0 B7R1.2 C[C@@H]1CNC(=O)C1 SPC-r288 [0,0,0,0,0,0|3,0,1]=4 1 B7R1.2 C[C@H]1CNC(=O)C1 SPC-n787 [0,0,0,0,0,0|3,0,1]=4 2 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m128 [0,0,0,0,0,0|3,0,1]=4 3 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m129 [0,0,0,0,0,0|3,0,1]=4 4 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m820 [0,0,0,0,0,0|3,0,1]=4 5 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-t534 [0,0,0,0,0,0|3,0,1]=4 6 B7R1.2 O=C1CCC(=O)C1 SPC-h715 [0,0,0,0,0,0|1,0,0]=1 7 B7R1.2 O=C1CC[C@H](O)C1 SPC-q537 [0,0,0,0,0,0|1,0,2]=3 8 B7R1.2 O=C1CNC(=O)C1 SPC-n497 [0,0,0,0,0,0|2,0,0]=2 9 B7R1.2 O=C1C[C@@H](O)CN1 SPC-s696 [0,0,0,0,0,0|2,0,2]=4 10 B7R1.2 O=C1C[C@@H](S)CN1 SPC-u488 [0,0,0,0,0,0|2,1,1]=4 11 B6R1.2 IC1=COCC1 SPC-t718 [1,0,0,0,0,0|3,0,0]=4 12 B6R1.2 IC1=NC=CO1 SPC-m994 [1,0,0,0,0,0|2,0,1]=4 13 B6R1.2 O=C1C=CCC1 SPC-g207 [1,0,0,0,0,0|1,0,0]=2 14 B6R1.2 O=C1C=CCO1 SPC-t619 [1,0,0,0,0,0|2,0,0]=3 15 B6R1.2 O=C1C=CNN1 SPC-p382 [1,0,0,0,0,0|3,0,0]=4 16 B6R1.2 O=C1CCNC1 SPC-g182 [1,0,0,0,0,0|2,0,0]=3 17 B6R1.2 O=C1CCOC1 SPC-g234 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.1 NC[C@@H]1CNC(=O)O1 SPC-n802 [0,1,0,0,0,0|2,0,1]=4 19 B8R1.1 NC[C@H]1CNC(=O)O1 SPC-j887 [0,1,0,0,0,0|2,0,1]=4 20 B8R1.1 NC[C@H]1CNC(=O)O1 SPC-q943 [0,1,0,0,0,0|2,0,1]=4 21 B8R1.1 O=C1CC[C@@H](CO)N1 SPC-g157 [0,1,0,0,0,0|1,0,2]=4 22 B8R1.1 O=C1CC[C@H](CO)N1 SPC-n804 [0,1,0,0,0,0|1,0,2]=4 23 B8R1.18 CC1=CC(=O)O[C@@H]1O SPC-s367 [0,1,0,0,0,0|3,0,0]=4 24 B8R1.50 CN1C(=O)CSC1=S SPC-m393 [0,1,0,0,0,0|2,1,0]=4 25 B8R1.50 CN1C(=O)N=NC1=O SPC-w118 [0,1,0,0,0,0|3,0,0]=4 26 B8R1.50 O=C1CCC(=O)N1I SPC-m873 [0,1,0,0,0,0|1,0,0]=2 27 B6R1.4 C[C@@H]1OCC1=O SPC-p252 [0,0,0,0,1,0|2,0,1]=4 28 B6R1.4 N[C@@H]1CNC1=O SPC-u597 [0,0,0,0,1,0|2,0,1]=4 29 B6R1.4 N[C@H]1CNC1=O SPC-s686 [0,0,0,0,1,0|2,0,1]=4 30 B6R1.4 O=C1CC[C@@H]1Br SPC-u765 [0,0,0,0,1,0|1,0,1]=3 31 B6R1.5 CC1CC(=O)C1 SPC-n075 [0,0,0,0,1,0|2,0,1]=4 32 B6R1.5 CN1CC(=O)C1 SPC-i955 [0,0,0,0,1,0|3,0,0]=4 33 B6R1.5 CN1CC(=O)C1 SPC-p044 [0,0,0,0,1,0|3,0,0]=4 34 B6R1.5 NC1CC(=O)C1 SPC-g768 [0,0,0,0,1,0|2,0,1]=4 35 B6R1.5 O=C1CC(Br)C1 SPC-i596 [0,0,0,0,1,0|2,0,1]=4 36 B8R1.3 C[C@@H]1C=CC(=O)CC1 SPC-s978 [0,0,0,0,0,1|2,0,1]=4 37 B8R1.3 C[C@H]1CCC(=O)NC1 SPC-p145 [0,0,0,0,0,1|2,0,1]=4 38 B8R1.3 N[C@@H]1CCC(=O)NC1 SPC-r045 [0,0,0,0,0,1|2,0,1]=4 39 B8R1.3 N[C@H]1CCC(=O)NC1 SPC-h503 [0,0,0,0,0,1|2,0,1]=4 40 B8R1.3 N[C@H]1CCC(=O)NC1 SPC-r044 [0,0,0,0,0,1|2,0,1]=4 41 B8R1.3 O=C1CCC(F)CC1 SPC-u525 [0,0,0,0,0,1|2,0,1]=4 42 B8R1.4 C[C@@H]1CC(=O)CCN1 SPC-j888 [0,0,0,0,0,1|2,0,1]=4 43 B8R1.4 C[C@@H]1CNCC(=O)N1 SPC-n811 [0,0,0,0,0,1|2,0,1]=4 44 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-j895 [0,0,0,0,0,1|2,0,1]=4 45 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-m537 [0,0,0,0,0,1|2,0,1]=4 46 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-n719 [0,0,0,0,0,1|2,0,1]=4 47 B8R1.4 C[C@H]1CC(=O)CCO1 SPC-k855 [0,0,0,0,0,1|2,0,1]=4 48 B8R1.4 C[C@H]1CCNC(=O)C1 SPC-p144 [0,0,0,0,0,1|2,0,1]=4 49 B8R1.4 C[C@H]1CNCC(=O)N1 SPC-n812 [0,0,0,0,0,1|2,0,1]=4 50 B8R1.4 NC1=CC(=O)COC1 SPC-t582 [0,0,0,0,0,1|2,0,0]=3 51 B8R1.4 N[C@@H]1COCC(=O)C1 SPC-u616 [0,0,0,0,0,1|2,0,1]=4 52 B8R1.4 N[C@H]1CCNC(=O)C1 SPC-j029 [0,0,0,0,0,1|2,0,1]=4 53 B8R1.4 O=C1CCC[C@H](O)C1 SPC-p385 [0,0,0,0,0,1|1,0,2]=4 54 B8R1.4 O=C1CCNC(=O)C1 SPC-g649 [0,0,0,0,0,1|1,0,0]=2 55 B8R1.4 O=C1CNCC(=O)N1 SPC-r025 [0,0,0,0,0,1|1,0,0]=2 56 B8R1.4 O=C1COCC(=O)C1 SPC-k937 [0,0,0,0,0,1|1,0,0]=2 57 B8R1.4 O=C1CSCC(=O)C1 SPC-t654 [0,0,0,0,0,1|1,0,0]=2 58 B5R1.1 C1=COC=N1 SPC-m896 [2,0,0,0,0,0|1,0,1]=4 59 B7R0.5 CC(C)C(=O)OCCl SPC-n339 [0,1,1,0,0,0|1,0,1]=4 60 B7R1.4 N[C@H]1CCNC1=O SPC-u507 [1,1,0,0,0,0|1,0,1]=4 61 B7R1.4 N[C@H]1CCOC1=O SPC-s908 [1,1,0,0,0,0|0,0,1]=3 62 B7R1.8 O=C1CC[C@@H]1CO SPC-p096 [0,1,0,0,1,0|0,0,2]=4 63 B7R1.17 CC1(C)CCC1=O SPC-s190 [0,1,0,0,1,0|1,0,1]=4 64 B9R1.3 CN1C(=O)CNCC1=O SPC-v084 [0,1,0,0,0,1|1,0,0]=3 65 B9R1.3 O=C1CCCC(O)=C1I SPC-s937 [0,1,0,0,0,1|1,0,1]=4 66 B9R1.34 NC1CC(=O)NC(=O)C1 SPC-r038 [0,1,0,0,0,1|1,0,0]=3 67 B9R1.22 O=C1C[C@H](O)[C@@H](CO)O1 SPC-m818 [0,2,0,0,0,0|0,0,2]=4 68 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 SPC-h594 [0,2,0,0,0,0|1,0,1]=4 69 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 SPC-g806 [0,2,0,0,0,0|0,0,1]=3 70 B9R1.35 O=C1CC[C@@H](C(=O)O)S1 SPC-p725 [0,2,0,0,0,0|0,1,1]=4 71 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-h678 [0,2,0,0,0,0|1,0,1]=4 72 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-k770 [0,2,0,0,0,0|1,0,1]=4 73 B9R1.37 CN1C(=O)C[C@H](N)C1=O SPC-r266 [0,2,0,0,0,0|1,0,0]=3 74 B7R1.18 O=C(O)C1CCC1 SPC-a107 [0,0,1,1,0,0|1,0,1]=4 75 B7R1.18 O=C(O)C1CNC1 SPC-g671 [0,0,1,1,0,0|2,0,0]=4 76 B7R1.18 O=C(O)C1COC1 SPC-a017 [0,0,1,1,0,0|2,0,0]=4 77 B7R1.18 O=C(O)C1CSC1 SPC-a106 [0,0,1,1,0,0|2,0,0]=4 78 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-g935 [0,0,1,1,0,0|1,0,1]=4 79 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-h064 [0,0,1,1,0,0|1,0,1]=4 80 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-a304 [0,0,1,1,0,0|0,0,2]=4 81 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-u910 [0,0,1,1,0,0|0,0,2]=4 82 B7R1.18 O=C(O)[C@H]1CCN1 SPC-h200 [0,0,1,1,0,0|1,0,1]=4 83 B7R1.18 O=C(O)[C@H]1CCO1 SPC-u911 [0,0,1,1,0,0|0,0,2]=4 84 B9R2.25 O=C1OC(=O)C2CC12 SPC-g395 [0,0,0,1,0,1|0,0,0]=2 85 B5R1.2 O=C1CCN1 SPC-t120 [1,0,0,0,1,0|1,0,0]=3 86 B5R1.2 O=C1CNC1 SPC-h722 [1,0,0,0,1,0|1,0,1]=4 87 B5R1.2 O=C1CSC1 SPC-a100 [1,0,0,0,1,0|1,0,1]=4