0 B8R1.7 C1C=C(CO1)C(=O)O DA-27535 [1,0,0,0,0,0|2,0,1]=4 1 B8R1.7 C1CC(NC1)C(=O)Cl DA-41821 [1,0,0,0,0,0|1,0,0]=2 2 B8R1.7 C1CC(SC1)C(=O)Cl DA-41850 [1,0,0,0,0,0|2,0,0]=3 3 B8R1.7 C1COCC1C(=O)N DA-41026 [1,0,0,0,0,0|3,0,0]=4 4 B8R1.7 CC(=O)C1CCOC1 DA-30524 [1,0,0,0,0,0|3,0,0]=4 5 B10R1.14 COC(=O)C1=CC(CC1)O DA-32677 [0,1,0,0,0,0|1,0,2]=4 6 B10R1.59 CC1CC(C(=O)O1)C(=O)O DA-43036 [0,1,0,0,0,0|3,0,0]=4 7 B8R0.9 CC(=O)OCC(CCl)O DA-23853 [0,0,1,0,0,0|3,0,0]=4 8 B8R0.9 CC(CCC(=O)O)C=C DA-39098 [0,0,1,0,0,0|2,0,1]=4 9 B8R0.9 CC(CN)CNC(=O)C DA-45920 [0,0,1,0,0,0|3,0,0]=4 10 B8R0.28 CC(C)COCC(=O)O DA-28580 [0,0,1,0,0,0|2,0,0]=3 11 B10R1.13 C1CC(=O)CNC1C(=O)O DA-37041 [0,0,0,0,0,1|0,0,2]=3 12 B10R1.13 C1CC(CCC1C(=O)O)Br DA-39820 [0,0,0,0,0,1|2,0,0]=3 13 B10R1.13 CC1CCC(CN1)C(=O)N DA-35999 [0,0,0,0,0,1|3,0,0]=4 14 B10R1.54 CN1CCC(C1)CC(=O)O DA-29191 [0,0,0,0,0,1|3,0,0]=4 15 B10R1.113 CC(=O)N1CCCC(C1)O DA-31188 [0,0,0,0,0,1|3,0,0]=4 16 B10R1.113 CC1CCCC(C1)C(=O)Cl DA-23324 [0,0,0,0,0,1|3,0,0]=4 17 B7R0.5 CCNC(=O)C(=O)O DA-27699 [1,0,1,0,0,0|1,0,1]=4 18 B7R0.6 CC(C#CC(=O)O)O DA-41638 [1,0,1,0,0,0|0,0,2]=4 19 B7R0.6 CC(CCC(=O)O)I DA-41244 [1,0,1,0,0,0|1,0,0]=3 20 B7R0.15 CCC(C=C)C(=O)O DA-26255 [1,0,1,0,0,0|1,0,1]=4 21 B7R1.1 C1CC(NC1)C#N DA-25679 [2,0,0,0,0,0|1,0,1]=4 22 B7R1.1 C1CSCC1C=O DA-48034 [2,0,0,0,0,0|2,0,0]=4 23 B9R0.11 CC(C)CC(C)(C(=O)O)O DA-26148 [0,1,1,0,0,0|2,0,0]=4 24 B9R0.56 CC(C)(C)CCCC(=O)O DA-38321 [0,1,1,0,0,0|2,0,0]=4 25 B9R1.11 C1CCC(C1)C(=O)CCl DA-26686 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.163 CC1(CCCC1)C(=O)Cl DA-29140 [1,1,0,0,0,0|2,0,0]=4 27 B9R1.163 CC1(CCCN1)C(=O)O DA-25786 [1,1,0,0,0,0|0,0,0]=2 28 B9R1.163 C[C@]1(CCCN1)C(=O)N DA-41217 [1,1,0,0,0,0|1,0,0]=3 29 B9R1.82 COC(=O)C1CC(=C)C1 DA-43929 [0,1,0,0,1,0|1,0,1]=4 30 B9R1.164 CC1(CC(C1)C(=O)Cl)C DA-24792 [0,1,0,0,1,0|2,0,0]=4 31 B9R1.164 CC1(CC(C1)C(=O)N)C DA-24791 [0,1,0,0,1,0|2,0,0]=4 32 B9R1.164 CC1(CC(C1)C(=O)O)Cl DA-23844 [0,1,0,0,1,0|1,0,0]=3 33 B11R1.3 CO[C@H]1CC[C@@H](CC1)C(=O)O DA-41523 [0,1,0,0,0,1|1,0,0]=3 34 B11R1.15 CCOC(=O)C1CCC(C1)N DA-34111 [0,2,0,0,0,0|2,0,0]=4 35 B11R1.44 CCC1CCC(C1)C(=O)OC DA-41880 [0,2,0,0,0,0|2,0,0]=4 36 B11R1.44 COC(=O)C1CCC(C1)CN DA-32840 [0,2,0,0,0,0|2,0,0]=4 37 B9R1.6 CC(=O)C1COCCO1 DA-31656 [0,0,1,1,0,0|2,0,0]=4 38 B9R1.49 C1CC(CCC(=O)C1)O DA-23103 [0,0,1,1,0,0|2,0,0]=4 39 B9R1.84 C1CC(C1)CCC(=O)O DA-34953 [0,0,1,1,0,0|2,0,0]=4 40 B9R1.119 COC1(CCC1)C(=O)O DA-29254 [0,0,1,1,0,0|2,0,0]=4 41 B11R2.914 COC(=O)C1CC2C(C1)O2 DA-35951 [0,1,0,1,0,0|1,0,0]=3 42 B7R1.10 C=C1CC(C1)C=O DA-25534 [1,0,0,0,1,0|1,0,1]=4 43 B7R1.10 CNC1CC(C1)O DA-24867 [1,0,0,0,1,0|2,0,0]=4 44 B7R1.12 C=C1CC1C(=O)O DA-25803 [0,0,0,0,2,0|1,0,1]=4 45 B7R1.12 CC1CC1C(=O)N DA-25804 [0,0,0,0,2,0|2,0,0]=4 46 B9R1.13 C1CCC(C1)CC(=O)Cl DA-34937 [1,0,0,0,0,1|2,0,0]=4 47 B9R1.13 C1CCC(C1)CC(=O)O DA-34939 [1,0,0,0,0,1|1,0,0]=3 48 B9R1.13 CC(=O)NC1CCCC1 DA-43035 [1,0,0,0,0,1|2,0,0]=4