0 B9R0.2 CC(=O)NCCCCCN T5222 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.2 CCCCCCCC(=O)O T3946 [0,0,0,0,0,0|1,0,2]=3 2 B9R0.2 CS(=O)CCCCN=C=S TQ0207 [0,0,0,0,0,0|3,0,1]=4 3 B9R0.2 C[S@@](=O)CCCCN=C=S T8281 [0,0,0,0,0,0|3,0,1]=4 4 B8R0.4 CCCCCCCCO T10024 [1,0,0,0,0,0|1,0,2]=4 5 B8R0.7 CC(=O)NCCCCN T7508 [1,0,0,0,0,0|2,0,0]=3 6 B8R0.7 NCCCCCC(=O)O T0881 [1,0,0,0,0,0|2,0,0]=3 7 B10R0.3 CC(C)=CCCC(C)CC=O T8061 [0,1,0,0,0,0|2,0,1]=4 8 B10R0.3 CC(C)=CCC[C@H](C)CC=O T8013 [0,1,0,0,0,0|2,0,1]=4 9 B10R0.4 CCCCCCCCC(=O)O T3947 [0,1,0,0,0,0|1,0,2]=4 10 B10R0.4 NCCCCCCCC(=O)O T8102 [0,1,0,0,0,0|1,0,2]=4 11 B10R0.75 CCCCCCC(O)C(=O)O T7481 [0,1,0,0,0,0|1,0,2]=4 12 B10R0.97 O=C(O)CCCCCC(=O)O T4795 [0,1,0,0,0,0|2,0,0]=3 13 B10R1.61 O=C(O)C1CCCCN1O T19458 [0,0,0,1,0,0|3,0,0]=4 14 B10R1.64 CC(=O)NC1CCSC1=O T0316 [0,0,0,1,0,0|3,0,0]=4 15 B10R1.64 NC(=O)CN1CCCC1=O T0426 [0,0,0,1,0,0|3,0,0]=4 16 B7R0.4 CCCCCC(C)N T0359 [2,0,0,0,0,0|1,0,1]=4 17 B7R0.4 NCCCCC(=O)O T5089 [2,0,0,0,0,0|2,0,0]=4 18 B9R0.47 C=CCSC[C@H](N)C(=O)O T2772 [1,1,0,0,0,0|2,0,0]=4 19 B9R0.47 NCCCCC(N)C(=O)O T19290 [1,1,0,0,0,0|2,0,0]=4 20 B9R0.47 NCCCC[C@H](N)C(=O)O T2A2498 [1,1,0,0,0,0|2,0,0]=4 21 B9R0.47 NCCCC[C@H](N)C(=O)O T8071 [1,1,0,0,0,0|2,0,0]=4 22 B9R0.55 CC(=O)NCCCC(=O)O T4728 [1,1,0,0,0,0|2,0,0]=4 23 B9R0.55 O=C(O)CCCCC(=O)O T2228 [1,1,0,0,0,0|2,0,0]=4 24 B9R0.55 O=C(O)CCCCC(=O)O T7146 [1,1,0,0,0,0|2,0,0]=4 25 B11R0.30 CC(=O)NCCCCCC(=O)O T0436 [0,2,0,0,0,0|1,0,0]=3 26 B11R0.30 O=C(O)CCCCCCC(=O)O T4734 [0,2,0,0,0,0|1,0,1]=4 27 B11R0.148 CCCCCCCCCC(C)=O T8017 [0,2,0,0,0,0|0,0,2]=4 28 B11R0.148 CCCCCCCCOC(C)=O T5667 [0,2,0,0,0,0|0,0,2]=4 29 B9R1.6 O=C(O)C1CCCCC1 T5563 [1,0,0,1,0,0|1,0,1]=4 30 B9R1.6 O=C(O)C1CCCCN1 T4819 [1,0,0,1,0,0|2,0,0]=4 31 B9R1.6 O=C(O)[C@@H]1CCCCN1 T4762 [1,0,0,1,0,0|2,0,0]=4 32 B9R1.6 O=C(O)[C@H]1CCCCN1 T13634 [1,0,0,1,0,0|2,0,0]=4 33 B11R2.67 O=C1CCC2CCC(=O)N12 T16783 [0,0,0,2,0,0|2,0,0]=4 34 B11R2.533 C=C1CC[C@H]2C[C@@H]1C2(C)C T8360 [0,0,0,2,0,0|1,0,1]=4 35 B11R2.432 CN1C2CCC1CC(=O)C2 Fr13711 [0,0,0,2,0,0|1,0,1]=4