0 B7R0.9 CC(C)(C)NC(N)=S AC-2400 [0,0,0,0,0,0|3,1,0]=4 1 B7R0.9 CC(C)(O)CC(=O)[O-] AC-20085 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.9 C[N+](C)(C)CC(=O)O AC-34957 [0,0,0,0,0,0|0,0,1]=1 3 B6R0.2 CC(O)CC(=O)O AC-5701 [1,0,0,0,0,0|2,0,1]=4 4 B6R0.2 CN(C)CC(=O)O AC-30735 [1,0,0,0,0,0|0,0,2]=3 5 B6R0.2 C[C@@H](N)CC(=O)O AC-22067 [1,0,0,0,0,0|2,0,1]=4 6 B6R0.2 C[C@H](N)CC(=O)O AC-5698 [1,0,0,0,0,0|2,0,1]=4 7 B6R0.2 C[C@H](O)CC(=O)[O-] AC-13946 [1,0,0,0,0,0|2,0,0]=3 8 B8R0.24 CC(C)(C)OC(=O)CN AC-8654 [0,1,0,0,0,0|3,0,0]=4 9 B8R0.27 CC(C)(C)C(N)C(=O)O AC-24097 [0,1,0,0,0,0|1,0,1]=3 10 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O AC-24096 [0,1,0,0,0,0|1,0,1]=3 11 B8R0.27 CC(C)(C)[C@H](N)C(=O)O AC-1454 [0,1,0,0,0,0|1,0,1]=3 12 B8R0.27 CC(C)(C)[C@H](N)C(=O)O AC-4269 [0,1,0,0,0,0|1,0,1]=3 13 B8R0.27 [C@H](N)(C(=O)O)C(C)(C)O AC-049 [0,1,0,0,0,0|2,0,1]=4 14 B8R0.27 [C@H](N)(C(=O)O)C(C)(C)O AC-1524 [0,1,0,0,0,0|2,0,1]=4 15 B8R1.51 CC1(C)CC(=O)NO1 AC-30800 [0,0,0,1,0,0|3,0,0]=4 16 B8R1.77 CC1(C)CC1C(=O)O AC-13096 [0,0,0,1,0,0|1,0,1]=3 17 B8R1.77 CC1(C)CC1C(N)=O AC-6625 [0,0,0,1,0,0|2,0,0]=3 18 B8R1.77 CC1(C)C[C@@H]1C(=O)O AC-9861 [0,0,0,1,0,0|1,0,1]=3 19 B6R0.7 CC(C)(C)S(N)=O AC-6446 [0,0,0,0,1,0|3,0,0]=4 20 B6R0.7 CC(C)(C)[S@@](N)=O AC-4655 [0,0,0,0,1,0|3,0,0]=4 21 B6R0.7 CC(C)(C)[S@@](N)=O AC-763 [0,0,0,0,1,0|3,0,0]=4 22 B6R0.7 CC(C)(Cl)C(=O)O AC-5641 [0,0,0,0,1,0|2,0,1]=4 23 B6R0.7 CC(C)(N)C(=O)O AC-2694 [0,0,0,0,1,0|2,0,1]=4 24 B8R0.29 CC(C)(C)NCC(=O)Cl AC-23122 [0,0,0,0,0,1|2,0,0]=3 25 B8R0.29 CC(C)(C)NCC(=O)O AC-22361 [0,0,0,0,0,1|1,0,1]=3 26 B5R0.4 CC(C)(C)CN AC-26539 [2,0,0,0,0,0|2,0,0]=4 27 B7R0.2 CN(C)CC(=O)NN AC-29363 [1,1,0,0,0,0|1,0,1]=4 28 B7R0.16 CC(C)C(N)C(=O)O AC-24062 [1,1,0,0,0,0|1,0,1]=4 29 B7R0.16 CC(C)[C@@H](Br)C(=O)O AC-23805 [1,1,0,0,0,0|1,0,1]=4 30 B7R0.16 CC(C)[C@@H](Br)C(=O)O AC-5643 [1,1,0,0,0,0|1,0,1]=4 31 B7R0.16 CC(C)[C@@H](N)C(=O)O AC-24061 [1,1,0,0,0,0|1,0,1]=4 32 B7R0.8 C[Si](C)(C)C\C=C\O AC-30876 [1,1,0,0,0,0|1,0,1]=4 33 B7R0.13 CC(=O)C(C)(C)CO AC-30558 [0,1,0,0,1,0|2,0,0]=4 34 B7R0.13 CC(C)(CN)C(N)=O AC-8492 [0,1,0,0,1,0|2,0,0]=4 35 B7R0.13 CC(C)(CO)C(=O)O AC-29208 [0,1,0,0,1,0|1,0,1]=4 36 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O AC-6597 [0,1,0,0,0,1|1,0,1]=4 37 B9R0.25 COC(=O)C(N)C(C)(C)C AC-26419 [0,2,0,0,0,0|1,0,1]=4 38 B9R0.25 COC(=O)[C@H](N)C(C)(C)C AC-26420 [0,2,0,0,0,0|1,0,1]=4 39 B7R1.2 CN1CCC(=O)C1 AC-7086 [1,0,0,1,0,0|1,0,1]=4 40 B7R1.12 CC1CC1C(=O)O AC-26542 [1,0,0,1,0,0|1,0,1]=4 41 B7R1.12 CC1CC1C(N)=O AC-31195 [1,0,0,1,0,0|2,0,0]=4 42 B7R1.20 O=C(O)CC1CC1 AC-1476 [1,0,0,1,0,0|1,0,1]=4 43 B7R1.19 CC1(C(=O)O)CC1 AC-5063 [0,0,0,1,1,0|1,0,1]=4 44 B7R1.19 CC1(C(N)=O)CC1 AC-30447 [0,0,0,1,1,0|2,0,0]=4 45 B5R0.5 CC(=O)C(=O)[O-] AC-20029 [1,0,0,0,1,0|2,0,0]=4 46 B5R0.5 C[C@H](O)C(=O)[O-] AC-14439 [1,0,0,0,1,0|2,0,0]=4 47 B9R0.56 CC(=O)OCC[N+](C)(C)C AC-32576 [0,0,0,0,0,2|1,0,0]=3 48 B9R0.56 CC(=O)SCC[N+](C)(C)C AC-37018 [0,0,0,0,0,2|1,0,0]=3 49 B9R0.56 C[N+](C)(C)NCCC(=O)[O-] AC-2090 [0,0,0,0,0,2|0,0,0]=2