0 B14R1.520 O=C(OCC)CNCC1=CC=CC=C1 M10090848P [0,0,0,0,0,0|1,0,0]=1 1 B13R1.718 O=C(OC)C\N=C\C1=CC=CC=C1 M10420934P [1,0,0,0,0,0|1,0,1]=3 2 B15R1.11 O=C(OCC)CCCC1=CC=C(Br)C=C1 M10661313P [0,1,0,0,0,0|0,0,0]=1 3 B15R1.89 O=C(OCC)CNC(C1=CC=CC=C1)=O M10031765P [0,1,0,0,0,0|1,0,1]=3 4 B15R2.73 O=C(C1=CNC2=C1C=CC=C2)OCC M10020574P [0,0,0,1,0,0|1,0,2]=4 5 B13R1.42 O=C(OCC)COC1=CC=CC=C1 M10045364P [0,0,0,0,1,0|1,0,0]=2 6 B15R1.778 O=C(OCC)CCNCC1=CC=CC=C1 M10180745P [0,0,0,0,0,1|0,0,0]=1 7 B12R1.252 O=C(O)CCCC1=NC=CC=C1 M10649446P [2,0,0,0,0,0|1,0,0]=3 8 B12R1.252 O=C([O-])CCCC1=CC=CC=C1 M10035233P [2,0,0,0,0,0|0,0,1]=3 9 B14R1.13 O=C(OC)CCCC1=CC=C(N)C=C1 M10166747P [1,1,0,0,0,0|0,0,0]=2 10 B14R1.756 C[C@H](NCC1=CC=CC=C1)C(OC)=O M10161045P [1,1,0,0,0,0|1,0,0]=3 11 B14R1.29 O=C(OCC)CC(C1=CC=NC=C1)=O M10193613P [0,1,0,0,1,0|1,0,1]=4 12 B14R1.29 O=C(OCC)CC(C1=NC=CC=C1)=O M10194204P [0,1,0,0,1,0|1,0,1]=4 13 B14R1.29 O=C(OCC)C[C@@H](N)C1=CC=CC=C1 M10862056P [0,1,0,0,1,0|0,0,0]=2 14 B14R1.29 O=C(OCC)C[C@H](N)C1=CC=CC=C1 M10796437P [0,1,0,0,1,0|0,0,0]=2 15 B14R1.29 O=C(OCC)C[C@H](O)C1=CC=CC=C1 M10220276P [0,1,0,0,1,0|0,0,0]=2 16 B14R1.502 O=C(OCC)CCC1=CC=C(O)C=C1 M10181797P [0,1,0,0,1,0|0,0,0]=2 17 B14R1.502 O=C(OCC)\N=C\C1=CC=C(Cl)C=C1 M10940149P [0,1,0,0,1,0|1,0,1]=4 18 B14R1.818 O=C(OC(C)C)\C=C\C1=CC=CC=C1 M10110590P [0,1,0,0,1,0|0,0,2]=4 19 B16R1.58 O=C(OCC)CCC(C1=CC=C(Br)C=C1)=O M10211949P [0,2,0,0,0,0|0,0,1]=3 20 B16R1.12547 O=C(OC(C)(C)C)NOCC1=CC=CC=C1 M10476596P [0,2,0,0,0,0|2,0,0]=4 21 B14R2.19 O=C1CN(CC2=CC=CC=C2)CC1 M10025236P [1,0,0,1,0,0|1,0,0]=3 22 B14R2.19 S=C1OC[C@@H](CC2=CC=CC=C2)N1 M10821511P [1,0,0,1,0,0|1,1,0]=4 23 B14R2.19 S=C1OC[C@H](CC2=CC=CC=C2)N1 M10768680P [1,0,0,1,0,0|1,1,0]=4 24 B14R2.21 O=C1CC(C2=CC=CC=C2)CCC1 M10167473P [0,0,0,1,1,0|1,0,0]=3 25 B14R2.21 O=C1NC(C2=CC=CC=C2)CCC1 M10245848P [0,0,0,1,1,0|2,0,0]=4 26 B14R2.598 O=C1O[C@H](C2=CC=CC=C2)[C@H](C)N1 M10141652P [0,0,0,1,1,0|2,0,0]=4 27 B16R2.3258 O=C1NCCN(CC2=CC=CC=C2)CC1 M10281004P [0,0,0,1,0,1|1,0,0]=3 28 B16R2.767 O=C(C1COC2=CC=CC=C2O1)OCC M10065829P [0,1,0,1,0,0|1,0,0]=3 29 B16R2.124 O=C1CN(CC2=CC=CC=C2)CCC1C M10215796P [0,1,0,1,0,0|2,0,0]=4 30 B12R1.27 CCC(OCC1=CC=CC=C1)=O M10004505P [1,0,0,0,1,0|1,0,0]=3 31 B12R1.27 O=C(CCC1=CC=CC=C1)CBr M10215691P [1,0,0,0,1,0|1,0,0]=3 32 B12R1.27 O=C(NCC1=CC=CC=C1)CCl M10045433P [1,0,0,0,1,0|2,0,0]=4 33 B12R1.27 O=C(OC)CNC1=CC=CC=C1 M10121939P [1,0,0,0,1,0|1,0,0]=3 34 B12R1.27 O=C(OC)COC1=CC=CC=C1 M10039630P [1,0,0,0,1,0|1,0,0]=3 35 B12R1.32 O=C(OCC)CC1=NC=CC=C1 M10047179P [0,0,0,0,2,0|1,0,0]=3 36 B12R1.32 O=C(OCC)CC1=NC=NC=C1 M11120451P [0,0,0,0,2,0|2,0,0]=4