CID Name SMILES Class Subclass Hit Ratio
13032 N-Isopropylaniline CC(C)Nc1ccccc1 Aniline Aniline 0/47
119716 Isononanamine CC(C)CCCCCCN Aliphatic (noncyclic) Branched monoamine 0/44
7096 1-Phenylpiperazine c1ccc(N2CCNCC2)cc1 Aniline Aniline 0/32
60993 N,N-Diethylethylenediamine CCN(CC)CCN Aliphatic (noncyclic) Branched diamine 0/32
1727 4-Aminopyridine Nc1ccncc1 Heterocyclic aromatic Pyridine 0/48
7973 2-Bromopyridine Brc1ccccn1 Heterocyclic aromatic Pyridine 0/27
14310 N-Butylaniline CCCCNc1ccccc1 Aniline Aniline 0/44
1049 Pyridine c1ccncc1 Heterocyclic aromatic Pyridine 1/48
6115 Aniline Nc1ccccc1 Aniline Aniline 1/48
13195 4-Methylimidazole Cc1cnc[nH]1 Heterocyclic aromatic Pyrrole 1/47