0 B14R1.716 CCC(=O)OCCOC1=CC=CC=C1 F16706 [0,0,0,0,0,0|1,0,1]=2 1 B14R1.716 COC(=O)CCOCC1=CC=CC=C1 O11889 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.337 CC(=O)NCCSC1=CC=CC=C1 AT24197 [1,0,0,0,0,0|2,0,1]=4 3 B13R1.337 CC(=O)OCCCC1=CC=NC=C1 AC9652 [1,0,0,0,0,0|1,0,2]=4 4 B13R1.337 O=[N+]([O-])CC\C=C\C1=CC=CC=C1 F15310 [1,0,0,0,0,0|3,0,0]=4 5 B15R1.1321 CCC(=O)[C@@H](C)COCC1=CC=CC=C1 W10350 [0,1,0,0,0,0|2,0,1]=4 6 B15R2.79765 O=C(CO)C1=CC=CC2=CC=CC=C21 AC3802 [0,0,0,1,0,0|2,0,1]=4 7 B13R1.718 COC(=O)NCCC1=CC=CC=C1 F15323 [0,0,0,0,1,0|2,0,1]=4 8 B14R1.420 CC(=O)OCCC(=O)C1=CC=CC=C1 A51013 [1,1,0,0,0,0|0,0,1]=3 9 B14R1.1025 COC(=O)C\C=C\C1=CC=CC(F)=C1 AB10116 [0,1,0,0,1,0|1,0,0]=3 10 B16R1.1343 O=C(CO)OCC(=O)OCC1=CC=CC=C1 13043 [0,1,0,0,0,1|1,0,1]=4 11 B16R1.905 CCOC(=O)CC\C=C\C1=CC=CC(Br)=C1 S11637 [0,2,0,0,0,0|1,0,0]=3 12 B14R2.14 OCC1=C(C2=CC=CC=C2)C=NO1 C92203 [1,0,0,1,0,0|2,0,0]=4 13 B14R2.2 CC(=O)OC1=CSC2=C1C=CC=C2 AC9432 [1,0,0,1,0,0|1,0,1]=4 14 B14R2.2 CC(=O)O[C@H]1CCC2=C1C=CC=C2 T70688 [1,0,0,1,0,0|0,0,2]=4 15 B14R2.68 O=C1CCC(C2=CC=CC=C2)=NN1 T70008 [0,0,0,1,1,0|2,0,0]=4 16 B14R2.68 O=C1CCN(C2=CC=CC=C2)CC1 F13287 [0,0,0,1,1,0|1,0,1]=4 17 B14R2.68 O=C1CN[C@H](C2=CC=CC=C2)CO1 77665 [0,0,0,1,1,0|1,0,1]=4 18 B14R2.68 O=C1CN[C@H](C2=CC=CC=C2)CO1 P18324 [0,0,0,1,1,0|1,0,1]=4 19 B14R2.95 CCC(=O)C1=CNC2=C1C=CC=C2 F53571 [0,0,0,1,1,0|1,0,1]=4 20 B14R2.958 COC(=O)[C@@H]1N=C1C2=CC=CC=C2 AC4984 [0,0,0,1,1,0|2,0,0]=4 21 B16R2.5 CCCC(=O)OC1=CNC2=C1C=CC=C2 FD10324 [0,1,0,1,0,0|1,0,1]=4 22 B16R2.160202 CCCC(=O)C1=CC=CC2=CC=CC=C21 N14295 [0,1,0,1,0,0|1,0,1]=4 23 B16R2.2829 O=C1CC[C@H](OC(=O)C2=CC=CC=C2)C1 F53150 [0,1,0,1,0,0|2,0,0]=4