100000730119 [0,2,0,0,0,0|1,1,0]=4 9093 B15R1.25367 Cc1cc(c(c(c1SC[C@@H](C)O)C)C)O 62a_100000730119_100009817552 [0,2,0,0,0,0|1,1,0]=4 9094 B15R1.25367 Cc1cc(c(c(c1SC[C@@H](C)O)C)C)O 62a_100009817552_100000730119 [0,2,0,0,0,0|1,1,0]=4 9095 B15R1.25388 Cc1cc(c(c(c1)Br)OCC(C)(C)C)C 34a_100011934984_100011219605 [0,2,0,0,0,0|2,0,0]=4 9096 B15R1.25388 Cc1cc(c(c(c1)Br)OCC(C)(C)F)C 34a_100011934984_100011997219 [0,2,0,0,0,0|2,0,0]=4 9097 B15R1.25388 Cc1cc(c(c(c1)Br)OCC(C)(C)O)C 34a_100011934984_100000764493 [0,2,0,0,0,0|2,0,0]=4 9098 B15R1.25388 Cc1cc(c(c(c1)Br)OCC(C)(C)O)C 7a_100011934984_100000764493 [0,2,0,0,0,0|2,0,0]=4 9099 B15R1.25388 Cc1cc(c(c(c1)C)NCC(C)(C)C)C 34a_100000210045_100011219605 [0,2,0,0,0,0|2,0,0]=4 9100 B15R1.25388 Cc1cc(c(c(c1)C)NCC(C)(C)F)C 34a_100000210045_100011997219 [0,2,0,0,0,0|2,0,0]=4 9101 B15R1.25388 Cc1cc(c(c(c1)C)NCC(C)(C)O)C 34a_100000210045_100000764493 [0,2,0,0,0,0|2,0,0]=4 9102 B15R1.25388 Cc1cc(c(c(c1)C)NCC(C)(C)O)C 7a_100000210045_100000764493 [0,2,0,0,0,0|2,0,0]=4 9103 B15R1.25388 Cc1cc(c(c(c1)C)OCC(C)(C)C)C 34a_100000212074_100011219605 [0,2,0,0,0,0|1,0,0]=3 9104 B15R1.25388 Cc1cc(c(c(c1)C)OCC(C)(C)F)C 34a_100000212074_100011997219 [0,2,0,0,0,0|1,0,0]=3 9105 B15R1.25388 Cc1cc(c(c(c1)C)OCC(C)(C)O)C 34a_100000212074_100000764493 [0,2,0,0,0,0|1,0,0]=3 9106 B15R1.25388 Cc1cc(c(c(c1)C)OCC(C)(C)O)C 7a_100000212074_100000764493 [0,2,0,0,0,0|1,0,0]=3 9107 B15R1.25388 Cc1cc(c(c(c1)C)OC[Si](C)(C)C)C 7a_100000212074_100000233785 [0,2,0,0,0,0|1,1,0]=4 9108 B15R1.25388 Cc1cc(c(c(c1)C)SCC(C)(C)C)C 62a_100011204320_100011219605 [0,2,0,0,0,0|1,1,0]=4 9109 B15R1.25388 Cc1cc(c(c(c1)C)SCC(C)(C)C)C 62a_100011219605_100011204320 [0,2,0,0,0,0|1,1,0]=4 9110 B15R1.25388 Cc1cc(c(c(c1)C)SCC(C)(C)F)C 62a_100011204320_100011997219 [0,2,0,0,0,0|1,1,0]=4 9111 B15R1.25388 Cc1cc(c(c(c1)C)SCC(C)(C)F)C 62a_100011997219_100011204320 [0,2,0,0,0,0|1,1,0]=4 9112 B15R1.25388 Cc1cc(c(c(c1)C)SCC(C)(C)O)C 62a_100000764493_100011204320 [0,2,0,0,0,0|1,1,0]=4 9113 B15R1.25388 Cc1cc(c(c(c1)C)SCC(C)(C)O)C 62a_100011204320_100000764493 [0,2,0,0,0,0|1,1,0]=4 9114 B15R1.25388 Cc1cc(c(c(c1)N)OCC(C)(C)C)C 34a_100011216242_100011219605 [0,2,0,0,0,0|2,0,0]=4 9115 B15R1.25388 Cc1cc(c(c(c1)N)OCC(C)(C)F)C 34a_100011216242_100011997219 [0,2,0,0,0,0|2,0,0]=4 9116 B15R1.25388 Cc1cc(c(c(c1)N)OCC(C)(C)O)C 34a_100011216242_100000764493 [0,2,0,0,0,0|2,0,0]=4 9117 B15R1.25388 Cc1cc(c(c(c1)N)OCC(C)(C)O)C 7a_100011216242_100000764493 [0,2,0,0,0,0|2,0,0]=4 9118 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)C)C)Br 34a_100000737279_100011219605 [0,2,0,0,0,0|2,0,0]=4 9119 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)C)C)Cl 34a_100000692879_100011219605 [0,2,0,0,0,0|2,0,0]=4 9120 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)C)C)F 34a_100011290887_100011219605 [0,2,0,0,0,0|2,0,0]=4 9121 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)C)C)O 34a_100011934200_100011219605 [0,2,0,0,0,0|2,0,0]=4 9122 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)F)C)Br 34a_100000737279_100011997219 [0,2,0,0,0,0|2,0,0]=4 9123 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)F)C)Cl 34a_100000692879_100011997219 [0,2,0,0,0,0|2,0,0]=4 9124 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)F)C)F 34a_100011290887_100011997219 [0,2,0,0,0,0|2,0,0]=4 9125 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)F)C)O 34a_100011934200_100011997219 [0,2,0,0,0,0|2,0,0]=4 9126 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)Br 34a_100000737279_100000764493 [0,2,0,0,0,0|2,0,0]=4 9127 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)Br 7a_100000737279_100000764493 [0,2,0,0,0,0|2,0,0]=4 9128 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)Cl 34a_100000692879_100000764493 [0,2,0,0,0,0|2,0,0]=4 9129 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)Cl 7a_100000692879_100000764493 [0,2,0,0,0,0|2,0,0]=4 9130 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)F 34a_100011290887_100000764493 [0,2,0,0,0,0|2,0,0]=4 9131 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)F 7a_100011290887_100000764493 [0,2,0,0,0,0|2,0,0]=4 9132 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)I 7a_100011356821_100000764493 [0,2,0,0,0,0|2,0,0]=4 9133 B15R1.25388 Cc1cc(cc(c1NCC(C)(C)O)C)O 34a_100011934200_100000764493 [0,2,0,0,0,0|2,0,0]=4 9134 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)Br)Br 34a_100000186369_100011219605 [0,2,0,0,0,0|2,0,0]=4 9135 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)Br)Cl 34a_100012337756_100011219605 [0,2,0,0,0,0|2,0,0]=4 9136 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)Br)I 34a_100010982682_100011219605 [0,2,0,0,0,0|2,0,0]=4 9137 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)Br)N 34a_100010064301_100011219605 [0,2,0,0,0,0|2,0,0]=4 9138 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)C)Br 34a_100000187306_100011219605 [0,2,0,0,0,0|1,0,0]=3 9139 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)C)Cl 34a_100000211519_100011219605 [0,2,0,0,0,0|1,0,0]=3 9140 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)C)F 34a_100000081862_100011219605 [0,2,0,0,0,0|1,0,0]=3 9141 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)C)I 34a_100011216129_100011219605 [0,2,0,0,0,0|1,0,0]=3 9142 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)C)N 34a_100000703291_100011219605 [0,2,0,0,0,0|1,0,0]=3 9143 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)Cl)Br 34a_100000211485_100011219605 [0,2,0,0,0,0|2,0,0]=4 9144 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)Cl)Cl 34a_100011218458_100011219605 [0,2,0,0,0,0|2,0,0]=4 9145 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)Cl)I 34a_200015900153_100011219605 [0,2,0,0,0,0|2,0,0]=4 9146 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)I)Cl 34a_100012343667_100011219605 [0,2,0,0,0,0|2,0,0]=4 9147 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)N)Br 34a_100011825904_100011219605 [0,2,0,0,0,0|2,0,0]=4 9148 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)C)N)F 34a_100000130126_100011219605 [0,2,0,0,0,0|2,0,0]=4 9149 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)Br)Br 34a_100000186369_100011997219 [0,2,0,0,0,0|2,0,0]=4 9150 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)Br)Cl 34a_100012337756_100011997219 [0,2,0,0,0,0|2,0,0]=4 9151 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)Br)I 34a_100010982682_100011997219 [0,2,0,0,0,0|2,0,0]=4 9152 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)Br)N 34a_100010064301_100011997219 [0,2,0,0,0,0|2,0,0]=4 9153 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)C)Br 34a_100000187306_100011997219 [0,2,0,0,0,0|1,0,0]=3 9154 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)C)Cl 34a_100000211519_100011997219 [0,2,0,0,0,0|1,0,0]=3 9155 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)C)F 34a_100000081862_100011997219 [0,2,0,0,0,0|1,0,0]=3 9156 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)C)I 34a_100011216129_100011997219 [0,2,0,0,0,0|1,0,0]=3 9157 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)C)N 34a_100000703291_100011997219 [0,2,0,0,0,0|1,0,0]=3 9158 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)Cl)Br 34a_100000211485_100011997219 [0,2,0,0,0,0|2,0,0]=4 9159 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)Cl)Cl 34a_100011218458_100011997219 [0,2,0,0,0,0|2,0,0]=4 9160 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)Cl)I 34a_200015900153_100011997219 [0,2,0,0,0,0|2,0,0]=4 9161 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)I)Cl 34a_100012343667_100011997219 [0,2,0,0,0,0|2,0,0]=4 9162 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)N)Br 34a_100011825904_100011997219 [0,2,0,0,0,0|2,0,0]=4 9163 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)F)N)F 34a_100000130126_100011997219 [0,2,0,0,0,0|2,0,0]=4 9164 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)Br 34a_100000186369_100000764493 [0,2,0,0,0,0|2,0,0]=4 9165 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)Br 7a_100000186369_100000764493 [0,2,0,0,0,0|2,0,0]=4 9166 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)Cl 34a_100012337756_100000764493 [0,2,0,0,0,0|2,0,0]=4 9167 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)Cl 7a_100012337756_100000764493 [0,2,0,0,0,0|2,0,0]=4 9168 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)I 34a_100010982682_100000764493 [0,2,0,0,0,0|2,0,0]=4 9169 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)I 7a_100010982682_100000764493 [0,2,0,0,0,0|2,0,0]=4 9170 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)N 34a_100010064301_100000764493 [0,2,0,0,0,0|2,0,0]=4 9171 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Br)N 7a_100010064301_100000764493 [0,2,0,0,0,0|2,0,0]=4 9172 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)Br 34a_100000187306_100000764493 [0,2,0,0,0,0|1,0,0]=3 9173 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)Br 7a_100000187306_100000764493 [0,2,0,0,0,0|1,0,0]=3 9174 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)Cl 34a_100000211519_100000764493 [0,2,0,0,0,0|1,0,0]=3 9175 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)Cl 7a_100000211519_100000764493 [0,2,0,0,0,0|1,0,0]=3 9176 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)F 34a_100000081862_100000764493 [0,2,0,0,0,0|1,0,0]=3 9177 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)F 7a_100000081862_100000764493 [0,2,0,0,0,0|1,0,0]=3 9178 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)I 34a_100011216129_100000764493 [0,2,0,0,0,0|1,0,0]=3 9179 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)I 7a_100011216129_100000764493 [0,2,0,0,0,0|1,0,0]=3 9180 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)N 34a_100000703291_100000764493 [0,2,0,0,0,0|1,0,0]=3 9181 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)C)N 7a_100000703291_100000764493 [0,2,0,0,0,0|1,0,0]=3 9182 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Cl)Br 34a_100000211485_100000764493 [0,2,0,0,0,0|2,0,0]=4 9183 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Cl)Br 7a_100000211485_100000764493 [0,2,0,0,0,0|2,0,0]=4 9184 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Cl)Cl 34a_100011218458_100000764493 [0,2,0,0,0,0|2,0,0]=4 9185 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Cl)Cl 7a_100011218458_100000764493 [0,2,0,0,0,0|2,0,0]=4 9186 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Cl)I 34a_200015900153_100000764493 [0,2,0,0,0,0|2,0,0]=4 9187 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)Cl)I 7a_200015900153_100000764493 [0,2,0,0,0,0|2,0,0]=4 9188 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)I)Cl 34a_100012343667_100000764493 [0,2,0,0,0,0|2,0,0]=4 9189 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)I)Cl 7a_100012343667_100000764493 [0,2,0,0,0,0|2,0,0]=4 9190 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)N)Br 34a_100011825904_100000764493 [0,2,0,0,0,0|2,0,0]=4 9191 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)N)Br 7a_100011825904_100000764493 [0,2,0,0,0,0|2,0,0]=4 9192 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)N)F 34a_100000130126_100000764493 [0,2,0,0,0,0|2,0,0]=4 9193 B15R1.25388 Cc1cc(cc(c1OCC(C)(C)O)N)F 7a_100000130126_100000764493 [0,2,0,0,0,0|2,0,0]=4 9194 B15R1.25388 Cc1cc(cc(c1OC[Si](C)(C)C)C)Br 7a_100000187306_100000233785 [0,2,0,0,0,0|1,1,0]=4 9195 B15R1.25388 Cc1cc(cc(c1OC[Si](C)(C)C)C)Cl 7a_100000211519_100000233785 [0,2,0,0,0,0|1,1,0]=4 9196 B15R1.25388 Cc1cc(cc(c1OC[Si](C)(C)C)C)F 7a_100000081862_100000233785 [0,2,0,0,0,0|1,1,0]=4 9197 B15R1.25388 Cc1cc(cc(c1OC[Si](C)(C)C)C)I 7a_100011216129_100000233785 [0,2,0,0,0,0|1,1,0]=4 9198 B15R1.25388 Cc1cc(cc(c1OC[Si](C)(C)C)C)N 7a_100000703291_100000233785 [0,2,0,0,0,0|1,1,0]=4 9199 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)Br 62a_100009814048_100011219605 [0,2,0,0,0,0|1,1,0]=4 9200 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)Br 62a_100011219605_100009814048 [0,2,0,0,0,0|1,1,0]=4 9201 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)Cl 62a_100010244930_100011219605 [0,2,0,0,0,0|1,1,0]=4 9202 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)Cl 62a_100011219605_100010244930 [0,2,0,0,0,0|1,1,0]=4 9203 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)F 62a_100011219605_100012356666 [0,2,0,0,0,0|1,1,0]=4 9204 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)F 62a_100012356666_100011219605 [0,2,0,0,0,0|1,1,0]=4 9205 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)N 62a_100000215964_100011219605 [0,2,0,0,0,0|1,1,0]=4 9206 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)N 62a_100011219605_100000215964 [0,2,0,0,0,0|1,1,0]=4 9207 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)O 62a_100000243743_100011219605 [0,2,0,0,0,0|1,1,0]=4 9208 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)C)C)O 62a_100011219605_100000243743 [0,2,0,0,0,0|1,1,0]=4 9209 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)Br 62a_100009814048_100011997219 [0,2,0,0,0,0|1,1,0]=4 9210 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)Br 62a_100011997219_100009814048 [0,2,0,0,0,0|1,1,0]=4 9211 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)Cl 62a_100010244930_100011997219 [0,2,0,0,0,0|1,1,0]=4 9212 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)Cl 62a_100011997219_100010244930 [0,2,0,0,0,0|1,1,0]=4 9213 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)F 62a_100011997219_100012356666 [0,2,0,0,0,0|1,1,0]=4 9214 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)F 62a_100012356666_100011997219 [0,2,0,0,0,0|1,1,0]=4 9215 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)N 62a_100000215964_100011997219 [0,2,0,0,0,0|1,1,0]=4 9216 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)N 62a_100011997219_100000215964 [0,2,0,0,0,0|1,1,0]=4 9217 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)O 62a_100000243743_100011997219 [0,2,0,0,0,0|1,1,0]=4 9218 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)F)C)O 62a_100011997219_100000243743 [0,2,0,0,0,0|1,1,0]=4 9219 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)Br 62a_100000764493_100009814048 [0,2,0,0,0,0|1,1,0]=4 9220 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)Br 62a_100009814048_100000764493 [0,2,0,0,0,0|1,1,0]=4 9221 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)Cl 62a_100000764493_100010244930 [0,2,0,0,0,0|1,1,0]=4 9222 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)Cl 62a_100010244930_100000764493 [0,2,0,0,0,0|1,1,0]=4 9223 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)F 62a_100000764493_100012356666 [0,2,0,0,0,0|1,1,0]=4 9224 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)F 62a_100012356666_100000764493 [0,2,0,0,0,0|1,1,0]=4 9225 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)N 62a_100000215964_100000764493 [0,2,0,0,0,0|1,1,0]=4 9226 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)N 62a_100000764493_100000215964 [0,2,0,0,0,0|1,1,0]=4 9227 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)O 62a_100000243743_100000764493 [0,2,0,0,0,0|1,1,0]=4 9228 B15R1.25388 Cc1cc(cc(c1SCC(C)(C)O)C)O 62a_100000764493_100000243743 [0,2,0,0,0,0|1,1,0]=4 9229 B15R1.38791 C=CC(O)COc1c(cc(cc1C)Br)C 34a_100000187306_100000730141 [0,2,0,0,0,0|1,0,1]=4 9230 B15R1.38791 C=CC(O)COc1c(cc(cc1C)Br)C 7a_100000187306_100000730141 [0,2,0,0,0,0|1,0,1]=4 9231 B15R1.38791 C=CC(O)COc1c(cc(cc1C)C)C 34a_100000212074_100000730141 [0,2,0,0,0,0|1,0,1]=4 9232 B15R1.38791 C=CC(O)COc1c(cc(cc1C)C)C 7a_100000212074_100000730141 [0,2,0,0,0,0|1,0,1]=4 9233 B15R1.38791 C=CC(O)COc1c(cc(cc1C)Cl)C 34a_100000211519_100000730141 [0,2,0,0,0,0|1,0,1]=4 9234 B15R1.38791 C=CC(O)COc1c(cc(cc1C)Cl)C 7a_100000211519_100000730141 [0,2,0,0,0,0|1,0,1]=4 9235 B15R1.38791 C=CC(O)COc1c(cc(cc1C)F)C 34a_100000081862_100000730141 [0,2,0,0,0,0|1,0,1]=4 9236 B15R1.38791 C=CC(O)COc1c(cc(cc1C)F)C 7a_100000081862_100000730141 [0,2,0,0,0,0|1,0,1]=4 9237 B15R1.38791 C=CC(O)COc1c(cc(cc1C)I)C 34a_100011216129_100000730141 [0,2,0,0,0,0|1,0,1]=4 9238 B15R1.38791 C=CC(O)COc1c(cc(cc1C)I)C 7a_100011216129_100000730141 [0,2,0,0,0,0|1,0,1]=4 9239 B15R1.38791 C=CC(O)COc1c(cc(cc1C)N)C 34a_100000703291_100000730141 [0,2,0,0,0,0|1,0,1]=4 9240 B15R1.38791 C=CC(O)COc1c(cc(cc1C)N)C 7a_100000703291_100000730141 [0,2,0,0,0,0|1,0,1]=4 9241 B15R1.38791 CCC(=O)COc1c(cc(cc1C)Br)C 1458a_100009812269_100000210202 [0,2,0,0,0,0|1,0,1]=4 9242 B15R1.38791 CCC(=O)COc1c(cc(cc1C)Br)C 7a_100000187306_100000747405 [0,2,0,0,0,0|1,0,1]=4 9243 B15R1.38791 CCC(=O)COc1c(cc(cc1C)C)C 1458a_200000183695_100000210202 [0,2,0,0,0,0|1,0,1]=4 9244 B15R1.38791 CCC(=O)COc1c(cc(cc1C)C)C 7a_100000212074_100000747405 [0,2,0,0,0,0|1,0,1]=4 9245 B15R1.38791 CCC(=O)COc1c(cc(cc1C)Cl)C 1458a_100000183735_100000210202 [0,2,0,0,0,0|1,0,1]=4 9246 B15R1.38791 CCC(=O)COc1c(cc(cc1C)Cl)C 7a_100000211519_100000747405 [0,2,0,0,0,0|1,0,1]=4 9247 B15R1.38791 CCC(=O)COc1c(cc(cc1C)F)C 7a_100000081862_100000747405 [0,2,0,0,0,0|1,0,1]=4 9248 B15R1.38791 CCC(=O)COc1c(cc(cc1C)I)C 7a_100011216129_100000747405 [0,2,0,0,0,0|1,0,1]=4 9249 B15R1.38791 CCC(=O)COc1c(cc(cc1C)N)C 7a_100000703291_100000747405 [0,2,0,0,0,0|1,0,1]=4 9250 B15R1.38791 CCC(C)CNc1c(cc(cc1C)Br)C 34a_100000737279_100000748023 [0,2,0,0,0,0|2,0,0]=4 9251 B15R1.38791 CCC(C)CNc1c(cc(cc1C)Br)C 7a_100000737279_100000748023 [0,2,0,0,0,0|2,0,0]=4 9252 B15R1.38791 CCC(C)CNc1c(cc(cc1C)C)C 34a_100000210045_100000748023 [0,2,0,0,0,0|2,0,0]=4 9253 B15R1.38791 CCC(C)CNc1c(cc(cc1C)C)C 7a_100000210045_100000748023 [0,2,0,0,0,0|2,0,0]=4 9254 B15R1.38791 CCC(C)CNc1c(cc(cc1C)Cl)C 34a_100000692879_100000748023 [0,2,0,0,0,0|2,0,0]=4 9255 B15R1.38791 CCC(C)CNc1c(cc(cc1C)Cl)C 7a_100000692879_100000748023 [0,2,0,0,0,0|2,0,0]=4 9256 B15R1.38791 CCC(C)CNc1c(cc(cc1C)F)C 34a_100011290887_100000748023 [0,2,0,0,0,0|2,0,0]=4 9257 B15R1.38791 CCC(C)CNc1c(cc(cc1C)F)C 7a_100011290887_100000748023 [0,2,0,0,0,0|2,0,0]=4 9258 B15R1.38791 CCC(C)CNc1c(cc(cc1C)I)C 7a_100011356821_100000748023 [0,2,0,0,0,0|2,0,0]=4 9259 B15R1.38791 CCC(C)CNc1c(cc(cc1C)O)C 34a_100011934200_100000748023 [0,2,0,0,0,0|2,0,0]=4 9260 B15R1.38791 CCC(C)COc1c(cc(cc1Br)Br)C 34a_100000186369_100000748023 [0,2,0,0,0,0|2,0,0]=4 9261 B15R1.38791 CCC(C)COc1c(cc(cc1Br)Br)C 7a_100000186369_100000748023 [0,2,0,0,0,0|2,0,0]=4 9262 B15R1.38791 CCC(C)COc1c(cc(cc1Br)C)C 34a_100011934984_100000748023 [0,2,0,0,0,0|2,0,0]=4 9263 B15R1.38791 CCC(C)COc1c(cc(cc1Br)C)C 7a_100011934984_100000748023 [0,2,0,0,0,0|2,0,0]=4 9264 B15R1.38791 CCC(C)COc1c(cc(cc1Br)Cl)C 34a_100012337756_100000748023 [0,2,0,0,0,0|2,0,0]=4 9265 B15R1.38791 CCC(C)COc1c(cc(cc1Br)Cl)C 7a_100012337756_100000748023 [0,2,0,0,0,0|2,0,0]=4 9266 B15R1.38791 CCC(C)COc1c(cc(cc1Br)I)C 34a_100010982682_100000748023 [0,2,0,0,0,0|2,0,0]=4 9267 B15R1.38791 CCC(C)COc1c(cc(cc1Br)I)C 7a_100010982682_100000748023 [0,2,0,0,0,0|2,0,0]=4 9268 B15R1.38791 CCC(C)COc1c(cc(cc1Br)N)C 34a_100010064301_100000748023 [0,2,0,0,0,0|2,0,0]=4 9269 B15R1.38791 CCC(C)COc1c(cc(cc1Br)N)C 7a_100010064301_100000748023 [0,2,0,0,0,0|2,0,0]=4 9270 B15R1.38791 CCC(C)COc1c(cc(cc1C)Br)C 34a_100000187306_100000748023 [0,2,0,0,0,0|1,0,0]=3 9271 B15R1.38791 CCC(C)COc1c(cc(cc1C)Br)C 7a_100000187306_100000748023 [0,2,0,0,0,0|1,0,0]=3 9272 B15R1.38791 CCC(C)COc1c(cc(cc1C)C)C 34a_100000212074_100000748023 [0,2,0,0,0,0|1,0,0]=3 9273 B15R1.38791 CCC(C)COc1c(cc(cc1C)C)C 7a_100000212074_100000748023 [0,2,0,0,0,0|1,0,0]=3 9274 B15R1.38791 CCC(C)COc1c(cc(cc1C)Cl)C 34a_100000211519_100000748023 [0,2,0,0,0,0|1,0,0]=3 9275 B15R1.38791 CCC(C)COc1c(cc(cc1C)Cl)C 7a_100000211519_100000748023 [0,2,0,0,0,0|1,0,0]=3 9276 B15R1.38791 CCC(C)COc1c(cc(cc1C)F)C 34a_100000081862_100000748023 [0,2,0,0,0,0|1,0,0]=3 9277 B15R1.38791 CCC(C)COc1c(cc(cc1C)F)C 7a_100000081862_100000748023 [0,2,0,0,0,0|1,0,0]=3 9278 B15R1.38791 CCC(C)COc1c(cc(cc1C)I)C 34a_100011216129_100000748023 [0,2,0,0,0,0|1,0,0]=3 9279 B15R1.38791 CCC(C)COc1c(cc(cc1C)I)C 7a_100011216129_100000748023 [0,2,0,0,0,0|1,0,0]=3 9280 B15R1.38791 CCC(C)COc1c(cc(cc1C)N)C 34a_100000703291_100000748023 [0,2,0,0,0,0|1,0,0]=3 9281 B15R1.38791 CCC(C)COc1c(cc(cc1C)N)C 7a_100000703291_100000748023 [0,2,0,0,0,0|1,0,0]=3 9282 B15R1.38791 CCC(C)COc1c(cc(cc1Cl)Br)C 34a_100000211485_100000748023 [0,2,0,0,0,0|2,0,0]=4 9283 B15R1.38791 CCC(C)COc1c(cc(cc1Cl)Br)C 7a_100000211485_100000748023 [0,2,0,0,0,0|2,0,0]=4 9284 B15R1.38791 CCC(C)COc1c(cc(cc1Cl)Cl)C 34a_100011218458_100000748023 [0,2,0,0,0,0|2,0,0]=4 9285 B15R1.38791 CCC(C)COc1c(cc(cc1Cl)Cl)C 7a_100011218458_100000748023 [0,2,0,0,0,0|2,0,0]=4 9286 B15R1.38791 CCC(C)COc1c(cc(cc1Cl)I)C 34a_200015900153_100000748023 [0,2,0,0,0,0|2,0,0]=4 9287 B15R1.38791 CCC(C)COc1c(cc(cc1Cl)I)C 7a_200015900153_100000748023 [0,2,0,0,0,0|2,0,0]=4 9288 B15R1.38791 CCC(C)COc1c(cc(cc1I)Cl)C 34a_100012343667_100000748023 [0,2,0,0,0,0|2,0,0]=4 9289 B15R1.38791 CCC(C)COc1c(cc(cc1I)Cl)C 7a_100012343667_100000748023 [0,2,0,0,0,0|2,0,0]=4 9290 B15R1.38791 CCC(C)COc1c(cc(cc1N)Br)C 34a_100011825904_100000748023 [0,2,0,0,0,0|2,0,0]=4 9291 B15R1.38791 CCC(C)COc1c(cc(cc1N)Br)C 7a_100011825904_100000748023 [0,2,0,0,0,0|2,0,0]=4 9292 B15R1.38791 CCC(C)COc1c(cc(cc1N)C)C 34a_100011216242_100000748023 [0,2,0,0,0,0|2,0,0]=4 9293 B15R1.38791 CCC(C)COc1c(cc(cc1N)C)C 7a_100011216242_100000748023 [0,2,0,0,0,0|2,0,0]=4 9294 B15R1.38791 CCC(C)COc1c(cc(cc1N)F)C 34a_100000130126_100000748023 [0,2,0,0,0,0|2,0,0]=4 9295 B15R1.38791 CCC(C)COc1c(cc(cc1N)F)C 7a_100000130126_100000748023 [0,2,0,0,0,0|2,0,0]=4 9296 B15R1.38791 CCC(C)CSc1c(cc(cc1C)Br)C 62a_100000748023_100009814048 [0,2,0,0,0,0|1,1,0]=4 9297 B15R1.38791 CCC(C)CSc1c(cc(cc1C)Br)C 62a_100009814048_100000748023 [0,2,0,0,0,0|1,1,0]=4 9298 B15R1.38791 CCC(C)CSc1c(cc(cc1C)C)C 62a_100000748023_100011204320 [0,2,0,0,0,0|1,1,0]=4 9299 B15R1.38791 CCC(C)CSc1c(cc(cc1C)C)C 62a_100011204320_100000748023 [0,2,0,0,0,0|1,1,0]=4 9300 B15R1.38791 CCC(C)CSc1c(cc(cc1C)Cl)C 62a_100000748023_100010244930 [0,2,0,0,0,0|1,1,0]=4 9301 B15R1.38791 CCC(C)CSc1c(cc(cc1C)Cl)C 62a_100010244930_100000748023 [0,2,0,0,0,0|1,1,0]=4 9302 B15R1.38791 CCC(C)CSc1c(cc(cc1C)F)C 62a_100000748023_100012356666 [0,2,0,0,0,0|1,1,0]=4 9303 B15R1.38791 CCC(C)CSc1c(cc(cc1C)F)C 62a_100012356666_100000748023 [0,2,0,0,0,0|1,1,0]=4 9304 B15R1.38791 CCC(C)CSc1c(cc(cc1C)N)C 62a_100000215964_100000748023 [0,2,0,0,0,0|1,1,0]=4 9305 B15R1.38791 CCC(C)CSc1c(cc(cc1C)N)C 62a_100000748023_100000215964 [0,2,0,0,0,0|1,1,0]=4 9306 B15R1.38791 CCC(C)CSc1c(cc(cc1C)O)C 62a_100000243743_100000748023 [0,2,0,0,0,0|1,1,0]=4 9307 B15R1.38791 CCC(C)CSc1c(cc(cc1C)O)C 62a_100000748023_100000243743 [0,2,0,0,0,0|1,1,0]=4 9308 B15R1.38791 CCC(O)CNc1c(cc(cc1C)Br)C 34a_100000737279_100011218378 [0,2,0,0,0,0|2,0,0]=4 9309 B15R1.38791 CCC(O)CNc1c(cc(cc1C)Br)C 7a_100000737279_100011218378 [0,2,0,0,0,0|2,0,0]=4 9310 B15R1.38791 CCC(O)CNc1c(cc(cc1C)C)C 34a_100000210045_100011218378 [0,2,0,0,0,0|2,0,0]=4 9311 B15R1.38791 CCC(O)CNc1c(cc(cc1C)C)C 7a_100000210045_100011218378 [0,2,0,0,0,0|2,0,0]=4 9312 B15R1.38791 CCC(O)CNc1c(cc(cc1C)Cl)C 34a_100000692879_100011218378 [0,2,0,0,0,0|2,0,0]=4 9313 B15R1.38791 CCC(O)CNc1c(cc(cc1C)Cl)C 7a_100000692879_100011218378 [0,2,0,0,0,0|2,0,0]=4 9314 B15R1.38791 CCC(O)CNc1c(cc(cc1C)F)C 34a_100011290887_100011218378 [0,2,0,0,0,0|2,0,0]=4 9315 B15R1.38791 CCC(O)CNc1c(cc(cc1C)F)C 7a_100011290887_100011218378 [0,2,0,0,0,0|2,0,0]=4 9316 B15R1.38791 CCC(O)CNc1c(cc(cc1C)I)C 7a_100011356821_100011218378 [0,2,0,0,0,0|2,0,0]=4 9317 B15R1.38791 CCC(O)CNc1c(cc(cc1C)O)C 34a_100011934200_100011218378 [0,2,0,0,0,0|2,0,0]=4 9318 B15R1.38791 CCC(O)COc1c(cc(cc1Br)Br)C 34a_100000186369_100011218378 [0,2,0,0,0,0|2,0,0]=4 9319 B15R1.38791 CCC(O)COc1c(cc(cc1Br)Br)C 7a_100000186369_100011218378 [0,2,0,0,0,0|2,0,0]=4 9320 B15R1.38791 CCC(O)COc1c(cc(cc1Br)C)C 34a_100011934984_100011218378 [0,2,0,0,0,0|2,0,0]=4 9321 B15R1.38791 CCC(O)COc1c(cc(cc1Br)C)C 7a_100011934984_100011218378 [0,2,0,0,0,0|2,0,0]=4 9322 B15R1.38791 CCC(O)COc1c(cc(cc1Br)Cl)C 34a_100012337756_100011218378 [0,2,0,0,0,0|2,0,0]=4 9323 B15R1.38791 CCC(O)COc1c(cc(cc1Br)Cl)C 7a_100012337756_100011218378 [0,2,0,0,0,0|2,0,0]=4 9324 B15R1.38791 CCC(O)COc1c(cc(cc1Br)I)C 34a_100010982682_100011218378 [0,2,0,0,0,0|2,0,0]=4 9325 B15R1.38791 CCC(O)COc1c(cc(cc1Br)I)C 7a_100010982682_100011218378 [0,2,0,0,0,0|2,0,0]=4 9326 B15R1.38791 CCC(O)COc1c(cc(cc1Br)N)C 34a_100010064301_100011218378 [0,2,0,0,0,0|2,0,0]=4 9327 B15R1.38791 CCC(O)COc1c(cc(cc1Br)N)C 7a_100010064301_100011218378 [0,2,0,0,0,0|2,0,0]=4 9328 B15R1.38791 CCC(O)COc1c(cc(cc1C)Br)C 34a_100000187306_100011218378 [0,2,0,0,0,0|1,0,0]=3 9329 B15R1.38791 CCC(O)COc1c(cc(cc1C)Br)C 7a_100000187306_100011218378 [0,2,0,0,0,0|1,0,0]=3 9330 B15R1.38791 CCC(O)COc1c(cc(cc1C)C)C 34a_100000212074_100011218378 [0,2,0,0,0,0|1,0,0]=3 9331 B15R1.38791 CCC(O)COc1c(cc(cc1C)C)C 7a_100000212074_100011218378 [0,2,0,0,0,0|1,0,0]=3 9332 B15R1.38791 CCC(O)COc1c(cc(cc1C)Cl)C 34a_100000211519_100011218378 [0,2,0,0,0,0|1,0,0]=3 9333 B15R1.38791 CCC(O)COc1c(cc(cc1C)Cl)C 7a_100000211519_100011218378 [0,2,0,0,0,0|1,0,0]=3 9334 B15R1.38791 CCC(O)COc1c(cc(cc1C)F)C 34a_100000081862_100011218378 [0,2,0,0,0,0|1,0,0]=3 9335 B15R1.38791 CCC(O)COc1c(cc(cc1C)F)C 7a_100000081862_100011218378 [0,2,0,0,0,0|1,0,0]=3 9336 B15R1.38791 CCC(O)COc1c(cc(cc1C)I)C 34a_100011216129_100011218378 [0,2,0,0,0,0|1,0,0]=3 9337 B15R1.38791 CCC(O)COc1c(cc(cc1C)I)C 7a_100011216129_100011218378 [0,2,0,0,0,0|1,0,0]=3 9338 B15R1.38791 CCC(O)COc1c(cc(cc1C)N)C 34a_100000703291_100011218378 [0,2,0,0,0,0|1,0,0]=3 9339 B15R1.38791 CCC(O)COc1c(cc(cc1C)N)C 7a_100000703291_100011218378 [0,2,0,0,0,0|1,0,0]=3 9340 B15R1.38791 CCC(O)COc1c(cc(cc1Cl)Br)C 34a_100000211485_100011218378 [0,2,0,0,0,0|2,0,0]=4 9341 B15R1.38791 CCC(O)COc1c(cc(cc1Cl)Br)C 7a_100000211485_100011218378 [0,2,0,0,0,0|2,0,0]=4 9342 B15R1.38791 CCC(O)COc1c(cc(cc1Cl)Cl)C 34a_100011218458_100011218378 [0,2,0,0,0,0|2,0,0]=4 9343 B15R1.38791 CCC(O)COc1c(cc(cc1Cl)Cl)C 7a_100011218458_100011218378 [0,2,0,0,0,0|2,0,0]=4 9344 B15R1.38791 CCC(O)COc1c(cc(cc1Cl)I)C 34a_200015900153_100011218378 [0,2,0,0,0,0|2,0,0]=4 9345 B15R1.38791 CCC(O)COc1c(cc(cc1Cl)I)C 7a_200015900153_100011218378 [0,2,0,0,0,0|2,0,0]=4 9346 B15R1.38791 CCC(O)COc1c(cc(cc1I)Cl)C 34a_100012343667_100011218378 [0,2,0,0,0,0|2,0,0]=4 9347 B15R1.38791 CCC(O)COc1c(cc(cc1I)Cl)C 7a_100012343667_100011218378 [0,2,0,0,0,0|2,0,0]=4 9348 B15R1.38791 CCC(O)COc1c(cc(cc1N)Br)C 34a_100011825904_100011218378 [0,2,0,0,0,0|2,0,0]=4 9349 B15R1.38791 CCC(O)COc1c(cc(cc1N)Br)C 7a_100011825904_100011218378 [0,2,0,0,0,0|2,0,0]=4 9350 B15R1.38791 CCC(O)COc1c(cc(cc1N)C)C 34a_100011216242_100011218378 [0,2,0,0,0,0|2,0,0]=4 9351 B15R1.38791 CCC(O)COc1c(cc(cc1N)C)C 7a_100011216242_100011218378 [0,2,0,0,0,0|2,0,0]=4 9352 B15R1.38791 CCC(O)COc1c(cc(cc1N)F)C 34a_100000130126_100011218378 [0,2,0,0,0,0|2,0,0]=4 9353 B15R1.38791 CCC(O)COc1c(cc(cc1N)F)C 7a_100000130126_100011218378 [0,2,0,0,0,0|2,0,0]=4 9354 B15R1.38791 CCC(O)CSc1c(cc(cc1C)Br)C 62a_100009814048_100011218378 [0,2,0,0,0,0|1,1,0]=4 9355 B15R1.38791 CCC(O)CSc1c(cc(cc1C)Br)C 62a_100011218378_100009814048 [0,2,0,0,0,0|1,1,0]=4 9356 B15R1.38791 CCC(O)CSc1c(cc(cc1C)C)C 62a_100011204320_100011218378 [0,2,0,0,0,0|1,1,0]=4 9357 B15R1.38791 CCC(O)CSc1c(cc(cc1C)C)C 62a_100011218378_100011204320 [0,2,0,0,0,0|1,1,0]=4 9358 B15R1.38791 CCC(O)CSc1c(cc(cc1C)Cl)C 62a_100010244930_100011218378 [0,2,0,0,0,0|1,1,0]=4 9359 B15R1.38791 CCC(O)CSc1c(cc(cc1C)Cl)C 62a_100011218378_100010244930 [0,2,0,0,0,0|1,1,0]=4 9360 B15R1.38791 CCC(O)CSc1c(cc(cc1C)F)C 62a_100011218378_100012356666 [0,2,0,0,0,0|1,1,0]=4 9361 B15R1.38791 CCC(O)CSc1c(cc(cc1C)F)C 62a_100012356666_100011218378 [0,2,0,0,0,0|1,1,0]=4 9362 B15R1.38791 CCC(O)CSc1c(cc(cc1C)N)C 62a_100000215964_100011218378 [0,2,0,0,0,0|1,1,0]=4 9363 B15R1.38791 CCC(O)CSc1c(cc(cc1C)N)C 62a_100011218378_100000215964 [0,2,0,0,0,0|1,1,0]=4 9364 B15R1.38791 CCC(O)CSc1c(cc(cc1C)O)C 62a_100000243743_100011218378 [0,2,0,0,0,0|1,1,0]=4 9365 B15R1.38791 CCC(O)CSc1c(cc(cc1C)O)C 62a_100011218378_100000243743 [0,2,0,0,0,0|1,1,0]=4 9366 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)Br)C 34a_100000737279_100009816398 [0,2,0,0,0,0|2,0,0]=4 9367 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)Br)C 7a_100000737279_100009816398 [0,2,0,0,0,0|2,0,0]=4 9368 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)C)C 34a_100000210045_100009816398 [0,2,0,0,0,0|2,0,0]=4 9369 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)C)C 7a_100000210045_100009816398 [0,2,0,0,0,0|2,0,0]=4 9370 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)Cl)C 34a_100000692879_100009816398 [0,2,0,0,0,0|2,0,0]=4 9371 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)Cl)C 7a_100000692879_100009816398 [0,2,0,0,0,0|2,0,0]=4 9372 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)F)C 34a_100011290887_100009816398 [0,2,0,0,0,0|2,0,0]=4 9373 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)F)C 7a_100011290887_100009816398 [0,2,0,0,0,0|2,0,0]=4 9374 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)I)C 7a_100011356821_100009816398 [0,2,0,0,0,0|2,0,0]=4 9375 B15R1.38791 CC[C@H](C)CNc1c(cc(cc1C)O)C 34a_100011934200_100009816398 [0,2,0,0,0,0|2,0,0]=4 9376 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)Br)C 34a_100000186369_100009816398 [0,2,0,0,0,0|2,0,0]=4 9377 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)Br)C 7a_100000186369_100009816398 [0,2,0,0,0,0|2,0,0]=4 9378 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)C)C 34a_100011934984_100009816398 [0,2,0,0,0,0|2,0,0]=4 9379 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)C)C 7a_100011934984_100009816398 [0,2,0,0,0,0|2,0,0]=4 9380 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)Cl)C 34a_100012337756_100009816398 [0,2,0,0,0,0|2,0,0]=4 9381 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)Cl)C 7a_100012337756_100009816398 [0,2,0,0,0,0|2,0,0]=4 9382 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)I)C 34a_100010982682_100009816398 [0,2,0,0,0,0|2,0,0]=4 9383 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)I)C 7a_100010982682_100009816398 [0,2,0,0,0,0|2,0,0]=4 9384 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)N)C 34a_100010064301_100009816398 [0,2,0,0,0,0|2,0,0]=4 9385 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Br)N)C 7a_100010064301_100009816398 [0,2,0,0,0,0|2,0,0]=4 9386 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)Br)C 34a_100000187306_100009816398 [0,2,0,0,0,0|1,0,0]=3 9387 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)Br)C 7a_100000187306_100009816398 [0,2,0,0,0,0|1,0,0]=3 9388 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)C)C 34a_100000212074_100009816398 [0,2,0,0,0,0|1,0,0]=3 9389 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)C)C 7a_100000212074_100009816398 [0,2,0,0,0,0|1,0,0]=3 9390 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)Cl)C 34a_100000211519_100009816398 [0,2,0,0,0,0|1,0,0]=3 9391 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)Cl)C 7a_100000211519_100009816398 [0,2,0,0,0,0|1,0,0]=3 9392 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)F)C 34a_100000081862_100009816398 [0,2,0,0,0,0|1,0,0]=3 9393 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)F)C 7a_100000081862_100009816398 [0,2,0,0,0,0|1,0,0]=3 9394 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)I)C 34a_100011216129_100009816398 [0,2,0,0,0,0|1,0,0]=3 9395 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)I)C 7a_100011216129_100009816398 [0,2,0,0,0,0|1,0,0]=3 9396 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)N)C 34a_100000703291_100009816398 [0,2,0,0,0,0|1,0,0]=3 9397 B15R1.38791 CC[C@H](C)COc1c(cc(cc1C)N)C 7a_100000703291_100009816398 [0,2,0,0,0,0|1,0,0]=3 9398 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Cl)Br)C 34a_100000211485_100009816398 [0,2,0,0,0,0|2,0,0]=4 9399 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Cl)Br)C 7a_100000211485_100009816398 [0,2,0,0,0,0|2,0,0]=4 9400 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Cl)Cl)C 34a_100011218458_100009816398 [0,2,0,0,0,0|2,0,0]=4 9401 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Cl)Cl)C 7a_100011218458_100009816398 [0,2,0,0,0,0|2,0,0]=4 9402 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Cl)I)C 34a_200015900153_100009816398 [0,2,0,0,0,0|2,0,0]=4 9403 B15R1.38791 CC[C@H](C)COc1c(cc(cc1Cl)I)C 7a_200015900153_100009816398 [0,2,0,0,0,0|2,0,0]=4 9404 B15R1.38791 CC[C@H](C)COc1c(cc(cc1I)Cl)C 34a_100012343667_100009816398 [0,2,0,0,0,0|2,0,0]=4 9405 B15R1.38791 CC[C@H](C)COc1c(cc(cc1I)Cl)C 7a_100012343667_100009816398 [0,2,0,0,0,0|2,0,0]=4 9406 B15R1.38791 CC[C@H](C)COc1c(cc(cc1N)Br)C 34a_100011825904_100009816398 [0,2,0,0,0,0|2,0,0]=4 9407 B15R1.38791 CC[C@H](C)COc1c(cc(cc1N)Br)C 7a_100011825904_100009816398 [0,2,0,0,0,0|2,0,0]=4 9408 B15R1.38791 CC[C@H](C)COc1c(cc(cc1N)C)C 34a_100011216242_100009816398 [0,2,0,0,0,0|2,0,0]=4 9409 B15R1.38791 CC[C@H](C)COc1c(cc(cc1N)C)C 7a_100011216242_100009816398 [0,2,0,0,0,0|2,0,0]=4 9410 B15R1.38791 CC[C@H](C)COc1c(cc(cc1N)F)C 34a_100000130126_100009816398 [0,2,0,0,0,0|2,0,0]=4 9411 B15R1.38791 CC[C@H](C)COc1c(cc(cc1N)F)C 7a_100000130126_100009816398 [0,2,0,0,0,0|2,0,0]=4 9412 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)Br)C 62a_100009814048_100009816398 [0,2,0,0,0,0|1,1,0]=4 9413 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)Br)C 62a_100009816398_100009814048 [0,2,0,0,0,0|1,1,0]=4 9414 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)C)C 62a_100009816398_100011204320 [0,2,0,0,0,0|1,1,0]=4 9415 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)C)C 62a_100011204320_100009816398 [0,2,0,0,0,0|1,1,0]=4 9416 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)Cl)C 62a_100009816398_100010244930 [0,2,0,0,0,0|1,1,0]=4 9417 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)Cl)C 62a_100010244930_100009816398 [0,2,0,0,0,0|1,1,0]=4 9418 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)F)C 62a_100009816398_100012356666 [0,2,0,0,0,0|1,1,0]=4 9419 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)F)C 62a_100012356666_100009816398 [0,2,0,0,0,0|1,1,0]=4 9420 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)N)C 62a_100000215964_100009816398 [0,2,0,0,0,0|1,1,0]=4 9421 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)N)C 62a_100009816398_100000215964 [0,2,0,0,0,0|1,1,0]=4 9422 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)O)C 62a_100000243743_100009816398 [0,2,0,0,0,0|1,1,0]=4 9423 B15R1.38791 CC[C@H](C)CSc1c(cc(cc1C)O)C 62a_100009816398_100000243743 [0,2,0,0,0,0|1,1,0]=4 9424 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Br)C 11a_106832991635_100009812269 [0,2,0,0,0,0|1,0,1]=4 9425 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Br)C 1626a_100102657272_100009812269 [0,2,0,0,0,0|1,0,1]=4 9426 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Br)C 240690a_100102657272_100009812269 [0,2,0,0,0,0|1,0,1]=4 9427 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Br)C 34a_100000187306_100000183359 [0,2,0,0,0,0|1,0,1]=4 9428 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Br)C 527a_100102657272_100009812269 [0,2,0,0,0,0|1,0,1]=4 9429 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Br)C 7a_100000187306_100000183359 [0,2,0,0,0,0|1,0,1]=4 9430 B15R1.38791 CNC(=O)COc1c(cc(cc1C)C)C 11a_106832991635_200000183695 [0,2,0,0,0,0|1,0,1]=4 9431 B15R1.38791 CNC(=O)COc1c(cc(cc1C)C)C 1626a_100102657272_200000183695 [0,2,0,0,0,0|1,0,1]=4 9432 B15R1.38791 CNC(=O)COc1c(cc(cc1C)C)C 240690a_100102657272_200000183695 [0,2,0,0,0,0|1,0,1]=4 9433 B15R1.38791 CNC(=O)COc1c(cc(cc1C)C)C 34a_100000212074_100000183359 [0,2,0,0,0,0|1,0,1]=4 9434 B15R1.38791 CNC(=O)COc1c(cc(cc1C)C)C 527a_100102657272_200000183695 [0,2,0,0,0,0|1,0,1]=4 9435 B15R1.38791 CNC(=O)COc1c(cc(cc1C)C)C 7a_100000212074_100000183359 [0,2,0,0,0,0|1,0,1]=4 9436 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Cl)C 11a_106832991635_100000183735 [0,2,0,0,0,0|1,0,1]=4 9437 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Cl)C 1626a_100102657272_100000183735 [0,2,0,0,0,0|1,0,1]=4 9438 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Cl)C 240690a_100102657272_100000183735 [0,2,0,0,0,0|1,0,1]=4 9439 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Cl)C 34a_100000211519_100000183359 [0,2,0,0,0,0|1,0,1]=4 9440 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Cl)C 527a_100102657272_100000183735 [0,2,0,0,0,0|1,0,1]=4 9441 B15R1.38791 CNC(=O)COc1c(cc(cc1C)Cl)C 7a_100000211519_100000183359 [0,2,0,0,0,0|1,0,1]=4 9442 B15R1.38791 CNC(=O)COc1c(cc(cc1C)F)C 34a_100000081862_100000183359 [0,2,0,0,0,0|1,0,1]=4 9443 B15R1.38791 CNC(=O)COc1c(cc(cc1C)F)C 7a_100000081862_100000183359 [0,2,0,0,0,0|1,0,1]=4 9444 B15R1.38791 CNC(=O)COc1c(cc(cc1C)I)C 34a_100011216129_100000183359 [0,2,0,0,0,0|1,0,1]=4 9445 B15R1.38791 CNC(=O)COc1c(cc(cc1C)I)C 7a_100011216129_100000183359 [0,2,0,0,0,0|1,0,1]=4 9446 B15R1.38791 CNC(=O)COc1c(cc(cc1C)N)C 34a_100000703291_100000183359 [0,2,0,0,0,0|1,0,1]=4 9447 B15R1.38791 CNC(=O)COc1c(cc(cc1C)N)C 7a_100000703291_100000183359 [0,2,0,0,0,0|1,0,1]=4 9448 B15R1.38791 COC(=O)COc1c(cc(cc1C)Br)C 34a_100000187306_100000747449 [0,2,0,0,0,0|1,0,1]=4 9449 B15R1.38791 COC(=O)COc1c(cc(cc1C)Br)C 7a_100000187306_100000747449 [0,2,0,0,0,0|1,0,1]=4 9450 B15R1.38791 COC(=O)COc1c(cc(cc1C)C)C 34a_100000212074_100000747449 [0,2,0,0,0,0|1,0,1]=4 9451 B15R1.38791 COC(=O)COc1c(cc(cc1C)C)C 7a_100000212074_100000747449 [0,2,0,0,0,0|1,0,1]=4 9452 B15R1.38791 COC(=O)COc1c(cc(cc1C)Cl)C 34a_100000211519_100000747449 [0,2,0,0,0,0|1,0,1]=4 9453 B15R1.38791 COC(=O)COc1c(cc(cc1C)Cl)C 7a_100000211519_100000747449 [0,2,0,0,0,0|1,0,1]=4 9454 B15R1.38791 COC(=O)COc1c(cc(cc1C)F)C 34a_100000081862_100000747449 [0,2,0,0,0,0|1,0,1]=4 9455 B15R1.38791 COC(=O)COc1c(cc(cc1C)F)C 7a_100000081862_100000747449 [0,2,0,0,0,0|1,0,1]=4 9456 B15R1.38791 COC(=O)COc1c(cc(cc1C)I)C 34a_100011216129_100000747449 [0,2,0,0,0,0|1,0,1]=4 9457 B15R1.38791 COC(=O)COc1c(cc(cc1C)I)C 7a_100011216129_100000747449 [0,2,0,0,0,0|1,0,1]=4 9458 B15R1.38791 COC(=O)COc1c(cc(cc1C)N)C 34a_100000703291_100000747449 [0,2,0,0,0,0|1,0,1]=4 9459 B15R1.38791 COC(=O)COc1c(cc(cc1C)N)C 7a_100000703291_100000747449 [0,2,0,0,0,0|1,0,1]=4 9460 B15R1.38791 Cc1cc(c(c(c1)Br)OCC(O)CO)C 34a_100011934984_100011219619 [0,2,0,0,0,0|2,0,0]=4 9461 B15R1.38791 Cc1cc(c(c(c1)Br)OCC(O)CO)C 7a_100011934984_100011219619 [0,2,0,0,0,0|2,0,0]=4 9462 B15R1.38791 Cc1cc(c(c(c1)Br)OC[C@@H](C)CO)C 34a_100011934984_100000059175 [0,2,0,0,0,0|2,0,0]=4 9463 B15R1.38791 Cc1cc(c(c(c1)Br)OC[C@@H](C)CO)C 7a_100011934984_100000059175 [0,2,0,0,0,0|2,0,0]=4 9464 B15R1.38791 Cc1cc(c(c(c1)Br)OC[C@@H](O)CF)C 34a_100011934984_100015614560 [0,2,0,0,0,0|2,0,0]=4 9465 B15R1.38791 Cc1cc(c(c(c1)Br)OC[C@@H](O)CF)C 7a_100011934984_100015614560 [0,2,0,0,0,0|2,0,0]=4 9466 B15R1.38791 Cc1cc(c(c(c1)Br)OC[C@@H](O)CO)C 34a_100011934984_100009815848 [0,2,0,0,0,0|2,0,0]=4 9467 B15R1.38791 Cc1cc(c(c(c1)Br)OC[C@@H](O)CO)C 7a_100011934984_100009815848 [0,2,0,0,0,0|2,0,0]=4 9468 B15R1.38791 Cc1cc(c(c(c1)C)COC(C)CN)C 34a_100000210904_100000749405 [0,2,0,0,0,0|2,0,0]=4 9469 B15R1.38791 Cc1cc(c(c(c1)C)NCC(O)CO)C 34a_100000210045_100011219619 [0,2,0,0,0,0|2,0,0]=4 9470 B15R1.38791 Cc1cc(c(c(c1)C)NCC(O)CO)C 7a_100000210045_100011219619 [0,2,0,0,0,0|2,0,0]=4 9471 B15R1.38791 Cc1cc(c(c(c1)C)NC[C@@H](C)CO)C 34a_100000210045_100000059175 [0,2,0,0,0,0|2,0,0]=4 9472 B15R1.38791 Cc1cc(c(c(c1)C)NC[C@@H](C)CO)C 7a_100000210045_100000059175 [0,2,0,0,0,0|2,0,0]=4 9473 B15R1.38791 Cc1cc(c(c(c1)C)NC[C@@H](O)CF)C 34a_100000210045_100015614560 [0,2,0,0,0,0|2,0,0]=4 9474 B15R1.38791 Cc1cc(c(c(c1)C)NC[C@@H](O)CF)C 7a_100000210045_100015614560 [0,2,0,0,0,0|2,0,0]=4 9475 B15R1.38791 Cc1cc(c(c(c1)C)NC[C@@H](O)CO)C 34a_100000210045_100009815848 [0,2,0,0,0,0|2,0,0]=4 9476 B15R1.38791 Cc1cc(c(c(c1)C)NC[C@@H](O)CO)C 7a_100000210045_100009815848 [0,2,0,0,0,0|2,0,0]=4 9477 B15R1.38791 Cc1cc(c(c(c1)C)OCC(=O)CF)C 1458a_200000183695_100015361967 [0,2,0,0,0,0|1,0,1]=4 9478 B15R1.38791 Cc1cc(c(c(c1)C)OCC(O)CO)C 34a_100000212074_100011219619 [0,2,0,0,0,0|1,0,0]=3 9479 B15R1.38791 Cc1cc(c(c(c1)C)OCC(O)CO)C 7a_100000212074_100011219619 [0,2,0,0,0,0|1,0,0]=3 9480 B15R1.38791 Cc1cc(c(c(c1)C)OC[C@@H](C)CO)C 34a_100000212074_100000059175 [0,2,0,0,0,0|1,0,0]=3 9481 B15R1.38791 Cc1cc(c(c(c1)C)OC[C@@H](C)CO)C 7a_100000212074_100000059175 [0,2,0,0,0,0|1,0,0]=3 9482 B15R1.38791 Cc1cc(c(c(c1)C)OC[C@@H](O)CF)C 34a_100000212074_100015614560 [0,2,0,0,0,0|1,0,0]=3 9483 B15R1.38791 Cc1cc(c(c(c1)C)OC[C@@H](O)CF)C 7a_100000212074_100015614560 [0,2,0,0,0,0|1,0,0]=3 9484 B15R1.38791 Cc1cc(c(c(c1)C)OC[C@@H](O)CO)C 34a_100000212074_100009815848 [0,2,0,0,0,0|1,0,0]=3 9485 B15R1.38791 Cc1cc(c(c(c1)C)OC[C@@H](O)CO)C 7a_100000212074_100009815848 [0,2,0,0,0,0|1,0,0]=3 9486 B15R1.38791 Cc1cc(c(c(c1)C)SCC(O)CO)C 62a_100011204320_100011219619 [0,2,0,0,0,0|1,1,0]=4 9487 B15R1.38791 Cc1cc(c(c(c1)C)SCC(O)CO)C 62a_100011219619_100011204320 [0,2,0,0,0,0|1,1,0]=4 9488 B15R1.38791 Cc1cc(c(c(c1)C)SC[C@@H](C)CO)C 62a_100000059175_100011204320 [0,2,0,0,0,0|1,1,0]=4 9489 B15R1.38791 Cc1cc(c(c(c1)C)SC[C@@H](C)CO)C 62a_100011204320_100000059175 [0,2,0,0,0,0|1,1,0]=4 9490 B15R1.38791 Cc1cc(c(c(c1)C)SC[C@@H](O)CF)C 62a_100011204320_100015614560 [0,2,0,0,0,0|1,1,0]=4 9491 B15R1.38791 Cc1cc(c(c(c1)C)SC[C@@H](O)CF)C 62a_100015614560_100011204320 [0,2,0,0,0,0|1,1,0]=4 9492 B15R1.38791 Cc1cc(c(c(c1)C)SC[C@@H](O)CO)C 62a_100009815848_100011204320 [0,2,0,0,0,0|1,1,0]=4 9493 B15R1.38791 Cc1cc(c(c(c1)C)SC[C@@H](O)CO)C 62a_100011204320_100009815848 [0,2,0,0,0,0|1,1,0]=4 9494 B15R1.38791 Cc1cc(c(c(c1)N)OCC(O)CO)C 34a_100011216242_100011219619 [0,2,0,0,0,0|2,0,0]=4 9495 B15R1.38791 Cc1cc(c(c(c1)N)OCC(O)CO)C 7a_100011216242_100011219619 [0,2,0,0,0,0|2,0,0]=4 9496 B15R1.38791 Cc1cc(c(c(c1)N)OC[C@@H](C)CO)C 34a_100011216242_100000059175 [0,2,0,0,0,0|2,0,0]=4 9497 B15R1.38791 Cc1cc(c(c(c1)N)OC[C@@H](C)CO)C 7a_100011216242_100000059175 [0,2,0,0,0,0|2,0,0]=4 9498 B15R1.38791 Cc1cc(c(c(c1)N)OC[C@@H](O)CF)C 34a_100011216242_100015614560 [0,2,0,0,0,0|2,0,0]=4 9499 B15R1.38791 Cc1cc(c(c(c1)N)OC[C@@H](O)CF)C 7a_100011216242_100015614560 [0,2,0,0,0,0|2,0,0]=4 9500 B15R1.38791 Cc1cc(c(c(c1)N)OC[C@@H](O)CO)C 34a_100011216242_100009815848 [0,2,0,0,0,0|2,0,0]=4 9501 B15R1.38791 Cc1cc(c(c(c1)N)OC[C@@H](O)CO)C 7a_100011216242_100009815848 [0,2,0,0,0,0|2,0,0]=4 9502 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)Br 34a_100000737279_100011219619 [0,2,0,0,0,0|2,0,0]=4 9503 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)Br 7a_100000737279_100011219619 [0,2,0,0,0,0|2,0,0]=4 9504 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)Cl 34a_100000692879_100011219619 [0,2,0,0,0,0|2,0,0]=4 9505 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)Cl 7a_100000692879_100011219619 [0,2,0,0,0,0|2,0,0]=4 9506 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)F 34a_100011290887_100011219619 [0,2,0,0,0,0|2,0,0]=4 9507 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)F 7a_100011290887_100011219619 [0,2,0,0,0,0|2,0,0]=4 9508 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)I 7a_100011356821_100011219619 [0,2,0,0,0,0|2,0,0]=4 9509 B15R1.38791 Cc1cc(cc(c1NCC(O)CO)C)O 34a_100011934200_100011219619 [0,2,0,0,0,0|2,0,0]=4 9510 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)Br 34a_100000737279_100000059175 [0,2,0,0,0,0|2,0,0]=4 9511 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)Br 7a_100000737279_100000059175 [0,2,0,0,0,0|2,0,0]=4 9512 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)Cl 34a_100000692879_100000059175 [0,2,0,0,0,0|2,0,0]=4 9513 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)Cl 7a_100000692879_100000059175 [0,2,0,0,0,0|2,0,0]=4 9514 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)F 34a_100011290887_100000059175 [0,2,0,0,0,0|2,0,0]=4 9515 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)F 7a_100011290887_100000059175 [0,2,0,0,0,0|2,0,0]=4 9516 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)I 7a_100011356821_100000059175 [0,2,0,0,0,0|2,0,0]=4 9517 B15R1.38791 Cc1cc(cc(c1NC[C@@H](C)CO)C)O 34a_100011934200_100000059175 [0,2,0,0,0,0|2,0,0]=4 9518 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)Br 34a_100000737279_100015614560 [0,2,0,0,0,0|2,0,0]=4 9519 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)Br 7a_100000737279_100015614560 [0,2,0,0,0,0|2,0,0]=4 9520 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)Cl 34a_100000692879_100015614560 [0,2,0,0,0,0|2,0,0]=4 9521 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)Cl 7a_100000692879_100015614560 [0,2,0,0,0,0|2,0,0]=4 9522 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)F 34a_100011290887_100015614560 [0,2,0,0,0,0|2,0,0]=4 9523 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)F 7a_100011290887_100015614560 [0,2,0,0,0,0|2,0,0]=4 9524 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)I 7a_100011356821_100015614560 [0,2,0,0,0,0|2,0,0]=4 9525 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CF)C)O 34a_100011934200_100015614560 [0,2,0,0,0,0|2,0,0]=4 9526 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)Br 34a_100000737279_100009815848 [0,2,0,0,0,0|2,0,0]=4 9527 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)Br 7a_100000737279_100009815848 [0,2,0,0,0,0|2,0,0]=4 9528 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)Cl 34a_100000692879_100009815848 [0,2,0,0,0,0|2,0,0]=4 9529 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)Cl 7a_100000692879_100009815848 [0,2,0,0,0,0|2,0,0]=4 9530 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)F 34a_100011290887_100009815848 [0,2,0,0,0,0|2,0,0]=4 9531 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)F 7a_100011290887_100009815848 [0,2,0,0,0,0|2,0,0]=4 9532 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)I 7a_100011356821_100009815848 [0,2,0,0,0,0|2,0,0]=4 9533 B15R1.38791 Cc1cc(cc(c1NC[C@@H](O)CO)C)O 34a_100011934200_100009815848 [0,2,0,0,0,0|2,0,0]=4 9534 B15R1.38791 Cc1cc(cc(c1OCC(=O)CF)C)Br 1458a_100009812269_100015361967 [0,2,0,0,0,0|1,0,1]=4 9535 B15R1.38791 Cc1cc(cc(c1OCC(=O)CF)C)Cl 1458a_100000183735_100015361967 [0,2,0,0,0,0|1,0,1]=4 9536 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)Br 34a_100000186369_100011219619 [0,2,0,0,0,0|2,0,0]=4 9537 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)Br 7a_100000186369_100011219619 [0,2,0,0,0,0|2,0,0]=4 9538 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)Cl 34a_100012337756_100011219619 [0,2,0,0,0,0|2,0,0]=4 9539 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)Cl 7a_100012337756_100011219619 [0,2,0,0,0,0|2,0,0]=4 9540 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)I 34a_100010982682_100011219619 [0,2,0,0,0,0|2,0,0]=4 9541 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)I 7a_100010982682_100011219619 [0,2,0,0,0,0|2,0,0]=4 9542 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)N 34a_100010064301_100011219619 [0,2,0,0,0,0|2,0,0]=4 9543 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Br)N 7a_100010064301_100011219619 [0,2,0,0,0,0|2,0,0]=4 9544 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)Br 34a_100000187306_100011219619 [0,2,0,0,0,0|1,0,0]=3 9545 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)Br 7a_100000187306_100011219619 [0,2,0,0,0,0|1,0,0]=3 9546 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)Cl 34a_100000211519_100011219619 [0,2,0,0,0,0|1,0,0]=3 9547 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)Cl 7a_100000211519_100011219619 [0,2,0,0,0,0|1,0,0]=3 9548 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)F 34a_100000081862_100011219619 [0,2,0,0,0,0|1,0,0]=3 9549 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)F 7a_100000081862_100011219619 [0,2,0,0,0,0|1,0,0]=3 9550 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)I 34a_100011216129_100011219619 [0,2,0,0,0,0|1,0,0]=3 9551 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)I 7a_100011216129_100011219619 [0,2,0,0,0,0|1,0,0]=3 9552 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)N 34a_100000703291_100011219619 [0,2,0,0,0,0|1,0,0]=3 9553 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)C)N 7a_100000703291_100011219619 [0,2,0,0,0,0|1,0,0]=3 9554 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Cl)Br 34a_100000211485_100011219619 [0,2,0,0,0,0|2,0,0]=4 9555 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Cl)Br 7a_100000211485_100011219619 [0,2,0,0,0,0|2,0,0]=4 9556 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Cl)Cl 34a_100011218458_100011219619 [0,2,0,0,0,0|2,0,0]=4 9557 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Cl)Cl 7a_100011218458_100011219619 [0,2,0,0,0,0|2,0,0]=4 9558 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Cl)I 34a_200015900153_100011219619 [0,2,0,0,0,0|2,0,0]=4 9559 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)Cl)I 7a_200015900153_100011219619 [0,2,0,0,0,0|2,0,0]=4 9560 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)I)Cl 34a_100012343667_100011219619 [0,2,0,0,0,0|2,0,0]=4 9561 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)I)Cl 7a_100012343667_100011219619 [0,2,0,0,0,0|2,0,0]=4 9562 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)N)Br 34a_100011825904_100011219619 [0,2,0,0,0,0|2,0,0]=4 9563 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)N)Br 7a_100011825904_100011219619 [0,2,0,0,0,0|2,0,0]=4 9564 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)N)F 34a_100000130126_100011219619 [0,2,0,0,0,0|2,0,0]=4 9565 B15R1.38791 Cc1cc(cc(c1OCC(O)CO)N)F 7a_100000130126_100011219619 [0,2,0,0,0,0|2,0,0]=4 9566 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)Br 34a_100000186369_100000059175 [0,2,0,0,0,0|2,0,0]=4 9567 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)Br 7a_100000186369_100000059175 [0,2,0,0,0,0|2,0,0]=4 9568 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)Cl 34a_100012337756_100000059175 [0,2,0,0,0,0|2,0,0]=4 9569 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)Cl 7a_100012337756_100000059175 [0,2,0,0,0,0|2,0,0]=4 9570 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)I 34a_100010982682_100000059175 [0,2,0,0,0,0|2,0,0]=4 9571 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)I 7a_100010982682_100000059175 [0,2,0,0,0,0|2,0,0]=4 9572 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)N 34a_100010064301_100000059175 [0,2,0,0,0,0|2,0,0]=4 9573 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Br)N 7a_100010064301_100000059175 [0,2,0,0,0,0|2,0,0]=4 9574 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)Br 34a_100000187306_100000059175 [0,2,0,0,0,0|1,0,0]=3 9575 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)Br 7a_100000187306_100000059175 [0,2,0,0,0,0|1,0,0]=3 9576 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)Cl 34a_100000211519_100000059175 [0,2,0,0,0,0|1,0,0]=3 9577 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)Cl 7a_100000211519_100000059175 [0,2,0,0,0,0|1,0,0]=3 9578 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)F 34a_100000081862_100000059175 [0,2,0,0,0,0|1,0,0]=3 9579 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)F 7a_100000081862_100000059175 [0,2,0,0,0,0|1,0,0]=3 9580 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)I 34a_100011216129_100000059175 [0,2,0,0,0,0|1,0,0]=3 9581 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)I 7a_100011216129_100000059175 [0,2,0,0,0,0|1,0,0]=3 9582 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)N 34a_100000703291_100000059175 [0,2,0,0,0,0|1,0,0]=3 9583 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)C)N 7a_100000703291_100000059175 [0,2,0,0,0,0|1,0,0]=3 9584 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Cl)Br 34a_100000211485_100000059175 [0,2,0,0,0,0|2,0,0]=4 9585 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Cl)Br 7a_100000211485_100000059175 [0,2,0,0,0,0|2,0,0]=4 9586 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Cl)Cl 34a_100011218458_100000059175 [0,2,0,0,0,0|2,0,0]=4 9587 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Cl)Cl 7a_100011218458_100000059175 [0,2,0,0,0,0|2,0,0]=4 9588 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Cl)I 34a_200015900153_100000059175 [0,2,0,0,0,0|2,0,0]=4 9589 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)Cl)I 7a_200015900153_100000059175 [0,2,0,0,0,0|2,0,0]=4 9590 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)I)Cl 34a_100012343667_100000059175 [0,2,0,0,0,0|2,0,0]=4 9591 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)I)Cl 7a_100012343667_100000059175 [0,2,0,0,0,0|2,0,0]=4 9592 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)N)Br 34a_100011825904_100000059175 [0,2,0,0,0,0|2,0,0]=4 9593 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)N)Br 7a_100011825904_100000059175 [0,2,0,0,0,0|2,0,0]=4 9594 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)N)F 34a_100000130126_100000059175 [0,2,0,0,0,0|2,0,0]=4 9595 B15R1.38791 Cc1cc(cc(c1OC[C@@H](C)CO)N)F 7a_100000130126_100000059175 [0,2,0,0,0,0|2,0,0]=4 9596 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)Br 34a_100000186369_100015614560 [0,2,0,0,0,0|2,0,0]=4 9597 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)Br 7a_100000186369_100015614560 [0,2,0,0,0,0|2,0,0]=4 9598 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)Cl 34a_100012337756_100015614560 [0,2,0,0,0,0|2,0,0]=4 9599 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)Cl 7a_100012337756_100015614560 [0,2,0,0,0,0|2,0,0]=4 9600 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)I 34a_100010982682_100015614560 [0,2,0,0,0,0|2,0,0]=4 9601 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)I 7a_100010982682_100015614560 [0,2,0,0,0,0|2,0,0]=4 9602 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)N 34a_100010064301_100015614560 [0,2,0,0,0,0|2,0,0]=4 9603 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Br)N 7a_100010064301_100015614560 [0,2,0,0,0,0|2,0,0]=4 9604 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)Br 34a_100000187306_100015614560 [0,2,0,0,0,0|1,0,0]=3 9605 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)Br 7a_100000187306_100015614560 [0,2,0,0,0,0|1,0,0]=3 9606 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)Cl 34a_100000211519_100015614560 [0,2,0,0,0,0|1,0,0]=3 9607 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)Cl 7a_100000211519_100015614560 [0,2,0,0,0,0|1,0,0]=3 9608 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)F 34a_100000081862_100015614560 [0,2,0,0,0,0|1,0,0]=3 9609 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)F 7a_100000081862_100015614560 [0,2,0,0,0,0|1,0,0]=3 9610 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)I 34a_100011216129_100015614560 [0,2,0,0,0,0|1,0,0]=3 9611 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)I 7a_100011216129_100015614560 [0,2,0,0,0,0|1,0,0]=3 9612 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)N 34a_100000703291_100015614560 [0,2,0,0,0,0|1,0,0]=3 9613 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)C)N 7a_100000703291_100015614560 [0,2,0,0,0,0|1,0,0]=3 9614 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Cl)Br 34a_100000211485_100015614560 [0,2,0,0,0,0|2,0,0]=4 9615 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Cl)Br 7a_100000211485_100015614560 [0,2,0,0,0,0|2,0,0]=4 9616 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Cl)Cl 34a_100011218458_100015614560 [0,2,0,0,0,0|2,0,0]=4 9617 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Cl)Cl 7a_100011218458_100015614560 [0,2,0,0,0,0|2,0,0]=4 9618 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Cl)I 34a_200015900153_100015614560 [0,2,0,0,0,0|2,0,0]=4 9619 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)Cl)I 7a_200015900153_100015614560 [0,2,0,0,0,0|2,0,0]=4 9620 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)I)Cl 34a_100012343667_100015614560 [0,2,0,0,0,0|2,0,0]=4 9621 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)I)Cl 7a_100012343667_100015614560 [0,2,0,0,0,0|2,0,0]=4 9622 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)N)Br 34a_100011825904_100015614560 [0,2,0,0,0,0|2,0,0]=4 9623 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)N)Br 7a_100011825904_100015614560 [0,2,0,0,0,0|2,0,0]=4 9624 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)N)F 34a_100000130126_100015614560 [0,2,0,0,0,0|2,0,0]=4 9625 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CF)N)F 7a_100000130126_100015614560 [0,2,0,0,0,0|2,0,0]=4 9626 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)Br 34a_100000186369_100009815848 [0,2,0,0,0,0|2,0,0]=4 9627 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)Br 7a_100000186369_100009815848 [0,2,0,0,0,0|2,0,0]=4 9628 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)Cl 34a_100012337756_100009815848 [0,2,0,0,0,0|2,0,0]=4 9629 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)Cl 7a_100012337756_100009815848 [0,2,0,0,0,0|2,0,0]=4 9630 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)I 34a_100010982682_100009815848 [0,2,0,0,0,0|2,0,0]=4 9631 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)I 7a_100010982682_100009815848 [0,2,0,0,0,0|2,0,0]=4 9632 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)N 34a_100010064301_100009815848 [0,2,0,0,0,0|2,0,0]=4 9633 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Br)N 7a_100010064301_100009815848 [0,2,0,0,0,0|2,0,0]=4 9634 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)Br 34a_100000187306_100009815848 [0,2,0,0,0,0|1,0,0]=3 9635 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)Br 7a_100000187306_100009815848 [0,2,0,0,0,0|1,0,0]=3 9636 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)Cl 34a_100000211519_100009815848 [0,2,0,0,0,0|1,0,0]=3 9637 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)Cl 7a_100000211519_100009815848 [0,2,0,0,0,0|1,0,0]=3 9638 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)F 34a_100000081862_100009815848 [0,2,0,0,0,0|1,0,0]=3 9639 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)F 7a_100000081862_100009815848 [0,2,0,0,0,0|1,0,0]=3 9640 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)I 34a_100011216129_100009815848 [0,2,0,0,0,0|1,0,0]=3 9641 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)I 7a_100011216129_100009815848 [0,2,0,0,0,0|1,0,0]=3 9642 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)N 34a_100000703291_100009815848 [0,2,0,0,0,0|1,0,0]=3 9643 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)C)N 7a_100000703291_100009815848 [0,2,0,0,0,0|1,0,0]=3 9644 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Cl)Br 34a_100000211485_100009815848 [0,2,0,0,0,0|2,0,0]=4 9645 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Cl)Br 7a_100000211485_100009815848 [0,2,0,0,0,0|2,0,0]=4 9646 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Cl)Cl 34a_100011218458_100009815848 [0,2,0,0,0,0|2,0,0]=4 9647 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Cl)Cl 7a_100011218458_100009815848 [0,2,0,0,0,0|2,0,0]=4 9648 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Cl)I 34a_200015900153_100009815848 [0,2,0,0,0,0|2,0,0]=4 9649 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)Cl)I 7a_200015900153_100009815848 [0,2,0,0,0,0|2,0,0]=4 9650 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)I)Cl 34a_100012343667_100009815848 [0,2,0,0,0,0|2,0,0]=4 9651 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)I)Cl 7a_100012343667_100009815848 [0,2,0,0,0,0|2,0,0]=4 9652 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)N)Br 34a_100011825904_100009815848 [0,2,0,0,0,0|2,0,0]=4 9653 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)N)Br 7a_100011825904_100009815848 [0,2,0,0,0,0|2,0,0]=4 9654 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)N)F 34a_100000130126_100009815848 [0,2,0,0,0,0|2,0,0]=4 9655 B15R1.38791 Cc1cc(cc(c1OC[C@@H](O)CO)N)F 7a_100000130126_100009815848 [0,2,0,0,0,0|2,0,0]=4 9656 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)Br 62a_100009814048_100011219619 [0,2,0,0,0,0|1,1,0]=4 9657 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)Br 62a_100011219619_100009814048 [0,2,0,0,0,0|1,1,0]=4 9658 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)Cl 62a_100010244930_100011219619 [0,2,0,0,0,0|1,1,0]=4 9659 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)Cl 62a_100011219619_100010244930 [0,2,0,0,0,0|1,1,0]=4 9660 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)F 62a_100011219619_100012356666 [0,2,0,0,0,0|1,1,0]=4 9661 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)F 62a_100012356666_100011219619 [0,2,0,0,0,0|1,1,0]=4 9662 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)N 62a_100000215964_100011219619 [0,2,0,0,0,0|1,1,0]=4 9663 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)N 62a_100011219619_100000215964 [0,2,0,0,0,0|1,1,0]=4 9664 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)O 62a_100000243743_100011219619 [0,2,0,0,0,0|1,1,0]=4 9665 B15R1.38791 Cc1cc(cc(c1SCC(O)CO)C)O 62a_100011219619_100000243743 [0,2,0,0,0,0|1,1,0]=4 9666 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)Br 62a_100000059175_100009814048 [0,2,0,0,0,0|1,1,0]=4 9667 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)Br 62a_100009814048_100000059175 [0,2,0,0,0,0|1,1,0]=4 9668 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)Cl 62a_100000059175_100010244930 [0,2,0,0,0,0|1,1,0]=4 9669 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)Cl 62a_100010244930_100000059175 [0,2,0,0,0,0|1,1,0]=4 9670 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)F 62a_100000059175_100012356666 [0,2,0,0,0,0|1,1,0]=4 9671 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)F 62a_100012356666_100000059175 [0,2,0,0,0,0|1,1,0]=4 9672 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)N 62a_100000059175_100000215964 [0,2,0,0,0,0|1,1,0]=4 9673 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)N 62a_100000215964_100000059175 [0,2,0,0,0,0|1,1,0]=4 9674 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)O 62a_100000059175_100000243743 [0,2,0,0,0,0|1,1,0]=4 9675 B15R1.38791 Cc1cc(cc(c1SC[C@@H](C)CO)C)O 62a_100000243743_100000059175 [0,2,0,0,0,0|1,1,0]=4 9676 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)Br 62a_100009814048_100015614560 [0,2,0,0,0,0|1,1,0]=4 9677 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)Br 62a_100015614560_100009814048 [0,2,0,0,0,0|1,1,0]=4 9678 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)Cl 62a_100010244930_100015614560 [0,2,0,0,0,0|1,1,0]=4 9679 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)Cl 62a_100015614560_100010244930 [0,2,0,0,0,0|1,1,0]=4 9680 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)F 62a_100012356666_100015614560 [0,2,0,0,0,0|1,1,0]=4 9681 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)F 62a_100015614560_100012356666 [0,2,0,0,0,0|1,1,0]=4 9682 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)N 62a_100000215964_100015614560 [0,2,0,0,0,0|1,1,0]=4 9683 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)N 62a_100015614560_100000215964 [0,2,0,0,0,0|1,1,0]=4 9684 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)O 62a_100000243743_100015614560 [0,2,0,0,0,0|1,1,0]=4 9685 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CF)C)O 62a_100015614560_100000243743 [0,2,0,0,0,0|1,1,0]=4 9686 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)Br 62a_100009814048_100009815848 [0,2,0,0,0,0|1,1,0]=4 9687 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)Br 62a_100009815848_100009814048 [0,2,0,0,0,0|1,1,0]=4 9688 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)Cl 62a_100009815848_100010244930 [0,2,0,0,0,0|1,1,0]=4 9689 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)Cl 62a_100010244930_100009815848 [0,2,0,0,0,0|1,1,0]=4 9690 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)F 62a_100009815848_100012356666 [0,2,0,0,0,0|1,1,0]=4 9691 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)F 62a_100012356666_100009815848 [0,2,0,0,0,0|1,1,0]=4 9692 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)N 62a_100000215964_100009815848 [0,2,0,0,0,0|1,1,0]=4 9693 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)N 62a_100009815848_100000215964 [0,2,0,0,0,0|1,1,0]=4 9694 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)O 62a_100000243743_100009815848 [0,2,0,0,0,0|1,1,0]=4 9695 B15R1.38791 Cc1cc(cc(c1SC[C@@H](O)CO)C)O 62a_100009815848_100000243743 [0,2,0,0,0,0|1,1,0]=4 9696 B15R1.8289 Cc1cccc(c1OC(F)C(F)(F)F)C 34a_100000210341_200000036121 [0,2,0,0,0,0|2,0,0]=4 9697 B15R1.8313 Cc1cccc(c1N(C)CC(C)(C)C)C 34a_100011645471_100011219605 [0,2,0,0,0,0|2,0,0]=4 9698 B15R1.8313 Cc1cccc(c1N(C)CC(C)(C)F)C 34a_100011645471_100011997219 [0,2,0,0,0,0|2,0,0]=4 9699 B15R1.8313 Cc1cccc(c1N(C)CC(C)(C)O)C 34a_100011645471_100000764493 [0,2,0,0,0,0|2,0,0]=4 9700 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)C)Br)Cl 34a_200010391122_100011219605 [0,2,0,0,0,0|2,0,0]=4 9701 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)C)Br)F 34a_200010391124_100011219605 [0,2,0,0,0,0|2,0,0]=4 9702 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)F)Br)Cl 34a_200010391122_100011997219 [0,2,0,0,0,0|2,0,0]=4 9703 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)F)Br)F 34a_200010391124_100011997219 [0,2,0,0,0,0|2,0,0]=4 9704 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)O)Br)Cl 34a_200010391122_100000764493 [0,2,0,0,0,0|2,0,0]=4 9705 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)O)Br)Cl 7a_200010391122_100000764493 [0,2,0,0,0,0|2,0,0]=4 9706 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)O)Br)F 34a_200010391124_100000764493 [0,2,0,0,0,0|2,0,0]=4 9707 B15R1.23306 Cc1c(ccc(c1OCC(C)(C)O)Br)F 7a_200010391124_100000764493 [0,2,0,0,0,0|2,0,0]=4 9708 B15R1.23306 Cc1ccc(c(c1C)NCC(C)(C)C)C 34a_100000117417_100011219605 [0,2,0,0,0,0|2,0,0]=4 9709 B15R1.23306 Cc1ccc(c(c1C)NCC(C)(C)F)C 34a_100000117417_100011997219 [0,2,0,0,0,0|2,0,0]=4 9710 B15R1.23306 Cc1ccc(c(c1C)NCC(C)(C)O)C 34a_100000117417_100000764493 [0,2,0,0,0,0|2,0,0]=4 9711 B15R1.23306 Cc1ccc(c(c1C)NCC(C)(C)O)C 7a_100000117417_100000764493 [0,2,0,0,0,0|2,0,0]=4 9712 B15R1.23306 Cc1ccc(c(c1C)OCC(C)(C)C)C 34a_100000211305_100011219605 [0,2,0,0,0,0|1,0,0]=3 9713 B15R1.23306 Cc1ccc(c(c1C)OCC(C)(C)F)C 34a_100000211305_100011997219 [0,2,0,0,0,0|1,0,0]=3 9714 B15R1.23306 Cc1ccc(c(c1C)OCC(C)(C)O)C 34a_100000211305_100000764493 [0,2,0,0,0,0|1,0,0]=3 9715 B15R1.23306 Cc1ccc(c(c1C)OCC(C)(C)O)C 7a_100000211305_100000764493 [0,2,0,0,0,0|1,0,0]=3 9716 B15R1.23306 Cc1ccc(c(c1C)OC[Si](C)(C)C)C 7a_100000211305_100000233785 [0,2,0,0,0,0|1,1,0]=4 9717 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)C)C)Br 34a_200010074581_100011219605 [0,2,0,0,0,0|2,0,0]=4 9718 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)C)C)Cl 34a_200020642106_100011219605 [0,2,0,0,0,0|2,0,0]=4 9719 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)C)C)I 34a_200010115591_100011219605 [0,2,0,0,0,0|2,0,0]=4 9720 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)F)C)Br 34a_200010074581_100011997219 [0,2,0,0,0,0|2,0,0]=4 9721 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)F)C)Cl 34a_200020642106_100011997219 [0,2,0,0,0,0|2,0,0]=4 9722 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)F)C)I 34a_200010115591_100011997219 [0,2,0,0,0,0|2,0,0]=4 9723 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)O)C)Br 34a_200010074581_100000764493 [0,2,0,0,0,0|2,0,0]=4 9724 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)O)C)Cl 34a_200020642106_100000764493 [0,2,0,0,0,0|2,0,0]=4 9725 B15R1.23306 Cc1ccc(c(c1NCC(C)(C)O)C)I 34a_200010115591_100000764493 [0,2,0,0,0,0|2,0,0]=4 9726 B15R1.23306 Cc1ccc(c(c1OCC(C)(C)C)Cl)N 34a_100000036876_100011219605 [0,2,0,0,0,0|2,0,0]=4 9727 B15R1.23306 Cc1ccc(c(c1OCC(C)(C)F)Cl)N 34a_100000036876_100011997219 [0,2,0,0,0,0|2,0,0]=4 9728 B15R1.23306 Cc1ccc(c(c1OCC(C)(C)O)Cl)N 34a_100000036876_100000764493 [0,2,0,0,0,0|2,0,0]=4 9729 B15R1.23306 Cc1ccc(c(c1OCC(C)(C)O)Cl)N 7a_100000036876_100000764493 [0,2,0,0,0,0|2,0,0]=4 9730 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)C)C)F 62a_100011068659_100011219605 [0,2,0,0,0,0|1,1,0]=4 9731 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)C)C)F 62a_100011219605_100011068659 [0,2,0,0,0,0|1,1,0]=4 9732 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)C)C)N 62a_100011219605_106354213274 [0,2,0,0,0,0|1,1,0]=4 9733 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)C)C)N 62a_106354213274_100011219605 [0,2,0,0,0,0|1,1,0]=4 9734 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)C)C)O 62a_100010659238_100011219605 [0,2,0,0,0,0|1,1,0]=4 9735 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)C)C)O 62a_100011219605_100010659238 [0,2,0,0,0,0|1,1,0]=4 9736 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)F)C)F 62a_100011068659_100011997219 [0,2,0,0,0,0|1,1,0]=4 9737 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)F)C)F 62a_100011997219_100011068659 [0,2,0,0,0,0|1,1,0]=4 9738 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)F)C)N 62a_100011997219_106354213274 [0,2,0,0,0,0|1,1,0]=4 9739 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)F)C)N 62a_106354213274_100011997219 [0,2,0,0,0,0|1,1,0]=4 9740 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)F)C)O 62a_100010659238_100011997219 [0,2,0,0,0,0|1,1,0]=4 9741 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)F)C)O 62a_100011997219_100010659238 [0,2,0,0,0,0|1,1,0]=4 9742 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)O)C)F 62a_100000764493_100011068659 [0,2,0,0,0,0|1,1,0]=4 9743 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)O)C)F 62a_100011068659_100000764493 [0,2,0,0,0,0|1,1,0]=4 9744 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)O)C)N 62a_100000764493_106354213274 [0,2,0,0,0,0|1,1,0]=4 9745 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)O)C)N 62a_106354213274_100000764493 [0,2,0,0,0,0|1,1,0]=4 9746 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)O)C)O 62a_100000764493_100010659238 [0,2,0,0,0,0|1,1,0]=4 9747 B15R1.23306 Cc1ccc(c(c1SCC(C)(C)O)C)O 62a_100010659238_100000764493 [0,2,0,0,0,0|1,1,0]=4 9748 B15R1.28269 COC(C)(C)CNc1c(cccc1C)C 34a_100000185769_100000701081 [0,2,0,0,0,0|2,0,0]=4 9749 B15R1.28269 COC(C)(C)COc1c(cccc1Br)C 34a_100009817157_100000701081 [0,2,0,0,0,0|2,0,0]=4 9750 B15R1.28269 COC(C)(C)COc1c(cccc1C)C 34a_100000210341_100000701081 [0,2,0,0,0,0|1,0,0]=3 9751 B15R1.28269 COC(C)(C)COc1c(cccc1Cl)C 34a_100000033731_100000701081 [0,2,0,0,0,0|2,0,0]=4 9752 B15R1.28269 COC(C)(C)COc1c(cccc1F)C 34a_100011659162_100000701081 [0,2,0,0,0,0|2,0,0]=4 9753 B15R1.28269 COC(C)(C)COc1c(cccc1N)C 34a_100000756359_100000701081 [0,2,0,0,0,0|2,0,0]=4 9754 B15R1.28269 COC(C)(C)COc1c(ccnc1C)C 34a_100011934651_100000701081 [0,2,0,0,0,0|2,0,0]=4 9755 B15R1.28269 COC(C)(C)CSc1c(cccc1C)C 62a_100000033847_100000701081 [0,2,0,0,0,0|1,1,0]=4 9756 B15R1.28269 COC(C)(C)CSc1c(cccc1C)C 62a_100000701081_100000033847 [0,2,0,0,0,0|1,1,0]=4 9757 B15R1.28269 Cc1cccc(c1NCC(C)(C)CO)C 34a_100000185769_100009813988 [0,2,0,0,0,0|2,0,0]=4 9758 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)Br 34a_100009817157_100009813988 [0,2,0,0,0,0|2,0,0]=4 9759 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)Br 7a_100009817157_100009813988 [0,2,0,0,0,0|2,0,0]=4 9760 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)C 34a_100000210341_100009813988 [0,2,0,0,0,0|1,0,0]=3 9761 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)C 7a_100000210341_100009813988 [0,2,0,0,0,0|1,0,0]=3 9762 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)Cl 34a_100000033731_100009813988 [0,2,0,0,0,0|2,0,0]=4 9763 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)Cl 7a_100000033731_100009813988 [0,2,0,0,0,0|2,0,0]=4 9764 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)F 34a_100011659162_100009813988 [0,2,0,0,0,0|2,0,0]=4 9765 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)F 7a_100011659162_100009813988 [0,2,0,0,0,0|2,0,0]=4 9766 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)N 34a_100000756359_100009813988 [0,2,0,0,0,0|2,0,0]=4 9767 B15R1.28269 Cc1cccc(c1OCC(C)(C)CO)N 7a_100000756359_100009813988 [0,2,0,0,0,0|2,0,0]=4 9768 B15R1.28269 Cc1cccc(c1SCC(C)(C)CO)C 62a_100000033847_100009813988 [0,2,0,0,0,0|1,1,0]=4 9769 B15R1.28269 Cc1cccc(c1SCC(C)(C)CO)C 62a_100009813988_100000033847 [0,2,0,0,0,0|1,1,0]=4 9770 B15R1.28269 Cc1ccnc(c1OCC(C)(C)CO)C 34a_100011934651_100009813988 [0,2,0,0,0,0|2,0,0]=4 9771 B15R1.28269 Cc1ccnc(c1OCC(C)(C)CO)C 7a_100011934651_100009813988 [0,2,0,0,0,0|2,0,0]=4 9772 B15R1.8455 Cc1ccc(c(c1C(=O)CC(C)C)C)Br 1458a_100012355652_100000210624 [0,2,0,0,0,0|2,0,0]=4 9773 B15R1.8455 Cc1ccc(c(c1C(=O)CC(C)O)C)Br 1458a_100012355652_100011218427 [0,2,0,0,0,0|2,0,0]=4 9774 B15R1.8455 Cc1ccc(c(c1[C@@H](N)CC(C)C)C)F 271570a_100015190218_100011068659 [0,2,0,0,0,0|2,0,0]=4 9775 B15R1.8455 Cc1ccc(c(c1[C@@H](N)CC(C)C)C)N 271570a_100015190218_106354213274 [0,2,0,0,0,0|2,0,0]=4 9776 B15R1.8455 Cc1ccc(c(c1[C@@H](N)CC(C)C)C)O 271570a_100015190218_100010659238 [0,2,0,0,0,0|2,0,0]=4 9777 B15R1.36276 CCC(C)CC(=O)c1c(cccc1C)C 1458a_100000758298_100000748023 [0,2,0,0,0,0|2,0,0]=4 9778 B15R1.36276 CCC(C)CN(C)c1c(cccc1C)C 2230a_100011645471_100000748023 [0,2,0,0,0,0|2,0,0]=4 9779 B15R1.36276 CCC(C)CN(C)c1c(cccc1C)C 269982a_100011645471_100000748023 [0,2,0,0,0,0|2,0,0]=4 9780 B15R1.36276 CCC(C)CN(C)c1c(cccc1C)C 34a_100011645471_100000748023 [0,2,0,0,0,0|2,0,0]=4 9781 B15R1.36276 CCC(O)CC(=O)c1c(cccc1C)C 1458a_100000758298_100011218378 [0,2,0,0,0,0|2,0,0]=4 9782 B15R1.36276 CCC(O)CN(C)c1c(cccc1C)C 2230a_100011645471_100011218378 [0,2,0,0,0,0|2,0,0]=4 9783 B15R1.36276 CCC(O)CN(C)c1c(cccc1C)C 269982a_100011645471_100011218378 [0,2,0,0,0,0|2,0,0]=4 9784 B15R1.36276 CCC(O)CN(C)c1c(cccc1C)C 34a_100011645471_100011218378 [0,2,0,0,0,0|2,0,0]=4 9785 B15R1.36276 CC[C@H](C)CC(=O)c1c(cccc1C)C 1458a_100000758298_100009816398 [0,2,0,0,0,0|2,0,0]=4 9786 B15R1.36276 CC[C@H](C)CN(C)c1c(cccc1C)C 2230a_100011645471_100009816398 [0,2,0,0,0,0|2,0,0]=4 9787 B15R1.36276 CC[C@H](C)CN(C)c1c(cccc1C)C 269982a_100011645471_100009816398 [0,2,0,0,0,0|2,0,0]=4 9788 B15R1.36276 CC[C@H](C)CN(C)c1c(cccc1C)C 34a_100011645471_100009816398 [0,2,0,0,0,0|2,0,0]=4 9789 B15R1.36276 Cc1cccc(c1C(=O)C[C@@H](C)CO)C 1458a_100000758298_100000059175 [0,2,0,0,0,0|2,0,0]=4 9790 B15R1.36276 Cc1cccc(c1N(C)CC(O)CO)C 2230a_100011645471_100011219619 [0,2,0,0,0,0|2,0,0]=4 9791 B15R1.36276 Cc1cccc(c1N(C)CC(O)CO)C 34a_100011645471_100011219619 [0,2,0,0,0,0|2,0,0]=4 9792 B15R1.36276 Cc1cccc(c1N(C)C[C@@H](C)CO)C 2230a_100011645471_100000059175 [0,2,0,0,0,0|2,0,0]=4 9793 B15R1.36276 Cc1cccc(c1N(C)C[C@@H](C)CO)C 269982a_100011645471_100000059175 [0,2,0,0,0,0|2,0,0]=4 9794 B15R1.36276 Cc1cccc(c1N(C)C[C@@H](C)CO)C 34a_100011645471_100000059175 [0,2,0,0,0,0|2,0,0]=4 9795 B15R1.36276 Cc1cccc(c1N(C)C[C@@H](O)CF)C 2230a_100011645471_100015614560 [0,2,0,0,0,0|2,0,0]=4 9796 B15R1.36276 Cc1cccc(c1N(C)C[C@@H](O)CF)C 34a_100011645471_100015614560 [0,2,0,0,0,0|2,0,0]=4 9797 B15R1.36276 Cc1cccc(c1N(C)C[C@@H](O)CO)C 2230a_100011645471_100009815848 [0,2,0,0,0,0|2,0,0]=4 9798 B15R1.36276 Cc1cccc(c1N(C)C[C@@H](O)CO)C 34a_100011645471_100009815848 [0,2,0,0,0,0|2,0,0]=4 9799 B15R1.8417 CC(=O)C(C)Oc1c(ccc(c1C)C)C 7a_100000211305_100000179758 [0,2,0,0,0,0|1,0,1]=4 9800 B15R1.8417 Cc1ccc(c(c1C)OC(C)C(=O)N)C 34a_100000211305_100000702099 [0,2,0,0,0,0|1,0,1]=4 9801 B15R1.8417 Cc1ccc(c(c1C)OC(C)C(=O)N)C 7a_100000211305_100000702099 [0,2,0,0,0,0|1,0,1]=4 9802 B15R1.8417 Cc1ccc(c(c1C)OC(F)C(=O)N)C 34a_100000211305_100009813875 [0,2,0,0,0,0|1,0,1]=4 9803 B15R1.8417 Cc1ccc(c(c1C)OC(F)C(=O)N)C 7a_100000211305_100009813875 [0,2,0,0,0,0|1,0,1]=4 9804 B15R1.13264 CCC(=O)C(C)Oc1c(cccc1C)C 7a_100000210341_100000742827 [0,2,0,0,0,0|1,0,1]=4 9805 B15R1.13264 CNC(=O)C(C)Oc1c(cccc1C)C 34a_100000210341_100000731044 [0,2,0,0,0,0|1,0,1]=4 9806 B15R1.13264 CNC(=O)C(C)Oc1c(cccc1C)C 7a_100000210341_100000209862 [0,2,0,0,0,0|1,0,1]=4 9807 B15R1.13264 CNC(=O)C(F)Oc1c(cccc1C)C 34a_100000210341_100009813575 [0,2,0,0,0,0|1,0,1]=4 9808 B15R1.13264 CNC(=O)C(F)Oc1c(cccc1C)C 7a_100000210341_100009813575 [0,2,0,0,0,0|1,0,1]=4 9809 B15R1.13264 CNC(C)C(=O)Nc1c(cccc1C)C 2230a_100000218346_200000210301 [0,2,0,0,0,0|1,0,1]=4 9810 B15R1.13264 CNC(C)C(=O)Nc1c(cccc1C)C 2230a_106832991635_100000230315 [0,2,0,0,0,0|1,0,1]=4 9811 B15R1.13264 CNC(C)C(=O)Nc1c(cccc1C)C 34a_100000218346_200000210301 [0,2,0,0,0,0|1,0,1]=4 9812 B15R1.13264 CNC(C)C(=O)Nc1c(cccc1C)C 34a_100102657272_100000230315 [0,2,0,0,0,0|1,0,1]=4 9813 B15R1.13264 CNC(C)C(=O)Nc1c(cccc1C)C 7a_106832991635_100000230315 [0,2,0,0,0,0|1,0,1]=4 9814 B15R1.13264 COC(=O)C(C)Oc1c(cccc1C)C 34a_100000210341_100000211248 [0,2,0,0,0,0|1,0,1]=4 9815 B15R1.13264 COC(=O)C(C)Oc1c(cccc1C)C 7a_100000210341_100000211248 [0,2,0,0,0,0|1,0,1]=4 9816 B15R1.13264 Cc1cccc(c1NC(=O)C(C)N[13CH3])C 2230a_100000218346_200025704644 [0,2,0,0,0,0|1,0,1]=4 9817 B15R1.13264 Cc1cccc(c1NC(=O)C(C)N[13CH3])C 34a_100000218346_200025704644 [0,2,0,0,0,0|1,0,1]=4 9818 B15R1.13479 CCC(Oc1c(cccc1C)C)C(=O)N 34a_100000210341_100000750255 [0,2,0,0,0,0|1,0,1]=4 9819 B15R1.13479 CCC(Oc1c(cccc1C)C)C(=O)N 7a_100000210341_100000750255 [0,2,0,0,0,0|1,0,1]=4 9820 B15R1.25617 CC(=O)C(C)(C)Oc1c(cccc1C)C 7a_100000210341_100000075568 [0,2,0,0,0,0|1,0,1]=4 9821 B15R1.25617 Cc1cccc(c1OC(C)(C)C(=O)N)C 34a_100000210341_100000702505 [0,2,0,0,0,0|1,0,1]=4 9822 B15R1.25617 Cc1cccc(c1OC(C)(C)C(=O)N)C 7a_100000210341_100000702505 [0,2,0,0,0,0|1,0,1]=4 9823 B15R1.25617 Cc1cccc(c1OC(F)(F)C(=O)N)C 7a_100000210341_100009811971 [0,2,0,0,0,0|1,0,1]=4 9824 B15R1.25617 Cc1cccc(c1OC(F)(F)C(F)F)C 34a_100000210341_100000034128 [0,2,0,0,0,0|2,0,0]=4 9825 B15R1.1866 COc1ccc(c(c1C)NCC(C)C)C 34a_100000089760_100000210624 [0,2,0,0,0,0|2,0,0]=4 9826 B15R1.1866 COc1ccc(c(c1C)NCC(C)C)C 7a_100000089760_100000210760 [0,2,0,0,0,0|2,0,0]=4 9827 B15R1.1866 COc1ccc(c(c1C)NCC(C)O)C 34a_100000089760_100011218427 [0,2,0,0,0,0|2,0,0]=4 9828 B15R1.1866 COc1ccc(c(c1C)NCC(C)O)C 7a_100000089760_100011218427 [0,2,0,0,0,0|2,0,0]=4 9829 B15R1.1866 COc1ccc(c(c1C)NC[C@@H](C)O)C 34a_100000089760_100009817552 [0,2,0,0,0,0|2,0,0]=4 9830 B15R1.1866 COc1ccc(c(c1C)NC[C@@H](C)O)C 7a_100000089760_100009817552 [0,2,0,0,0,0|2,0,0]=4 9831 B15R1.1866 COc1ccc(c(c1C)SCC(C)C)C 62a_100000210624_100016151084 [0,2,0,0,0,0|1,1,0]=4 9832 B15R1.1866 COc1ccc(c(c1C)SCC(C)C)C 62a_100016151084_100000210760 [0,2,0,0,0,0|1,1,0]=4 9833 B15R1.1866 COc1ccc(c(c1C)SCC(C)O)C 62a_100011218427_100016151084 [0,2,0,0,0,0|1,1,0]=4 9834 B15R1.1866 COc1ccc(c(c1C)SCC(C)O)C 62a_100016151084_100011218427 [0,2,0,0,0,0|1,1,0]=4 9835 B15R1.1866 COc1ccc(c(c1C)SC[C@@H](C)O)C 62a_100009817552_100016151084 [0,2,0,0,0,0|1,1,0]=4 9836 B15R1.1866 COc1ccc(c(c1C)SC[C@@H](C)O)C 62a_100016151084_100009817552 [0,2,0,0,0,0|1,1,0]=4 9837 B15R1.1866 Cc1ncc(c(c1OCC(C)C)C)CO 34a_100000006305_100000210624 [0,2,0,0,0,0|2,0,0]=4 9838 B15R1.1866 Cc1ncc(c(c1OCC(C)C)C)CO 7a_100000006305_100000210760 [0,2,0,0,0,0|2,0,0]=4 9839 B15R1.1866 Cc1ncc(c(c1OCC(C)O)C)CO 34a_100000006305_100011218427 [0,2,0,0,0,0|2,0,0]=4 9840 B15R1.1866 Cc1ncc(c(c1OCC(C)O)C)CO 7a_100000006305_100011218427 [0,2,0,0,0,0|2,0,0]=4 9841 B15R1.1866 Cc1ncc(c(c1OC[C@@H](C)O)C)CO 34a_100000006305_100009817552 [0,2,0,0,0,0|2,0,0]=4 9842 B15R1.1866 Cc1ncc(c(c1OC[C@@H](C)O)C)CO 7a_100000006305_100009817552 [0,2,0,0,0,0|2,0,0]=4 9843 B15R1.12386 C=CC(O)COc1c(ccc(c1C)C)C 34a_100000211305_100000730141 [0,2,0,0,0,0|1,0,1]=4 9844 B15R1.12386 C=CC(O)COc1c(ccc(c1C)C)C 7a_100000211305_100000730141 [0,2,0,0,0,0|1,0,1]=4 9845 B15R1.12386 CCC(=O)COc1c(ccc(c1C)C)C 7a_100000211305_100000747405 [0,2,0,0,0,0|1,0,1]=4 9846 B15R1.12386 CCC(C)CNc1c(ccc(c1C)Br)C 34a_200010074581_100000748023 [0,2,0,0,0,0|2,0,0]=4 9847 B15R1.12386 CCC(C)CNc1c(ccc(c1C)C)C 2230a_100000117417_100000748023 [0,2,0,0,0,0|2,0,0]=4 9848 B15R1.12386 CCC(C)CNc1c(ccc(c1C)C)C 34a_100000117417_100000748023 [0,2,0,0,0,0|2,0,0]=4 9849 B15R1.12386 CCC(C)CNc1c(ccc(c1C)C)C 7a_100000117417_100000748023 [0,2,0,0,0,0|2,0,0]=4 9850 B15R1.12386 CCC(C)CNc1c(ccc(c1C)Cl)C 2230a_200020642106_100000748023 [0,2,0,0,0,0|2,0,0]=4 9851 B15R1.12386 CCC(C)CNc1c(ccc(c1C)Cl)C 34a_200020642106_100000748023 [0,2,0,0,0,0|2,0,0]=4 9852 B15R1.12386 CCC(C)CNc1c(ccc(c1C)I)C 34a_200010115591_100000748023 [0,2,0,0,0,0|2,0,0]=4 9853 B15R1.12386 CCC(C)COc1c(ccc(c1C)C)C 34a_100000211305_100000748023 [0,2,0,0,0,0|1,0,0]=3 9854 B15R1.12386 CCC(C)COc1c(ccc(c1C)C)C 7a_100000211305_100000748023 [0,2,0,0,0,0|1,0,0]=3 9855 B15R1.12386 CCC(C)COc1c(ccc(c1C)Cl)Br 34a_200010391122_100000748023 [0,2,0,0,0,0|2,0,0]=4 9856 B15R1.12386 CCC(C)COc1c(ccc(c1C)Cl)Br 7a_200010391122_100000748023 [0,2,0,0,0,0|2,0,0]=4 9857 B15R1.12386 CCC(C)COc1c(ccc(c1C)F)Br 34a_200010391124_100000748023 [0,2,0,0,0,0|2,0,0]=4 9858 B15R1.12386 CCC(C)COc1c(ccc(c1C)F)Br 7a_200010391124_100000748023 [0,2,0,0,0,0|2,0,0]=4 9859 B15R1.12386 CCC(C)COc1c(ccc(c1Cl)N)C 34a_100000036876_100000748023 [0,2,0,0,0,0|2,0,0]=4 9860 B15R1.12386 CCC(C)COc1c(ccc(c1Cl)N)C 7a_100000036876_100000748023 [0,2,0,0,0,0|2,0,0]=4 9861 B15R1.12386 CCC(C)CSc1c(ccc(c1C)F)C 62a_100000748023_100011068659 [0,2,0,0,0,0|1,1,0]=4 9862 B15R1.12386 CCC(C)CSc1c(ccc(c1C)F)C 62a_100011068659_100000748023 [0,2,0,0,0,0|1,1,0]=4 9863 B15R1.12386 CCC(C)CSc1c(ccc(c1C)N)C 62a_100000748023_106354213274 [0,2,0,0,0,0|1,1,0]=4 9864 B15R1.12386 CCC(C)CSc1c(ccc(c1C)N)C 62a_106354213274_100000748023 [0,2,0,0,0,0|1,1,0]=4 9865 B15R1.12386 CCC(C)CSc1c(ccc(c1C)O)C 62a_100000748023_100010659238 [0,2,0,0,0,0|1,1,0]=4 9866 B15R1.12386 CCC(C)CSc1c(ccc(c1C)O)C 62a_100010659238_100000748023 [0,2,0,0,0,0|1,1,0]=4 9867 B15R1.12386 CCC(O)CNc1c(ccc(c1C)Br)C 34a_200010074581_100011218378 [0,2,0,0,0,0|2,0,0]=4 9868 B15R1.12386 CCC(O)CNc1c(ccc(c1C)C)C 2230a_100000117417_100011218378 [0,2,0,0,0,0|2,0,0]=4 9869 B15R1.12386 CCC(O)CNc1c(ccc(c1C)C)C 34a_100000117417_100011218378 [0,2,0,0,0,0|2,0,0]=4 9870 B15R1.12386 CCC(O)CNc1c(ccc(c1C)C)C 7a_100000117417_100011218378 [0,2,0,0,0,0|2,0,0]=4 9871 B15R1.12386 CCC(O)CNc1c(ccc(c1C)Cl)C 2230a_200020642106_100011218378 [0,2,0,0,0,0|2,0,0]=4 9872 B15R1.12386 CCC(O)CNc1c(ccc(c1C)Cl)C 34a_200020642106_100011218378 [0,2,0,0,0,0|2,0,0]=4 9873 B15R1.12386 CCC(O)CNc1c(ccc(c1C)I)C 34a_200010115591_100011218378 [0,2,0,0,0,0|2,0,0]=4 9874 B15R1.12386 CCC(O)COc1c(ccc(c1C)C)C 34a_100000211305_100011218378 [0,2,0,0,0,0|1,0,0]=3 9875 B15R1.12386 CCC(O)COc1c(ccc(c1C)C)C 7a_100000211305_100011218378 [0,2,0,0,0,0|1,0,0]=3 9876 B15R1.12386 CCC(O)COc1c(ccc(c1C)Cl)Br 34a_200010391122_100011218378 [0,2,0,0,0,0|2,0,0]=4 9877 B15R1.12386 CCC(O)COc1c(ccc(c1C)Cl)Br 7a_200010391122_100011218378 [0,2,0,0,0,0|2,0,0]=4 9878 B15R1.12386 CCC(O)COc1c(ccc(c1C)F)Br 34a_200010391124_100011218378 [0,2,0,0,0,0|2,0,0]=4 9879 B15R1.12386 CCC(O)COc1c(ccc(c1C)F)Br 7a_200010391124_100011218378 [0,2,0,0,0,0|2,0,0]=4 9880 B15R1.12386 CCC(O)COc1c(ccc(c1Cl)N)C 34a_100000036876_100011218378 [0,2,0,0,0,0|2,0,0]=4 9881 B15R1.12386 CCC(O)COc1c(ccc(c1Cl)N)C 7a_100000036876_100011218378 [0,2,0,0,0,0|2,0,0]=4 9882 B15R1.12386 CCC(O)CSc1c(ccc(c1C)F)C 62a_100011068659_100011218378 [0,2,0,0,0,0|1,1,0]=4 9883 B15R1.12386 CCC(O)CSc1c(ccc(c1C)F)C 62a_100011218378_100011068659 [0,2,0,0,0,0|1,1,0]=4 9884 B15R1.12386 CCC(O)CSc1c(ccc(c1C)N)C 62a_100011218378_106354213274 [0,2,0,0,0,0|1,1,0]=4 9885 B15R1.12386 CCC(O)CSc1c(ccc(c1C)N)C 62a_106354213274_100011218378 [0,2,0,0,0,0|1,1,0]=4 9886 B15R1.12386 CCC(O)CSc1c(ccc(c1C)O)C 62a_100010659238_100011218378 [0,2,0,0,0,0|1,1,0]=4 9887 B15R1.12386 CCC(O)CSc1c(ccc(c1C)O)C 62a_100011218378_100010659238 [0,2,0,0,0,0|1,1,0]=4 9888 B15R1.12386 CC[C@H](C)CNc1c(ccc(c1C)Br)C 34a_200010074581_100009816398 [0,2,0,0,0,0|2,0,0]=4 9889 B15R1.12386 CC[C@H](C)CNc1c(ccc(c1C)C)C 2230a_100000117417_100009816398 [0,2,0,0,0,0|2,0,0]=4 9890 B15R1.12386 CC[C@H](C)CNc1c(ccc(c1C)C)C 34a_100000117417_100009816398 [0,2,0,0,0,0|2,0,0]=4 9891 B15R1.12386 CC[C@H](C)CNc1c(ccc(c1C)C)C 7a_100000117417_100009816398 [0,2,0,0,0,0|2,0,0]=4 9892 B15R1.12386 CC[C@H](C)CNc1c(ccc(c1C)Cl)C 2230a_200020642106_100009816398 [0,2,0,0,0,0|2,0,0]=4 9893 B15R1.12386 CC[C@H](C)CNc1c(ccc(c1C)Cl)C 34a_200020642106_100009816398 [0,2,0,0,0,0|2,0,0]=4 9894 B15R1.12386 CC[C@H](C)CNc1c(ccc(c1C)I)C 34a_200010115591_100009816398 [0,2,0,0,0,0|2,0,0]=4 9895 B15R1.12386 CC[C@H](C)COc1c(ccc(c1C)C)C 34a_100000211305_100009816398 [0,2,0,0,0,0|1,0,0]=3 9896 B15R1.12386 CC[C@H](C)COc1c(ccc(c1C)C)C 7a_100000211305_100009816398 [0,2,0,0,0,0|1,0,0]=3 9897 B15R1.12386 CC[C@H](C)COc1c(ccc(c1C)Cl)Br 34a_200010391122_100009816398 [0,2,0,0,0,0|2,0,0]=4 9898 B15R1.12386 CC[C@H](C)COc1c(ccc(c1C)Cl)Br 7a_200010391122_100009816398 [0,2,0,0,0,0|2,0,0]=4 9899 B15R1.12386 CC[C@H](C)COc1c(ccc(c1C)F)Br 34a_200010391124_100009816398 [0,2,0,0,0,0|2,0,0]=4 9900 B15R1.12386 CC[C@H](C)COc1c(ccc(c1C)F)Br 7a_200010391124_100009816398 [0,2,0,0,0,0|2,0,0]=4 9901 B15R1.12386 CC[C@H](C)COc1c(ccc(c1Cl)N)C 34a_100000036876_100009816398 [0,2,0,0,0,0|2,0,0]=4 9902 B15R1.12386 CC[C@H](C)COc1c(ccc(c1Cl)N)C 7a_100000036876_100009816398 [0,2,0,0,0,0|2,0,0]=4 9903 B15R1.12386 CC[C@H](C)CSc1c(ccc(c1C)F)C 62a_100009816398_100011068659 [0,2,0,0,0,0|1,1,0]=4 9904 B15R1.12386 CC[C@H](C)CSc1c(ccc(c1C)F)C 62a_100011068659_100009816398 [0,2,0,0,0,0|1,1,0]=4 9905 B15R1.12386 CC[C@H](C)CSc1c(ccc(c1C)N)C 62a_100009816398_106354213274 [0,2,0,0,0,0|1,1,0]=4 9906 B15R1.12386 CC[C@H](C)CSc1c(ccc(c1C)N)C 62a_106354213274_100009816398 [0,2,0,0,0,0|1,1,0]=4 9907 B15R1.12386 CC[C@H](C)CSc1c(ccc(c1C)O)C 62a_100009816398_100010659238 [0,2,0,0,0,0|1,1,0]=4 9908 B15R1.12386 CC[C@H](C)CSc1c(ccc(c1C)O)C 62a_100010659238_100009816398 [0,2,0,0,0,0|1,1,0]=4 9909 B15R1.12386 CNC(=O)COc1c(ccc(c1C)C)C 34a_100000211305_100000183359 [0,2,0,0,0,0|1,0,1]=4 9910 B15R1.12386 CNC(=O)COc1c(ccc(c1C)C)C 7a_100000211305_100000183359 [0,2,0,0,0,0|1,0,1]=4 9911 B15R1.12386 COC(=O)COc1c(ccc(c1C)C)C 34a_100000211305_100000747449 [0,2,0,0,0,0|1,0,1]=4 9912 B15R1.12386 COC(=O)COc1c(ccc(c1C)C)C 7a_100000211305_100000747449 [0,2,0,0,0,0|1,0,1]=4 9913 B15R1.12386 Cc1c(ccc(c1OCC(O)CO)Br)Cl 34a_200010391122_100011219619 [0,2,0,0,0,0|2,0,0]=4 9914 B15R1.12386 Cc1c(ccc(c1OCC(O)CO)Br)Cl 7a_200010391122_100011219619 [0,2,0,0,0,0|2,0,0]=4 9915 B15R1.12386 Cc1c(ccc(c1OCC(O)CO)Br)F 34a_200010391124_100011219619 [0,2,0,0,0,0|2,0,0]=4 9916 B15R1.12386 Cc1c(ccc(c1OCC(O)CO)Br)F 7a_200010391124_100011219619 [0,2,0,0,0,0|2,0,0]=4 9917 B15R1.12386 Cc1c(ccc(c1OC[C@@H](C)CO)Br)Cl 34a_200010391122_100000059175 [0,2,0,0,0,0|2,0,0]=4 9918 B15R1.12386 Cc1c(ccc(c1OC[C@@H](C)CO)Br)Cl 7a_200010391122_100000059175 [0,2,0,0,0,0|2,0,0]=4 9919 B15R1.12386 Cc1c(ccc(c1OC[C@@H](C)CO)Br)F 34a_200010391124_100000059175 [0,2,0,0,0,0|2,0,0]=4 9920 B15R1.12386 Cc1c(ccc(c1OC[C@@H](C)CO)Br)F 7a_200010391124_100000059175 [0,2,0,0,0,0|2,0,0]=4 9921 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CF)Br)Cl 34a_200010391122_100015614560 [0,2,0,0,0,0|2,0,0]=4 9922 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CF)Br)Cl 7a_200010391122_100015614560 [0,2,0,0,0,0|2,0,0]=4 9923 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CF)Br)F 34a_200010391124_100015614560 [0,2,0,0,0,0|2,0,0]=4 9924 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CF)Br)F 7a_200010391124_100015614560 [0,2,0,0,0,0|2,0,0]=4 9925 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CO)Br)Cl 34a_200010391122_100009815848 [0,2,0,0,0,0|2,0,0]=4 9926 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CO)Br)Cl 7a_200010391122_100009815848 [0,2,0,0,0,0|2,0,0]=4 9927 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CO)Br)F 34a_200010391124_100009815848 [0,2,0,0,0,0|2,0,0]=4 9928 B15R1.12386 Cc1c(ccc(c1OC[C@@H](O)CO)Br)F 7a_200010391124_100009815848 [0,2,0,0,0,0|2,0,0]=4 9929 B15R1.12386 Cc1ccc(c(c1C)NCC(O)CO)C 2230a_100000117417_100011219619 [0,2,0,0,0,0|2,0,0]=4 9930 B15R1.12386 Cc1ccc(c(c1C)NCC(O)CO)C 34a_100000117417_100011219619 [0,2,0,0,0,0|2,0,0]=4 9931 B15R1.12386 Cc1ccc(c(c1C)NCC(O)CO)C 7a_100000117417_100011219619 [0,2,0,0,0,0|2,0,0]=4 9932 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](C)CO)C 2230a_100000117417_100000059175 [0,2,0,0,0,0|2,0,0]=4 9933 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](C)CO)C 34a_100000117417_100000059175 [0,2,0,0,0,0|2,0,0]=4 9934 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](C)CO)C 7a_100000117417_100000059175 [0,2,0,0,0,0|2,0,0]=4 9935 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](O)CF)C 2230a_100000117417_100015614560 [0,2,0,0,0,0|2,0,0]=4 9936 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](O)CF)C 34a_100000117417_100015614560 [0,2,0,0,0,0|2,0,0]=4 9937 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](O)CF)C 7a_100000117417_100015614560 [0,2,0,0,0,0|2,0,0]=4 9938 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](O)CO)C 2230a_100000117417_100009815848 [0,2,0,0,0,0|2,0,0]=4 9939 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](O)CO)C 34a_100000117417_100009815848 [0,2,0,0,0,0|2,0,0]=4 9940 B15R1.12386 Cc1ccc(c(c1C)NC[C@@H](O)CO)C 7a_100000117417_100009815848 [0,2,0,0,0,0|2,0,0]=4 9941 B15R1.12386 Cc1ccc(c(c1C)OCC(O)CO)C 34a_100000211305_100011219619 [0,2,0,0,0,0|1,0,0]=3 9942 B15R1.12386 Cc1ccc(c(c1C)OCC(O)CO)C 7a_100000211305_100011219619 [0,2,0,0,0,0|1,0,0]=3 9943 B15R1.12386 Cc1ccc(c(c1C)OC[C@@H](C)CO)C 34a_100000211305_100000059175 [0,2,0,0,0,0|1,0,0]=3 9944 B15R1.12386 Cc1ccc(c(c1C)OC[C@@H](C)CO)C 7a_100000211305_100000059175 [0,2,0,0,0,0|1,0,0]=3 9945 B15R1.12386 Cc1ccc(c(c1C)OC[C@@H](O)CF)C 34a_100000211305_100015614560 [0,2,0,0,0,0|1,0,0]=3 9946 B15R1.12386 Cc1ccc(c(c1C)OC[C@@H](O)CF)C 7a_100000211305_100015614560 [0,2,0,0,0,0|1,0,0]=3 9947 B15R1.12386 Cc1ccc(c(c1C)OC[C@@H](O)CO)C 34a_100000211305_100009815848 [0,2,0,0,0,0|1,0,0]=3 9948 B15R1.12386 Cc1ccc(c(c1C)OC[C@@H](O)CO)C 7a_100000211305_100009815848 [0,2,0,0,0,0|1,0,0]=3 9949 B15R1.12386 Cc1ccc(c(c1NCC(O)CO)C)Br 34a_200010074581_100011219619 [0,2,0,0,0,0|2,0,0]=4 9950 B15R1.12386 Cc1ccc(c(c1NCC(O)CO)C)Cl 2230a_200020642106_100011219619 [0,2,0,0,0,0|2,0,0]=4 9951 B15R1.12386 Cc1ccc(c(c1NCC(O)CO)C)Cl 34a_200020642106_100011219619 [0,2,0,0,0,0|2,0,0]=4 9952 B15R1.12386 Cc1ccc(c(c1NCC(O)CO)C)I 34a_200010115591_100011219619 [0,2,0,0,0,0|2,0,0]=4 9953 B15R1.12386 Cc1ccc(c(c1NC[C@@H](C)CO)C)Br 34a_200010074581_100000059175 [0,2,0,0,0,0|2,0,0]=4 9954 B15R1.12386 Cc1ccc(c(c1NC[C@@H](C)CO)C)Cl 2230a_200020642106_100000059175 [0,2,0,0,0,0|2,0,0]=4 9955 B15R1.12386 Cc1ccc(c(c1NC[C@@H](C)CO)C)Cl 34a_200020642106_100000059175 [0,2,0,0,0,0|2,0,0]=4 9956 B15R1.12386 Cc1ccc(c(c1NC[C@@H](C)CO)C)I 34a_200010115591_100000059175 [0,2,0,0,0,0|2,0,0]=4 9957 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CF)C)Br 34a_200010074581_100015614560 [0,2,0,0,0,0|2,0,0]=4 9958 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CF)C)Cl 2230a_200020642106_100015614560 [0,2,0,0,0,0|2,0,0]=4 9959 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CF)C)Cl 34a_200020642106_100015614560 [0,2,0,0,0,0|2,0,0]=4 9960 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CF)C)I 34a_200010115591_100015614560 [0,2,0,0,0,0|2,0,0]=4 9961 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CO)C)Br 34a_200010074581_100009815848 [0,2,0,0,0,0|2,0,0]=4 9962 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CO)C)Cl 2230a_200020642106_100009815848 [0,2,0,0,0,0|2,0,0]=4 9963 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CO)C)Cl 34a_200020642106_100009815848 [0,2,0,0,0,0|2,0,0]=4 9964 B15R1.12386 Cc1ccc(c(c1NC[C@@H](O)CO)C)I 34a_200010115591_100009815848 [0,2,0,0,0,0|2,0,0]=4 9965 B15R1.12386 Cc1ccc(c(c1OCC(O)CO)Cl)N 34a_100000036876_100011219619 [0,2,0,0,0,0|2,0,0]=4 9966 B15R1.12386 Cc1ccc(c(c1OCC(O)CO)Cl)N 7a_100000036876_100011219619 [0,2,0,0,0,0|2,0,0]=4 9967 B15R1.12386 Cc1ccc(c(c1OC[C@@H](C)CO)Cl)N 34a_100000036876_100000059175 [0,2,0,0,0,0|2,0,0]=4 9968 B15R1.12386 Cc1ccc(c(c1OC[C@@H](C)CO)Cl)N 7a_100000036876_100000059175 [0,2,0,0,0,0|2,0,0]=4 9969 B15R1.12386 Cc1ccc(c(c1OC[C@@H](O)CF)Cl)N 34a_100000036876_100015614560 [0,2,0,0,0,0|2,0,0]=4 9970 B15R1.12386 Cc1ccc(c(c1OC[C@@H](O)CF)Cl)N 7a_100000036876_100015614560 [0,2,0,0,0,0|2,0,0]=4 9971 B15R1.12386 Cc1ccc(c(c1OC[C@@H](O)CO)Cl)N 34a_100000036876_100009815848 [0,2,0,0,0,0|2,0,0]=4 9972 B15R1.12386 Cc1ccc(c(c1OC[C@@H](O)CO)Cl)N 7a_100000036876_100009815848 [0,2,0,0,0,0|2,0,0]=4 9973 B15R1.12386 Cc1ccc(c(c1SCC(O)CO)C)F 62a_100011068659_100011219619 [0,2,0,0,0,0|1,1,0]=4 9974 B15R1.12386 Cc1ccc(c(c1SCC(O)CO)C)F 62a_100011219619_100011068659 [0,2,0,0,0,0|1,1,0]=4 9975 B15R1.12386 Cc1ccc(c(c1SCC(O)CO)C)N 62a_100011219619_106354213274 [0,2,0,0,0,0|1,1,0]=4 9976 B15R1.12386 Cc1ccc(c(c1SCC(O)CO)C)N 62a_106354213274_100011219619 [0,2,0,0,0,0|1,1,0]=4 9977 B15R1.12386 Cc1ccc(c(c1SCC(O)CO)C)O 62a_100010659238_100011219619 [0,2,0,0,0,0|1,1,0]=4 9978 B15R1.12386 Cc1ccc(c(c1SCC(O)CO)C)O 62a_100011219619_100010659238 [0,2,0,0,0,0|1,1,0]=4 9979 B15R1.12386 Cc1ccc(c(c1SC[C@@H](C)CO)C)F 62a_100000059175_100011068659 [0,2,0,0,0,0|1,1,0]=4 9980 B15R1.12386 Cc1ccc(c(c1SC[C@@H](C)CO)C)F 62a_100011068659_100000059175 [0,2,0,0,0,0|1,1,0]=4 9981 B15R1.12386 Cc1ccc(c(c1SC[C@@H](C)CO)C)N 62a_100000059175_106354213274 [0,2,0,0,0,0|1,1,0]=4 9982 B15R1.12386 Cc1ccc(c(c1SC[C@@H](C)CO)C)N 62a_106354213274_100000059175 [0,2,0,0,0,0|1,1,0]=4 9983 B15R1.12386 Cc1ccc(c(c1SC[C@@H](C)CO)C)O 62a_100000059175_100010659238 [0,2,0,0,0,0|1,1,0]=4 9984 B15R1.12386 Cc1ccc(c(c1SC[C@@H](C)CO)C)O 62a_100010659238_100000059175 [0,2,0,0,0,0|1,1,0]=4 9985 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CF)C)F 62a_100011068659_100015614560 [0,2,0,0,0,0|1,1,0]=4 9986 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CF)C)F 62a_100015614560_100011068659 [0,2,0,0,0,0|1,1,0]=4 9987 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CF)C)N 62a_100015614560_106354213274 [0,2,0,0,0,0|1,1,0]=4 9988 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CF)C)N 62a_106354213274_100015614560 [0,2,0,0,0,0|1,1,0]=4 9989 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CF)C)O 62a_100010659238_100015614560 [0,2,0,0,0,0|1,1,0]=4 9990 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CF)C)O 62a_100015614560_100010659238 [0,2,0,0,0,0|1,1,0]=4 9991 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CO)C)F 62a_100009815848_100011068659 [0,2,0,0,0,0|1,1,0]=4 9992 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CO)C)F 62a_100011068659_100009815848 [0,2,0,0,0,0|1,1,0]=4 9993 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CO)C)N 62a_100009815848_106354213274 [0,2,0,0,0,0|1,1,0]=4 9994 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CO)C)N 62a_106354213274_100009815848 [0,2,0,0,0,0|1,1,0]=4 9995 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CO)C)O 62a_100009815848_100010659238 [0,2,0,0,0,0|1,1,0]=4 9996 B15R1.12386 Cc1ccc(c(c1SC[C@@H](O)CO)C)O 62a_100010659238_100009815848 [0,2,0,0,0,0|1,1,0]=4 9997 B15R1.15580 Cc1cc(c(c(c1C)NCC(C)C)C)C 2230a_100020670348_100000210760 [0,2,0,0,0,0|2,0,0]=4 9998 B15R1.15580 Cc1cc(c(c(c1C)NCC(C)C)C)C 34a_100020670348_100000210624 [0,2,0,0,0,0|2,0,0]=4 9999 B15R1.15580 Cc1cc(c(c(c1C)NCC(C)C)C)C 7a_100020670348_100000210760 [0,2,0,0,0,0|2,0,0]=4 10000 B15R1.15580 Cc1cc(c(c(c1C)NCC(C)O)C)C 2230a_100020670348_100011218427 [0,2,0,0,0,0|2,0,0]=4 10001 B15R1.15580 Cc1cc(c(c(c1C)NCC(C)O)C)C 34a_100020670348_100011218427 [0,2,0,0,0,0|2,0,0]=4 10002 B15R1.15580 Cc1cc(c(c(c1C)NCC(C)O)C)C 7a_100020670348_100011218427 [0,2,0,0,0,0|2,0,0]=4 10003 B15R1.15580 Cc1cc(c(c(c1C)NC[C@@H](C)O)C)C 2230a_100020670348_100009817552 [0,2,0,0,0,0|2,0,0]=4 10004 B15R1.15580 Cc1cc(c(c(c1C)NC[C@@H](C)O)C)C 34a_100020670348_100009817552 [0,2,0,0,0,0|2,0,0]=4 10005 B15R1.15580 Cc1cc(c(c(c1C)NC[C@@H](C)O)C)C 7a_100020670348_100009817552 [0,2,0,0,0,0|2,0,0]=4 10006 B15R1.15580 Cc1cc(c(c(c1C)SCC(C)C)C)C 62a_100000210624_100011215432 [0,2,0,0,0,0|1,1,0]=4 10007 B15R1.15580 Cc1cc(c(c(c1C)SCC(C)C)C)C 62a_100011215432_100000210760 [0,2,0,0,0,0|1,1,0]=4 10008 B15R1.15580 Cc1cc(c(c(c1C)SCC(C)O)C)C 62a_100011215432_100011218427 [0,2,0,0,0,0|1,1,0]=4 10009 B15R1.15580 Cc1cc(c(c(c1C)SCC(C)O)C)C 62a_100011218427_100011215432 [0,2,0,0,0,0|1,1,0]=4 10010 B15R1.15580 Cc1cc(c(c(c1C)SC[C@@H](C)O)C)C 62a_100009817552_100011215432 [0,2,0,0,0,0|1,1,0]=4 10011 B15R1.15580 Cc1cc(c(c(c1C)SC[C@@H](C)O)C)C 62a_100011215432_100009817552 [0,2,0,0,0,0|1,1,0]=4 10012 B15R1.30116 CCC(CC)CNc1c(cccc1C)C 34a_100000185769_100011215472 [0,2,0,0,0,0|2,0,0]=4 10013 B15R1.30116 CCC(CC)COc1c(cccc1Br)C 34a_100009817157_100011215472 [0,2,0,0,0,0|2,0,0]=4 10014 B15R1.30116 CCC(CC)COc1c(cccc1Br)C 7a_100009817157_100011215472 [0,2,0,0,0,0|2,0,0]=4 10015 B15R1.30116 CCC(CC)COc1c(cccc1C)C 34a_100000210341_100011215472 [0,2,0,0,0,0|1,0,0]=3 10016 B15R1.30116 CCC(CC)COc1c(cccc1C)C 7a_100000210341_100011215472 [0,2,0,0,0,0|1,0,0]=3 10017 B15R1.30116 CCC(CC)COc1c(cccc1Cl)C 34a_100000033731_100011215472 [0,2,0,0,0,0|2,0,0]=4 10018 B15R1.30116 CCC(CC)COc1c(cccc1Cl)C 7a_100000033731_100011215472 [0,2,0,0,0,0|2,0,0]=4 10019 B15R1.30116 CCC(CC)COc1c(cccc1F)C 34a_100011659162_100011215472 [0,2,0,0,0,0|2,0,0]=4 10020 B15R1.30116 CCC(CC)COc1c(cccc1F)C 7a_100011659162_100011215472 [0,2,0,0,0,0|2,0,0]=4 10021 B15R1.30116 CCC(CC)COc1c(cccc1N)C 34a_100000756359_100011215472 [0,2,0,0,0,0|2,0,0]=4 10022 B15R1.30116 CCC(CC)COc1c(cccc1N)C 7a_100000756359_100011215472 [0,2,0,0,0,0|2,0,0]=4 10023 B15R1.30116 CCC(CC)COc1c(ccnc1C)C 34a_100011934651_100011215472 [0,2,0,0,0,0|2,0,0]=4 10024 B15R1.30116 CCC(CC)COc1c(ccnc1C)C 7a_100011934651_100011215472 [0,2,0,0,0,0|2,0,0]=4 10025 B15R1.30116 CCC(CC)CSc1c(cccc1C)C 62a_100000033847_100011215472 [0,2,0,0,0,0|1,1,0]=4 10026 B15R1.30116 CCC(CC)CSc1c(cccc1C)C 62a_100011215472_100000033847 [0,2,0,0,0,0|1,1,0]=4 10027 B15R1.30116 COC(CNc1c(cccc1C)C)OC 34a_100000185769_100000211822 [0,2,0,0,0,0|2,0,0]=4 10028 B15R1.30116 COC(COc1c(cccc1Br)C)OC 34a_100009817157_100000211822 [0,2,0,0,0,0|2,0,0]=4 10029 B15R1.30116 COC(COc1c(cccc1Br)C)OC 7a_100009817157_100000751394 [0,2,0,0,0,0|2,0,0]=4 10030 B15R1.30116 COC(COc1c(cccc1C)C)OC 34a_100000210341_100000211822 [0,2,0,0,0,0|1,0,0]=3 10031 B15R1.30116 COC(COc1c(cccc1C)C)OC 7a_100000210341_100000751394 [0,2,0,0,0,0|1,0,0]=3 10032 B15R1.30116 COC(COc1c(cccc1Cl)C)OC 34a_100000033731_100000211822 [0,2,0,0,0,0|2,0,0]=4 10033 B15R1.30116 COC(COc1c(cccc1Cl)C)OC 7a_100000033731_100000751394 [0,2,0,0,0,0|2,0,0]=4 10034 B15R1.30116 COC(COc1c(cccc1F)C)OC 34a_100011659162_100000211822 [0,2,0,0,0,0|2,0,0]=4 10035 B15R1.30116 COC(COc1c(cccc1F)C)OC 7a_100011659162_100000751394 [0,2,0,0,0,0|2,0,0]=4 10036 B15R1.30116 COC(COc1c(cccc1N)C)OC 34a_100000756359_100000211822 [0,2,0,0,0,0|2,0,0]=4 10037 B15R1.30116 COC(COc1c(cccc1N)C)OC 7a_100000756359_100000751394 [0,2,0,0,0,0|2,0,0]=4 10038 B15R1.30116 COC(COc1c(ccnc1C)C)OC 34a_100011934651_100000211822 [0,2,0,0,0,0|2,0,0]=4 10039 B15R1.30116 COC(COc1c(ccnc1C)C)OC 7a_100011934651_100000751394 [0,2,0,0,0,0|2,0,0]=4 10040 B15R1.30116 COC(CSc1c(cccc1C)C)OC 62a_100000033847_100000751394 [0,2,0,0,0,0|1,1,0]=4 10041 B15R1.30116 COC(CSc1c(cccc1C)C)OC 62a_100000751394_100000033847 [0,2,0,0,0,0|1,1,0]=4 10042 B15R1.30116 Cc1cccc(c1COC(CN)CN)C 34a_100000031598_100000758300 [0,2,0,0,0,0|2,0,0]=4 10043 B15R1.36731 C#CCC(=O)COc1c(cccc1C)C 1458a_100000184085_100000184674 [0,2,0,0,0,0|1,0,1]=4 10044 B15R1.36731 C=CCC(=O)COc1c(cccc1C)C 1458a_100000184085_100000210623 [0,2,0,0,0,0|1,0,1]=4 10045 B15R1.36731 CCCC(=O)COc1c(cccc1C)C 1458a_100000184085_100000210303 [0,2,0,0,0,0|1,0,1]=4 10046 B15R1.36731 CCCC(=O)COc1c(cccc1C)C 7a_100000210341_100000747444 [0,2,0,0,0,0|1,0,1]=4 10047 B15R1.36731 CCCC(C)CNc1c(cccc1C)C 34a_100000185769_100011216630 [0,2,0,0,0,0|2,0,0]=4 10048 B15R1.36731 CCCC(C)COc1c(cccc1Br)C 34a_100009817157_100011216630 [0,2,0,0,0,0|2,0,0]=4 10049 B15R1.36731 CCCC(C)COc1c(cccc1Br)C 7a_100009817157_100011216630 [0,2,0,0,0,0|2,0,0]=4 10050 B15R1.36731 CCCC(C)COc1c(cccc1C)C 34a_100000210341_100011216630 [0,2,0,0,0,0|1,0,0]=3 10051 B15R1.36731 CCCC(C)COc1c(cccc1C)C 7a_100000210341_100011216630 [0,2,0,0,0,0|1,0,0]=3 10052 B15R1.36731 CCCC(C)COc1c(cccc1Cl)C 34a_100000033731_100011216630 [0,2,0,0,0,0|2,0,0]=4 10053 B15R1.36731 CCCC(C)COc1c(cccc1Cl)C 7a_100000033731_100011216630 [0,2,0,0,0,0|2,0,0]=4 10054 B15R1.36731 CCCC(C)COc1c(cccc1F)C 34a_100011659162_100011216630 [0,2,0,0,0,0|2,0,0]=4 10055 B15R1.36731 CCCC(C)COc1c(cccc1F)C 7a_100011659162_100011216630 [0,2,0,0,0,0|2,0,0]=4 10056 B15R1.36731 CCCC(C)COc1c(cccc1N)C 34a_100000756359_100011216630 [0,2,0,0,0,0|2,0,0]=4 10057 B15R1.36731 CCCC(C)COc1c(cccc1N)C 7a_100000756359_100011216630 [0,2,0,0,0,0|2,0,0]=4 10058 B15R1.36731 CCCC(C)COc1c(ccnc1C)C 34a_100011934651_100011216630 [0,2,0,0,0,0|2,0,0]=4 10059 B15R1.36731 CCCC(C)COc1c(ccnc1C)C 7a_100011934651_100011216630 [0,2,0,0,0,0|2,0,0]=4 10060 B15R1.36731 CCCC(C)CSc1c(cccc1C)C 62a_100000033847_100011216630 [0,2,0,0,0,0|1,1,0]=4 10061 B15R1.36731 CCCC(C)CSc1c(cccc1C)C 62a_100011216630_100000033847 [0,2,0,0,0,0|1,1,0]=4 10062 B15R1.36731 CCNC(=O)COc1c(cccc1C)C 11a_100015525214_100000184085 [0,2,0,0,0,0|1,0,1]=4 10063 B15R1.36731 CCNC(=O)COc1c(cccc1C)C 240690a_100015525214_100000184085 [0,2,0,0,0,0|1,0,1]=4 10064 B15R1.36731 CCNC(=O)COc1c(cccc1C)C 34a_100000210341_100000183381 [0,2,0,0,0,0|1,0,1]=4 10065 B15R1.36731 CCNC(=O)COc1c(cccc1C)C 527a_100015525214_100000184085 [0,2,0,0,0,0|1,0,1]=4 10066 B15R1.36731 CCNC(=O)COc1c(cccc1C)C 7a_100000210341_100000183381 [0,2,0,0,0,0|1,0,1]=4 10067 B15R1.36731 CCNC(C)COc1c(cccc1C)C 2230a_100000744845_100000210202 [0,2,0,0,0,0|0,0,0]=2 10068 B15R1.36731 CCNC(C)COc1c(cccc1C)C 270004a_100015525214_100011343208 [0,2,0,0,0,0|0,0,0]=2 10069 B15R1.36731 CCNC(C)COc1c(cccc1C)C 34a_100000744845_100000210202 [0,2,0,0,0,0|0,0,0]=2 10070 B15R1.36731 CCOC(=O)COc1c(cccc1C)C 34a_100000210341_100000188475 [0,2,0,0,0,0|1,0,1]=4 10071 B15R1.36731 CCOC(=O)COc1c(cccc1C)C 7a_100000210341_100000188475 [0,2,0,0,0,0|1,0,1]=4 10072 B15R1.36731 CNNC(=O)COc1c(cccc1C)C 22a_100016993582_100000184085 [0,2,0,0,0,0|1,0,1]=4 10073 B15R1.36731 COCC(O)CNc1c(cccc1C)C 34a_100000185769_100011215053 [0,2,0,0,0,0|2,0,0]=4 10074 B15R1.36731 COCC(O)COc1c(cccc1Br)C 34a_100009817157_100011215053 [0,2,0,0,0,0|2,0,0]=4 10075 B15R1.36731 COCC(O)COc1c(cccc1Br)C 7a_100009817157_100011215053 [0,2,0,0,0,0|2,0,0]=4 10076 B15R1.36731 COCC(O)COc1c(cccc1C)C 34a_100000210341_100011215053 [0,2,0,0,0,0|1,0,0]=3 10077 B15R1.36731 COCC(O)COc1c(cccc1C)C 7a_100000210341_100011215053 [0,2,0,0,0,0|1,0,0]=3 10078 B15R1.36731 COCC(O)COc1c(cccc1Cl)C 34a_100000033731_100011215053 [0,2,0,0,0,0|2,0,0]=4 10079 B15R1.36731 COCC(O)COc1c(cccc1Cl)C 7a_100000033731_100011215053 [0,2,0,0,0,0|2,0,0]=4 10080 B15R1.36731 COCC(O)COc1c(cccc1F)C 34a_100011659162_100011215053 [0,2,0,0,0,0|2,0,0]=4 10081 B15R1.36731 COCC(O)COc1c(cccc1F)C 7a_100011659162_100011215053 [0,2,0,0,0,0|2,0,0]=4 10082 B15R1.36731 COCC(O)COc1c(cccc1N)C 34a_100000756359_100011215053 [0,2,0,0,0,0|2,0,0]=4 10083 B15R1.36731 COCC(O)COc1c(cccc1N)C 7a_100000756359_100011215053 [0,2,0,0,0,0|2,0,0]=4 10084 B15R1.36731 COCC(O)COc1c(ccnc1C)C 34a_100011934651_100011215053 [0,2,0,0,0,0|2,0,0]=4 10085 B15R1.36731 COCC(O)COc1c(ccnc1C)C 7a_100011934651_100011215053 [0,2,0,0,0,0|2,0,0]=4 10086 B15R1.36731 COCC(O)CSc1c(cccc1C)C 62a_100000033847_100011215053 [0,2,0,0,0,0|1,1,0]=4 10087 B15R1.36731 COCC(O)CSc1c(cccc1C)C 62a_100011215053_100000033847 [0,2,0,0,0,0|1,1,0]=4 10088 B15R1.36731 Cc1cccc(c1OCC(=O)CC#N)C 1458a_100000184085_100011214920 [0,2,0,0,0,0|1,0,1]=4 10089 B15R1.36731 Cc1cccc(c1OCC(=O)CCF)C 1458a_100000184085_100011217306 [0,2,0,0,0,0|1,0,1]=4 10090 B15R1.36731 Cc1cccc(c1OCC(=O)CCO)C 1458a_100000184085_100000211926 [0,2,0,0,0,0|1,0,1]=4 10091 B15R1.36731 Cc1cccc(c1OCC(=O)NCO)C 34a_100000210341_100000185155 [0,2,0,0,0,0|1,0,1]=4 10092 B15R1.36731 Cc1cccc(c1OCC(=O)NCO)C 7a_100000210341_100000185155 [0,2,0,0,0,0|1,0,1]=4 10093 B15R1.36731 Cc1cccc(c1OCC(C)NCF)C 34a_100000744845_100015361967 [0,2,0,0,0,0|0,0,0]=2 10094 B15R1.36731 Cc1cccc(c1OC[C@@H](O)CC#N)Br 7a_100009817157_100000001066 [0,2,0,0,0,0|2,0,0]=4 10095 B15R1.36731 Cc1cccc(c1OC[C@@H](O)CC#N)C 7a_100000210341_100000001066 [0,2,0,0,0,0|1,0,0]=3 10096 B15R1.36731 Cc1cccc(c1OC[C@@H](O)CC#N)Cl 7a_100000033731_100000001066 [0,2,0,0,0,0|2,0,0]=4 10097 B15R1.36731 Cc1cccc(c1OC[C@@H](O)CC#N)F 7a_100011659162_100000001066 [0,2,0,0,0,0|2,0,0]=4 10098 B15R1.36731 Cc1cccc(c1OC[C@@H](O)CC#N)N 7a_100000756359_100000001066 [0,2,0,0,0,0|2,0,0]=4 10099 B15R1.36731 Cc1cccc(c1SC[C@@H](O)CC#N)C 62a_100000001066_100000033847 [0,2,0,0,0,0|1,1,0]=4 10100 B15R1.36731 Cc1cccc(c1SC[C@@H](O)CC#N)C 62a_100000033847_100000001066 [0,2,0,0,0,0|1,1,0]=4 10101 B15R1.36731 Cc1ccnc(c1OC[C@@H](O)CC#N)C 7a_100011934651_100000001066 [0,2,0,0,0,0|2,0,0]=4 10102 B13R1.149 Cc1cccc(c1)COC[C@@H](C)N 34a_100000737577_100000211840 [0,0,1,1,0,0|0,0,2]=4 10103 B13R1.149 Cc1cccc(n1)COC[C@@H](C)N 34a_100000737577_100000757606 [0,0,1,1,0,0|1,0,1]=4 10104 B13R2.435 CC(=O)C1Cc2ccccc2O1 1458a_100000209886_200000210301 [1,0,0,1,0,0|1,0,1]=4 10105 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2O1 1458a_100000209886_200025704644 [1,0,0,1,0,0|1,0,1]=4 10106 B13R2.3587 Brc1ccccc1OCC2CC2 34a_100000181306_100000742324 [1,0,0,1,0,0|2,0,0]=4 10107 B13R2.3587 Brc1ccccc1OCC2CC2 7a_100000181306_100000742324 [1,0,0,1,0,0|2,0,0]=4 10108 B13R2.3587 Brc1ccccc1OCC2CO2 34a_100000181306_102125554688 [1,0,0,1,0,0|2,0,0]=4 10109 B13R2.3587 Brc1ccccc1OCC2CO2 7a_100000181306_102125554688 [1,0,0,1,0,0|2,0,0]=4 10110 B13R2.3587 Brc1ccccc1OCC2CS2 7a_100000181306_100000031435 [1,0,0,1,0,0|2,0,0]=4 10111 B13R2.3587 Brc1ccccc1OC[C@@H]2CO2 7a_100000181306_100000745022 [1,0,0,1,0,0|2,0,0]=4 10112 B13R2.3587 Cc1ccccc1NCC2CC2 34a_100015192222_100000742324 [1,0,0,1,0,0|2,0,0]=4 10113 B13R2.3587 Cc1ccccc1NCC2CO2 34a_100015192222_102125554688 [1,0,0,1,0,0|2,0,0]=4 10114 B13R2.3587 Cc1ccccc1OCC2CC2 34a_100000210338_100000742324 [1,0,0,1,0,0|1,0,0]=3 10115 B13R2.3587 Cc1ccccc1OCC2CC2 7a_100000210338_100000742324 [1,0,0,1,0,0|1,0,0]=3 10116 B13R2.3587 Cc1ccccc1OCC2CO2 34a_100000210338_102125554688 [1,0,0,1,0,0|1,0,0]=3 10117 B13R2.3587 Cc1ccccc1OCC2CO2 7a_100000210338_102125554688 [1,0,0,1,0,0|1,0,0]=3 10118 B13R2.3587 Cc1ccccc1OCC2CS2 7a_100000210338_100000031435 [1,0,0,1,0,0|1,0,0]=3 10119 B13R2.3587 Cc1ccccc1OC[C@@H]2CO2 7a_100000210338_100000745022 [1,0,0,1,0,0|1,0,0]=3 10120 B13R2.3587 Cc1ccccc1SCC2CC2 62a_100000210755_100000742324 [1,0,0,1,0,0|1,1,0]=4 10121 B13R2.3587 Cc1ccccc1SCC2CC2 62a_100000756562_100000210755 [1,0,0,1,0,0|1,1,0]=4 10122 B13R2.3587 Cc1ccccc1SCC2CO2 62a_100000210755_102125554688 [1,0,0,1,0,0|1,1,0]=4 10123 B13R2.3587 Cc1ccccc1SCC2CO2 62a_102125554688_100000210755 [1,0,0,1,0,0|1,1,0]=4 10124 B13R2.3587 Cc1ccccc1SCC2CS2 62a_100000031435_100000210755 [1,0,0,1,0,0|1,1,0]=4 10125 B13R2.3587 Cc1ccccc1SCC2CS2 62a_100000210755_100000031435 [1,0,0,1,0,0|1,1,0]=4 10126 B13R2.3587 Cc1ccccc1SC[C@@H]2CO2 62a_100000210755_100000745022 [1,0,0,1,0,0|1,1,0]=4 10127 B13R2.3587 Cc1ccccc1SC[C@@H]2CO2 62a_100000745022_100000210755 [1,0,0,1,0,0|1,1,0]=4 10128 B13R2.3587 Cc1ccncc1OCC2CC2 34a_100011997053_100000742324 [1,0,0,1,0,0|2,0,0]=4 10129 B13R2.3587 Cc1ccncc1OCC2CC2 7a_100011997053_100000742324 [1,0,0,1,0,0|2,0,0]=4 10130 B13R2.3587 Cc1ccncc1OCC2CO2 34a_100011997053_102125554688 [1,0,0,1,0,0|2,0,0]=4 10131 B13R2.3587 Cc1ccncc1OCC2CO2 7a_100011997053_102125554688 [1,0,0,1,0,0|2,0,0]=4 10132 B13R2.3587 Cc1ccncc1OCC2CS2 7a_100011997053_100000031435 [1,0,0,1,0,0|2,0,0]=4 10133 B13R2.3587 Cc1ccncc1OC[C@@H]2CO2 7a_100011997053_100000745022 [1,0,0,1,0,0|2,0,0]=4 10134 B13R2.3587 Cc1cnccc1OCC2CC2 34a_100000694293_100000742324 [1,0,0,1,0,0|2,0,0]=4 10135 B13R2.3587 Cc1cnccc1OCC2CO2 34a_100000694293_102125554688 [1,0,0,1,0,0|2,0,0]=4 10136 B13R2.3587 Cc1ncccc1OCC2CC2 34a_100000745507_100000742324 [1,0,0,1,0,0|2,0,0]=4 10137 B13R2.3587 Cc1ncccc1OCC2CC2 7a_100000745507_100000742324 [1,0,0,1,0,0|2,0,0]=4 10138 B13R2.3587 Cc1ncccc1OCC2CO2 34a_100000745507_102125554688 [1,0,0,1,0,0|2,0,0]=4 10139 B13R2.3587 Cc1ncccc1OCC2CO2 7a_100000745507_102125554688 [1,0,0,1,0,0|2,0,0]=4 10140 B13R2.3587 Cc1ncccc1OCC2CS2 7a_100000745507_100000031435 [1,0,0,1,0,0|2,0,0]=4 10141 B13R2.3587 Cc1ncccc1OC[C@@H]2CO2 7a_100000745507_100000745022 [1,0,0,1,0,0|2,0,0]=4 10142 B13R2.3587 Clc1ccccc1OCC2CC2 34a_100000210172_100000742324 [1,0,0,1,0,0|2,0,0]=4 10143 B13R2.3587 Clc1ccccc1OCC2CC2 7a_100000210172_100000742324 [1,0,0,1,0,0|2,0,0]=4 10144 B13R2.3587 Clc1ccccc1OCC2CO2 34a_100000210172_102125554688 [1,0,0,1,0,0|2,0,0]=4 10145 B13R2.3587 Clc1ccccc1OCC2CO2 7a_100000210172_102125554688 [1,0,0,1,0,0|2,0,0]=4 10146 B13R2.3587 Clc1ccccc1OCC2CS2 7a_100000210172_100000031435 [1,0,0,1,0,0|2,0,0]=4 10147 B13R2.3587 Clc1ccccc1OC[C@@H]2CO2 7a_100000210172_100000745022 [1,0,0,1,0,0|2,0,0]=4 10148 B13R2.3587 Fc1ccccc1OCC2CC2 34a_100000210171_100000742324 [1,0,0,1,0,0|2,0,0]=4 10149 B13R2.3587 Fc1ccccc1OCC2CC2 7a_100000210171_100000742324 [1,0,0,1,0,0|2,0,0]=4 10150 B13R2.3587 Fc1ccccc1OCC2CO2 34a_100000210171_102125554688 [1,0,0,1,0,0|2,0,0]=4 10151 B13R2.3587 Fc1ccccc1OCC2CO2 7a_100000210171_102125554688 [1,0,0,1,0,0|2,0,0]=4 10152 B13R2.3587 Fc1ccccc1OCC2CS2 7a_100000210171_100000031435 [1,0,0,1,0,0|2,0,0]=4 10153 B13R2.3587 Fc1ccccc1OC[C@@H]2CO2 7a_100000210171_100000745022 [1,0,0,1,0,0|2,0,0]=4 10154 B13R2.3587 Ic1ccccc1OCC2CC2 34a_100000739446_100000742324 [1,0,0,1,0,0|2,0,0]=4 10155 B13R2.3587 Ic1ccccc1OCC2CC2 7a_100000739446_100000742324 [1,0,0,1,0,0|2,0,0]=4 10156 B13R2.3587 Ic1ccccc1OCC2CO2 34a_100000739446_102125554688 [1,0,0,1,0,0|2,0,0]=4 10157 B13R2.3587 Ic1ccccc1OCC2CO2 7a_100000739446_102125554688 [1,0,0,1,0,0|2,0,0]=4 10158 B13R2.3587 Ic1ccccc1OCC2CS2 7a_100000739446_100000031435 [1,0,0,1,0,0|2,0,0]=4 10159 B13R2.3587 Ic1ccccc1OC[C@@H]2CO2 7a_100000739446_100000745022 [1,0,0,1,0,0|2,0,0]=4 10160 B13R2.3587 Nc1ccccc1OCC2CC2 34a_100000185747_100000742324 [1,0,0,1,0,0|2,0,0]=4 10161 B13R2.3587 Nc1ccccc1OCC2CC2 7a_100000185747_100000742324 [1,0,0,1,0,0|2,0,0]=4 10162 B13R2.3587 Nc1ccccc1OCC2CO2 34a_100000185747_102125554688 [1,0,0,1,0,0|2,0,0]=4 10163 B13R2.3587 Nc1ccccc1OCC2CO2 7a_100000185747_102125554688 [1,0,0,1,0,0|2,0,0]=4 10164 B13R2.3587 Nc1ccccc1OCC2CS2 7a_100000185747_100000031435 [1,0,0,1,0,0|2,0,0]=4 10165 B13R2.3587 Nc1ccccc1OC[C@@H]2CO2 7a_100000185747_100000745022 [1,0,0,1,0,0|2,0,0]=4 10166 B13R2.3587 Oc1ccccc1OCC2CC2 271570a_203496583355_100011316338 [1,0,0,1,0,0|2,0,0]=4 10167 B13R2.54 CCN1Cc2cccc(c2C1)C 2230a_100020635169_100000210202 [1,0,0,1,0,0|2,0,0]=4 10168 B13R2.54 CCN1Cc2cccc(c2C1)C 269982a_100020635169_100000204670 [1,0,0,1,0,0|2,0,0]=4 10169 B13R2.54 CCN1Cc2cccc(c2C1)C 34a_100020635169_100000210202 [1,0,0,1,0,0|2,0,0]=4 10170 B13R2.54 CNC1Cc2cccc(c2C1)C 270004a_106832991635_100010637320 [1,0,0,1,0,0|2,0,0]=4 10171 B13R2.54 OCC1Cc2cccc(c2O1)O 271570a_203496583355_200102525175 [1,0,0,1,0,0|2,0,0]=4 10172 B13R2.402 Brc1cccc(c1OC2CC2)Br 34a_100000736428_100000211595 [1,0,0,1,0,0|2,0,0]=4 10173 B13R2.402 Brc1cccc(c1OC2CC2)I 34a_100010084509_100000211595 [1,0,0,1,0,0|2,0,0]=4 10174 B13R2.402 Cc1cccc(c1NC2CC2)Br 34a_100011834072_100000211595 [1,0,0,1,0,0|2,0,0]=4 10175 B13R2.402 Cc1cccc(c1NC2CC2)C 34a_100000185769_100000211595 [1,0,0,1,0,0|1,0,0]=3 10176 B13R2.402 Cc1cccc(c1NC2CC2)Cl 34a_100000756524_100000211595 [1,0,0,1,0,0|2,0,0]=4 10177 B13R2.402 Cc1cccc(c1NC2CC2)F 34a_100000766463_100000211595 [1,0,0,1,0,0|2,0,0]=4 10178 B13R2.402 Cc1cccc(c1NC2CC2)O 34a_100000743429_100000211595 [1,0,0,1,0,0|2,0,0]=4 10179 B13R2.402 Cc1cccc(c1OC2CC2)Br 34a_100009817157_100000211595 [1,0,0,1,0,0|1,0,0]=3 10180 B13R2.402 Cc1cccc(c1OC2CC2)C 34a_100000210341_100000211595 [1,0,0,1,0,0|0,0,0]=2 10181 B13R2.402 Cc1cccc(c1OC2CC2)Cl 34a_100000033731_100000211595 [1,0,0,1,0,0|1,0,0]=3 10182 B13R2.402 Cc1cccc(c1OC2CC2)F 34a_100011659162_100000211595 [1,0,0,1,0,0|1,0,0]=3 10183 B13R2.402 Cc1cccc(c1OC2CC2)N 34a_100000756359_100000211595 [1,0,0,1,0,0|1,0,0]=3 10184 B13R2.402 Cc1cccc(c1SC2CC2)Br 62a_100010141302_100000211595 [1,0,0,1,0,0|1,1,0]=4 10185 B13R2.402 Cc1cccc(c1SC2CC2)C 62a_100000033847_100000211595 [1,0,0,1,0,0|0,1,0]=3 10186 B13R2.402 Cc1cccc(c1SC2CC2)Cl 62a_100000043165_100000211595 [1,0,0,1,0,0|1,1,0]=4 10187 B13R2.402 Cc1cccc(c1SC2CC2)F 62a_100011218421_100000211595 [1,0,0,1,0,0|1,1,0]=4 10188 B13R2.402 Cc1cccc(c1SC2CC2)N 62a_100000684715_100000211595 [1,0,0,1,0,0|1,1,0]=4 10189 B13R2.402 Cc1cccc(c1SC2CC2)O 62a_100000686692_100000211595 [1,0,0,1,0,0|1,1,0]=4 10190 B13R2.402 Cc1ccnc(c1OC2CC2)C 34a_100011934651_100000211595 [1,0,0,1,0,0|1,0,0]=3 10191 B13R2.402 Cc1ccnc(c1OC2CC2)Cl 34a_100000696282_100000211595 [1,0,0,1,0,0|2,0,0]=4 10192 B13R2.402 Cc1ccnc(c1SC2CC2)C 62a_100012000501_100000211595 [1,0,0,1,0,0|1,1,0]=4 10193 B13R2.402 Cc1cncc(c1SC2CC2)C 62a_100009817138_100000211595 [1,0,0,1,0,0|1,1,0]=4 10194 B13R2.402 Cc1ncnc(c1OC2CC2)C 34a_100009878406_100000211595 [1,0,0,1,0,0|2,0,0]=4 10195 B13R2.402 Cc1occc(=O)c1OC2CC2 34a_100000031901_100000211595 [1,0,0,1,0,0|2,0,0]=4 10196 B13R2.402 Clc1cccc(c1OC2CC2)Br 34a_100010214474_100000211595 [1,0,0,1,0,0|2,0,0]=4 10197 B13R2.402 Clc1cccc(c1OC2CC2)Cl 34a_100000211709_100000211595 [1,0,0,1,0,0|2,0,0]=4 10198 B13R2.402 Clc1cccc(c1OC2CC2)I 34a_100010202889_100000211595 [1,0,0,1,0,0|2,0,0]=4 10199 B13R2.402 Fc1cccc(c1OC2CC2)Br 34a_100009813666_100000211595 [1,0,0,1,0,0|2,0,0]=4 10200 B13R2.402 Fc1cccc(c1OC2CC2)Cl 34a_100000694953_100000211595 [1,0,0,1,0,0|2,0,0]=4 10201 B13R2.402 Fc1cccc(c1OC2CC2)F 34a_100000230165_100000211595 [1,0,0,1,0,0|2,0,0]=4 10202 B13R2.402 Fc1cccc(c1OC2CC2)I 34a_100010186298_100000211595 [1,0,0,1,0,0|2,0,0]=4 10203 B13R2.402 Nc1cccc(c1OC2CC2)Br 34a_100011934915_100000211595 [1,0,0,1,0,0|2,0,0]=4 10204 B13R2.402 Nc1cccc(c1OC2CC2)Cl 34a_100000754742_100000211595 [1,0,0,1,0,0|2,0,0]=4 10205 B13R2.402 Nc1cccc(c1OC2CC2)F 34a_100011934987_100000211595 [1,0,0,1,0,0|2,0,0]=4 10206 B13R2.402 Nc1cccc(c1OC2CC2)I 34a_100010084371_100000211595 [1,0,0,1,0,0|2,0,0]=4 10207 B13R2.402 Nc1cccc(c1OC2CC2)N 34a_200016994477_100000211595 [1,0,0,1,0,0|2,0,0]=4 10208 B13R2.4820 Oc1cccc2c1OCCCC2 271570a_203496583355_100010333594 [1,0,0,1,0,0|1,0,0]=3 10209 B13R2.4826 CC1(Cc2cccc(c2O1)O)C 271570a_203496583355_100000741280 [0,0,0,1,1,0|2,0,0]=4 10210 B15R2.8633 Cc1cccc(c1CNCC2CC2)C 207a_100000735609_100000758299 [0,0,0,1,0,1|2,0,0]=4 10211 B15R2.8633 Cc1cccc(c1CNCC2CC2)C 2230a_100000735609_100000758300 [0,0,0,1,0,1|2,0,0]=4 10212 B15R2.8633 Cc1cccc(c1CNCC2CC2)C 269862a_100000689800_100000741477 [0,0,0,1,0,1|2,0,0]=4 10213 B15R2.8633 Cc1cccc(c1CNCC2CC2)C 270004a_100000735609_100000758299 [0,0,0,1,0,1|2,0,0]=4 10214 B15R2.8633 Cc1cccc(c1CNCC2CC2)C 34a_100000689800_100000742324 [0,0,0,1,0,1|2,0,0]=4 10215 B15R2.8633 Cc1cccc(c1CNCC2CC2)C 34a_100000735609_100000758300 [0,0,0,1,0,1|2,0,0]=4 10216 B15R2.8633 Cc1cccc(c1CNCC2CO2)C 34a_100000689800_102125554688 [0,0,0,1,0,1|2,0,0]=4 10217 B15R2.8633 Cc1cccc(c1COCC2CC2)Br 34a_100000211283_100010146847 [0,0,0,1,0,1|2,0,0]=4 10218 B15R2.8633 Cc1cccc(c1COCC2CC2)C 34a_100000211283_100000758300 [0,0,0,1,0,1|1,0,0]=3 10219 B15R2.8633 Cc1cccc(c1COCC2CC2)C 34a_100011933981_100000742324 [0,0,0,1,0,1|1,0,0]=3 10220 B15R2.8633 Cc1cccc(c1COCC2CC2)C 7a_100011933981_100000742324 [0,0,0,1,0,1|1,0,0]=3 10221 B15R2.8633 Cc1cccc(c1COCC2CC2)Cl 34a_100000082531_100000742324 [0,0,0,1,0,1|2,0,0]=4 10222 B15R2.8633 Cc1cccc(c1COCC2CC2)Cl 7a_100000082531_100000742324 [0,0,0,1,0,1|2,0,0]=4 10223 B15R2.8633 Cc1cccc(c1COCC2CC2)F 34a_100000057874_100000742324 [0,0,0,1,0,1|2,0,0]=4 10224 B15R2.8633 Cc1cccc(c1COCC2CC2)F 34a_100000211283_100009814554 [0,0,0,1,0,1|2,0,0]=4 10225 B15R2.8633 Cc1cccc(c1COCC2CC2)F 7a_100000057874_100000742324 [0,0,0,1,0,1|2,0,0]=4 10226 B15R2.8633 Cc1cccc(c1COCC2CC2)I 34a_100000211283_100010150146 [0,0,0,1,0,1|2,0,0]=4 10227 B15R2.8633 Cc1cccc(c1COCC2CO2)C 34a_100011933981_102125554688 [0,0,0,1,0,1|1,0,0]=3 10228 B15R2.8633 Cc1cccc(c1COCC2CO2)C 7a_100011933981_102125554688 [0,0,0,1,0,1|1,0,0]=3 10229 B15R2.8633 Cc1cccc(c1COCC2CO2)Cl 34a_100000082531_102125554688 [0,0,0,1,0,1|2,0,0]=4 10230 B15R2.8633 Cc1cccc(c1COCC2CO2)Cl 7a_100000082531_102125554688 [0,0,0,1,0,1|2,0,0]=4 10231 B15R2.8633 Cc1cccc(c1COCC2CO2)F 34a_100000057874_102125554688 [0,0,0,1,0,1|2,0,0]=4 10232 B15R2.8633 Cc1cccc(c1COCC2CO2)F 7a_100000057874_102125554688 [0,0,0,1,0,1|2,0,0]=4 10233 B15R2.8633 Cc1cccc(c1COCC2CS2)C 7a_100011933981_100000031435 [0,0,0,1,0,1|1,0,0]=3 10234 B15R2.8633 Cc1cccc(c1COCC2CS2)Cl 7a_100000082531_100000031435 [0,0,0,1,0,1|2,0,0]=4 10235 B15R2.8633 Cc1cccc(c1COCC2CS2)F 7a_100000057874_100000031435 [0,0,0,1,0,1|2,0,0]=4 10236 B15R2.8633 Cc1cccc(c1COC[C@@H]2CO2)Br 34a_100000757423_100010146847 [0,0,0,1,0,1|2,0,0]=4 10237 B15R2.8633 Cc1cccc(c1COC[C@@H]2CO2)C 34a_100000757423_100000758300 [0,0,0,1,0,1|1,0,0]=3 10238 B15R2.8633 Cc1cccc(c1COC[C@@H]2CO2)C 7a_100011933981_100000745022 [0,0,0,1,0,1|1,0,0]=3 10239 B15R2.8633 Cc1cccc(c1COC[C@@H]2CO2)Cl 7a_100000082531_100000745022 [0,0,0,1,0,1|2,0,0]=4 10240 B15R2.8633 Cc1cccc(c1COC[C@@H]2CO2)F 34a_100000757423_100009814554 [0,0,0,1,0,1|2,0,0]=4 10241 B15R2.8633 Cc1cccc(c1COC[C@@H]2CO2)F 7a_100000057874_100000745022 [0,0,0,1,0,1|2,0,0]=4 10242 B15R2.8633 Cc1cccc(c1COC[C@@H]2CO2)I 34a_100000757423_100010150146 [0,0,0,1,0,1|2,0,0]=4 10243 B15R2.8633 Cc1cccc(c1CSCC2CC2)C 62a_100000756562_100000758300 [0,0,0,1,0,1|1,1,0]=4 10244 B15R2.8633 Cc1cccc(c1CSCC2CC2)C 62a_100000758300_100000742324 [0,0,0,1,0,1|1,1,0]=4 10245 B15R2.8633 Cc1cccc(c1CSCC2CO2)C 62a_100000758300_102125554688 [0,0,0,1,0,1|1,1,0]=4 10246 B15R2.8633 Cc1cccc(c1CSCC2CO2)C 62a_102125554688_100000758300 [0,0,0,1,0,1|1,1,0]=4 10247 B15R2.8633 Cc1cccc(c1CSCC2CS2)C 62a_100000031435_100000758300 [0,0,0,1,0,1|1,1,0]=4 10248 B15R2.8633 Cc1cccc(c1CSCC2CS2)C 62a_100000758300_100000031435 [0,0,0,1,0,1|1,1,0]=4 10249 B15R2.8633 Cc1cccc(c1CSC[C@@H]2CO2)C 62a_100000745022_100000758300 [0,0,0,1,0,1|1,1,0]=4 10250 B15R2.8633 Cc1cccc(c1CSC[C@@H]2CO2)C 62a_100000758300_100000745022 [0,0,0,1,0,1|1,1,0]=4 10251 B15R2.8633 Cc1cccc(c1NCCC2CC2)C 34a_100000185769_100000694398 [0,0,0,1,0,1|2,0,0]=4 10252 B15R2.8633 Cc1cccc(c1NCCC2CO2)C 34a_100000185769_100000732470 [0,0,0,1,0,1|2,0,0]=4 10253 B15R2.8633 Cc1cccc(c1OCCC2CC2)Br 34a_100009817157_100000694398 [0,0,0,1,0,1|2,0,0]=4 10254 B15R2.8633 Cc1cccc(c1OCCC2CC2)Br 7a_100009817157_100000764125 [0,0,0,1,0,1|2,0,0]=4 10255 B15R2.8633 Cc1cccc(c1OCCC2CC2)C 34a_100000210341_100000694398 [0,0,0,1,0,1|1,0,0]=3 10256 B15R2.8633 Cc1cccc(c1OCCC2CC2)C 7a_100000210341_100000764125 [0,0,0,1,0,1|1,0,0]=3 10257 B15R2.8633 Cc1cccc(c1OCCC2CC2)Cl 34a_100000033731_100000694398 [0,0,0,1,0,1|2,0,0]=4 10258 B15R2.8633 Cc1cccc(c1OCCC2CC2)Cl 7a_100000033731_100000764125 [0,0,0,1,0,1|2,0,0]=4 10259 B15R2.8633 Cc1cccc(c1OCCC2CC2)F 34a_100011659162_100000694398 [0,0,0,1,0,1|2,0,0]=4 10260 B15R2.8633 Cc1cccc(c1OCCC2CC2)F 7a_100011659162_100000764125 [0,0,0,1,0,1|2,0,0]=4 10261 B15R2.8633 Cc1cccc(c1OCCC2CC2)N 34a_100000756359_100000694398 [0,0,0,1,0,1|2,0,0]=4 10262 B15R2.8633 Cc1cccc(c1OCCC2CC2)N 7a_100000756359_100000764125 [0,0,0,1,0,1|2,0,0]=4 10263 B15R2.8633 Cc1cccc(c1OCCC2CO2)Br 34a_100009817157_100000732470 [0,0,0,1,0,1|2,0,0]=4 10264 B15R2.8633 Cc1cccc(c1OCCC2CO2)Br 7a_100009817157_100000732470 [0,0,0,1,0,1|2,0,0]=4 10265 B15R2.8633 Cc1cccc(c1OCCC2CO2)C 34a_100000210341_100000732470 [0,0,0,1,0,1|1,0,0]=3 10266 B15R2.8633 Cc1cccc(c1OCCC2CO2)C 7a_100000210341_100000732470 [0,0,0,1,0,1|1,0,0]=3 10267 B15R2.8633 Cc1cccc(c1OCCC2CO2)Cl 34a_100000033731_100000732470 [0,0,0,1,0,1|2,0,0]=4 10268 B15R2.8633 Cc1cccc(c1OCCC2CO2)Cl 7a_100000033731_100000732470 [0,0,0,1,0,1|2,0,0]=4 10269 B15R2.8633 Cc1cccc(c1OCCC2CO2)F 34a_100011659162_100000732470 [0,0,0,1,0,1|2,0,0]=4 10270 B15R2.8633 Cc1cccc(c1OCCC2CO2)F 7a_100011659162_100000732470 [0,0,0,1,0,1|2,0,0]=4 10271 B15R2.8633 Cc1cccc(c1OCCC2CO2)N 34a_100000756359_100000732470 [0,0,0,1,0,1|2,0,0]=4 10272 B15R2.8633 Cc1cccc(c1OCCC2CO2)N 7a_100000756359_100000732470 [0,0,0,1,0,1|2,0,0]=4 10273 B15R2.8633 Cc1cccc(c1SCCC2CC2)C 62a_100000033847_100000764125 [0,0,0,1,0,1|1,1,0]=4 10274 B15R2.8633 Cc1cccc(c1SCCC2CC2)C 62a_100000764125_100000033847 [0,0,0,1,0,1|1,1,0]=4 10275 B15R2.8633 Cc1cccc(c1SCCC2CO2)C 62a_100000033847_100000732470 [0,0,0,1,0,1|1,1,0]=4 10276 B15R2.8633 Cc1cccc(c1SCCC2CO2)C 62a_100000732470_100000033847 [0,0,0,1,0,1|1,1,0]=4 10277 B15R2.8633 Cc1ccnc(c1OCCC2CC2)C 34a_100011934651_100000694398 [0,0,0,1,0,1|2,0,0]=4 10278 B15R2.8633 Cc1ccnc(c1OCCC2CC2)C 7a_100011934651_100000764125 [0,0,0,1,0,1|2,0,0]=4 10279 B15R2.8633 Cc1ccnc(c1OCCC2CO2)C 34a_100011934651_100000732470 [0,0,0,1,0,1|2,0,0]=4 10280 B15R2.8633 Cc1ccnc(c1OCCC2CO2)C 7a_100011934651_100000732470 [0,0,0,1,0,1|2,0,0]=4 10281 B15R2.13461 Cc1cccc2c1CN(C2)CC(C)C 2230a_100020635169_100000210760 [0,0,0,1,0,1|2,0,0]=4 10282 B15R2.13461 Cc1cccc2c1CN(C2)CC(C)C 269982a_100020635169_100000210624 [0,0,0,1,0,1|2,0,0]=4 10283 B15R2.13461 Cc1cccc2c1CN(C2)CC(C)C 270004a_100020635169_100000210432 [0,0,0,1,0,1|2,0,0]=4 10284 B15R2.13461 Cc1cccc2c1CN(C2)CC(C)C 34a_100020635169_100000210624 [0,0,0,1,0,1|2,0,0]=4 10285 B15R2.13461 Cc1cccc2c1CN(C2)CC(C)O 2230a_100020635169_100011218427 [0,0,0,1,0,1|2,0,0]=4 10286 B15R2.13461 Cc1cccc2c1CN(C2)CC(C)O 269982a_100020635169_100011218427 [0,0,0,1,0,1|2,0,0]=4 10287 B15R2.13461 Cc1cccc2c1CN(C2)CC(C)O 34a_100020635169_100011218427 [0,0,0,1,0,1|2,0,0]=4 10288 B15R2.13461 Cc1cccc2c1CN(C2)C[C@@H](C)O 2230a_100020635169_100009817552 [0,0,0,1,0,1|2,0,0]=4 10289 B15R2.13461 Cc1cccc2c1CN(C2)C[C@@H](C)O 269982a_100020635169_100009817552 [0,0,0,1,0,1|2,0,0]=4 10290 B15R2.13461 Cc1cccc2c1CN(C2)C[C@@H](C)O 34a_100020635169_100009817552 [0,0,0,1,0,1|2,0,0]=4 10291 B15R2.13598 Cc1cccc2c1CCN(C2)C(C)C 2230a_200000752276_100000210206 [0,0,0,1,0,1|2,0,0]=4 10292 B15R2.13598 Cc1cccc2c1CCN(C2)C(C)C 269982a_200000752276_100000210206 [0,0,0,1,0,1|2,0,0]=4 10293 B15R2.13598 Cc1cccc2c1CCN(C2)C(C)C 34a_200000752276_100000210206 [0,0,0,1,0,1|2,0,0]=4 10294 B15R2.15420 Cc1cccc(c1CN[C@@H]2C[C@@H]2F)C 2230a_100015190264_100000758300 [0,0,0,1,0,1|2,0,0]=4 10295 B15R2.15420 Cc1cccc(c1CN[C@@H]2C[C@H]2F)C 2230a_100025746932_100000758300 [0,0,0,1,0,1|2,0,0]=4 10296 B15R2.15420 Cc1cccc(c1CN[C@@H]2C[C@H]2F)C 34a_100025746932_100000758300 [0,0,0,1,0,1|2,0,0]=4 10297 B15R2.48035 Cc1cccc(c1CN2CC(C2)C)C 2230a_100000702820_100000758300 [0,0,0,1,0,1|2,0,0]=4 10298 B15R2.48035 Cc1cccc(c1CN2CC(C2)C)C 269982a_100000702820_100000758300 [0,0,0,1,0,1|2,0,0]=4 10299 B15R2.48035 Cc1cccc(c1CN2CC(C2)C)C 270004a_100000702820_100000758299 [0,0,0,1,0,1|2,0,0]=4 10300 B15R2.48035 Cc1cccc(c1CN2CC(C2)C)C 34a_100000702820_100000758300 [0,0,0,1,0,1|2,0,0]=4 10301 B15R2.48035 Cc1cccc(c1CN2CC(C2)F)C 2230a_100000690557_100000758300 [0,0,0,1,0,1|2,0,0]=4 10302 B15R2.48035 Cc1cccc(c1CN2CC(C2)F)C 269982a_100000690557_100000758300 [0,0,0,1,0,1|2,0,0]=4 10303 B15R2.48035 Cc1cccc(c1CN2CC(C2)F)C 270004a_100000690557_100000758299 [0,0,0,1,0,1|2,0,0]=4 10304 B15R2.48035 Cc1cccc(c1CN2CC(C2)F)C 34a_100000690557_100000758300 [0,0,0,1,0,1|2,0,0]=4 10305 B15R2.48035 Cc1cccc(c1CN2CC(C2)O)C 269982a_100000749847_100000758300 [0,0,0,1,0,1|2,0,0]=4 10306 B15R2.48035 Cc1cccc(c1OC2CN(C2)C)C 269982a_100015185316_200000210301 [0,0,0,1,0,1|2,0,0]=4 10307 B15R2.48035 Cc1cccc(c1OC2CN(C2)C)C 34a_100015185316_200000210301 [0,0,0,1,0,1|2,0,0]=4 10308 B15R2.48035 Cc1cccc(c1OC2CN(C2)[13CH3])C 269982a_100015185316_200025704644 [0,0,0,1,0,1|2,0,0]=4 10309 B15R2.48035 Cc1cccc(c1OC2CN(C2)[13CH3])C 34a_100015185316_200025704644 [0,0,0,1,0,1|2,0,0]=4 10310 B15R2.2055 CCc1cccc(c1NCC2CC2)C 2230a_100000210048_100000742324 [0,1,0,1,0,0|2,0,0]=4 10311 B15R2.2055 CCc1cccc(c1NCC2CC2)C 34a_100000210048_100000742324 [0,1,0,1,0,0|2,0,0]=4 10312 B15R2.2055 CCc1cccc(c1NCC2CC2)C 7a_100000210048_100000742324 [0,1,0,1,0,0|2,0,0]=4 10313 B15R2.2055 CCc1cccc(c1NCC2CO2)C 2230a_100000210048_100011216344 [0,1,0,1,0,0|2,0,0]=4 10314 B15R2.2055 CCc1cccc(c1NCC2CO2)C 34a_100000210048_102125554688 [0,1,0,1,0,0|2,0,0]=4 10315 B15R2.2055 CCc1cccc(c1NCC2CO2)C 7a_100000210048_102125554688 [0,1,0,1,0,0|2,0,0]=4 10316 B15R2.2055 CCc1cccc(c1NCC2CS2)C 7a_100000210048_100000031435 [0,1,0,1,0,0|2,0,0]=4 10317 B15R2.2055 CCc1cccc(c1NC[C@@H]2CO2)C 7a_100000210048_100000745022 [0,1,0,1,0,0|2,0,0]=4 10318 B15R2.2055 CCc1cccc(c1OCC2CC2)Br 34a_200010001580_100000742324 [0,1,0,1,0,0|2,0,0]=4 10319 B15R2.2055 CCc1cccc(c1OCC2CC2)Br 7a_200010001580_100000742324 [0,1,0,1,0,0|2,0,0]=4 10320 B15R2.2055 CCc1cccc(c1OCC2CC2)C 34a_100000034007_100000742324 [0,1,0,1,0,0|1,0,0]=3 10321 B15R2.2055 CCc1cccc(c1OCC2CC2)C 7a_100000034007_100000742324 [0,1,0,1,0,0|1,0,0]=3 10322 B15R2.2055 CCc1cccc(c1OCC2CO2)Br 34a_200010001580_102125554688 [0,1,0,1,0,0|2,0,0]=4 10323 B15R2.2055 CCc1cccc(c1OCC2CO2)Br 7a_200010001580_102125554688 [0,1,0,1,0,0|2,0,0]=4 10324 B15R2.2055 CCc1cccc(c1OCC2CO2)C 34a_100000034007_102125554688 [0,1,0,1,0,0|1,0,0]=3 10325 B15R2.2055 CCc1cccc(c1OCC2CO2)C 7a_100000034007_102125554688 [0,1,0,1,0,0|1,0,0]=3 10326 B15R2.2055 CCc1cccc(c1OCC2CS2)Br 7a_200010001580_100000031435 [0,1,0,1,0,0|2,0,0]=4 10327 B15R2.2055 CCc1cccc(c1OCC2CS2)C 7a_100000034007_100000031435 [0,1,0,1,0,0|1,0,0]=3 10328 B15R2.2055 CCc1cccc(c1OC[C@@H]2CO2)Br 7a_200010001580_100000745022 [0,1,0,1,0,0|2,0,0]=4 10329 B15R2.2055 CCc1cccc(c1OC[C@@H]2CO2)C 7a_100000034007_100000745022 [0,1,0,1,0,0|1,0,0]=3 10330 B15R2.2055 CCc1cccc(c1SCC2CC2)C 62a_100000036235_100000742324 [0,1,0,1,0,0|1,1,0]=4 10331 B15R2.2055 CCc1cccc(c1SCC2CC2)C 62a_100000756562_100000036235 [0,1,0,1,0,0|1,1,0]=4 10332 B15R2.2055 CCc1cccc(c1SCC2CO2)C 62a_100000036235_102125554688 [0,1,0,1,0,0|1,1,0]=4 10333 B15R2.2055 CCc1cccc(c1SCC2CO2)C 62a_102125554688_100000036235 [0,1,0,1,0,0|1,1,0]=4 10334 B15R2.2055 CCc1cccc(c1SCC2CS2)C 62a_100000031435_100000036235 [0,1,0,1,0,0|1,1,0]=4 10335 B15R2.2055 CCc1cccc(c1SCC2CS2)C 62a_100000036235_100000031435 [0,1,0,1,0,0|1,1,0]=4 10336 B15R2.2055 CCc1cccc(c1SC[C@@H]2CO2)C 62a_100000036235_100000745022 [0,1,0,1,0,0|1,1,0]=4 10337 B15R2.2055 CCc1cccc(c1SC[C@@H]2CO2)C 62a_100000745022_100000036235 [0,1,0,1,0,0|1,1,0]=4 10338 B15R2.2055 COc1cccc(c1NCC2CC2)C 2230a_100000758225_100000742324 [0,1,0,1,0,0|2,0,0]=4 10339 B15R2.2055 COc1cccc(c1NCC2CC2)C 34a_100000758225_100000742324 [0,1,0,1,0,0|2,0,0]=4 10340 B15R2.2055 COc1cccc(c1NCC2CO2)C 2230a_100000758225_100011216344 [0,1,0,1,0,0|2,0,0]=4 10341 B15R2.2055 COc1cccc(c1NCC2CO2)C 34a_100000758225_102125554688 [0,1,0,1,0,0|2,0,0]=4 10342 B15R2.2055 COc1cccc(c1OCC2CC2)Br 34a_100000686866_100000742324 [0,1,0,1,0,0|2,0,0]=4 10343 B15R2.2055 COc1cccc(c1OCC2CC2)C 34a_100011219253_100000742324 [0,1,0,1,0,0|1,0,0]=3 10344 B15R2.2055 COc1cccc(c1OCC2CC2)C 7a_100011219253_100000742324 [0,1,0,1,0,0|1,0,0]=3 10345 B15R2.2055 COc1cccc(c1OCC2CC2)Cl 34a_100009851661_100000742324 [0,1,0,1,0,0|2,0,0]=4 10346 B15R2.2055 COc1cccc(c1OCC2CC2)Cl 7a_100009851661_100000742324 [0,1,0,1,0,0|2,0,0]=4 10347 B15R2.2055 COc1cccc(c1OCC2CC2)F 34a_100000036725_100000742324 [0,1,0,1,0,0|2,0,0]=4 10348 B15R2.2055 COc1cccc(c1OCC2CC2)F 7a_100000036725_100000742324 [0,1,0,1,0,0|2,0,0]=4 10349 B15R2.2055 COc1cccc(c1OCC2CC2)N 34a_100000123586_100000742324 [0,1,0,1,0,0|2,0,0]=4 10350 B15R2.2055 COc1cccc(c1OCC2CO2)Br 34a_100000686866_102125554688 [0,1,0,1,0,0|2,0,0]=4 10351 B15R2.2055 COc1cccc(c1OCC2CO2)C 34a_100011219253_102125554688 [0,1,0,1,0,0|1,0,0]=3 10352 B15R2.2055 COc1cccc(c1OCC2CO2)C 7a_100011219253_102125554688 [0,1,0,1,0,0|1,0,0]=3 10353 B15R2.2055 COc1cccc(c1OCC2CO2)Cl 34a_100009851661_102125554688 [0,1,0,1,0,0|2,0,0]=4 10354 B15R2.2055 COc1cccc(c1OCC2CO2)Cl 7a_100009851661_102125554688 [0,1,0,1,0,0|2,0,0]=4 10355 B15R2.2055 COc1cccc(c1OCC2CO2)F 34a_100000036725_102125554688 [0,1,0,1,0,0|2,0,0]=4 10356 B15R2.2055 COc1cccc(c1OCC2CO2)F 7a_100000036725_102125554688 [0,1,0,1,0,0|2,0,0]=4 10357 B15R2.2055 COc1cccc(c1OCC2CO2)N 34a_100000123586_102125554688 [0,1,0,1,0,0|2,0,0]=4 10358 B15R2.2055 COc1cccc(c1OCC2CS2)C 7a_100011219253_100000031435 [0,1,0,1,0,0|1,0,0]=3 10359 B15R2.2055 COc1cccc(c1OCC2CS2)Cl 7a_100009851661_100000031435 [0,1,0,1,0,0|2,0,0]=4 10360 B15R2.2055 COc1cccc(c1OCC2CS2)F 7a_100000036725_100000031435 [0,1,0,1,0,0|2,0,0]=4 10361 B15R2.2055 COc1cccc(c1OC[C@@H]2CO2)C 7a_100011219253_100000745022 [0,1,0,1,0,0|1,0,0]=3 10362 B15R2.2055 COc1cccc(c1OC[C@@H]2CO2)Cl 7a_100009851661_100000745022 [0,1,0,1,0,0|2,0,0]=4 10363 B15R2.2055 COc1cccc(c1OC[C@@H]2CO2)F 7a_100000036725_100000745022 [0,1,0,1,0,0|2,0,0]=4 10364 B15R2.2055 COc1cccc(c1SCC2CC2)C 62a_100000756562_100010191535 [0,1,0,1,0,0|1,1,0]=4 10365 B15R2.2055 COc1cccc(c1SCC2CC2)C 62a_100010191535_100000742324 [0,1,0,1,0,0|1,1,0]=4 10366 B15R2.2055 COc1cccc(c1SCC2CO2)C 62a_100010191535_102125554688 [0,1,0,1,0,0|1,1,0]=4 10367 B15R2.2055 COc1cccc(c1SCC2CO2)C 62a_102125554688_100010191535 [0,1,0,1,0,0|1,1,0]=4 10368 B15R2.2055 COc1cccc(c1SCC2CS2)C 62a_100000031435_100010191535 [0,1,0,1,0,0|1,1,0]=4 10369 B15R2.2055 COc1cccc(c1SCC2CS2)C 62a_100010191535_100000031435 [0,1,0,1,0,0|1,1,0]=4 10370 B15R2.2055 COc1cccc(c1SC[C@@H]2CO2)C 62a_100000745022_100010191535 [0,1,0,1,0,0|1,1,0]=4 10371 B15R2.2055 COc1cccc(c1SC[C@@H]2CO2)C 62a_100010191535_100000745022 [0,1,0,1,0,0|1,1,0]=4 10372 B15R2.2055 Cc1cccc(c1NCC2CC2)CO 34a_100011215590_100000742324 [0,1,0,1,0,0|2,0,0]=4 10373 B15R2.2055 Cc1cccc(c1NCC2CO2)CO 34a_100011215590_102125554688 [0,1,0,1,0,0|2,0,0]=4 10374 B15R2.2055 Cc1cccc(c1OCC2CC2)C#N 34a_100011659161_100000742324 [0,1,0,1,0,0|1,0,1]=4 10375 B15R2.2055 Cc1cccc(c1OCC2CC2)C#N 7a_100011659161_100000742324 [0,1,0,1,0,0|1,0,1]=4 10376 B15R2.2055 Cc1cccc(c1OCC2CC2)CN 34a_100020639391_100000742324 [0,1,0,1,0,0|1,0,0]=3 10377 B15R2.2055 Cc1cccc(c1OCC2CO2)C#N 34a_100011659161_102125554688 [0,1,0,1,0,0|1,0,1]=4 10378 B15R2.2055 Cc1cccc(c1OCC2CO2)C#N 7a_100011659161_102125554688 [0,1,0,1,0,0|1,0,1]=4 10379 B15R2.2055 Cc1cccc(c1OCC2CO2)CN 34a_100020639391_102125554688 [0,1,0,1,0,0|1,0,0]=3 10380 B15R2.2055 Cc1cccc(c1OCC2CS2)C#N 7a_100011659161_100000031435 [0,1,0,1,0,0|1,0,1]=4 10381 B15R2.2055 Cc1cccc(c1OC[C@@H]2CO2)C#N 7a_100011659161_100000745022 [0,1,0,1,0,0|1,0,1]=4 10382 B15R2.2055 Cc1cccc(c1SCC2CC2)CO 62a_100000756562_100011659289 [0,1,0,1,0,0|1,1,0]=4 10383 B15R2.2055 Cc1cccc(c1SCC2CC2)CO 62a_100011659289_100000742324 [0,1,0,1,0,0|1,1,0]=4 10384 B15R2.2055 Cc1cccc(c1SCC2CO2)CO 62a_100011659289_102125554688 [0,1,0,1,0,0|1,1,0]=4 10385 B15R2.2055 Cc1cccc(c1SCC2CO2)CO 62a_102125554688_100011659289 [0,1,0,1,0,0|1,1,0]=4 10386 B15R2.2055 Cc1cccc(c1SCC2CS2)CO 62a_100000031435_100011659289 [0,1,0,1,0,0|1,1,0]=4 10387 B15R2.2055 Cc1cccc(c1SCC2CS2)CO 62a_100011659289_100000031435 [0,1,0,1,0,0|1,1,0]=4 10388 B15R2.2055 Cc1cccc(c1SC[C@@H]2CO2)CO 62a_100000745022_100011659289 [0,1,0,1,0,0|1,1,0]=4 10389 B15R2.2055 Cc1cccc(c1SC[C@@H]2CO2)CO 62a_100011659289_100000745022 [0,1,0,1,0,0|1,1,0]=4 10390 B15R2.2055 OCc1cccc(c1OCC2CC2)F 34a_100011997349_100000742324 [0,1,0,1,0,0|2,0,0]=4 10391 B15R2.2055 OCc1cccc(c1OCC2CC2)F 7a_100011997349_100000742324 [0,1,0,1,0,0|2,0,0]=4 10392 B15R2.2055 OCc1cccc(c1OCC2CO2)F 34a_100011997349_102125554688 [0,1,0,1,0,0|2,0,0]=4 10393 B15R2.2055 OCc1cccc(c1OCC2CO2)F 7a_100011997349_102125554688 [0,1,0,1,0,0|2,0,0]=4 10394 B15R2.2055 OCc1cccc(c1OCC2CS2)F 7a_100011997349_100000031435 [0,1,0,1,0,0|2,0,0]=4 10395 B15R2.2055 OCc1cccc(c1OC[C@@H]2CO2)F 7a_100011997349_100000745022 [0,1,0,1,0,0|2,0,0]=4 10396 B15R2.4200 Cc1cc(c(c(c1)Br)OCC2CC2)C 34a_100011934984_100000742324 [0,1,0,1,0,0|2,0,0]=4 10397 B15R2.4200 Cc1cc(c(c(c1)Br)OCC2CC2)C 7a_100011934984_100000742324 [0,1,0,1,0,0|2,0,0]=4 10398 B15R2.4200 Cc1cc(c(c(c1)Br)OCC2CO2)C 34a_100011934984_102125554688 [0,1,0,1,0,0|2,0,0]=4 10399 B15R2.4200 Cc1cc(c(c(c1)Br)OCC2CO2)C 7a_100011934984_102125554688 [0,1,0,1,0,0|2,0,0]=4 10400 B15R2.4200 Cc1cc(c(c(c1)Br)OCC2CS2)C 7a_100011934984_100000031435 [0,1,0,1,0,0|2,0,0]=4 10401 B15R2.4200 Cc1cc(c(c(c1)Br)OC[C@@H]2CO2)C 7a_100011934984_100000745022 [0,1,0,1,0,0|2,0,0]=4 10402 B15R2.4200 Cc1cc(c(c(c1)C)NCC2CC2)C 34a_100000210045_100000742324 [0,1,0,1,0,0|2,0,0]=4 10403 B15R2.4200 Cc1cc(c(c(c1)C)NCC2CC2)C 7a_100000210045_100000742324 [0,1,0,1,0,0|2,0,0]=4 10404 B15R2.4200 Cc1cc(c(c(c1)C)NCC2CO2)C 34a_100000210045_102125554688 [0,1,0,1,0,0|2,0,0]=4 10405 B15R2.4200 Cc1cc(c(c(c1)C)NCC2CO2)C 7a_100000210045_102125554688 [0,1,0,1,0,0|2,0,0]=4 10406 B15R2.4200 Cc1cc(c(c(c1)C)NCC2CS2)C 7a_100000210045_100000031435 [0,1,0,1,0,0|2,0,0]=4 10407 B15R2.4200 Cc1cc(c(c(c1)C)NC[C@@H]2CO2)C 7a_100000210045_100000745022 [0,1,0,1,0,0|2,0,0]=4 10408 B15R2.4200 Cc1cc(c(c(c1)C)OCC2CC2)C 34a_100000212074_100000742324 [0,1,0,1,0,0|1,0,0]=3 10409 B15R2.4200 Cc1cc(c(c(c1)C)OCC2CC2)C 7a_100000212074_100000742324 [0,1,0,1,0,0|1,0,0]=3 10410 B15R2.4200 Cc1cc(c(c(c1)C)OCC2CO2)C 34a_100000212074_102125554688 [0,1,0,1,0,0|1,0,0]=3 10411 B15R2.4200 Cc1cc(c(c(c1)C)OCC2CO2)C 7a_100000212074_102125554688 [0,1,0,1,0,0|1,0,0]=3 10412 B15R2.4200 Cc1cc(c(c(c1)C)OCC2CS2)C 7a_100000212074_100000031435 [0,1,0,1,0,0|1,0,0]=3 10413 B15R2.4200 Cc1cc(c(c(c1)C)OC[C@@H]2CO2)C 7a_100000212074_100000745022 [0,1,0,1,0,0|1,0,0]=3 10414 B15R2.4200 Cc1cc(c(c(c1)C)SCC2CC2)C 62a_100000756562_100011204320 [0,1,0,1,0,0|1,1,0]=4 10415 B15R2.4200 Cc1cc(c(c(c1)C)SCC2CC2)C 62a_100011204320_100000742324 [0,1,0,1,0,0|1,1,0]=4 10416 B15R2.4200 Cc1cc(c(c(c1)C)SCC2CO2)C 62a_100011204320_102125554688 [0,1,0,1,0,0|1,1,0]=4 10417 B15R2.4200 Cc1cc(c(c(c1)C)SCC2CO2)C 62a_102125554688_100011204320 [0,1,0,1,0,0|1,1,0]=4 10418 B15R2.4200 Cc1cc(c(c(c1)C)SCC2CS2)C 62a_100000031435_100011204320 [0,1,0,1,0,0|1,1,0]=4 10419 B15R2.4200 Cc1cc(c(c(c1)C)SCC2CS2)C 62a_100011204320_100000031435 [0,1,0,1,0,0|1,1,0]=4 10420 B15R2.4200 Cc1cc(c(c(c1)C)SC[C@@H]2CO2)C 62a_100000745022_100011204320 [0,1,0,1,0,0|1,1,0]=4 10421 B15R2.4200 Cc1cc(c(c(c1)C)SC[C@@H]2CO2)C 62a_100011204320_100000745022 [0,1,0,1,0,0|1,1,0]=4 10422 B15R2.4200 Cc1cc(c(c(c1)N)OCC2CC2)C 34a_100011216242_100000742324 [0,1,0,1,0,0|2,0,0]=4 10423 B15R2.4200 Cc1cc(c(c(c1)N)OCC2CC2)C 7a_100011216242_100000742324 [0,1,0,1,0,0|2,0,0]=4 10424 B15R2.4200 Cc1cc(c(c(c1)N)OCC2CO2)C 34a_100011216242_102125554688 [0,1,0,1,0,0|2,0,0]=4 10425 B15R2.4200 Cc1cc(c(c(c1)N)OCC2CO2)C 7a_100011216242_102125554688 [0,1,0,1,0,0|2,0,0]=4 10426 B15R2.4200 Cc1cc(c(c(c1)N)OCC2CS2)C 7a_100011216242_100000031435 [0,1,0,1,0,0|2,0,0]=4 10427 B15R2.4200 Cc1cc(c(c(c1)N)OC[C@@H]2CO2)C 7a_100011216242_100000745022 [0,1,0,1,0,0|2,0,0]=4 10428 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)Br 34a_100000737279_100000742324 [0,1,0,1,0,0|2,0,0]=4 10429 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)Br 7a_100000737279_100000742324 [0,1,0,1,0,0|2,0,0]=4 10430 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)Cl 34a_100000692879_100000742324 [0,1,0,1,0,0|2,0,0]=4 10431 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)Cl 7a_100000692879_100000742324 [0,1,0,1,0,0|2,0,0]=4 10432 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)F 34a_100011290887_100000742324 [0,1,0,1,0,0|2,0,0]=4 10433 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)F 7a_100011290887_100000742324 [0,1,0,1,0,0|2,0,0]=4 10434 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)I 7a_100011356821_100000742324 [0,1,0,1,0,0|2,0,0]=4 10435 B15R2.4200 Cc1cc(cc(c1NCC2CC2)C)O 34a_100011934200_100000742324 [0,1,0,1,0,0|2,0,0]=4 10436 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)Br 34a_100000737279_102125554688 [0,1,0,1,0,0|2,0,0]=4 10437 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)Br 7a_100000737279_102125554688 [0,1,0,1,0,0|2,0,0]=4 10438 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)Cl 34a_100000692879_102125554688 [0,1,0,1,0,0|2,0,0]=4 10439 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)Cl 7a_100000692879_102125554688 [0,1,0,1,0,0|2,0,0]=4 10440 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)F 34a_100011290887_102125554688 [0,1,0,1,0,0|2,0,0]=4 10441 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)F 7a_100011290887_102125554688 [0,1,0,1,0,0|2,0,0]=4 10442 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)I 7a_100011356821_102125554688 [0,1,0,1,0,0|2,0,0]=4 10443 B15R2.4200 Cc1cc(cc(c1NCC2CO2)C)O 34a_100011934200_102125554688 [0,1,0,1,0,0|2,0,0]=4 10444 B15R2.4200 Cc1cc(cc(c1NCC2CS2)C)Br 7a_100000737279_100000031435 [0,1,0,1,0,0|2,0,0]=4 10445 B15R2.4200 Cc1cc(cc(c1NCC2CS2)C)Cl 7a_100000692879_100000031435 [0,1,0,1,0,0|2,0,0]=4 10446 B15R2.4200 Cc1cc(cc(c1NCC2CS2)C)F 7a_100011290887_100000031435 [0,1,0,1,0,0|2,0,0]=4 10447 B15R2.4200 Cc1cc(cc(c1NCC2CS2)C)I 7a_100011356821_100000031435 [0,1,0,1,0,0|2,0,0]=4 10448 B15R2.4200 Cc1cc(cc(c1NC[C@@H]2CO2)C)Br 7a_100000737279_100000745022 [0,1,0,1,0,0|2,0,0]=4 10449 B15R2.4200 Cc1cc(cc(c1NC[C@@H]2CO2)C)Cl 7a_100000692879_100000745022 [0,1,0,1,0,0|2,0,0]=4 10450 B15R2.4200 Cc1cc(cc(c1NC[C@@H]2CO2)C)F 7a_100011290887_100000745022 [0,1,0,1,0,0|2,0,0]=4 10451 B15R2.4200 Cc1cc(cc(c1NC[C@@H]2CO2)C)I 7a_100011356821_100000745022 [0,1,0,1,0,0|2,0,0]=4 10452 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)Br 34a_100000186369_100000742324 [0,1,0,1,0,0|2,0,0]=4 10453 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)Br 7a_100000186369_100000742324 [0,1,0,1,0,0|2,0,0]=4 10454 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)Cl 34a_100012337756_100000742324 [0,1,0,1,0,0|2,0,0]=4 10455 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)Cl 7a_100012337756_100000742324 [0,1,0,1,0,0|2,0,0]=4 10456 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)I 34a_100010982682_100000742324 [0,1,0,1,0,0|2,0,0]=4 10457 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)I 7a_100010982682_100000742324 [0,1,0,1,0,0|2,0,0]=4 10458 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)N 34a_100010064301_100000742324 [0,1,0,1,0,0|2,0,0]=4 10459 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Br)N 7a_100010064301_100000742324 [0,1,0,1,0,0|2,0,0]=4 10460 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)Br 34a_100000187306_100000742324 [0,1,0,1,0,0|1,0,0]=3 10461 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)Br 7a_100000187306_100000742324 [0,1,0,1,0,0|1,0,0]=3 10462 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)Cl 34a_100000211519_100000742324 [0,1,0,1,0,0|1,0,0]=3 10463 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)Cl 7a_100000211519_100000742324 [0,1,0,1,0,0|1,0,0]=3 10464 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)F 34a_100000081862_100000742324 [0,1,0,1,0,0|1,0,0]=3 10465 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)F 7a_100000081862_100000742324 [0,1,0,1,0,0|1,0,0]=3 10466 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)I 34a_100011216129_100000742324 [0,1,0,1,0,0|1,0,0]=3 10467 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)I 7a_100011216129_100000742324 [0,1,0,1,0,0|1,0,0]=3 10468 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)N 34a_100000703291_100000742324 [0,1,0,1,0,0|1,0,0]=3 10469 B15R2.4200 Cc1cc(cc(c1OCC2CC2)C)N 7a_100000703291_100000742324 [0,1,0,1,0,0|1,0,0]=3 10470 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Cl)Br 34a_100000211485_100000742324 [0,1,0,1,0,0|2,0,0]=4 10471 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Cl)Br 7a_100000211485_100000742324 [0,1,0,1,0,0|2,0,0]=4 10472 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Cl)Cl 34a_100011218458_100000742324 [0,1,0,1,0,0|2,0,0]=4 10473 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Cl)Cl 7a_100011218458_100000742324 [0,1,0,1,0,0|2,0,0]=4 10474 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Cl)I 34a_200015900153_100000742324 [0,1,0,1,0,0|2,0,0]=4 10475 B15R2.4200 Cc1cc(cc(c1OCC2CC2)Cl)I 7a_200015900153_100000742324 [0,1,0,1,0,0|2,0,0]=4 10476 B15R2.4200 Cc1cc(cc(c1OCC2CC2)I)Cl 34a_100012343667_100000742324 [0,1,0,1,0,0|2,0,0]=4 10477 B15R2.4200 Cc1cc(cc(c1OCC2CC2)I)Cl 7a_100012343667_100000742324 [0,1,0,1,0,0|2,0,0]=4 10478 B15R2.4200 Cc1cc(cc(c1OCC2CC2)N)Br 34a_100011825904_100000742324 [0,1,0,1,0,0|2,0,0]=4 10479 B15R2.4200 Cc1cc(cc(c1OCC2CC2)N)Br 7a_100011825904_100000742324 [0,1,0,1,0,0|2,0,0]=4 10480 B15R2.4200 Cc1cc(cc(c1OCC2CC2)N)F 34a_100000130126_100000742324 [0,1,0,1,0,0|2,0,0]=4 10481 B15R2.4200 Cc1cc(cc(c1OCC2CC2)N)F 7a_100000130126_100000742324 [0,1,0,1,0,0|2,0,0]=4 10482 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)Br 34a_100000186369_102125554688 [0,1,0,1,0,0|2,0,0]=4 10483 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)Br 7a_100000186369_102125554688 [0,1,0,1,0,0|2,0,0]=4 10484 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)Cl 34a_100012337756_102125554688 [0,1,0,1,0,0|2,0,0]=4 10485 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)Cl 7a_100012337756_102125554688 [0,1,0,1,0,0|2,0,0]=4 10486 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)I 34a_100010982682_102125554688 [0,1,0,1,0,0|2,0,0]=4 10487 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)I 7a_100010982682_102125554688 [0,1,0,1,0,0|2,0,0]=4 10488 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)N 34a_100010064301_102125554688 [0,1,0,1,0,0|2,0,0]=4 10489 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Br)N 7a_100010064301_102125554688 [0,1,0,1,0,0|2,0,0]=4 10490 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)Br 34a_100000187306_102125554688 [0,1,0,1,0,0|1,0,0]=3 10491 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)Br 7a_100000187306_102125554688 [0,1,0,1,0,0|1,0,0]=3 10492 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)Cl 34a_100000211519_102125554688 [0,1,0,1,0,0|1,0,0]=3 10493 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)Cl 7a_100000211519_102125554688 [0,1,0,1,0,0|1,0,0]=3 10494 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)F 34a_100000081862_102125554688 [0,1,0,1,0,0|1,0,0]=3 10495 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)F 7a_100000081862_102125554688 [0,1,0,1,0,0|1,0,0]=3 10496 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)I 34a_100011216129_102125554688 [0,1,0,1,0,0|1,0,0]=3 10497 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)I 7a_100011216129_102125554688 [0,1,0,1,0,0|1,0,0]=3 10498 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)N 34a_100000703291_102125554688 [0,1,0,1,0,0|1,0,0]=3 10499 B15R2.4200 Cc1cc(cc(c1OCC2CO2)C)N 7a_100000703291_102125554688 [0,1,0,1,0,0|1,0,0]=3 10500 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Cl)Br 34a_100000211485_102125554688 [0,1,0,1,0,0|2,0,0]=4 10501 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Cl)Br 7a_100000211485_102125554688 [0,1,0,1,0,0|2,0,0]=4 10502 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Cl)Cl 34a_100011218458_102125554688 [0,1,0,1,0,0|2,0,0]=4 10503 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Cl)Cl 7a_100011218458_102125554688 [0,1,0,1,0,0|2,0,0]=4 10504 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Cl)I 34a_200015900153_102125554688 [0,1,0,1,0,0|2,0,0]=4 10505 B15R2.4200 Cc1cc(cc(c1OCC2CO2)Cl)I 7a_200015900153_102125554688 [0,1,0,1,0,0|2,0,0]=4 10506 B15R2.4200 Cc1cc(cc(c1OCC2CO2)I)Cl 34a_100012343667_102125554688 [0,1,0,1,0,0|2,0,0]=4 10507 B15R2.4200 Cc1cc(cc(c1OCC2CO2)I)Cl 7a_100012343667_102125554688 [0,1,0,1,0,0|2,0,0]=4 10508 B15R2.4200 Cc1cc(cc(c1OCC2CO2)N)Br 34a_100011825904_102125554688 [0,1,0,1,0,0|2,0,0]=4 10509 B15R2.4200 Cc1cc(cc(c1OCC2CO2)N)Br 7a_100011825904_102125554688 [0,1,0,1,0,0|2,0,0]=4 10510 B15R2.4200 Cc1cc(cc(c1OCC2CO2)N)F 34a_100000130126_102125554688 [0,1,0,1,0,0|2,0,0]=4 10511 B15R2.4200 Cc1cc(cc(c1OCC2CO2)N)F 7a_100000130126_102125554688 [0,1,0,1,0,0|2,0,0]=4 10512 B15R2.4200 Cc1cc(cc(c1OCC2CS2)Br)Br 7a_100000186369_100000031435 [0,1,0,1,0,0|2,0,0]=4 10513 B15R2.4200 Cc1cc(cc(c1OCC2CS2)Br)Cl 7a_100012337756_100000031435 [0,1,0,1,0,0|2,0,0]=4 10514 B15R2.4200 Cc1cc(cc(c1OCC2CS2)Br)I 7a_100010982682_100000031435 [0,1,0,1,0,0|2,0,0]=4 10515 B15R2.4200 Cc1cc(cc(c1OCC2CS2)Br)N 7a_100010064301_100000031435 [0,1,0,1,0,0|2,0,0]=4 10516 B15R2.4200 Cc1cc(cc(c1OCC2CS2)C)Br 7a_100000187306_100000031435 [0,1,0,1,0,0|1,0,0]=3 10517 B15R2.4200 Cc1cc(cc(c1OCC2CS2)C)Cl 7a_100000211519_100000031435 [0,1,0,1,0,0|1,0,0]=3 10518 B15R2.4200 Cc1cc(cc(c1OCC2CS2)C)F 7a_100000081862_100000031435 [0,1,0,1,0,0|1,0,0]=3 10519 B15R2.4200 Cc1cc(cc(c1OCC2CS2)C)I 7a_100011216129_100000031435 [0,1,0,1,0,0|1,0,0]=3 10520 B15R2.4200 Cc1cc(cc(c1OCC2CS2)C)N 7a_100000703291_100000031435 [0,1,0,1,0,0|1,0,0]=3 10521 B15R2.4200 Cc1cc(cc(c1OCC2CS2)Cl)Br 7a_100000211485_100000031435 [0,1,0,1,0,0|2,0,0]=4 10522 B15R2.4200 Cc1cc(cc(c1OCC2CS2)Cl)Cl 7a_100011218458_100000031435 [0,1,0,1,0,0|2,0,0]=4 10523 B15R2.4200 Cc1cc(cc(c1OCC2CS2)Cl)I 7a_200015900153_100000031435 [0,1,0,1,0,0|2,0,0]=4 10524 B15R2.4200 Cc1cc(cc(c1OCC2CS2)I)Cl 7a_100012343667_100000031435 [0,1,0,1,0,0|2,0,0]=4 10525 B15R2.4200 Cc1cc(cc(c1OCC2CS2)N)Br 7a_100011825904_100000031435 [0,1,0,1,0,0|2,0,0]=4 10526 B15R2.4200 Cc1cc(cc(c1OCC2CS2)N)F 7a_100000130126_100000031435 [0,1,0,1,0,0|2,0,0]=4 10527 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)Br)Br 7a_100000186369_100000745022 [0,1,0,1,0,0|2,0,0]=4 10528 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)Br)Cl 7a_100012337756_100000745022 [0,1,0,1,0,0|2,0,0]=4 10529 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)Br)I 7a_100010982682_100000745022 [0,1,0,1,0,0|2,0,0]=4 10530 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)Br)N 7a_100010064301_100000745022 [0,1,0,1,0,0|2,0,0]=4 10531 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)C)Br 7a_100000187306_100000745022 [0,1,0,1,0,0|1,0,0]=3 10532 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)C)Cl 7a_100000211519_100000745022 [0,1,0,1,0,0|1,0,0]=3 10533 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)C)F 7a_100000081862_100000745022 [0,1,0,1,0,0|1,0,0]=3 10534 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)C)I 7a_100011216129_100000745022 [0,1,0,1,0,0|1,0,0]=3 10535 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)C)N 7a_100000703291_100000745022 [0,1,0,1,0,0|1,0,0]=3 10536 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)Cl)Br 7a_100000211485_100000745022 [0,1,0,1,0,0|2,0,0]=4 10537 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)Cl)Cl 7a_100011218458_100000745022 [0,1,0,1,0,0|2,0,0]=4 10538 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)Cl)I 7a_200015900153_100000745022 [0,1,0,1,0,0|2,0,0]=4 10539 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)I)Cl 7a_100012343667_100000745022 [0,1,0,1,0,0|2,0,0]=4 10540 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)N)Br 7a_100011825904_100000745022 [0,1,0,1,0,0|2,0,0]=4 10541 B15R2.4200 Cc1cc(cc(c1OC[C@@H]2CO2)N)F 7a_100000130126_100000745022 [0,1,0,1,0,0|2,0,0]=4 10542 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)Br 62a_100000756562_100009814048 [0,1,0,1,0,0|1,1,0]=4 10543 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)Br 62a_100009814048_100000742324 [0,1,0,1,0,0|1,1,0]=4 10544 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)Cl 62a_100000756562_100010244930 [0,1,0,1,0,0|1,1,0]=4 10545 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)Cl 62a_100010244930_100000742324 [0,1,0,1,0,0|1,1,0]=4 10546 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)F 62a_100000756562_100012356666 [0,1,0,1,0,0|1,1,0]=4 10547 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)F 62a_100012356666_100000742324 [0,1,0,1,0,0|1,1,0]=4 10548 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)N 62a_100000215964_100000742324 [0,1,0,1,0,0|1,1,0]=4 10549 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)N 62a_100000756562_100000215964 [0,1,0,1,0,0|1,1,0]=4 10550 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)O 62a_100000243743_100000742324 [0,1,0,1,0,0|1,1,0]=4 10551 B15R2.4200 Cc1cc(cc(c1SCC2CC2)C)O 62a_100000756562_100000243743 [0,1,0,1,0,0|1,1,0]=4 10552 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)Br 62a_100009814048_102125554688 [0,1,0,1,0,0|1,1,0]=4 10553 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)Br 62a_102125554688_100009814048 [0,1,0,1,0,0|1,1,0]=4 10554 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)Cl 62a_100010244930_102125554688 [0,1,0,1,0,0|1,1,0]=4 10555 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)Cl 62a_102125554688_100010244930 [0,1,0,1,0,0|1,1,0]=4 10556 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)F 62a_100012356666_102125554688 [0,1,0,1,0,0|1,1,0]=4 10557 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)F 62a_102125554688_100012356666 [0,1,0,1,0,0|1,1,0]=4 10558 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)N 62a_100000215964_102125554688 [0,1,0,1,0,0|1,1,0]=4 10559 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)N 62a_102125554688_100000215964 [0,1,0,1,0,0|1,1,0]=4 10560 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)O 62a_100000243743_102125554688 [0,1,0,1,0,0|1,1,0]=4 10561 B15R2.4200 Cc1cc(cc(c1SCC2CO2)C)O 62a_102125554688_100000243743 [0,1,0,1,0,0|1,1,0]=4 10562 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)Br 62a_100000031435_100009814048 [0,1,0,1,0,0|1,1,0]=4 10563 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)Br 62a_100009814048_100000031435 [0,1,0,1,0,0|1,1,0]=4 10564 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)Cl 62a_100000031435_100010244930 [0,1,0,1,0,0|1,1,0]=4 10565 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)Cl 62a_100010244930_100000031435 [0,1,0,1,0,0|1,1,0]=4 10566 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)F 62a_100000031435_100012356666 [0,1,0,1,0,0|1,1,0]=4 10567 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)F 62a_100012356666_100000031435 [0,1,0,1,0,0|1,1,0]=4 10568 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)N 62a_100000031435_100000215964 [0,1,0,1,0,0|1,1,0]=4 10569 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)N 62a_100000215964_100000031435 [0,1,0,1,0,0|1,1,0]=4 10570 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)O 62a_100000031435_100000243743 [0,1,0,1,0,0|1,1,0]=4 10571 B15R2.4200 Cc1cc(cc(c1SCC2CS2)C)O 62a_100000243743_100000031435 [0,1,0,1,0,0|1,1,0]=4 10572 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)Br 62a_100000745022_100009814048 [0,1,0,1,0,0|1,1,0]=4 10573 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)Br 62a_100009814048_100000745022 [0,1,0,1,0,0|1,1,0]=4 10574 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)Cl 62a_100000745022_100010244930 [0,1,0,1,0,0|1,1,0]=4 10575 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)Cl 62a_100010244930_100000745022 [0,1,0,1,0,0|1,1,0]=4 10576 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)F 62a_100000745022_100012356666 [0,1,0,1,0,0|1,1,0]=4 10577 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)F 62a_100012356666_100000745022 [0,1,0,1,0,0|1,1,0]=4 10578 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)N 62a_100000215964_100000745022 [0,1,0,1,0,0|1,1,0]=4 10579 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)N 62a_100000745022_100000215964 [0,1,0,1,0,0|1,1,0]=4 10580 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)O 62a_100000243743_100000745022 [0,1,0,1,0,0|1,1,0]=4 10581 B15R2.4200 Cc1cc(cc(c1SC[C@@H]2CO2)C)O 62a_100000745022_100000243743 [0,1,0,1,0,0|1,1,0]=4 10582 B15R2.48036 Cc1cccc(c1NCC2(CO2)C)C 34a_100000185769_100000760498 [0,1,0,1,0,0|2,0,0]=4 10583 B15R2.48036 Cc1cccc(c1OCC2(CO2)C)Br 34a_100009817157_100000760498 [0,1,0,1,0,0|2,0,0]=4 10584 B15R2.48036 Cc1cccc(c1OCC2(CO2)C)C 34a_100000210341_100000760498 [0,1,0,1,0,0|1,0,0]=3 10585 B15R2.48036 Cc1cccc(c1OCC2(CO2)C)Cl 34a_100000033731_100000760498 [0,1,0,1,0,0|2,0,0]=4 10586 B15R2.48036 Cc1cccc(c1OCC2(CO2)C)F 34a_100011659162_100000760498 [0,1,0,1,0,0|2,0,0]=4 10587 B15R2.48036 Cc1cccc(c1OCC2(CO2)C)N 34a_100000756359_100000760498 [0,1,0,1,0,0|2,0,0]=4 10588 B15R2.48036 Cc1cccc(c1SCC2(CO2)C)C 62a_100000033847_100000760498 [0,1,0,1,0,0|1,1,0]=4 10589 B15R2.48036 Cc1cccc(c1SCC2(CO2)C)C 62a_100000760498_100000033847 [0,1,0,1,0,0|1,1,0]=4 10590 B15R2.48036 Cc1ccnc(c1OCC2(CO2)C)C 34a_100011934651_100000760498 [0,1,0,1,0,0|2,0,0]=4 10591 B15R2.15369 Cc1cccc(c1C(=O)CC2CC2)C 1458a_100000758298_100000742324 [0,1,0,1,0,0|2,0,0]=4 10592 B15R2.15369 Cc1cccc(c1C(=O)CC2CO2)C 1458a_100000758298_100011216344 [0,1,0,1,0,0|2,0,0]=4 10593 B15R2.15369 Cc1cccc(c1C(=O)CC2CS2)C 1458a_100000758298_100000031435 [0,1,0,1,0,0|2,0,0]=4 10594 B15R2.15369 Cc1cccc(c1C(=O)C[C@@H]2CO2)C 1458a_100000758298_100000745022 [0,1,0,1,0,0|2,0,0]=4 10595 B15R2.15369 Cc1cccc(c1N(C)CC2CC2)C 2230a_100011645471_100000742324 [0,1,0,1,0,0|2,0,0]=4 10596 B15R2.15369 Cc1cccc(c1N(C)CC2CC2)C 269982a_100011645471_100000756562 [0,1,0,1,0,0|2,0,0]=4 10597 B15R2.15369 Cc1cccc(c1N(C)CC2CC2)C 34a_100011645471_100000742324 [0,1,0,1,0,0|2,0,0]=4 10598 B15R2.15369 Cc1cccc(c1N(C)CC2CO2)C 2230a_100011645471_100011216344 [0,1,0,1,0,0|2,0,0]=4 10599 B15R2.15369 Cc1cccc(c1N(C)CC2CO2)C 269982a_100011645471_102125554688 [0,1,0,1,0,0|2,0,0]=4 10600 B15R2.15369 Cc1cccc(c1N(C)CC2CO2)C 34a_100011645471_102125554688 [0,1,0,1,0,0|2,0,0]=4 10601 B15R2.15369 Cc1cccc(c1N(C)CC2CS2)C 269982a_100011645471_100000031435 [0,1,0,1,0,0|2,0,0]=4 10602 B15R2.15369 Cc1cccc(c1N(C)C[C@@H]2CO2)C 269982a_100011645471_100000745022 [0,1,0,1,0,0|2,0,0]=4 10603 B15R2.15370 Cc1cccc(c1OC2CCC2=O)C 34a_100000210341_100009892977 [0,1,0,1,0,0|1,0,1]=4 10604 B15R2.15370 Cc1cccc(c1OC2CCC2=O)C 7a_100000210341_100009892977 [0,1,0,1,0,0|1,0,1]=4 10605 B15R2.15646 Cc1c(ccc(c1OCC2CC2)Br)Cl 34a_200010391122_100000742324 [0,1,0,1,0,0|2,0,0]=4 10606 B15R2.15646 Cc1c(ccc(c1OCC2CC2)Br)Cl 7a_200010391122_100000742324 [0,1,0,1,0,0|2,0,0]=4 10607 B15R2.15646 Cc1c(ccc(c1OCC2CC2)Br)F 34a_200010391124_100000742324 [0,1,0,1,0,0|2,0,0]=4 10608 B15R2.15646 Cc1c(ccc(c1OCC2CC2)Br)F 7a_200010391124_100000742324 [0,1,0,1,0,0|2,0,0]=4 10609 B15R2.15646 Cc1c(ccc(c1OCC2CO2)Br)Cl 34a_200010391122_102125554688 [0,1,0,1,0,0|2,0,0]=4 10610 B15R2.15646 Cc1c(ccc(c1OCC2CO2)Br)Cl 7a_200010391122_102125554688 [0,1,0,1,0,0|2,0,0]=4 10611 B15R2.15646 Cc1c(ccc(c1OCC2CO2)Br)F 34a_200010391124_102125554688 [0,1,0,1,0,0|2,0,0]=4 10612 B15R2.15646 Cc1c(ccc(c1OCC2CO2)Br)F 7a_200010391124_102125554688 [0,1,0,1,0,0|2,0,0]=4 10613 B15R2.15646 Cc1c(ccc(c1OCC2CS2)Br)Cl 7a_200010391122_100000031435 [0,1,0,1,0,0|2,0,0]=4 10614 B15R2.15646 Cc1c(ccc(c1OCC2CS2)Br)F 7a_200010391124_100000031435 [0,1,0,1,0,0|2,0,0]=4 10615 B15R2.15646 Cc1c(ccc(c1OC[C@@H]2CO2)Br)Cl 7a_200010391122_100000745022 [0,1,0,1,0,0|2,0,0]=4 10616 B15R2.15646 Cc1c(ccc(c1OC[C@@H]2CO2)Br)F 7a_200010391124_100000745022 [0,1,0,1,0,0|2,0,0]=4 10617 B15R2.15646 Cc1ccc(c(c1C)NCC2CC2)C 2230a_100000117417_100000742324 [0,1,0,1,0,0|2,0,0]=4 10618 B15R2.15646 Cc1ccc(c(c1C)NCC2CC2)C 34a_100000117417_100000742324 [0,1,0,1,0,0|2,0,0]=4 10619 B15R2.15646 Cc1ccc(c(c1C)NCC2CC2)C 7a_100000117417_100000742324 [0,1,0,1,0,0|2,0,0]=4 10620 B15R2.15646 Cc1ccc(c(c1C)NCC2CO2)C 2230a_100000117417_100011216344 [0,1,0,1,0,0|2,0,0]=4 10621 B15R2.15646 Cc1ccc(c(c1C)NCC2CO2)C 34a_100000117417_102125554688 [0,1,0,1,0,0|2,0,0]=4 10622 B15R2.15646 Cc1ccc(c(c1C)NCC2CO2)C 7a_100000117417_102125554688 [0,1,0,1,0,0|2,0,0]=4 10623 B15R2.15646 Cc1ccc(c(c1C)NCC2CS2)C 7a_100000117417_100000031435 [0,1,0,1,0,0|2,0,0]=4 10624 B15R2.15646 Cc1ccc(c(c1C)NC[C@@H]2CO2)C 7a_100000117417_100000745022 [0,1,0,1,0,0|2,0,0]=4 10625 B15R2.15646 Cc1ccc(c(c1C)OCC2CC2)C 34a_100000211305_100000742324 [0,1,0,1,0,0|1,0,0]=3 10626 B15R2.15646 Cc1ccc(c(c1C)OCC2CC2)C 7a_100000211305_100000742324 [0,1,0,1,0,0|1,0,0]=3 10627 B15R2.15646 Cc1ccc(c(c1C)OCC2CO2)C 34a_100000211305_102125554688 [0,1,0,1,0,0|1,0,0]=3 10628 B15R2.15646 Cc1ccc(c(c1C)OCC2CO2)C 7a_100000211305_102125554688 [0,1,0,1,0,0|1,0,0]=3 10629 B15R2.15646 Cc1ccc(c(c1C)OCC2CS2)C 7a_100000211305_100000031435 [0,1,0,1,0,0|1,0,0]=3 10630 B15R2.15646 Cc1ccc(c(c1C)OC[C@@H]2CO2)C 7a_100000211305_100000745022 [0,1,0,1,0,0|1,0,0]=3 10631 B15R2.15646 Cc1ccc(c(c1NCC2CC2)C)Br 34a_200010074581_100000742324 [0,1,0,1,0,0|2,0,0]=4 10632 B15R2.15646 Cc1ccc(c(c1NCC2CC2)C)Cl 2230a_200020642106_100000742324 [0,1,0,1,0,0|2,0,0]=4 10633 B15R2.15646 Cc1ccc(c(c1NCC2CC2)C)Cl 34a_200020642106_100000742324 [0,1,0,1,0,0|2,0,0]=4 10634 B15R2.15646 Cc1ccc(c(c1NCC2CC2)C)I 34a_200010115591_100000742324 [0,1,0,1,0,0|2,0,0]=4 10635 B15R2.15646 Cc1ccc(c(c1NCC2CO2)C)Br 34a_200010074581_102125554688 [0,1,0,1,0,0|2,0,0]=4 10636 B15R2.15646 Cc1ccc(c(c1NCC2CO2)C)Cl 2230a_200020642106_100011216344 [0,1,0,1,0,0|2,0,0]=4 10637 B15R2.15646 Cc1ccc(c(c1NCC2CO2)C)Cl 34a_200020642106_102125554688 [0,1,0,1,0,0|2,0,0]=4 10638 B15R2.15646 Cc1ccc(c(c1NCC2CO2)C)I 34a_200010115591_102125554688 [0,1,0,1,0,0|2,0,0]=4 10639 B15R2.15646 Cc1ccc(c(c1OCC2CC2)Cl)N 34a_100000036876_100000742324 [0,1,0,1,0,0|2,0,0]=4 10640 B15R2.15646 Cc1ccc(c(c1OCC2CC2)Cl)N 7a_100000036876_100000742324 [0,1,0,1,0,0|2,0,0]=4 10641 B15R2.15646 Cc1ccc(c(c1OCC2CO2)Cl)N 34a_100000036876_102125554688 [0,1,0,1,0,0|2,0,0]=4 10642 B15R2.15646 Cc1ccc(c(c1OCC2CO2)Cl)N 7a_100000036876_102125554688 [0,1,0,1,0,0|2,0,0]=4 10643 B15R2.15646 Cc1ccc(c(c1OCC2CS2)Cl)N 7a_100000036876_100000031435 [0,1,0,1,0,0|2,0,0]=4 10644 B15R2.15646 Cc1ccc(c(c1OC[C@@H]2CO2)Cl)N 7a_100000036876_100000745022 [0,1,0,1,0,0|2,0,0]=4 10645 B15R2.15646 Cc1ccc(c(c1SCC2CC2)C)F 62a_100000756562_100011068659 [0,1,0,1,0,0|1,1,0]=4 10646 B15R2.15646 Cc1ccc(c(c1SCC2CC2)C)F 62a_100011068659_100000742324 [0,1,0,1,0,0|1,1,0]=4 10647 B15R2.15646 Cc1ccc(c(c1SCC2CC2)C)N 62a_100000756562_106354213274 [0,1,0,1,0,0|1,1,0]=4 10648 B15R2.15646 Cc1ccc(c(c1SCC2CC2)C)N 62a_106354213274_100000742324 [0,1,0,1,0,0|1,1,0]=4 10649 B15R2.15646 Cc1ccc(c(c1SCC2CC2)C)O 62a_100000756562_100010659238 [0,1,0,1,0,0|1,1,0]=4 10650 B15R2.15646 Cc1ccc(c(c1SCC2CC2)C)O 62a_100010659238_100000742324 [0,1,0,1,0,0|1,1,0]=4 10651 B15R2.15646 Cc1ccc(c(c1SCC2CO2)C)F 62a_100011068659_102125554688 [0,1,0,1,0,0|1,1,0]=4 10652 B15R2.15646 Cc1ccc(c(c1SCC2CO2)C)F 62a_102125554688_100011068659 [0,1,0,1,0,0|1,1,0]=4 10653 B15R2.15646 Cc1ccc(c(c1SCC2CO2)C)N 62a_102125554688_106354213274 [0,1,0,1,0,0|1,1,0]=4 10654 B15R2.15646 Cc1ccc(c(c1SCC2CO2)C)N 62a_106354213274_102125554688 [0,1,0,1,0,0|1,1,0]=4 10655 B15R2.15646 Cc1ccc(c(c1SCC2CO2)C)O 62a_100010659238_102125554688 [0,1,0,1,0,0|1,1,0]=4 10656 B15R2.15646 Cc1ccc(c(c1SCC2CO2)C)O 62a_102125554688_100010659238 [0,1,0,1,0,0|1,1,0]=4 10657 B15R2.15646 Cc1ccc(c(c1SCC2CS2)C)F 62a_100000031435_100011068659 [0,1,0,1,0,0|1,1,0]=4 10658 B15R2.15646 Cc1ccc(c(c1SCC2CS2)C)F 62a_100011068659_100000031435 [0,1,0,1,0,0|1,1,0]=4 10659 B15R2.15646 Cc1ccc(c(c1SCC2CS2)C)N 62a_100000031435_106354213274 [0,1,0,1,0,0|1,1,0]=4 10660 B15R2.15646 Cc1ccc(c(c1SCC2CS2)C)N 62a_106354213274_100000031435 [0,1,0,1,0,0|1,1,0]=4 10661 B15R2.15646 Cc1ccc(c(c1SCC2CS2)C)O 62a_100000031435_100010659238 [0,1,0,1,0,0|1,1,0]=4 10662 B15R2.15646 Cc1ccc(c(c1SCC2CS2)C)O 62a_100010659238_100000031435 [0,1,0,1,0,0|1,1,0]=4 10663 B15R2.15646 Cc1ccc(c(c1SC[C@@H]2CO2)C)F 62a_100000745022_100011068659 [0,1,0,1,0,0|1,1,0]=4 10664 B15R2.15646 Cc1ccc(c(c1SC[C@@H]2CO2)C)F 62a_100011068659_100000745022 [0,1,0,1,0,0|1,1,0]=4 10665 B15R2.15646 Cc1ccc(c(c1SC[C@@H]2CO2)C)N 62a_100000745022_106354213274 [0,1,0,1,0,0|1,1,0]=4 10666 B15R2.15646 Cc1ccc(c(c1SC[C@@H]2CO2)C)N 62a_106354213274_100000745022 [0,1,0,1,0,0|1,1,0]=4 10667 B15R2.15646 Cc1ccc(c(c1SC[C@@H]2CO2)C)O 62a_100000745022_100010659238 [0,1,0,1,0,0|1,1,0]=4 10668 B15R2.15646 Cc1ccc(c(c1SC[C@@H]2CO2)C)O 62a_100010659238_100000745022 [0,1,0,1,0,0|1,1,0]=4 10669 B15R2.8669 Cc1cccc(c1NCC2CCC2)C 34a_100000185769_100000763275 [0,1,0,1,0,0|2,0,0]=4 10670 B15R2.8669 Cc1cccc(c1NCC2CCO2)C 34a_100000185769_100000103362 [0,1,0,1,0,0|2,0,0]=4 10671 B15R2.8669 Cc1cccc(c1NCC2COC2)C 34a_100000185769_100010264016 [0,1,0,1,0,0|2,0,0]=4 10672 B15R2.8669 Cc1cccc(c1OCC2CCC2)Br 34a_100009817157_100000763275 [0,1,0,1,0,0|2,0,0]=4 10673 B15R2.8669 Cc1cccc(c1OCC2CCC2)Br 7a_100009817157_100000763275 [0,1,0,1,0,0|2,0,0]=4 10674 B15R2.8669 Cc1cccc(c1OCC2CCC2)C 34a_100000210341_100000763275 [0,1,0,1,0,0|1,0,0]=3 10675 B15R2.8669 Cc1cccc(c1OCC2CCC2)C 7a_100000210341_100000763275 [0,1,0,1,0,0|1,0,0]=3 10676 B15R2.8669 Cc1cccc(c1OCC2CCC2)Cl 34a_100000033731_100000763275 [0,1,0,1,0,0|2,0,0]=4 10677 B15R2.8669 Cc1cccc(c1OCC2CCC2)Cl 7a_100000033731_100000763275 [0,1,0,1,0,0|2,0,0]=4 10678 B15R2.8669 Cc1cccc(c1OCC2CCC2)F 34a_100011659162_100000763275 [0,1,0,1,0,0|2,0,0]=4 10679 B15R2.8669 Cc1cccc(c1OCC2CCC2)F 7a_100011659162_100000763275 [0,1,0,1,0,0|2,0,0]=4 10680 B15R2.8669 Cc1cccc(c1OCC2CCC2)N 34a_100000756359_100000763275 [0,1,0,1,0,0|2,0,0]=4 10681 B15R2.8669 Cc1cccc(c1OCC2CCC2)N 7a_100000756359_100000763275 [0,1,0,1,0,0|2,0,0]=4 10682 B15R2.8669 Cc1cccc(c1OCC2CCO2)Br 34a_100009817157_100000103362 [0,1,0,1,0,0|2,0,0]=4 10683 B15R2.8669 Cc1cccc(c1OCC2CCO2)Br 7a_100009817157_100000103362 [0,1,0,1,0,0|2,0,0]=4 10684 B15R2.8669 Cc1cccc(c1OCC2CCO2)C 34a_100000210341_100000103362 [0,1,0,1,0,0|1,0,0]=3 10685 B15R2.8669 Cc1cccc(c1OCC2CCO2)C 7a_100000210341_100000103362 [0,1,0,1,0,0|1,0,0]=3 10686 B15R2.8669 Cc1cccc(c1OCC2CCO2)Cl 34a_100000033731_100000103362 [0,1,0,1,0,0|2,0,0]=4 10687 B15R2.8669 Cc1cccc(c1OCC2CCO2)Cl 7a_100000033731_100000103362 [0,1,0,1,0,0|2,0,0]=4 10688 B15R2.8669 Cc1cccc(c1OCC2CCO2)F 34a_100011659162_100000103362 [0,1,0,1,0,0|2,0,0]=4 10689 B15R2.8669 Cc1cccc(c1OCC2CCO2)F 7a_100011659162_100000103362 [0,1,0,1,0,0|2,0,0]=4 10690 B15R2.8669 Cc1cccc(c1OCC2CCO2)N 34a_100000756359_100000103362 [0,1,0,1,0,0|2,0,0]=4 10691 B15R2.8669 Cc1cccc(c1OCC2CCO2)N 7a_100000756359_100000103362 [0,1,0,1,0,0|2,0,0]=4 10692 B15R2.8669 Cc1cccc(c1OCC2COC2)Br 34a_100009817157_100010264016 [0,1,0,1,0,0|2,0,0]=4 10693 B15R2.8669 Cc1cccc(c1OCC2COC2)Br 7a_100009817157_100010264016 [0,1,0,1,0,0|2,0,0]=4 10694 B15R2.8669 Cc1cccc(c1OCC2COC2)C 34a_100000210341_100010264016 [0,1,0,1,0,0|1,0,0]=3 10695 B15R2.8669 Cc1cccc(c1OCC2COC2)C 7a_100000210341_100010264016 [0,1,0,1,0,0|1,0,0]=3 10696 B15R2.8669 Cc1cccc(c1OCC2COC2)Cl 34a_100000033731_100010264016 [0,1,0,1,0,0|2,0,0]=4 10697 B15R2.8669 Cc1cccc(c1OCC2COC2)Cl 7a_100000033731_100010264016 [0,1,0,1,0,0|2,0,0]=4 10698 B15R2.8669 Cc1cccc(c1OCC2COC2)F 34a_100011659162_100010264016 [0,1,0,1,0,0|2,0,0]=4 10699 B15R2.8669 Cc1cccc(c1OCC2COC2)F 7a_100011659162_100010264016 [0,1,0,1,0,0|2,0,0]=4 10700 B15R2.8669 Cc1cccc(c1OCC2COC2)N 34a_100000756359_100010264016 [0,1,0,1,0,0|2,0,0]=4 10701 B15R2.8669 Cc1cccc(c1OCC2COC2)N 7a_100000756359_100010264016 [0,1,0,1,0,0|2,0,0]=4 10702 B15R2.8669 Cc1cccc(c1SCC2CCC2)C 62a_100000033847_100000763275 [0,1,0,1,0,0|1,1,0]=4 10703 B15R2.8669 Cc1cccc(c1SCC2CCC2)C 62a_100000763275_100000033847 [0,1,0,1,0,0|1,1,0]=4 10704 B15R2.8669 Cc1cccc(c1SCC2CCO2)C 62a_100000033847_100000103362 [0,1,0,1,0,0|1,1,0]=4 10705 B15R2.8669 Cc1cccc(c1SCC2CCO2)C 62a_100000103362_100000033847 [0,1,0,1,0,0|1,1,0]=4 10706 B15R2.8669 Cc1cccc(c1SCC2COC2)C 62a_100000033847_100010264016 [0,1,0,1,0,0|1,1,0]=4 10707 B15R2.8669 Cc1cccc(c1SCC2COC2)C 62a_100010264016_100000033847 [0,1,0,1,0,0|1,1,0]=4 10708 B15R2.8669 Cc1ccnc(c1OCC2CCC2)C 34a_100011934651_100000763275 [0,1,0,1,0,0|2,0,0]=4 10709 B15R2.8669 Cc1ccnc(c1OCC2CCC2)C 7a_100011934651_100000763275 [0,1,0,1,0,0|2,0,0]=4 10710 B15R2.8669 Cc1ccnc(c1OCC2CCO2)C 34a_100011934651_100000103362 [0,1,0,1,0,0|2,0,0]=4 10711 B15R2.8669 Cc1ccnc(c1OCC2CCO2)C 7a_100011934651_100000103362 [0,1,0,1,0,0|2,0,0]=4 10712 B15R2.8669 Cc1ccnc(c1OCC2COC2)C 34a_100011934651_100010264016 [0,1,0,1,0,0|2,0,0]=4 10713 B15R2.8669 Cc1ccnc(c1OCC2COC2)C 7a_100011934651_100010264016 [0,1,0,1,0,0|2,0,0]=4 10714 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [1,0,0,0,1,0|1,0,1]=4 10715 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [1,0,0,0,1,0|1,0,1]=4 10716 B11R1.86 CC(C)Oc1ccccc1Br 34a_100000181306_100000210206 [1,0,0,0,1,0|2,0,0]=4 10717 B11R1.86 CC(C)Oc1ccccc1Br 7a_100000181306_100000210206 [1,0,0,0,1,0|2,0,0]=4 10718 B11R1.86 CC(C)Oc1ccccc1Cl 34a_100000210172_100000210206 [1,0,0,0,1,0|2,0,0]=4 10719 B11R1.86 CC(C)Oc1ccccc1Cl 7a_100000210172_100000210206 [1,0,0,0,1,0|2,0,0]=4 10720 B11R1.86 CC(C)Oc1ccccc1F 34a_100000210171_100000210206 [1,0,0,0,1,0|2,0,0]=4 10721 B11R1.86 CC(C)Oc1ccccc1F 7a_100000210171_100000210206 [1,0,0,0,1,0|2,0,0]=4 10722 B11R1.86 CC(C)Oc1ccccc1I 34a_100000739446_100000210206 [1,0,0,0,1,0|2,0,0]=4 10723 B11R1.86 CC(C)Oc1ccccc1I 7a_100000739446_100000210206 [1,0,0,0,1,0|2,0,0]=4 10724 B11R1.86 CC(C)Oc1ccccc1N 34a_100000185747_100000210206 [1,0,0,0,1,0|2,0,0]=4 10725 B11R1.86 CC(C)Oc1ccccc1N 7a_100000185747_100000210206 [1,0,0,0,1,0|2,0,0]=4 10726 B11R1.86 CC(C)Oc1ccccc1O 271570a_203496583355_100000173919 [1,0,0,0,1,0|2,0,0]=4 10727 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [1,0,0,0,1,0|1,0,1]=4 10728 B11R1.86 Cc1ccccc1CN(C)C 2230a_100000184421_200000210301 [1,0,0,0,1,0|2,0,0]=4 10729 B11R1.86 Cc1ccccc1CN(C)C 2230a_100102631434_100000211839 [1,0,0,0,1,0|2,0,0]=4 10730 B11R1.86 Cc1ccccc1CN(C)C 269982a_100000184421_200000210301 [1,0,0,0,1,0|2,0,0]=4 10731 B11R1.86 Cc1ccccc1CN(C)C 269982a_100102631434_100000211839 [1,0,0,0,1,0|2,0,0]=4 10732 B11R1.86 Cc1ccccc1CN(C)C 270004a_100102631434_100000211143 [1,0,0,0,1,0|2,0,0]=4 10733 B11R1.86 Cc1ccccc1CN(C)[13CH3] 2230a_100000184421_200025704644 [1,0,0,0,1,0|2,0,0]=4 10734 B11R1.86 Cc1ccccc1CN(C)[13CH3] 269982a_100000184421_200025704644 [1,0,0,0,1,0|2,0,0]=4 10735 B11R1.86 Cc1ccccc1NC(C)C 34a_100015192222_100000210206 [1,0,0,0,1,0|2,0,0]=4 10736 B11R1.86 Cc1ccccc1OC(C)C 34a_100000210338_100000210206 [1,0,0,0,1,0|1,0,0]=3 10737 B11R1.86 Cc1ccccc1OC(C)C 7a_100000210338_100000210206 [1,0,0,0,1,0|1,0,0]=3 10738 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210206_100000210755 [1,0,0,0,1,0|1,1,0]=4 10739 B11R1.86 Cc1ccccc1SC(C)C 62a_100000210755_100000210206 [1,0,0,0,1,0|1,1,0]=4 10740 B11R1.86 Cc1ccncc1OC(C)C 34a_100011997053_100000210206 [1,0,0,0,1,0|2,0,0]=4 10741 B11R1.86 Cc1ccncc1OC(C)C 7a_100011997053_100000210206 [1,0,0,0,1,0|2,0,0]=4 10742 B11R1.86 Cc1cnccc1OC(C)C 34a_100000694293_100000210206 [1,0,0,0,1,0|2,0,0]=4 10743 B11R1.86 Cc1ncccc1OC(C)C 34a_100000745507_100000210206 [1,0,0,0,1,0|2,0,0]=4 10744 B11R1.86 Cc1ncccc1OC(C)C 7a_100000745507_100000210206 [1,0,0,0,1,0|2,0,0]=4 10745 B11R1.465 CCCOc1c(n[nH]c1C)C 34a_100012186652_100000210303 [1,0,0,0,1,0|2,0,0]=4 10746 B11R1.156 C=C(C)c1c(cccc1C)C 271570a_100000694244_100000033847 [0,0,0,0,2,0|1,0,1]=4 10747 B11R1.156 CC(=O)c1c(cccc1C)C 1458a_100000758298_200000210301 [0,0,0,0,2,0|1,0,1]=4 10748 B11R1.156 Cc1cccc(c1C(=O)[13CH3])C 1458a_100000758298_200025704644 [0,0,0,0,2,0|1,0,1]=4 10749 B11R1.156 Cc1cccc(c1N(C)C)C 2230a_100011645471_200000210301 [0,0,0,0,2,0|2,0,0]=4 10750 B11R1.156 Cc1cccc(c1N(C)C)C 269982a_100011645471_200000210301 [0,0,0,0,2,0|2,0,0]=4 10751 B11R1.156 Cc1cccc(c1N(C)C)C 34a_100011645471_200000210301 [0,0,0,0,2,0|2,0,0]=4 10752 B11R1.156 Cc1cccc(c1N(C)[13CH3])C 2230a_100011645471_200025704644 [0,0,0,0,2,0|2,0,0]=4 10753 B11R1.156 Cc1cccc(c1N(C)[13CH3])C 269982a_100011645471_200025704644 [0,0,0,0,2,0|2,0,0]=4 10754 B11R1.156 Cc1cccc(c1N(C)[13CH3])C 34a_100011645471_200025704644 [0,0,0,0,2,0|2,0,0]=4 10755 B13R1.158 C=C(C)CCOc1ccccc1C 34a_100000210338_100000730704 [1,0,0,0,0,1|1,0,1]=4 10756 B13R1.158 C=C(C)CCOc1ccccc1C 7a_100000210338_100000730704 [1,0,0,0,0,1|1,0,1]=4 10757 B13R1.158 C=C(C)COCc1ccccc1C 34a_100000210245_100000211839 [1,0,0,0,0,1|1,0,1]=4 10758 B13R1.158 C=C(C)COCc1ccccc1C 34a_100000698903_100000748629 [1,0,0,0,0,1|1,0,1]=4 10759 B13R1.158 C=C(C)COCc1ccccc1C 7a_100000698903_100000748629 [1,0,0,0,0,1|1,0,1]=4 10760 B13R1.158 CC(=CCOc1ccccc1C)C 34a_100000210338_100000761012 [1,0,0,0,0,1|1,0,1]=4 10761 B13R1.158 CC(=CCOc1ccccc1C)C 7a_100000210338_100000761012 [1,0,0,0,0,1|1,0,1]=4 10762 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000070787_100000184434 [1,0,0,0,0,1|1,0,1]=4 10763 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000182324_200000210301 [1,0,0,0,0,1|1,0,1]=4 10764 B13R1.158 CC(=O)CCOc1ccccc1C 7a_100000210338_100000053229 [1,0,0,0,0,1|1,0,1]=4 10765 B13R1.158 CC(=O)COCc1ccccc1C 34a_100000211253_100000211839 [1,0,0,0,0,1|1,0,1]=4 10766 B13R1.158 CC(=O)OCOc1ccccc1C 34a_100000210338_100009813279 [1,0,0,0,0,1|1,0,1]=4 10767 B13R1.158 CC(Br)COCc1ccccc1Br 34a_100012180447_100000184730 [1,0,0,0,0,1|2,0,0]=4 10768 B13R1.158 CC(Br)COCc1ccccc1Cl 34a_100012180447_100000187162 [1,0,0,0,0,1|2,0,0]=4 10769 B13R1.158 CC(Br)COCc1ccccc1F 34a_100012180447_100000211605 [1,0,0,0,0,1|2,0,0]=4 10770 B13R1.158 CC(Br)COCc1ccccc1I 34a_100012180447_100011215278 [1,0,0,0,0,1|2,0,0]=4 10771 B13R1.158 CC(C)CCOc1ccccc1Br 34a_100000181306_100000210312 [1,0,0,0,0,1|2,0,0]=4 10772 B13R1.158 CC(C)CCOc1ccccc1Br 7a_100000181306_100000210626 [1,0,0,0,0,1|2,0,0]=4 10773 B13R1.158 CC(C)CCOc1ccccc1Cl 34a_100000210172_100000210312 [1,0,0,0,0,1|2,0,0]=4 10774 B13R1.158 CC(C)CCOc1ccccc1Cl 7a_100000210172_100000210626 [1,0,0,0,0,1|2,0,0]=4 10775 B13R1.158 CC(C)CCOc1ccccc1F 34a_100000210171_100000210312 [1,0,0,0,0,1|2,0,0]=4 10776 B13R1.158 CC(C)CCOc1ccccc1F 7a_100000210171_100000210626 [1,0,0,0,0,1|2,0,0]=4 10777 B13R1.158 CC(C)CCOc1ccccc1I 34a_100000739446_100000210312 [1,0,0,0,0,1|2,0,0]=4 10778 B13R1.158 CC(C)CCOc1ccccc1I 7a_100000739446_100000210626 [1,0,0,0,0,1|2,0,0]=4 10779 B13R1.158 CC(C)CCOc1ccccc1N 34a_100000185747_100000210312 [1,0,0,0,0,1|2,0,0]=4 10780 B13R1.158 CC(C)CCOc1ccccc1N 7a_100000185747_100000210626 [1,0,0,0,0,1|2,0,0]=4 10781 B13R1.158 CC(C)COCc1ccccc1Br 34a_100000210257_100000184730 [1,0,0,0,0,1|2,0,0]=4 10782 B13R1.158 CC(C)COCc1ccccc1Br 34a_100000756307_100000210624 [1,0,0,0,0,1|2,0,0]=4 10783 B13R1.158 CC(C)COCc1ccccc1Br 7a_100000756307_100000210760 [1,0,0,0,0,1|2,0,0]=4 10784 B13R1.158 CC(C)COCc1ccccc1Cl 34a_100000210257_100000187162 [1,0,0,0,0,1|2,0,0]=4 10785 B13R1.158 CC(C)COCc1ccccc1Cl 34a_100000210847_100000210624 [1,0,0,0,0,1|2,0,0]=4 10786 B13R1.158 CC(C)COCc1ccccc1Cl 7a_100000210847_100000210760 [1,0,0,0,0,1|2,0,0]=4 10787 B13R1.158 CC(C)COCc1ccccc1F 34a_100000210257_100000211605 [1,0,0,0,0,1|2,0,0]=4 10788 B13R1.158 CC(C)COCc1ccccc1F 34a_100000211962_100000210624 [1,0,0,0,0,1|2,0,0]=4 10789 B13R1.158 CC(C)COCc1ccccc1F 7a_100000211962_100000210760 [1,0,0,0,0,1|2,0,0]=4 10790 B13R1.158 CC(C)COCc1ccccc1I 34a_100000187465_100000210624 [1,0,0,0,0,1|2,0,0]=4 10791 B13R1.158 CC(C)COCc1ccccc1I 34a_100000210257_100011215278 [1,0,0,0,0,1|2,0,0]=4 10792 B13R1.158 CC(C)COCc1ccccc1I 7a_100000187465_100000210760 [1,0,0,0,0,1|2,0,0]=4 10793 B13R1.158 CC(C)COCc1ccccc1N 34a_100000212039_100000210624 [1,0,0,0,0,1|2,0,0]=4 10794 B13R1.158 CC(C)OCOc1ccccc1Br 34a_100000181306_100000709892 [1,0,0,0,0,1|2,0,0]=4 10795 B13R1.158 CC(C)OCOc1ccccc1Cl 34a_100000210172_100000709892 [1,0,0,0,0,1|2,0,0]=4 10796 B13R1.158 CC(C)OCOc1ccccc1F 34a_100000210171_100000709892 [1,0,0,0,0,1|2,0,0]=4 10797 B13R1.158 CC(C)OCOc1ccccc1I 34a_100000739446_100000709892 [1,0,0,0,0,1|2,0,0]=4 10798 B13R1.158 CC(C)OCOc1ccccc1N 34a_100000185747_100000709892 [1,0,0,0,0,1|2,0,0]=4 10799 B13R1.158 CC(F)COCc1ccccc1Br 34a_100015925927_100000184730 [1,0,0,0,0,1|2,0,0]=4 10800 B13R1.158 CC(F)COCc1ccccc1Cl 34a_100015925927_100000187162 [1,0,0,0,0,1|2,0,0]=4 10801 B13R1.158 CC(F)COCc1ccccc1F 34a_100015925927_100000211605 [1,0,0,0,0,1|2,0,0]=4 10802 B13R1.158 CC(F)COCc1ccccc1I 34a_100015925927_100011215278 [1,0,0,0,0,1|2,0,0]=4 10803 B13R1.158 CC(O)CCOc1ccccc1Br 34a_100000181306_100012276601 [1,0,0,0,0,1|2,0,0]=4 10804 B13R1.158 CC(O)CCOc1ccccc1Br 7a_100000181306_100012276601 [1,0,0,0,0,1|2,0,0]=4 10805 B13R1.158 CC(O)CCOc1ccccc1Cl 34a_100000210172_100012276601 [1,0,0,0,0,1|2,0,0]=4 10806 B13R1.158 CC(O)CCOc1ccccc1Cl 7a_100000210172_100012276601 [1,0,0,0,0,1|2,0,0]=4 10807 B13R1.158 CC(O)CCOc1ccccc1F 34a_100000210171_100012276601 [1,0,0,0,0,1|2,0,0]=4 10808 B13R1.158 CC(O)CCOc1ccccc1F 7a_100000210171_100012276601 [1,0,0,0,0,1|2,0,0]=4 10809 B13R1.158 CC(O)CCOc1ccccc1I 34a_100000739446_100012276601 [1,0,0,0,0,1|2,0,0]=4 10810 B13R1.158 CC(O)CCOc1ccccc1I 7a_100000739446_100012276601 [1,0,0,0,0,1|2,0,0]=4 10811 B13R1.158 CC(O)CCOc1ccccc1N 34a_100000185747_100012276601 [1,0,0,0,0,1|2,0,0]=4 10812 B13R1.158 CC(O)CCOc1ccccc1N 7a_100000185747_100012276601 [1,0,0,0,0,1|2,0,0]=4 10813 B13R1.158 CC(O)COCc1ccccc1Br 34a_100000756307_100011218427 [1,0,0,0,0,1|2,0,0]=4 10814 B13R1.158 CC(O)COCc1ccccc1Br 7a_100000756307_100011218427 [1,0,0,0,0,1|2,0,0]=4 10815 B13R1.158 CC(O)COCc1ccccc1Cl 34a_100000210847_100011218427 [1,0,0,0,0,1|2,0,0]=4 10816 B13R1.158 CC(O)COCc1ccccc1Cl 7a_100000210847_100011218427 [1,0,0,0,0,1|2,0,0]=4 10817 B13R1.158 CC(O)COCc1ccccc1F 34a_100000211962_100011218427 [1,0,0,0,0,1|2,0,0]=4 10818 B13R1.158 CC(O)COCc1ccccc1F 7a_100000211962_100011218427 [1,0,0,0,0,1|2,0,0]=4 10819 B13R1.158 CC(O)COCc1ccccc1I 34a_100000187465_100011218427 [1,0,0,0,0,1|2,0,0]=4 10820 B13R1.158 CC(O)COCc1ccccc1I 7a_100000187465_100011218427 [1,0,0,0,0,1|2,0,0]=4 10821 B13R1.158 CC(O)COCc1ccccc1N 34a_100000212039_100011218427 [1,0,0,0,0,1|2,0,0]=4 10822 B13R1.158 C[C@@H](Cl)COCc1ccccc1Br 34a_100016084084_100000184730 [1,0,0,0,0,1|2,0,0]=4 10823 B13R1.158 C[C@@H](Cl)COCc1ccccc1Cl 34a_100016084084_100000187162 [1,0,0,0,0,1|2,0,0]=4 10824 B13R1.158 C[C@@H](Cl)COCc1ccccc1F 34a_100016084084_100000211605 [1,0,0,0,0,1|2,0,0]=4 10825 B13R1.158 C[C@@H](Cl)COCc1ccccc1I 34a_100016084084_100011215278 [1,0,0,0,0,1|2,0,0]=4 10826 B13R1.158 C[C@@H](N)COCc1ccccc1Br 34a_100000737577_100000184730 [1,0,0,0,0,1|1,0,0]=3 10827 B13R1.158 C[C@@H](N)COCc1ccccc1Cl 34a_100000737577_100000187162 [1,0,0,0,0,1|1,0,0]=3 10828 B13R1.158 C[C@@H](N)COCc1ccccc1F 34a_100000737577_100000211605 [1,0,0,0,0,1|1,0,0]=3 10829 B13R1.158 C[C@@H](N)COCc1ccccc1I 34a_100000737577_100011215278 [1,0,0,0,0,1|1,0,0]=3 10830 B13R1.158 C[C@@H](N)COCc1cccnc1Br 34a_100000737577_100010140945 [1,0,0,0,0,1|2,0,0]=4 10831 B13R1.158 C[C@@H](N)COCc1cccnc1Cl 34a_100000737577_100000045678 [1,0,0,0,0,1|2,0,0]=4 10832 B13R1.158 C[C@@H](N)COCc1cccnc1F 34a_100000737577_100000099810 [1,0,0,0,0,1|2,0,0]=4 10833 B13R1.158 C[C@@H](N)COCc1ncccc1Br 34a_100000737577_100025702911 [1,0,0,0,0,1|2,0,0]=4 10834 B13R1.158 C[C@@H](N)COCc1ncccc1F 34a_100000737577_100000104219 [1,0,0,0,0,1|2,0,0]=4 10835 B13R1.158 C[C@@H](N)COCc1ncccc1O 34a_100000737577_200020655725 [1,0,0,0,0,1|2,0,0]=4 10836 B13R1.158 C[C@@H](O)COCc1ccccc1Br 34a_100000756307_100009817552 [1,0,0,0,0,1|2,0,0]=4 10837 B13R1.158 C[C@@H](O)COCc1ccccc1Br 7a_100000756307_100009817552 [1,0,0,0,0,1|2,0,0]=4 10838 B13R1.158 C[C@@H](O)COCc1ccccc1Cl 34a_100000210847_100009817552 [1,0,0,0,0,1|2,0,0]=4 10839 B13R1.158 C[C@@H](O)COCc1ccccc1Cl 7a_100000210847_100009817552 [1,0,0,0,0,1|2,0,0]=4 10840 B13R1.158 C[C@@H](O)COCc1ccccc1F 34a_100000211962_100009817552 [1,0,0,0,0,1|2,0,0]=4 10841 B13R1.158 C[C@@H](O)COCc1ccccc1F 7a_100000211962_100009817552 [1,0,0,0,0,1|2,0,0]=4 10842 B13R1.158 C[C@@H](O)COCc1ccccc1I 34a_100000187465_100009817552 [1,0,0,0,0,1|2,0,0]=4 10843 B13R1.158 C[C@@H](O)COCc1ccccc1I 7a_100000187465_100009817552 [1,0,0,0,0,1|2,0,0]=4 10844 B13R1.158 C[C@@H](O)COCc1ccccc1N 34a_100000212039_100009817552 [1,0,0,0,0,1|2,0,0]=4 10845 B13R1.158 Cc1ccccc1C=CCC(C)C 271570a_100016259101_100000210755 [1,0,0,0,0,1|2,0,0]=4 10846 B13R1.158 Cc1ccccc1CCNC(C)C 2230a_100000685071_100000210206 [1,0,0,0,0,1|2,0,0]=4 10847 B13R1.158 Cc1ccccc1CCNC(C)C 2230a_100138425928_100011713688 [1,0,0,0,0,1|2,0,0]=4 10848 B13R1.158 Cc1ccccc1CCNC(C)C 34a_100000685071_100000210206 [1,0,0,0,0,1|2,0,0]=4 10849 B13R1.158 Cc1ccccc1CCNC(C)C 34a_100138425928_100011713688 [1,0,0,0,0,1|2,0,0]=4 10850 B13R1.158 Cc1ccccc1CCOC(C)C 34a_100000212225_100011713688 [1,0,0,0,0,1|2,0,0]=4 10851 B13R1.158 Cc1ccccc1CCOC(C)C 34a_100011220023_100000210206 [1,0,0,0,0,1|2,0,0]=4 10852 B13R1.158 Cc1ccccc1CCOC(C)C 7a_100011220023_100000210206 [1,0,0,0,0,1|2,0,0]=4 10853 B13R1.158 Cc1ccccc1CCSC(C)C 62a_100000210206_100011713688 [1,0,0,0,0,1|2,0,0]=4 10854 B13R1.158 Cc1ccccc1CCSC(C)C 62a_100011713688_100000210206 [1,0,0,0,0,1|2,0,0]=4 10855 B13R1.158 Cc1ccccc1CNCC(C)C 207a_100000210953_100000211143 [1,0,0,0,0,1|2,0,0]=4 10856 B13R1.158 Cc1ccccc1CNCC(C)C 2230a_100000210953_100000211839 [1,0,0,0,0,1|2,0,0]=4 10857 B13R1.158 Cc1ccccc1CNCC(C)C 270004a_100000174972_100000210432 [1,0,0,0,0,1|2,0,0]=4 10858 B13R1.158 Cc1ccccc1CNCC(C)C 270004a_100000210953_100000211143 [1,0,0,0,0,1|2,0,0]=4 10859 B13R1.158 Cc1ccccc1CNCC(C)C 34a_100000174972_100000210624 [1,0,0,0,0,1|2,0,0]=4 10860 B13R1.158 Cc1ccccc1CNCC(C)C 34a_100000210953_100000211839 [1,0,0,0,0,1|2,0,0]=4 10861 B13R1.158 Cc1ccccc1CNCC(C)O 207a_100000210904_100000211143 [1,0,0,0,0,1|2,0,0]=4 10862 B13R1.158 Cc1ccccc1CNCC(C)O 2230a_100000210904_100000211839 [1,0,0,0,0,1|2,0,0]=4 10863 B13R1.158 Cc1ccccc1CNCC(C)O 270004a_100000210904_100000211143 [1,0,0,0,0,1|2,0,0]=4 10864 B13R1.158 Cc1ccccc1CNCC(C)O 34a_100000174972_100011218427 [1,0,0,0,0,1|2,0,0]=4 10865 B13R1.158 Cc1ccccc1CNCC(C)O 34a_100000210904_100000211839 [1,0,0,0,0,1|2,0,0]=4 10866 B13R1.158 Cc1ccccc1CNC[C@@H](C)O 34a_100000174972_100009817552 [1,0,0,0,0,1|2,0,0]=4 10867 B13R1.158 Cc1ccccc1COCC(=O)N 34a_100000698903_100000187820 [1,0,0,0,0,1|1,0,1]=4 10868 B13R1.158 Cc1ccccc1COCC(=O)N 7a_100000698903_100000187820 [1,0,0,0,0,1|1,0,1]=4 10869 B13R1.158 Cc1ccccc1COCC(C)Br 34a_100012180447_100000211839 [1,0,0,0,0,1|1,0,0]=3 10870 B13R1.158 Cc1ccccc1COCC(C)C 34a_100000210257_100000211839 [1,0,0,0,0,1|1,0,0]=3 10871 B13R1.158 Cc1ccccc1COCC(C)C 34a_100000698903_100000210624 [1,0,0,0,0,1|1,0,0]=3 10872 B13R1.158 Cc1ccccc1COCC(C)C 7a_100000698903_100000210760 [1,0,0,0,0,1|1,0,0]=3 10873 B13R1.158 Cc1ccccc1COCC(C)F 34a_100015925927_100000211839 [1,0,0,0,0,1|1,0,0]=3 10874 B13R1.158 Cc1ccccc1COCC(C)O 34a_100000698903_100011218427 [1,0,0,0,0,1|1,0,0]=3 10875 B13R1.158 Cc1ccccc1COCC(C)O 7a_100000698903_100011218427 [1,0,0,0,0,1|1,0,0]=3 10876 B13R1.158 Cc1ccccc1COCC(F)F 34a_100000698903_100011934356 [1,0,0,0,0,1|2,0,0]=4 10877 B13R1.158 Cc1ccccc1COCC(F)F 34a_100000743014_100000211839 [1,0,0,0,0,1|2,0,0]=4 10878 B13R1.158 Cc1ccccc1COCC(F)F 7a_100000698903_100011934356 [1,0,0,0,0,1|2,0,0]=4 10879 B13R1.158 Cc1ccccc1COC[C@@H](C)Cl 34a_100016084084_100000211839 [1,0,0,0,0,1|1,0,0]=3 10880 B13R1.158 Cc1ccccc1COC[C@@H](C)N 34a_100000737577_100000211839 [1,0,0,0,0,1|0,0,0]=2 10881 B13R1.158 Cc1ccccc1COC[C@@H](C)O 34a_100000698903_100009817552 [1,0,0,0,0,1|1,0,0]=3 10882 B13R1.158 Cc1ccccc1COC[C@@H](C)O 7a_100000698903_100009817552 [1,0,0,0,0,1|1,0,0]=3 10883 B13R1.158 Cc1ccccc1CSCC(C)C 62a_100000210624_100000211839 [1,0,0,0,0,1|1,1,0]=4 10884 B13R1.158 Cc1ccccc1CSCC(C)C 62a_100000211839_100000210760 [1,0,0,0,0,1|1,1,0]=4 10885 B13R1.158 Cc1ccccc1CSCC(C)O 62a_100000211839_100011218427 [1,0,0,0,0,1|1,1,0]=4 10886 B13R1.158 Cc1ccccc1CSCC(C)O 62a_100011218427_100000211839 [1,0,0,0,0,1|1,1,0]=4 10887 B13R1.158 Cc1ccccc1CSC[C@@H](C)O 62a_100000211839_100009817552 [1,0,0,0,0,1|1,1,0]=4 10888 B13R1.158 Cc1ccccc1CSC[C@@H](C)O 62a_100009817552_100000211839 [1,0,0,0,0,1|1,1,0]=4 10889 B13R1.158 Cc1ccccc1NCCC(C)C 34a_100015192222_100000210312 [1,0,0,0,0,1|2,0,0]=4 10890 B13R1.158 Cc1ccccc1NCCC(C)O 34a_100015192222_100012276601 [1,0,0,0,0,1|2,0,0]=4 10891 B13R1.158 Cc1ccccc1NCOC(C)C 34a_100015192222_100000709892 [1,0,0,0,0,1|2,0,0]=4 10892 B13R1.158 Cc1ccccc1OCCC(=O)N 34a_100000210338_100000731001 [1,0,0,0,0,1|1,0,1]=4 10893 B13R1.158 Cc1ccccc1OCCC(=O)N 7a_100000210338_100000744528 [1,0,0,0,0,1|1,0,1]=4 10894 B13R1.158 Cc1ccccc1OCCC(=O)[13CH3] 1458a_100000182324_200025704644 [1,0,0,0,0,1|1,0,1]=4 10895 B13R1.158 Cc1ccccc1OCCC(C)C 34a_100000210338_100000210312 [1,0,0,0,0,1|1,0,0]=3 10896 B13R1.158 Cc1ccccc1OCCC(C)C 7a_100000210338_100000210626 [1,0,0,0,0,1|1,0,0]=3 10897 B13R1.158 Cc1ccccc1OCCC(C)O 34a_100000210338_100012276601 [1,0,0,0,0,1|1,0,0]=3 10898 B13R1.158 Cc1ccccc1OCCC(C)O 7a_100000210338_100012276601 [1,0,0,0,0,1|1,0,0]=3 10899 B13R1.158 Cc1ccccc1OCCN(C)C 2230a_100102631434_100000184434 [1,0,0,0,0,1|2,0,0]=4 10900 B13R1.158 Cc1ccccc1OCCN(C)C 269982a_100102631434_100000184434 [1,0,0,0,0,1|2,0,0]=4 10901 B13R1.158 Cc1ccccc1OCCN(C)C 7a_100000210338_100000755713 [1,0,0,0,0,1|2,0,0]=4 10902 B13R1.158 Cc1ccccc1OCOC(C)C 34a_100000210338_100000709892 [1,0,0,0,0,1|1,0,0]=3 10903 B13R1.158 Cc1ccccc1SCCC(C)C 62a_100000210312_100000210755 [1,0,0,0,0,1|1,1,0]=4 10904 B13R1.158 Cc1ccccc1SCCC(C)C 62a_100000210755_100000210312 [1,0,0,0,0,1|1,1,0]=4 10905 B13R1.158 Cc1ccccc1SCCC(C)O 62a_100000210755_100012276601 [1,0,0,0,0,1|1,1,0]=4 10906 B13R1.158 Cc1ccccc1SCCC(C)O 62a_100012276601_100000210755 [1,0,0,0,0,1|1,1,0]=4 10907 B13R1.158 Cc1ccccc1SCOC(C)C 62a_100000210755_100000709892 [1,0,0,0,0,1|1,1,0]=4 10908 B13R1.158 Cc1ccccc1SCOC(C)C 62a_100000709892_100000210755 [1,0,0,0,0,1|1,1,0]=4 10909 B13R1.158 Cc1cccnc1COCC(C)Br 34a_100012180447_100000696600 [1,0,0,0,0,1|2,0,0]=4 10910 B13R1.158 Cc1cccnc1COCC(C)C 34a_100000210257_100000696600 [1,0,0,0,0,1|2,0,0]=4 10911 B13R1.158 Cc1cccnc1COCC(C)C 34a_100000698912_100000210624 [1,0,0,0,0,1|2,0,0]=4 10912 B13R1.158 Cc1cccnc1COCC(C)F 34a_100015925927_100000696600 [1,0,0,0,0,1|2,0,0]=4 10913 B13R1.158 Cc1cccnc1COCC(C)O 34a_100000698912_100011218427 [1,0,0,0,0,1|2,0,0]=4 10914 B13R1.158 Cc1cccnc1COC[C@@H](C)Cl 34a_100016084084_100000696600 [1,0,0,0,0,1|2,0,0]=4 10915 B13R1.158 Cc1cccnc1COC[C@@H](C)N 34a_100000737577_100000696600 [1,0,0,0,0,1|1,0,0]=3 10916 B13R1.158 Cc1cccnc1COC[C@@H](C)O 34a_100000698912_100009817552 [1,0,0,0,0,1|2,0,0]=4 10917 B13R1.158 Cc1ccncc1COCC(C)Br 34a_100012180447_100000690890 [1,0,0,0,0,1|2,0,0]=4 10918 B13R1.158 Cc1ccncc1COCC(C)C 34a_100000210257_100000690890 [1,0,0,0,0,1|2,0,0]=4 10919 B13R1.158 Cc1ccncc1COCC(C)C 34a_100011996381_100000210624 [1,0,0,0,0,1|2,0,0]=4 10920 B13R1.158 Cc1ccncc1COCC(C)F 34a_100015925927_100000690890 [1,0,0,0,0,1|2,0,0]=4 10921 B13R1.158 Cc1ccncc1COCC(C)O 34a_100011996381_100011218427 [1,0,0,0,0,1|2,0,0]=4 10922 B13R1.158 Cc1ccncc1COC[C@@H](C)Cl 34a_100016084084_100000690890 [1,0,0,0,0,1|2,0,0]=4 10923 B13R1.158 Cc1ccncc1COC[C@@H](C)N 34a_100000737577_100000690890 [1,0,0,0,0,1|1,0,0]=3 10924 B13R1.158 Cc1ccncc1COC[C@@H](C)O 34a_100011996381_100009817552 [1,0,0,0,0,1|2,0,0]=4 10925 B13R1.158 Cc1ccncc1OCCC(C)C 34a_100011997053_100000210312 [1,0,0,0,0,1|2,0,0]=4 10926 B13R1.158 Cc1ccncc1OCCC(C)C 7a_100011997053_100000210626 [1,0,0,0,0,1|2,0,0]=4 10927 B13R1.158 Cc1ccncc1OCCC(C)O 34a_100011997053_100012276601 [1,0,0,0,0,1|2,0,0]=4 10928 B13R1.158 Cc1ccncc1OCCC(C)O 7a_100011997053_100012276601 [1,0,0,0,0,1|2,0,0]=4 10929 B13R1.158 Cc1ccncc1OCOC(C)C 34a_100011997053_100000709892 [1,0,0,0,0,1|2,0,0]=4 10930 B13R1.158 Cc1cnccc1COCC(C)Br 34a_100012180447_100020672809 [1,0,0,0,0,1|2,0,0]=4 10931 B13R1.158 Cc1cnccc1COCC(C)C 34a_100000210257_100020672809 [1,0,0,0,0,1|2,0,0]=4 10932 B13R1.158 Cc1cnccc1COCC(C)C 34a_100011997032_100000210624 [1,0,0,0,0,1|2,0,0]=4 10933 B13R1.158 Cc1cnccc1COCC(C)F 34a_100015925927_100020672809 [1,0,0,0,0,1|2,0,0]=4 10934 B13R1.158 Cc1cnccc1COCC(C)O 34a_100011997032_100011218427 [1,0,0,0,0,1|2,0,0]=4 10935 B13R1.158 Cc1cnccc1COC[C@@H](C)Cl 34a_100016084084_100020672809 [1,0,0,0,0,1|2,0,0]=4 10936 B13R1.158 Cc1cnccc1COC[C@@H](C)N 34a_100000737577_100020672809 [1,0,0,0,0,1|1,0,0]=3 10937 B13R1.158 Cc1cnccc1COC[C@@H](C)O 34a_100011997032_100009817552 [1,0,0,0,0,1|2,0,0]=4 10938 B13R1.158 Cc1cnccc1OCCC(C)C 34a_100000694293_100000210312 [1,0,0,0,0,1|2,0,0]=4 10939 B13R1.158 Cc1cnccc1OCCC(C)O 34a_100000694293_100012276601 [1,0,0,0,0,1|2,0,0]=4 10940 B13R1.158 Cc1cnccc1OCOC(C)C 34a_100000694293_100000709892 [1,0,0,0,0,1|2,0,0]=4 10941 B13R1.158 Cc1ncccc1COCC(C)Br 34a_100012180447_100000732876 [1,0,0,0,0,1|2,0,0]=4 10942 B13R1.158 Cc1ncccc1COCC(C)C 34a_100000210257_100000732876 [1,0,0,0,0,1|2,0,0]=4 10943 B13R1.158 Cc1ncccc1COCC(C)C 34a_100000729262_100000210624 [1,0,0,0,0,1|2,0,0]=4 10944 B13R1.158 Cc1ncccc1COCC(C)C 7a_100000729262_100000210760 [1,0,0,0,0,1|2,0,0]=4 10945 B13R1.158 Cc1ncccc1COCC(C)F 34a_100015925927_100000732876 [1,0,0,0,0,1|2,0,0]=4 10946 B13R1.158 Cc1ncccc1COCC(C)O 34a_100000729262_100011218427 [1,0,0,0,0,1|2,0,0]=4 10947 B13R1.158 Cc1ncccc1COCC(C)O 7a_100000729262_100011218427 [1,0,0,0,0,1|2,0,0]=4 10948 B13R1.158 Cc1ncccc1COC[C@@H](C)Cl 34a_100016084084_100000732876 [1,0,0,0,0,1|2,0,0]=4 10949 B13R1.158 Cc1ncccc1COC[C@@H](C)N 34a_100000737577_100000732876 [1,0,0,0,0,1|1,0,0]=3 10950 B13R1.158 Cc1ncccc1COC[C@@H](C)O 34a_100000729262_100009817552 [1,0,0,0,0,1|2,0,0]=4 10951 B13R1.158 Cc1ncccc1COC[C@@H](C)O 7a_100000729262_100009817552 [1,0,0,0,0,1|2,0,0]=4 10952 B13R1.158 Cc1ncccc1OCCC(C)C 34a_100000745507_100000210312 [1,0,0,0,0,1|2,0,0]=4 10953 B13R1.158 Cc1ncccc1OCCC(C)C 7a_100000745507_100000210626 [1,0,0,0,0,1|2,0,0]=4 10954 B13R1.158 Cc1ncccc1OCCC(C)O 34a_100000745507_100012276601 [1,0,0,0,0,1|2,0,0]=4 10955 B13R1.158 Cc1ncccc1OCCC(C)O 7a_100000745507_100012276601 [1,0,0,0,0,1|2,0,0]=4 10956 B13R1.158 Cc1ncccc1OCOC(C)C 34a_100000745507_100000709892 [1,0,0,0,0,1|2,0,0]=4 10957 B13R1.3529 Cc1noc(c1COC[C@@H](C)N)C 34a_100000737577_100000184612 [0,0,0,0,1,1|2,0,0]=4 10958 B15R1.8290 C=C(C)CCOCc1c(cccc1C)C 34a_100000764851_100000758300 [0,0,0,0,0,2|1,0,1]=4 10959 B15R1.8290 C=C(C)CCOCc1c(cccc1C)C 34a_100011933981_100000730704 [0,0,0,0,0,2|1,0,1]=4 10960 B15R1.8290 C=C(C)CCOCc1c(cccc1C)C 7a_100011933981_100000730704 [0,0,0,0,0,2|1,0,1]=4 10961 B15R1.8290 CC(=CCCOc1c(cccc1C)C)C 34a_100000210341_100011217483 [0,0,0,0,0,2|1,0,1]=4 10962 B15R1.8290 CC(=CCCOc1c(cccc1C)C)C 7a_100000210341_100011217483 [0,0,0,0,0,2|1,0,1]=4 10963 B15R1.8290 CC(=CCOCc1c(cccc1C)C)C 34a_100000753907_100000758300 [0,0,0,0,0,2|1,0,1]=4 10964 B15R1.8290 CC(=CCOCc1c(cccc1C)C)C 34a_100011933981_100000761012 [0,0,0,0,0,2|1,0,1]=4 10965 B15R1.8290 CC(=CCOCc1c(cccc1C)C)C 7a_100011933981_100000761012 [0,0,0,0,0,2|1,0,1]=4 10966 B15R1.8290 CC(=O)CCCOc1c(cccc1C)C 34a_100000210341_100000685027 [0,0,0,0,0,2|1,0,1]=4 10967 B15R1.8290 CC(=O)CCCOc1c(cccc1C)C 7a_100000210341_100011215641 [0,0,0,0,0,2|1,0,1]=4 10968 B15R1.8290 CC(=O)CCOCc1c(cccc1C)C 34a_100000759926_100000758300 [0,0,0,0,0,2|1,0,1]=4 10969 B15R1.8290 CC(=O)CCOCc1c(cccc1C)C 7a_100000759926_100000758300 [0,0,0,0,0,2|1,0,1]=4 10970 B15R1.8290 CC(=O)CCOCc1c(cccc1C)C 7a_100011933981_100000053229 [0,0,0,0,0,2|1,0,1]=4 10971 B15R1.8290 CC(=O)NCCOc1c(cccc1C)C 11a_100000740230_100015343762 [0,0,0,0,0,2|1,0,1]=4 10972 B15R1.8290 CC(=O)NCCOc1c(cccc1C)C 1626a_100000740230_100015343762 [0,0,0,0,0,2|1,0,1]=4 10973 B15R1.8290 CC(=O)NCCOc1c(cccc1C)C 240690a_100000740230_100015343762 [0,0,0,0,0,2|1,0,1]=4 10974 B15R1.8290 CC(=O)NCCOc1c(cccc1C)C 527a_100000740230_100103153847 [0,0,0,0,0,2|1,0,1]=4 10975 B15R1.8290 CC(=O)NCCOc1c(cccc1C)C 7a_100000210341_100000189650 [0,0,0,0,0,2|1,0,1]=4 10976 B15R1.8290 CC(=O)OCCOc1c(cccc1C)C 34a_100000210341_100009814007 [0,0,0,0,0,2|1,0,1]=4 10977 B15R1.8290 CC(=O)OCCOc1c(cccc1C)C 7a_100000210341_100009814007 [0,0,0,0,0,2|1,0,1]=4 10978 B15R1.8290 CC(=O)OCOCc1c(cccc1C)C 34a_100011933981_100009813279 [0,0,0,0,0,2|1,0,1]=4 10979 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1Br)Cl 34a_100000706166_100010138402 [0,0,0,0,0,2|2,0,0]=4 10980 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1Br)F 34a_100000706166_100012145669 [0,0,0,0,0,2|2,0,0]=4 10981 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1Cl)Cl 34a_100000706166_100000187851 [0,0,0,0,0,2|2,0,0]=4 10982 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1Cl)F 34a_100000706166_100000187852 [0,0,0,0,0,2|2,0,0]=4 10983 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1F)F 34a_100000706166_100000698325 [0,0,0,0,0,2|2,0,0]=4 10984 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1I)Br 34a_100000706166_100010146611 [0,0,0,0,0,2|2,0,0]=4 10985 B15R1.8290 C[C@@H](N)CCOCc1c(cccc1I)F 34a_100000706166_100010149602 [0,0,0,0,0,2|2,0,0]=4 10986 B15R1.8290 C[C@@H](N)COCCc1c(cccc1Cl)Cl 34a_100000737577_100012161200 [0,0,0,0,0,2|2,0,0]=4 10987 B15R1.8290 Cc1cccc(c1C=NNCC(C)O)C 4a_200000730056_100000758299 [0,0,0,0,0,2|2,0,0]=4 10988 B15R1.8290 Cc1cccc(c1CNCCC(C)C)C 207a_100000210545_100000758299 [0,0,0,0,0,2|2,0,0]=4 10989 B15R1.8290 Cc1cccc(c1CNCCC(C)C)C 269862a_100000689800_100000185833 [0,0,0,0,0,2|2,0,0]=4 10990 B15R1.8290 Cc1cccc(c1CNCCC(C)C)C 270004a_100000210545_100000758299 [0,0,0,0,0,2|2,0,0]=4 10991 B15R1.8290 Cc1cccc(c1CNCCC(C)C)C 34a_100000689800_100000210312 [0,0,0,0,0,2|2,0,0]=4 10992 B15R1.8290 Cc1cccc(c1CNCCC(C)O)C 207a_200000755665_100000758299 [0,0,0,0,0,2|2,0,0]=4 10993 B15R1.8290 Cc1cccc(c1CNCCC(C)O)C 2230a_200000755665_100000758300 [0,0,0,0,0,2|2,0,0]=4 10994 B15R1.8290 Cc1cccc(c1CNCCC(C)O)C 270004a_200000755665_100000758299 [0,0,0,0,0,2|2,0,0]=4 10995 B15R1.8290 Cc1cccc(c1CNCCC(C)O)C 34a_100000689800_100012276601 [0,0,0,0,0,2|2,0,0]=4 10996 B15R1.8290 Cc1cccc(c1CNCOC(C)C)C 34a_100000689800_100000709892 [0,0,0,0,0,2|2,0,0]=4 10997 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 34a_100000757172_100000758300 [0,0,0,0,0,2|1,0,1]=4 10998 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 34a_100011933981_100000731001 [0,0,0,0,0,2|1,0,1]=4 10999 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 7a_100000757172_100000758300 [0,0,0,0,0,2|1,0,1]=4 11000 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 7a_100011933981_100000744528 [0,0,0,0,0,2|1,0,1]=4 11001 B15R1.8290 Cc1cccc(c1COCCC(C)Br)Br 34a_100009893172_100010146847 [0,0,0,0,0,2|2,0,0]=4 11002 B15R1.8290 Cc1cccc(c1COCCC(C)Br)C 34a_100009893172_100000758300 [0,0,0,0,0,2|1,0,0]=3 11003 B15R1.8290 Cc1cccc(c1COCCC(C)Br)F 34a_100009893172_100009814554 [0,0,0,0,0,2|2,0,0]=4 11004 B15R1.8290 Cc1cccc(c1COCCC(C)Br)I 34a_100009893172_100010150146 [0,0,0,0,0,2|2,0,0]=4 11005 B15R1.8290 Cc1cccc(c1COCCC(C)C)Br 34a_100000210254_100010146847 [0,0,0,0,0,2|2,0,0]=4 11006 B15R1.8290 Cc1cccc(c1COCCC(C)C)Br 7a_100000210254_100010146847 [0,0,0,0,0,2|2,0,0]=4 11007 B15R1.8290 Cc1cccc(c1COCCC(C)C)C 34a_100000210254_100000758300 [0,0,0,0,0,2|1,0,0]=3 11008 B15R1.8290 Cc1cccc(c1COCCC(C)C)C 34a_100011933981_100000210312 [0,0,0,0,0,2|1,0,0]=3 11009 B15R1.8290 Cc1cccc(c1COCCC(C)C)C 7a_100000210254_100000758300 [0,0,0,0,0,2|1,0,0]=3 11010 B15R1.8290 Cc1cccc(c1COCCC(C)C)C 7a_100011933981_100000210626 [0,0,0,0,0,2|1,0,0]=3 11011 B15R1.8290 Cc1cccc(c1COCCC(C)C)Cl 34a_100000082531_100000210312 [0,0,0,0,0,2|2,0,0]=4 11012 B15R1.8290 Cc1cccc(c1COCCC(C)C)Cl 7a_100000082531_100000210626 [0,0,0,0,0,2|2,0,0]=4 11013 B15R1.8290 Cc1cccc(c1COCCC(C)C)F 34a_100000057874_100000210312 [0,0,0,0,0,2|2,0,0]=4 11014 B15R1.8290 Cc1cccc(c1COCCC(C)C)F 34a_100000210254_100009814554 [0,0,0,0,0,2|2,0,0]=4 11015 B15R1.8290 Cc1cccc(c1COCCC(C)C)F 7a_100000057874_100000210626 [0,0,0,0,0,2|2,0,0]=4 11016 B15R1.8290 Cc1cccc(c1COCCC(C)C)F 7a_100000210254_100009814554 [0,0,0,0,0,2|2,0,0]=4 11017 B15R1.8290 Cc1cccc(c1COCCC(C)C)I 34a_100000210254_100010150146 [0,0,0,0,0,2|2,0,0]=4 11018 B15R1.8290 Cc1cccc(c1COCCC(C)C)I 7a_100000210254_100010150146 [0,0,0,0,0,2|2,0,0]=4 11019 B15R1.8290 Cc1cccc(c1COCCC(C)O)C 34a_100011933981_100012276601 [0,0,0,0,0,2|1,0,0]=3 11020 B15R1.8290 Cc1cccc(c1COCCC(C)O)C 7a_100011933981_100012276601 [0,0,0,0,0,2|1,0,0]=3 11021 B15R1.8290 Cc1cccc(c1COCCC(C)O)Cl 34a_100000082531_100012276601 [0,0,0,0,0,2|2,0,0]=4 11022 B15R1.8290 Cc1cccc(c1COCCC(C)O)Cl 7a_100000082531_100012276601 [0,0,0,0,0,2|2,0,0]=4 11023 B15R1.8290 Cc1cccc(c1COCCC(C)O)F 34a_100000057874_100012276601 [0,0,0,0,0,2|2,0,0]=4 11024 B15R1.8290 Cc1cccc(c1COCCC(C)O)F 7a_100000057874_100012276601 [0,0,0,0,0,2|2,0,0]=4 11025 B15R1.8290 Cc1cccc(c1COCCC(F)F)C 34a_100103093639_100000758300 [0,0,0,0,0,2|2,0,0]=4 11026 B15R1.8290 Cc1cccc(c1COCCN(C)C)C 7a_100011933981_100000755713 [0,0,0,0,0,2|2,0,0]=4 11027 B15R1.8290 Cc1cccc(c1COCC[C@@H](C)N)Br 34a_100000706166_100010146847 [0,0,0,0,0,2|1,0,0]=3 11028 B15R1.8290 Cc1cccc(c1COCC[C@@H](C)N)C 34a_100000706166_100000758300 [0,0,0,0,0,2|0,0,0]=2 11029 B15R1.8290 Cc1cccc(c1COCC[C@@H](C)N)F 34a_100000706166_100009814554 [0,0,0,0,0,2|1,0,0]=3 11030 B15R1.8290 Cc1cccc(c1COCC[C@@H](C)N)I 34a_100000706166_100010150146 [0,0,0,0,0,2|1,0,0]=3 11031 B15R1.8290 Cc1cccc(c1COCOC(C)C)C 34a_100011933981_100000709892 [0,0,0,0,0,2|1,0,0]=3 11032 B15R1.8290 Cc1cccc(c1COCOC(C)C)Cl 34a_100000082531_100000709892 [0,0,0,0,0,2|2,0,0]=4 11033 B15R1.8290 Cc1cccc(c1COCOC(C)C)F 34a_100000057874_100000709892 [0,0,0,0,0,2|2,0,0]=4 11034 B15R1.8290 Cc1cccc(c1CSCCC(C)C)C 62a_100000210312_100000758300 [0,0,0,0,0,2|1,1,0]=4 11035 B15R1.8290 Cc1cccc(c1CSCCC(C)C)C 62a_100000758300_100000210312 [0,0,0,0,0,2|1,1,0]=4 11036 B15R1.8290 Cc1cccc(c1CSCCC(C)O)C 62a_100000758300_100012276601 [0,0,0,0,0,2|1,1,0]=4 11037 B15R1.8290 Cc1cccc(c1CSCCC(C)O)C 62a_100012276601_100000758300 [0,0,0,0,0,2|1,1,0]=4 11038 B15R1.8290 Cc1cccc(c1CSCOC(C)C)C 62a_100000709892_100000758300 [0,0,0,0,0,2|1,1,0]=4 11039 B15R1.8290 Cc1cccc(c1CSCOC(C)C)C 62a_100000758300_100000709892 [0,0,0,0,0,2|1,1,0]=4 11040 B15R1.8290 Cc1cccc(c1NCCCC(C)C)C 34a_100000185769_100011214892 [0,0,0,0,0,2|2,0,0]=4 11041 B15R1.8290 Cc1cccc(c1NCCCC(C)O)C 34a_100000185769_200000718107 [0,0,0,0,0,2|2,0,0]=4 11042 B15R1.8290 Cc1cccc(c1NCCOC(C)C)C 34a_100000185769_100000211751 [0,0,0,0,0,2|2,0,0]=4 11043 B15R1.8290 Cc1cccc(c1NCCSC(C)C)C 34a_100000185769_100000730970 [0,0,0,0,0,2|2,0,0]=4 11044 B15R1.8290 Cc1cccc(c1NN=CCC(C)C)C 4a_100016987787_100000185833 [0,0,0,0,0,2|2,0,0]=4 11045 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)C 34a_100000210341_100102525003 [0,0,0,0,0,2|1,0,1]=4 11046 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)C 7a_100000210341_100102525003 [0,0,0,0,0,2|1,0,1]=4 11047 B15R1.8290 Cc1cccc(c1OCCCC(C)C)Br 34a_100009817157_100011214892 [0,0,0,0,0,2|2,0,0]=4 11048 B15R1.8290 Cc1cccc(c1OCCCC(C)C)Br 7a_100009817157_100011214892 [0,0,0,0,0,2|2,0,0]=4 11049 B15R1.8290 Cc1cccc(c1OCCCC(C)C)C 34a_100000210341_100011214892 [0,0,0,0,0,2|1,0,0]=3 11050 B15R1.8290 Cc1cccc(c1OCCCC(C)C)C 7a_100000210341_100011214892 [0,0,0,0,0,2|1,0,0]=3 11051 B15R1.8290 Cc1cccc(c1OCCCC(C)C)Cl 34a_100000033731_100011214892 [0,0,0,0,0,2|2,0,0]=4 11052 B15R1.8290 Cc1cccc(c1OCCCC(C)C)Cl 7a_100000033731_100011214892 [0,0,0,0,0,2|2,0,0]=4 11053 B15R1.8290 Cc1cccc(c1OCCCC(C)C)F 34a_100011659162_100011214892 [0,0,0,0,0,2|2,0,0]=4 11054 B15R1.8290 Cc1cccc(c1OCCCC(C)C)F 7a_100011659162_100011214892 [0,0,0,0,0,2|2,0,0]=4 11055 B15R1.8290 Cc1cccc(c1OCCCC(C)C)N 34a_100000756359_100011214892 [0,0,0,0,0,2|2,0,0]=4 11056 B15R1.8290 Cc1cccc(c1OCCCC(C)C)N 7a_100000756359_100011214892 [0,0,0,0,0,2|2,0,0]=4 11057 B15R1.8290 Cc1cccc(c1OCCCC(C)O)Br 34a_100009817157_200000718107 [0,0,0,0,0,2|2,0,0]=4 11058 B15R1.8290 Cc1cccc(c1OCCCC(C)O)Br 7a_100009817157_200000718107 [0,0,0,0,0,2|2,0,0]=4 11059 B15R1.8290 Cc1cccc(c1OCCCC(C)O)C 34a_100000210341_200000718107 [0,0,0,0,0,2|1,0,0]=3 11060 B15R1.8290 Cc1cccc(c1OCCCC(C)O)C 7a_100000210341_200000718107 [0,0,0,0,0,2|1,0,0]=3 11061 B15R1.8290 Cc1cccc(c1OCCCC(C)O)Cl 34a_100000033731_200000718107 [0,0,0,0,0,2|2,0,0]=4 11062 B15R1.8290 Cc1cccc(c1OCCCC(C)O)Cl 7a_100000033731_200000718107 [0,0,0,0,0,2|2,0,0]=4 11063 B15R1.8290 Cc1cccc(c1OCCCC(C)O)F 34a_100011659162_200000718107 [0,0,0,0,0,2|2,0,0]=4 11064 B15R1.8290 Cc1cccc(c1OCCCC(C)O)F 7a_100011659162_200000718107 [0,0,0,0,0,2|2,0,0]=4 11065 B15R1.8290 Cc1cccc(c1OCCCC(C)O)N 34a_100000756359_200000718107 [0,0,0,0,0,2|2,0,0]=4 11066 B15R1.8290 Cc1cccc(c1OCCCC(C)O)N 7a_100000756359_200000718107 [0,0,0,0,0,2|2,0,0]=4 11067 B15R1.8290 Cc1cccc(c1OCCCN(C)C)C 2230a_100015183114_200000210301 [0,0,0,0,0,2|2,0,0]=4 11068 B15R1.8290 Cc1cccc(c1OCCCN(C)C)C 269982a_100015183114_200000210301 [0,0,0,0,0,2|2,0,0]=4 11069 B15R1.8290 Cc1cccc(c1OCCCN(C)C)C 34a_100015183114_200000210301 [0,0,0,0,0,2|2,0,0]=4 11070 B15R1.8290 Cc1cccc(c1OCCCN(C)C)C 7a_100000210341_100000757444 [0,0,0,0,0,2|2,0,0]=4 11071 B15R1.8290 Cc1cccc(c1OCCCN(C)[13CH3])C 2230a_100015183114_200025704644 [0,0,0,0,0,2|2,0,0]=4 11072 B15R1.8290 Cc1cccc(c1OCCCN(C)[13CH3])C 269982a_100015183114_200025704644 [0,0,0,0,0,2|2,0,0]=4 11073 B15R1.8290 Cc1cccc(c1OCCCN(C)[13CH3])C 34a_100015183114_200025704644 [0,0,0,0,0,2|2,0,0]=4 11074 B15R1.8290 Cc1cccc(c1OCCNC(=O)N)C 7a_100000210341_200000034859 [0,0,0,0,0,2|1,0,1]=4 11075 B15R1.8290 Cc1cccc(c1OCCNC(C)C)C 2230a_100000740230_100000210206 [0,0,0,0,0,2|1,0,0]=3 11076 B15R1.8290 Cc1cccc(c1OCCNC(C)C)C 2230a_100138425928_100000184555 [0,0,0,0,0,2|1,0,0]=3 11077 B15R1.8290 Cc1cccc(c1OCCNC(C)C)C 34a_100000740230_100000210206 [0,0,0,0,0,2|1,0,0]=3 11078 B15R1.8290 Cc1cccc(c1OCCNC(C)C)C 34a_100138425928_100000184555 [0,0,0,0,0,2|1,0,0]=3 11079 B15R1.8290 Cc1cccc(c1OCCNC(C)C)Cl 2230a_100015186626_100000210206 [0,0,0,0,0,2|2,0,0]=4 11080 B15R1.8290 Cc1cccc(c1OCCNC(C)C)Cl 34a_100015186626_100000210206 [0,0,0,0,0,2|2,0,0]=4 11081 B15R1.8290 Cc1cccc(c1OCCOC(=O)N)C 34a_100000210341_200011214921 [0,0,0,0,0,2|1,0,1]=4 11082 B15R1.8290 Cc1cccc(c1OCCOC(=O)N)C 7a_100000210341_200011214921 [0,0,0,0,0,2|1,0,1]=4 11083 B15R1.8290 Cc1cccc(c1OCCOC(C)C)Br 34a_100009817157_100000211751 [0,0,0,0,0,2|2,0,0]=4 11084 B15R1.8290 Cc1cccc(c1OCCOC(C)C)Br 7a_100009817157_100000211751 [0,0,0,0,0,2|2,0,0]=4 11085 B15R1.8290 Cc1cccc(c1OCCOC(C)C)C 34a_100000210341_100000211751 [0,0,0,0,0,2|1,0,0]=3 11086 B15R1.8290 Cc1cccc(c1OCCOC(C)C)C 34a_100000212225_100000184555 [0,0,0,0,0,2|1,0,0]=3 11087 B15R1.8290 Cc1cccc(c1OCCOC(C)C)C 7a_100000210341_100000211751 [0,0,0,0,0,2|1,0,0]=3 11088 B15R1.8290 Cc1cccc(c1OCCOC(C)C)Cl 34a_100000033731_100000211751 [0,0,0,0,0,2|2,0,0]=4 11089 B15R1.8290 Cc1cccc(c1OCCOC(C)C)Cl 7a_100000033731_100000211751 [0,0,0,0,0,2|2,0,0]=4 11090 B15R1.8290 Cc1cccc(c1OCCOC(C)C)F 34a_100011659162_100000211751 [0,0,0,0,0,2|2,0,0]=4 11091 B15R1.8290 Cc1cccc(c1OCCOC(C)C)F 7a_100011659162_100000211751 [0,0,0,0,0,2|2,0,0]=4 11092 B15R1.8290 Cc1cccc(c1OCCOC(C)C)N 34a_100000756359_100000211751 [0,0,0,0,0,2|2,0,0]=4 11093 B15R1.8290 Cc1cccc(c1OCCOC(C)C)N 7a_100000756359_100000211751 [0,0,0,0,0,2|2,0,0]=4 11094 B15R1.8290 Cc1cccc(c1OCCSC(C)C)Br 34a_100009817157_100000730970 [0,0,0,0,0,2|2,0,0]=4 11095 B15R1.8290 Cc1cccc(c1OCCSC(C)C)Br 7a_100009817157_100000730970 [0,0,0,0,0,2|2,0,0]=4 11096 B15R1.8290 Cc1cccc(c1OCCSC(C)C)C 34a_100000210341_100000730970 [0,0,0,0,0,2|1,0,0]=3 11097 B15R1.8290 Cc1cccc(c1OCCSC(C)C)C 62a_100000184555_100000210206 [0,0,0,0,0,2|1,0,0]=3 11098 B15R1.8290 Cc1cccc(c1OCCSC(C)C)C 62a_100000210206_100000184555 [0,0,0,0,0,2|1,0,0]=3 11099 B15R1.8290 Cc1cccc(c1OCCSC(C)C)C 7a_100000210341_100000730970 [0,0,0,0,0,2|1,0,0]=3 11100 B15R1.8290 Cc1cccc(c1OCCSC(C)C)Cl 34a_100000033731_100000730970 [0,0,0,0,0,2|2,0,0]=4 11101 B15R1.8290 Cc1cccc(c1OCCSC(C)C)Cl 7a_100000033731_100000730970 [0,0,0,0,0,2|2,0,0]=4 11102 B15R1.8290 Cc1cccc(c1OCCSC(C)C)F 34a_100011659162_100000730970 [0,0,0,0,0,2|2,0,0]=4 11103 B15R1.8290 Cc1cccc(c1OCCSC(C)C)F 7a_100011659162_100000730970 [0,0,0,0,0,2|2,0,0]=4 11104 B15R1.8290 Cc1cccc(c1OCCSC(C)C)N 34a_100000756359_100000730970 [0,0,0,0,0,2|2,0,0]=4 11105 B15R1.8290 Cc1cccc(c1OCCSC(C)C)N 7a_100000756359_100000730970 [0,0,0,0,0,2|2,0,0]=4 11106 B15R1.8290 Cc1cccc(c1SCCCC(C)C)C 62a_100000033847_100011214892 [0,0,0,0,0,2|1,1,0]=4 11107 B15R1.8290 Cc1cccc(c1SCCCC(C)C)C 62a_100011214892_100000033847 [0,0,0,0,0,2|1,1,0]=4 11108 B15R1.8290 Cc1cccc(c1SCCCC(C)O)C 62a_100000033847_200000718107 [0,0,0,0,0,2|1,1,0]=4 11109 B15R1.8290 Cc1cccc(c1SCCCC(C)O)C 62a_200000718107_100000033847 [0,0,0,0,0,2|1,1,0]=4 11110 B15R1.8290 Cc1cccc(c1SCCOC(C)C)C 34a_200000080753_100000210206 [0,0,0,0,0,2|1,1,0]=4 11111 B15R1.8290 Cc1cccc(c1SCCOC(C)C)C 62a_100000033847_100000211751 [0,0,0,0,0,2|1,1,0]=4 11112 B15R1.8290 Cc1cccc(c1SCCOC(C)C)C 62a_100000211751_100000033847 [0,0,0,0,0,2|1,1,0]=4 11113 B15R1.8290 Cc1cccc(c1SCCOC(C)C)C 7a_200000080753_100000210206 [0,0,0,0,0,2|1,1,0]=4 11114 B15R1.8290 Cc1cccc(c1SCCSC(C)C)C 62a_100000033847_100000730970 [0,0,0,0,0,2|1,1,0]=4 11115 B15R1.8290 Cc1cccc(c1SCCSC(C)C)C 62a_100000730970_100000033847 [0,0,0,0,0,2|1,1,0]=4 11116 B15R1.8290 Cc1ccnc(c1OCCCC(C)C)C 34a_100011934651_100011214892 [0,0,0,0,0,2|2,0,0]=4 11117 B15R1.8290 Cc1ccnc(c1OCCCC(C)C)C 7a_100011934651_100011214892 [0,0,0,0,0,2|2,0,0]=4 11118 B15R1.8290 Cc1ccnc(c1OCCCC(C)O)C 34a_100011934651_200000718107 [0,0,0,0,0,2|2,0,0]=4 11119 B15R1.8290 Cc1ccnc(c1OCCCC(C)O)C 7a_100011934651_200000718107 [0,0,0,0,0,2|2,0,0]=4 11120 B15R1.8290 Cc1ccnc(c1OCCOC(C)C)C 34a_100011934651_100000211751 [0,0,0,0,0,2|2,0,0]=4 11121 B15R1.8290 Cc1ccnc(c1OCCOC(C)C)C 7a_100011934651_100000211751 [0,0,0,0,0,2|2,0,0]=4 11122 B15R1.8290 Cc1ccnc(c1OCCSC(C)C)C 34a_100011934651_100000730970 [0,0,0,0,0,2|2,0,0]=4 11123 B15R1.8290 Cc1ccnc(c1OCCSC(C)C)C 7a_100011934651_100000730970 [0,0,0,0,0,2|2,0,0]=4