0 B14R1.42 COC1=C(O)C=CC(CCC(C)=O)=C1 SC-19804 [0,0,0,0,0,0|0,0,0]=0 1 B13R1.511 O=C(O)CCC1=CC(O)=C(O)C=C1 SC-25524 [1,0,0,0,0,0|1,0,0]=2 2 B13R1.511 O=C(O)CCC1=CC=C(F)C(F)=C1 SC-78103 [1,0,0,0,0,0|3,0,0]=4 3 B13R1.511 O=C(O)\C=C\C1=CC=C(O)C(O)=C1 SC-B6225 [1,0,0,0,0,0|1,0,2]=4 4 B13R1.643 COC1=CC(\C=C\C(=O)O)=CC=C1 SC-80812 [1,0,0,0,0,0|1,0,2]=4 5 B15R1.4038 COC1=CC(CC(N)C(=O)O)=CC=C1O SC-67493 [0,1,0,0,0,0|1,0,0]=2 6 B15R1.5194 COC1=C(C)C(COC(C)=O)=NC=C1C SC-A2766 [0,1,0,0,0,0|3,0,0]=4 7 B15R1.12854 COC1=CC=C(CCC(=O)O)C=C1OC SC-02422 [0,1,0,0,0,0|1,0,0]=2 8 B15R1.12854 COC1=CC=C(COC(C)=O)C=C1OC SC-94183 [0,1,0,0,0,0|1,0,0]=2 9 B15R1.12854 COC1=CC=C(\C=C\C(=O)O)C=C1OC SC-02686 [0,1,0,0,0,0|1,0,2]=4 10 B15R1.12854 COC1=CC=C(\C=C\C(=O)O)C=C1OC SC-70733 [0,1,0,0,0,0|1,0,2]=4 11 B15R2.1754 COC1=CC2=C(C=C1O)OC(=O)C=C2 SC-90283 [0,0,0,1,0,0|1,0,2]=4 12 B15R2.7688 O=C(O)\C=C\C1=CC=C2OCOC2=C1 SC-02744 [0,0,0,1,0,0|1,0,2]=4 13 B13R1.52 COC1=CC(CC(=O)O)=CC=C1F SC-52178 [0,0,0,0,1,0|2,0,0]=3 14 B13R1.52 COC1=CC(CC(=O)O)=CC=C1O SC-18700 [0,0,0,0,1,0|1,0,0]=2 15 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 SC-01266 [2,0,0,0,0,0|2,0,0]=4 16 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 SC-26484 [2,0,0,0,0,0|2,0,0]=4 17 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 SC-16870 [2,0,0,0,0,0|2,0,0]=4 18 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 SC-45457 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 SC-13665 [2,0,0,0,0,0|1,0,0]=3 20 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 SC-13720 [2,0,0,0,0,0|2,0,0]=4 21 B12R1.286 COC1=C(O)C=CC(CCN)=C1 SC-23404 [2,0,0,0,0,0|1,0,0]=3 22 B12R1.286 COC1=CC(CCN)=CC=C1O SC-22667 [2,0,0,0,0,0|1,0,0]=3 23 B12R1.382 CNCCC1=CC=CC(OC)=C1 SC-77036 [2,0,0,0,0,0|1,0,0]=3 24 B12R1.382 COC1=CC(CCCBr)=CC=C1 SC-A3062 [2,0,0,0,0,0|1,0,1]=4 25 B14R1.686 NC(CC1=CC(I)=C(O)C=C1)C(=O)O SC-11023 [1,1,0,0,0,0|2,0,0]=4 26 B14R1.686 N[C@@H](CC1=CC(Br)=C(O)C=C1)C(=O)O SC-21989 [1,1,0,0,0,0|2,0,0]=4 27 B14R1.686 N[C@@H](CC1=CC(Cl)=C(O)C=C1)C(=O)O SC-10993 [1,1,0,0,0,0|2,0,0]=4 28 B14R1.686 N[C@@H](CC1=CC(O)=C(O)C=C1)C(=O)O SC-10704 [1,1,0,0,0,0|1,0,0]=3 29 B14R1.686 N[C@@H](CC1=CC=C(O)C(F)=C1)C(=O)O SC-11017 [1,1,0,0,0,0|2,0,0]=4 30 B14R1.3653 COC1=CC=C(CCC(=O)O)C=C1Cl SC-94955 [1,1,0,0,0,0|2,0,0]=4 31 B14R1.75 COC1=CC(CC(N)C(=O)O)=CC=C1 SC-10834 [1,1,0,0,0,0|1,0,0]=3 32 B14R1.3651 COC1=CC=C(CC(=O)O)C=C1OC SC-15993 [0,1,0,0,1,0|1,0,0]=3 33 B14R1.3651 COC1=CC=C(CC(C)=O)C=C1OC SC-46631 [0,1,0,0,1,0|0,0,0]=2 34 B14R2.2332 COC1=CC=C2CC(=O)CCC2=C1 SC-19707 [1,0,0,1,0,0|0,0,0]=2 35 B14R2.11684 COC1=C2CC(=O)CCC2=CC=C1 SC-20736 [1,0,0,1,0,0|0,0,0]=2 36 B14R2.1008 O=C(O)CC1=CC=C2OCCC2=C1 SC-06378 [0,0,0,1,1,0|2,0,0]=4 37 B16R2.1357 CC(CCC1=CC=C2OCOC2=C1)NN SC-60003 [0,1,0,1,0,0|1,0,1]=4 38 B16R2.36419 COC1=C(OC)C=C2C(=C1)CC2C(=O)O SC-24306 [0,1,0,1,0,0|1,0,0]=3 39 B12R1.19 CC(=O)CC1=CC=C(O)C(O)=C1 SC-82918 [1,0,0,0,1,0|0,0,0]=2 40 B12R1.19 O=C(O)CC1=CC=C(O)C(Br)=C1 SC-17049 [1,0,0,0,1,0|2,0,0]=4 41 B12R1.19 O=C(O)CC1=CC=C(O)C(O)=C1 SC-51734 [1,0,0,0,1,0|1,0,0]=3 42 B12R1.438 COC1=CC(NC(C)=O)=CC=C1 SC-A3130 [1,0,0,0,1,0|1,0,0]=3 43 B12R1.56 CC(=O)C1=CC=C(O)C(CO)=C1 SC-19911 [0,0,0,0,2,0|2,0,0]=4 44 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 SC-06033 [0,0,0,0,2,0|1,0,0]=3 45 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 SC-04834 [0,0,0,0,2,0|0,0,0]=2 46 B12R1.56 COC1=CC(C(=O)O)=CC=C1Br SC-52442 [0,0,0,0,2,0|2,0,0]=4 47 B12R1.56 COC1=CC(C(=O)O)=CC=C1C SC-06469 [0,0,0,0,2,0|2,0,0]=4 48 B12R1.56 COC1=CC(C(=O)O)=CC=C1F SC-50833 [0,0,0,0,2,0|2,0,0]=4 49 B12R1.56 COC1=CC(C(=O)O)=CC=C1N SC-02864 [0,0,0,0,2,0|2,0,0]=4 50 B12R1.56 COC1=CC(C(=O)O)=CC=C1O SC-15609 [0,0,0,0,2,0|1,0,0]=3 51 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1O SC-19550 [0,0,0,0,2,0|2,0,0]=4