smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)NC(Cc1c[nH+]c[nH]1)C(=O)[O-]	69488599	574416443	/nfs/dbraw/zinc/41/64/43/574416443.db2.gz	XDRNOONALRPQTA-UHFFFAOYSA-N	0	2	197.194	0.373	1	0	endogenous,in-vitro	ACAFLN
CC(=O)NC(Cc1c[nH]c[nH+]1)C(=O)[O-]	69488599	574416444	/nfs/dbraw/zinc/41/64/44/574416444.db2.gz	XDRNOONALRPQTA-UHFFFAOYSA-N	0	2	197.194	0.373	1	0	endogenous,in-vitro	ACAFLN
COC(=O)c1cc(C)n(O)c(=O)c1	84653825	168126584	/nfs/dbraw/zinc/12/65/84/168126584.db2.gz	BOJGCLATWZKCFW-UHFFFAOYSA-N	0	2	183.163	0.181	1	0		ACAFLN
[NH3+]C1=CC[C@@H](C(=O)[O-])C=C1	100818387	171145322	/nfs/dbraw/zinc/14/53/22/171145322.db2.gz	KPIGAUGIHGRSAF-YFKPBYRVSA-N	0	2	139.154	0.490	1	0		ACAFLN
[NH3+]C1=CC[C@H](C(=O)[O-])C=C1	100818390	171145386	/nfs/dbraw/zinc/14/53/86/171145386.db2.gz	KPIGAUGIHGRSAF-RXMQYKEDSA-N	0	2	139.154	0.490	1	0		ACAFLN