Cc1cc2cccc(OCC(CNC(C)(C)C)OC(=O)c3ccccc3)c2o1 |$;;;;;;;;;;;;;;;;;;;;;;;;;;;$| 28 1 0 28 Cc1cc2cccc(OCC(CN)OC(=O)c3ccccc3)c2o1 |$;;;;;;;;;;;;N_{amine:1};;;;;;;;;;;$| 24 1 0 24 CC(C)(C)NCC(O)CSc1nc(cs1)-c2ccc(s2)C(N)=O |$;;;;;;;;;;;;;;;;;;;;;;$| 23 1 0 23 CC(COc1cccc2cc(C)oc12)OC(=O)c3ccccc3 |$C_{amine:2};;;;;;;;;;;;;;;;;;;;;;$| 23 1 0 23 CC(C)(C)NCC(O)CSc1nc(cs1)-c2ccc(C=O)s2 |$;;;;;;;;;;;;;;;;;;;C_{amide:2};;$| 22 1 0 22 CC(C)NCC(O)COc1cccc2cc(oc12)C(C)=O |$;;;;;;;;;;;;;;;;;;;;$| 21 1 0 21 Cc1cc2cccc(OCC(O)CNC(C)(C)C)c2o1 |$;;;;;;;;;;;O_{ester:2};;;;;;;;$| 20 1 0 20 NCC(O)CSc1nc(cs1)-c2ccc(s2)C(N)=O |$N_{amine:1};;;;;;;;;;;;;;;;;;$| 19 1 0 19 CC(=O)c1cc2cccc(OCC(O)CN)c2o1 |$;;;;;;;;;;;;;;;N_{amine:1};;$| 18 1 0 18 CC(C)(C)NCC(CO)OC(=O)c1ccccc1 |$;;;;;;;;O_{ether:1};;;;;;;;;$| 18 1 0 18 CC(O)CSc1nc(cs1)-c2ccc(s2)C(N)=O |$C_{amine:2};;;;;;;;;;;;;;;;;$| 18 1 0 18 NCC(O)CSc1nc(cs1)-c2ccc(C=O)s2 |$N_{amine:1};;;;;;;;;;;;;;;C_{amide:2};;$| 18 1 0 18 CC(CNC(C)(C)C)OC(=O)c1ccccc1 |$C_{ether:2};;;;;;;;;;;;;;;;$| 17 1 0 17 CC(O)COc1cccc2cc(oc12)C(C)=O |$C_{amine:2};;;;;;;;;;;;;;;;$| 17 1 0 17 CC(O)CSc1nc(cs1)-c2ccc(C=O)s2 |$C_{amine:2};;;;;;;;;;;;;;C_{amide:2};;$| 17 1 0 17 Cc1cc2cccc(OCC(O)CN)c2o1 |$;;;;;;;;;;;O_{ester:2};;N_{amine:1};;$| 16 1 0 16 CC(C)(C)NCC(O)CSc1nccs1 |$;;;;;;;;;;;;C_{aromc-aromc:1};;$| 15 1 0 15 CC(O)COc1cccc2cc(C)oc12 |$C_{amine:2};;O_{ester:2};;;;;;;;;;;;$| 15 1 0 15 NCC(CO)OC(=O)c1ccccc1 |$N_{amine:1};;;;O_{ether:1};;;;;;;;;$| 14 1 0 14 CC(=O)c1cc2cccc(O)c2o1 |$;;;;;;;;;;O_{ether:1};;$| 13 1 0 13 CC(CN)OC(=O)c1ccccc1 |$C_{ether:2};;;N_{amine:1};;;;;;;;;$| 13 1 0 13 CC(CO)OC(=O)c1ccccc1 |$C_{amine:2};;;O_{ether:1};;;;;;;;;$| 13 1 0 13 CC(=O)c1cc2ccccc2o1 |$;;;;;;;;;C_{ether:2};;$| 12 1 0 12 CC(C)OC(=O)c1ccccc1 |$C_{ether:2};;C_{amine:2};;;;;;;;;$| 12 1 0 12 Cc1cc2cccc(O)c2o1 |$;;;;;;;;O_{ether:1};;$| 11 1 0 11 NCC(O)CSc1nccs1 |$N_{amine:1};;;;;;;;C_{aromc-aromc:1};;$| 11 1 0 11 CC(C)(C)N |$;;;;N_{amine:1}$| 5 2 0 10 CC(C)(C)NCC(O)CO |$;;;;;;;O_{ester:2};;O_{ether:1}$| 10 1 0 10 CC(O)CSc1nccs1 |$C_{amine:2};;;;;;;C_{aromc-aromc:1};;$| 10 1 0 10 Cc1cc2ccccc2o1 |$;;;;;;;C_{ether:2};;$| 10 1 0 10 CC(O)CNC(C)(C)C |$C_{ether:2};;O_{ester:2};;;;;;$| 9 1 0 9 CC(C)C |$;C_{amine:2};;$| 4 2 0 8 NC(=O)c1cccs1 |$;;;;;;C_{aromc-aromc:1};$| 8 1 0 8 O=Cc1ccccc1 |$;C_{ester:1};;;;;;$| 8 1 0 8 O=Cc1cccs1 |$;C_{amide:2};;;;C_{aromc-aromc:1};$| 7 1 0 7 NCC(O)CO |$N_{amine:1};;;O_{ester:2};;O_{ether:1}$| 6 1 0 6 CC(O)CN |$C_{ether:2};;O_{ester:2};;N_{amine:1}$| 5 1 0 5 CC(O)CO |$C_{amine:2};;O_{ester:2};;O_{ether:1}$| 5 1 0 5 CC(C)O |$C_{ether:2};;C_{amine:2};O_{ester:2}$| 4 1 0 4 N |$N_{amine:1,amine:1}$| 1 3 1 2 N |$N_{amide:3}$| 1 1 0 1 O |$O_{ether:1,ether:1}$| 1 2 1 1 CC(C)N |$;;;N_{amine:1}$| 4 1 1 0 CC(C)NCC(C)O |$;;;;;;C_{ether:2};$| 8 1 1 0 CC(C)NCC(O)CO |$;;;;;;;;O_{ether:1}$| 9 1 1 0 CC(C)O |$C_{ether:2};;C_{amine:2};$| 4 1 1 0 CC(O)CN |$C_{ether:2};;;;N_{amine:1}$| 5 1 1 0 CC(O)CO |$C_{amine:2};;;;O_{ether:1}$| 5 1 1 0 CCC |$;C_{amine:2};$| 3 1 1 0 NCC(O)CO |$N_{amine:1};;;;;O_{ether:1}$| 6 1 1 0