0 B9R1.35 C1CC(CC1C(=O)O)F WX611711 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.35 C1C[C@@H](C[C@@H]1C(=O)O)N WX604626 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.35 C1[C@H](CN[C@@H]1C(=O)O)F WX660039 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.35 CC1CCC(C1)C(=O)O WX611716 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O WX611125 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.1 C1CC(CC1CN)O WX601015 [1,0,0,0,0,0|2,0,1]=4 6 B8R1.1 C1C[C@H](C[C@@H]1C#N)O WX641022 [1,0,0,0,0,0|2,0,1]=4 7 B8R1.1 C1C[C@H](C[C@H]1C#N)O WX641020 [1,0,0,0,0,0|2,0,1]=4 8 B8R1.1 C1[C@@H](CN[C@@H]1CF)F WX601106 [1,0,0,0,0,0|2,0,1]=4 9 B8R1.1 C1[C@@H](CN[C@@H]1CO)F WX601107 [1,0,0,0,0,0|1,0,1]=3 10 B8R1.1 C1[C@H](CN[C@@H]1CO)F WX601179 [1,0,0,0,0,0|1,0,1]=3 11 B8R1.1 CC1CCC(C1)CO WX641103 [1,0,0,0,0,0|2,0,1]=4 12 B8R1.1 C[C@H]1C[C@H](NC1)CF WX601193 [1,0,0,0,0,0|2,0,1]=4 13 B8R1.1 C[C@H]1C[C@H](NC1)CO WX601192 [1,0,0,0,0,0|1,0,1]=3 14 B8R1.7 C1CC(OC1)C(=S)N WX619952 [1,0,0,0,0,0|2,1,0]=4 15 B8R1.7 C1CC(SC1)C(=O)O WX610408 [1,0,0,0,0,0|1,0,0]=2 16 B8R1.7 C1CCC(C1)C(=N)N WX619914 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.7 C1COCC1C(=O)O WX610323 [1,0,0,0,0,0|2,0,0]=3 18 B10R1.14 COC(=O)[C@@H]1C[C@@H](CN1)F WX660054 [0,1,0,0,0,0|1,0,0]=2 19 B10R1.14 COC(=O)[C@@H]1C[C@H](CN1)F WX660038 [0,1,0,0,0,0|1,0,0]=2 20 B10R1.14 COC(=O)[C@H]1C[C@H](CN1)F WX660041 [0,1,0,0,0,0|1,0,0]=2 21 B10R1.359 C1CC(CC1C(=O)O)(F)F WX611674 [0,1,0,0,0,0|2,0,0]=3 22 B8R0.28 CC(C)CNCC(=O)O WXC00158 [0,0,1,0,0,0|1,0,0]=2 23 B8R1.23 C1C(CC1F)C(=O)O WX610015 [0,0,0,0,1,0|1,0,0]=2 24 B8R1.23 C1C(CC1O)C(=O)O WX610009 [0,0,0,0,1,0|0,0,0]=1 25 B8R1.23 C1[C@@H](C[C@@H]1C(=O)O)O WX610012 [0,0,0,0,1,0|0,0,0]=1 26 B8R1.23 C=C1CC(C1)C(=O)O WX610003 [0,0,0,0,1,0|1,0,1]=3 27 B8R1.23 CC1CC(C1)C(=O)O WX610004 [0,0,0,0,1,0|1,0,0]=2 28 B8R1.23 CN1CC(C1)C(=O)O WX610403 [0,0,0,0,1,0|2,0,0]=3 29 B8R1.23 C[C@H]1C[C@@H](C1)C(=O)O WX610006 [0,0,0,0,1,0|1,0,0]=2 30 B8R1.23 C[C@H]1C[C@H](C1)C(=O)O WX610005 [0,0,0,0,1,0|1,0,0]=2 31 B10R1.13 CC1=CCC(CC1)C(=O)O WX610371 [0,0,0,0,0,1|2,0,1]=4 32 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)O WX611257 [0,0,0,0,0,1|2,0,0]=3 33 B7R0.5 C(CN)[C@@H](C(=O)O)N WX665073 [1,0,1,0,0,0|1,0,0]=3 34 B7R0.2 CC(C)C[C@H](CO)N WX600172 [1,0,1,0,0,0|1,0,1]=4 35 B7R1.1 C1CC(NC1)CO WX640259 [2,0,0,0,0,0|0,0,1]=3 36 B7R1.2 C1C[C@@H](C[C@@H]1N)O WX600013 [2,0,0,0,0,0|2,0,0]=4 37 B7R1.2 C1C[C@@H](C[C@H]1N)O WX600233 [2,0,0,0,0,0|2,0,0]=4 38 B7R1.2 C1C[C@H](C[C@@H]1N)O WX600015 [2,0,0,0,0,0|2,0,0]=4 39 B7R1.2 C1C[C@H](C[C@@H]1N)O WX600109 [2,0,0,0,0,0|2,0,0]=4 40 B7R1.2 C1C[C@H](C[C@@H]1N)O WX600355 [2,0,0,0,0,0|2,0,0]=4 41 B7R1.2 C1C[C@H](C[C@H]1N)O WX600108 [2,0,0,0,0,0|2,0,0]=4 42 B7R1.2 C1C[C@H](C[C@H]1N)O WX600234 [2,0,0,0,0,0|2,0,0]=4 43 B7R1.2 C1[C@@H](CNC1=O)O WX650011 [2,0,0,0,0,0|0,0,1]=3 44 B7R1.2 CC1CC(=O)NC1 WXC00781 [2,0,0,0,0,0|1,0,1]=4 45 B7R1.2 C[C@@H]1C[C@@H](CN1)F WX601109 [2,0,0,0,0,0|1,0,1]=4 46 B7R1.2 C[C@@H]1C[C@@H](CN1)O WX601206 [2,0,0,0,0,0|0,0,1]=3 47 B7R1.2 C[C@@H]1C[C@H](CN1)F WX601363 [2,0,0,0,0,0|1,0,1]=4 48 B7R1.2 C[C@@H]1C[C@H](CN1)O WX601205 [2,0,0,0,0,0|0,0,1]=3 49 B9R0.53 CC(C)CC(CC(=O)O)N WX665033 [0,1,1,0,0,0|2,0,0]=4 50 B9R1.133 C1[C@H](NCC1(F)F)CO WX601204 [1,1,0,0,0,0|1,0,1]=4 51 B9R1.11 COC(=O)C1CCCC1 WX618330 [1,1,0,0,0,0|1,0,0]=3 52 B9R1.11 COC(=O)C1CCCN1 WX604114 [1,1,0,0,0,0|0,0,0]=2 53 B9R1.11 COC(=O)C1CCNC1 WX604193 [1,1,0,0,0,0|2,0,0]=4 54 B9R1.19 CC(C)(C1CCCN1)O WX604734 [1,1,0,0,0,0|1,0,1]=4 55 B9R1.41 C1C(C(CN1)O)C(=O)O WX601556 [1,1,0,0,0,0|2,0,0]=4 56 B9R1.41 C1CN[C@@H]([C@H]1O)C(=O)O WX660034 [1,1,0,0,0,0|0,0,0]=2 57 B9R1.41 CC1CCCC1C(=O)O WX611680 [1,1,0,0,0,0|1,0,0]=3 58 B9R1.41 C[C@H]1[C@H](CCO1)C(=O)O WX611127 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.163 C[C@@]1(CCCN1)C(=O)O WX660001 [1,1,0,0,0,0|0,0,0]=2 60 B9R1.163 C[C@]1(CCCN1)C(=O)O WX660002 [1,1,0,0,0,0|0,0,0]=2 61 B9R1.82 COC(=O)C1CC(C1)O WX642118 [0,1,0,0,1,0|0,0,0]=2 62 B9R1.82 COC(=O)[C@H]1C[C@H](C1)O WX642178 [0,1,0,0,1,0|0,0,0]=2 63 B9R1.164 C1C(CC1(F)F)C(=O)O WXFC0148 [0,1,0,0,1,0|1,0,0]=3 64 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)O WXC01475 [0,1,0,0,0,1|1,0,0]=3 65 B11R1.22 C[C@@H]1CC[C@H](CN1)C(=O)OC WX604525 [0,1,0,0,0,1|2,0,0]=4 66 B11R1.727 C1CC(CCC1C(=O)O)(F)F WX612031 [0,1,0,0,0,1|2,0,0]=4 67 B11R1.175 C1CC(CC1C(=O)O)C(=O)O WX610045 [0,2,0,0,0,0|1,0,0]=3 68 B9R1.6 C1CCN[C@@H](C1)C(=O)O WX665058 [0,0,1,1,0,0|1,0,0]=3 69 B9R1.1 C1C(OCC(=O)N1)CN WXC00380 [0,0,1,1,0,0|2,0,0]=4 70 B9R1.1 C1C(OCC(=O)N1)CN WXC00381 [0,0,1,1,0,0|2,0,0]=4 71 B9R1.119 CCC1(CCC1)C(=O)O WX611657 [0,0,1,1,0,0|2,0,0]=4 72 B11R2.738 C1C2C(C(C1NC2=O)O)O WXC03273 [0,1,0,1,0,0|2,0,0]=4 73 B7R1.10 C1C(CC1F)CO WXFC0195 [1,0,0,0,1,0|1,0,1]=4 74 B7R1.12 C1[C@H]([C@@H]1F)C(=O)O WX610333 [0,0,0,0,2,0|1,0,0]=3 75 B7R1.12 C1[C@H]([C@H]1F)C(=O)O WX610334 [0,0,0,0,2,0|1,0,0]=3 76 B7R1.12 CC1CC1C(=O)O WX610273 [0,0,0,0,2,0|1,0,0]=3 77 B7R1.12 C[C@H]1C[C@@H]1C(=O)O WX611005 [0,0,0,0,2,0|1,0,0]=3 78 B9R1.2 C1C(CNCC1F)CO WX601162 [1,0,0,0,0,1|1,0,1]=4 79 B9R1.13 C1CCN(C1)CC(=O)O WX610257 [1,0,0,0,0,1|2,0,0]=4