0 B9R1.35 NC1CCC(C(=O)O)C1 SPC-h180 [0,0,0,1,0,0|0,0,2]=3 1 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SPC-q476 [0,0,0,1,0,0|0,0,2]=3 2 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SPC-t661 [0,0,0,1,0,0|0,0,2]=3 3 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 SPC-j914 [0,0,0,1,0,0|2,0,1]=4 4 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 SPC-j915 [0,0,0,1,0,0|2,0,1]=4 5 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 SPC-s047 [0,0,0,1,0,0|2,0,1]=4 6 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 SPC-k019 [0,0,0,1,0,0|2,0,1]=4 7 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 SPC-s048 [0,0,0,1,0,0|2,0,1]=4 8 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 SPC-n707 [0,0,0,1,0,0|2,0,1]=4 9 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 SPC-g127 [0,0,0,1,0,0|2,0,1]=4 10 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 SPC-k011 [0,0,0,1,0,0|2,0,1]=4 11 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SPC-m778 [0,0,0,1,0,0|2,0,1]=4 12 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SPC-t597 [0,0,0,1,0,0|2,0,1]=4 13 B9R1.69 N[C@H]1CCC(=O)NC1=O SPC-g515 [0,0,0,1,0,0|2,0,0]=3 14 B9R1.95 COC1CC(C(=O)O)C1 SPC-i683 [0,0,0,1,0,0|2,0,1]=4 15 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 SPC-i655 [0,0,0,1,0,0|2,0,1]=4 16 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 SPC-i033 [0,0,0,1,0,0|2,0,1]=4 17 B9R1.95 NCC1CC(C(=O)O)C1 SPC-m330 [0,0,0,1,0,0|2,0,1]=4 18 B8R0.29 O=C(O)CCC(F)(F)F SPC-v732 [1,1,0,0,0,0|2,0,0]=4 19 B10R0.93 N[C@@H](C[C@H](N)C(=O)O)C(=O)O SPC-q942 [0,2,0,0,0,0|1,0,0]=3 20 B8R1.1 O=C1CC[C@@H](CO)N1 SPC-g157 [1,0,0,1,0,0|1,0,1]=4 21 B8R1.1 O=C1CC[C@H](CO)N1 SPC-n804 [1,0,0,1,0,0|1,0,1]=4 22 B8R1.3 C[C@@H]1C=CC(=O)CC1 SPC-s978 [1,0,0,1,0,0|1,0,0]=3 23 B8R1.3 N[C@@H]1CCC(=O)NC1 SPC-r045 [1,0,0,1,0,0|1,0,1]=4 24 B8R1.3 N[C@H]1CCC(=O)NC1 SPC-h503 [1,0,0,1,0,0|1,0,1]=4 25 B8R1.3 N[C@H]1CCC(=O)NC1 SPC-r044 [1,0,0,1,0,0|1,0,1]=4 26 B8R1.7 O=C(O)C1=COCC1 SPC-g480 [1,0,0,1,0,0|1,0,1]=4 27 B8R1.7 O=C(O)C1CC=CC1 SPC-g185 [1,0,0,1,0,0|0,0,2]=4 28 B8R1.7 O=C(O)C1CCCC1 SPC-k222 [1,0,0,1,0,0|0,0,2]=4 29 B8R1.7 O=C(O)[C@@H]1CCNC1 SPC-n752 [1,0,0,1,0,0|1,0,1]=4 30 B8R1.7 O=C(O)[C@@H]1CCNC1 SPC-s684 [1,0,0,1,0,0|1,0,1]=4 31 B8R1.7 O=C(O)[C@@H]1CCOC1 SPC-h613 [1,0,0,1,0,0|1,0,1]=4 32 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-g474 [1,0,0,1,0,0|1,0,1]=4 33 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-j200 [1,0,0,1,0,0|1,0,1]=4 34 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-t662 [1,0,0,1,0,0|1,0,1]=4 35 B8R1.7 O=C(O)[C@H]1CCOC1 SPC-g501 [1,0,0,1,0,0|1,0,1]=4 36 B8R1.7 O=C(O)[C@H]1CCOC1 SPC-j337 [1,0,0,1,0,0|1,0,1]=4 37 B8R1.31 CN1CC[C@@H]1C(=O)O SPC-i181 [1,0,0,1,0,0|1,0,1]=4 38 B8R1.31 CN1CC[C@H]1C(=O)O SPC-p175 [1,0,0,1,0,0|1,0,1]=4 39 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O SPC-i928 [1,0,0,1,0,0|1,0,1]=4 40 B8R1.31 N[C@H]1CC[C@H]1C(=O)O SPC-i929 [1,0,0,1,0,0|1,0,1]=4 41 B8R1.34 O=C(O)CC1CCC1 SPC-a096 [1,0,0,1,0,0|0,0,2]=4 42 B8R1.34 O=C(O)CC1CNC1 SPC-h769 [1,0,0,1,0,0|1,0,1]=4 43 B8R1.34 O=C(O)CC1COC1 SPC-a018 [1,0,0,1,0,0|1,0,1]=4 44 B8R1.43 N#CC1CC1C(=O)O SPC-t815 [1,0,0,1,0,0|1,0,1]=4 45 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O SPC-q468 [1,0,0,1,0,0|1,0,1]=4 46 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O SPC-k256 [1,0,0,1,0,0|1,0,1]=4 47 B8R1.43 NCC1CC1C(=O)O SPC-v399 [1,0,0,1,0,0|1,0,1]=4 48 B8R1.23 C=C1CC(C(=O)O)C1 SPC-g775 [1,0,0,1,0,0|1,0,1]=4 49 B8R1.23 CC1CC(C(=O)O)C1 SPC-m202 [1,0,0,1,0,0|1,0,1]=4 50 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 SPC-i346 [1,0,0,1,0,0|1,0,1]=4 51 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 SPC-i384 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.23 NC1CC(C(=O)O)C1 SPC-q735 [1,0,0,1,0,0|0,0,1]=3 53 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SPC-h937 [1,0,0,1,0,0|0,0,1]=3 54 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 SPC-i508 [1,0,0,1,0,0|0,0,1]=3 55 B8R1.23 O=C(O)C1CC(Cl)C1 SPC-h856 [1,0,0,1,0,0|1,0,1]=4 56 B8R1.23 O=C(O)C1CC(F)C1 SPC-a125 [1,0,0,1,0,0|1,0,1]=4 57 B8R1.23 O=C(O)C1CC(O)C1 SPC-p384 [1,0,0,1,0,0|1,0,1]=4 58 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 SPC-q739 [1,0,0,1,0,0|1,0,1]=4 59 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 SPC-h918 [1,0,0,1,0,0|1,0,1]=4 60 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 SPC-h952 [1,0,0,1,0,0|1,0,1]=4 61 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 SPC-q738 [1,0,0,1,0,0|1,0,1]=4 62 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 SPC-i654 [1,0,0,1,0,0|1,0,1]=4 63 B8R1.23 O=C1C[C@@H](C(=O)O)N1 SPC-i679 [1,0,0,1,0,0|1,0,1]=4 64 B8R1.23 O=C1C[C@H](C(=O)O)N1 SPC-i186 [1,0,0,1,0,0|1,0,1]=4 65 B8R1.77 O=C(O)[C@@H]1CC1(F)F SPC-n672 [1,0,0,1,0,0|2,0,0]=4 66 B8R1.77 O=C(O)[C@H]1CC1(F)F SPC-j902 [1,0,0,1,0,0|2,0,0]=4 67 B8R1.77 O=C(O)[C@H]1CC1(F)F SPC-q542 [1,0,0,1,0,0|2,0,0]=4 68 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 SPC-m733 [0,0,0,1,0,1|0,0,2]=4 69 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 SPC-g845 [0,0,0,1,0,1|0,0,2]=4 70 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F SPC-v663 [0,1,0,1,0,0|2,0,0]=4 71 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 SPC-g914 [0,1,0,1,0,0|0,0,2]=4 72 B10R1.82 O=C(O)CCC1CC(=O)C1 SPC-q746 [0,1,0,1,0,0|1,0,1]=4