0 B5R0.5 CC(C(=N)N)O WX619923 [0,0,0,0,0,0|2,1,1]=4 1 B5R0.5 CN(C)C(=N)N WX619912 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.5 CN(C)C(=N)N WX619935 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.1 CC(C)NN WX684009 [1,0,0,0,0,0|2,0,0]=3 4 B4R0.1 CCC(=N)N WX619910 [1,0,0,0,0,0|2,0,1]=4 5 B6R0.3 CC(C)C(=N)NO WX619096 [0,1,0,0,0,0|1,1,1]=4 6 B6R0.3 CC(C)C(=O)NN WX684019 [0,1,0,0,0,0|1,1,1]=4 7 B6R0.3 CC(C)\C(=N\O)\N WX690138 [0,1,0,0,0,0|1,1,1]=4 8 B6R0.3 CN(C)C(=O)CI WX630194 [0,1,0,0,0,0|1,1,1]=4 9 B6R0.7 CC(=O)C(C)(C)N WX600266 [0,1,0,0,0,0|0,1,1]=3 10 B6R0.7 CC(C)(C(=N)N)O WXC00585 [0,1,0,0,0,0|2,0,1]=4 11 B6R0.7 CC(C)(C)C(=N)N WX619906 [0,1,0,0,0,0|2,0,1]=4 12 B6R0.7 CC(C)(C)C(=N)N WX619940 [0,1,0,0,0,0|2,0,1]=4 13 B6R0.7 C[C@@H](C(F)(F)F)N WX600101 [0,1,0,0,0,0|3,0,0]=4 14 B6R1.9 C1C(C1(F)F)N WX601170 [0,0,0,1,0,0|3,0,0]=4 15 B6R1.11 B(C1CC1)(O)O WX658003 [0,0,0,1,0,0|2,1,0]=4 16 B6R1.11 C1CC1C(=N)N WX619908 [0,0,0,1,0,0|2,0,1]=4 17 B6R1.11 C1CC1C(=N)N WX684410 [0,0,0,1,0,0|2,0,1]=4 18 B6R1.11 CC(C1CC1)O WX642143 [0,0,0,1,0,0|0,1,0]=2 19 B6R1.11 C[C@@H](C1CC1)N WX600160 [0,0,0,1,0,0|1,0,0]=2 20 B6R1.11 C[C@H](C1CC1)N WX600040 [0,0,0,1,0,0|1,0,0]=2 21 B6R1.11 C[C@H](C1CC1)N WXC03224 [0,0,0,1,0,0|1,0,0]=2 22 B5R0.1 CC(=O)CNC WX600212 [1,1,0,0,0,0|0,1,1]=4 23 B5R0.1 CC(C)CNN WX684055 [1,1,0,0,0,0|1,0,0]=3 24 B5R0.1 CC(CNN)O WX684013 [1,1,0,0,0,0|1,1,0]=4 25 B5R0.1 CC(CNN)O WX684431 [1,1,0,0,0,0|1,1,0]=4 26 B5R0.1 C[C@H](CC=C)O WX685032 [1,1,0,0,0,0|0,1,1]=4 27 B5R0.3 CC(CN)CCl WX600337 [1,1,0,0,0,0|1,0,0]=3 28 B5R0.3 CCC(C)NN WX684015 [1,1,0,0,0,0|1,0,0]=3 29 B5R0.3 CC[C@H](C)C#C WXC02726 [1,1,0,0,0,0|0,0,1]=3 30 B5R0.4 CC(C)(CN)O WX600104 [1,1,0,0,0,0|1,0,0]=3 31 B5R0.4 CC(CN)(F)F WX600332 [1,1,0,0,0,0|2,0,0]=4 32 B7R0.2 CC(C)C[C@H](CO)N WX600172 [0,1,0,0,0,1|1,0,0]=3 33 B7R0.5 CC(C)C(COC)N WX600059 [0,2,0,0,0,0|1,0,0]=3 34 B7R0.14 CCC(=O)C(C)(C)C WX625148 [0,2,0,0,0,0|0,1,1]=4 35 B5R1.2 C1C(CN1)F WX604199 [1,0,0,1,0,0|2,0,0]=4 36 B5R1.2 C1C(CN1)O WX604205 [1,0,0,1,0,0|1,1,0]=4 37 B5R1.2 C1C(CO1)N WX604200 [1,0,0,1,0,0|1,1,0]=4 38 B5R1.2 C1CC(C1)O WX642079 [1,0,0,1,0,0|0,1,0]=3 39 B5R1.2 CC1CCN1 WX604557 [1,0,0,1,0,0|1,0,0]=3 40 B5R1.2 CC1CNC1 WX604558 [1,0,0,1,0,0|1,0,0]=3 41 B5R1.3 C1CC1CO WX640290 [1,0,0,1,0,0|0,1,0]=3 42 B5R1.3 C1CC1NN WXC03921 [1,0,0,1,0,0|2,0,0]=4 43 B5R1.3 CNC1CC1 WX600338 [1,0,0,1,0,0|1,0,0]=3 44 B5R1.3 CNC1CC1 WX604563 [1,0,0,1,0,0|1,0,0]=3 45 B5R1.4 CC1CC1N WX604181 [1,0,0,1,0,0|1,0,0]=3 46 B5R1.4 CC1CC1N WX604564 [1,0,0,1,0,0|1,0,0]=3 47 B5R1.4 C[C@@H]1C[C@H]1N WX601308 [1,0,0,1,0,0|1,0,0]=3 48 B5R1.5 CC1(CC1)N WX600041 [1,0,0,1,0,0|1,0,0]=3 49 B5R1.5 CC1(CC1)N WX604565 [1,0,0,1,0,0|1,0,0]=3 50 B7R1.2 C1C[C@@H](C[C@@H]1N)O WX600013 [0,0,0,1,0,1|1,1,0]=4 51 B7R1.2 C1C[C@@H](C[C@H]1N)O WX600233 [0,0,0,1,0,1|1,1,0]=4 52 B7R1.2 C1C[C@H](C[C@@H]1N)F WX601024 [0,0,0,1,0,1|2,0,0]=4 53 B7R1.2 C1C[C@H](C[C@@H]1N)O WX600015 [0,0,0,1,0,1|1,1,0]=4 54 B7R1.2 C1C[C@H](C[C@@H]1N)O WX600109 [0,0,0,1,0,1|1,1,0]=4 55 B7R1.2 C1C[C@H](C[C@@H]1N)O WX600355 [0,0,0,1,0,1|1,1,0]=4 56 B7R1.2 C1C[C@H](C[C@H]1N)F WX601025 [0,0,0,1,0,1|2,0,0]=4 57 B7R1.2 C1C[C@H](C[C@H]1N)O WX600108 [0,0,0,1,0,1|1,1,0]=4 58 B7R1.2 C1C[C@H](C[C@H]1N)O WX600234 [0,0,0,1,0,1|1,1,0]=4 59 B7R1.2 CN1CCC(C1)N WX604198 [0,0,0,1,0,1|2,0,0]=4 60 B7R1.2 CN1CCC(C1)O WX642149 [0,0,0,1,0,1|1,1,0]=4 61 B7R1.2 C[C@@H]1C[C@@H](CN1)F WX601109 [0,0,0,1,0,1|2,0,0]=4 62 B7R1.2 C[C@@H]1C[C@@H](CN1)O WX601206 [0,0,0,1,0,1|1,1,0]=4 63 B7R1.2 C[C@@H]1C[C@H](CN1)F WX601363 [0,0,0,1,0,1|2,0,0]=4 64 B7R1.2 C[C@@H]1C[C@H](CN1)O WX601205 [0,0,0,1,0,1|1,1,0]=4 65 B7R1.4 C1C[C@H]([C@@H](C1)O)N WX604346 [0,1,0,1,0,0|1,1,0]=4 66 B7R1.4 C1[C@@H]([C@H](CN1)F)O WX601067 [0,1,0,1,0,0|1,1,0]=4 67 B7R1.4 C1[C@@H]([C@H](CO1)O)N WX604241 [0,1,0,1,0,0|1,1,0]=4 68 B7R1.4 C1[C@H]([C@@H](CN1)F)F WX601098 [0,1,0,1,0,0|2,0,0]=4 69 B7R1.4 C1[C@H]([C@@H](CO1)F)O WX641036 [0,1,0,1,0,0|1,1,0]=4 70 B7R1.4 C1[C@H]([C@@H](CO1)O)N WX601208 [0,1,0,1,0,0|1,1,0]=4 71 B7R1.4 C1[C@H]([C@H](CN1)F)F WX604101 [0,1,0,1,0,0|2,0,0]=4 72 B7R1.4 C1[C@H]([C@H](CN1)F)O WX601096 [0,1,0,1,0,0|1,1,0]=4 73 B7R1.4 C1[C@H]([C@H](CO1)F)N WXC03777 [0,1,0,1,0,0|2,0,0]=4 74 B7R1.4 CC1CNCC1O WX642148 [0,1,0,1,0,0|0,1,0]=3 75 B7R1.4 C[C@@H]1CNC[C@@H]1F WX601185 [0,1,0,1,0,0|1,0,0]=3 76 B7R1.4 C[C@@H]1[C@@H](CCO1)N WX601243 [0,1,0,1,0,0|1,0,0]=3 77 B7R1.4 C[C@H]1CCC[C@@H]1O WX641033 [0,1,0,1,0,0|0,1,0]=3 78 B7R1.4 C[C@H]1CCC[C@H]1N WX601120 [0,1,0,1,0,0|1,0,0]=3 79 B7R1.4 C[C@H]1CCC[C@H]1O WX641034 [0,1,0,1,0,0|0,1,0]=3 80 B7R1.4 C[C@H]1CNC[C@@H]1O WX642072 [0,1,0,1,0,0|0,1,0]=3 81 B7R1.4 C[C@H]1CNC[C@H]1O WX601066 [0,1,0,1,0,0|0,1,0]=3 82 B7R1.4 C[C@H]1COC[C@@H]1O WX641037 [0,1,0,1,0,0|0,1,0]=3 83 B7R1.4 C[C@H]1COC[C@H]1O WX641035 [0,1,0,1,0,0|0,1,0]=3 84 B7R1.18 CN(C)C1CNC1 WX604042 [0,1,0,1,0,0|2,0,0]=4 85 B7R1.19 CC(=O)C1(CC1)F WX625133 [0,1,0,1,0,0|0,1,1]=4 86 B7R1.22 CCC(=O)C1CC1 WX625032 [0,1,0,1,0,0|0,1,1]=4 87 B7R1.26 CC(C)(C1CC1)N WX600264 [0,1,0,1,0,0|1,0,0]=3