smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C#CCONC(=O)[C@@H](C(=O)[O-])C(C)C	1602701900	971327573	/nfs/dbraw/zinc/32/75/73/971327573.db2.gz	BYWNLDBUKUTERE-ZETCQYMHSA-N	-1	2	199.206	0.024	20	30		ACEDLM
C#CCONC(=O)[C@H](C(=O)[O-])C(C)C	1602701899	971327840	/nfs/dbraw/zinc/32/78/40/971327840.db2.gz	BYWNLDBUKUTERE-SSDOTTSWSA-N	-1	2	199.206	0.024	20	30		ACEDLM
C=CCONC(=O)[C@@H](C(=O)[O-])C1CC1	1602728737	971396070	/nfs/dbraw/zinc/39/60/70/971396070.db2.gz	AAIDHUAIIDDIJZ-ZETCQYMHSA-N	-1	2	199.206	0.331	20	30		ACEDLM
C=CCONC(=O)[C@H](C(=O)[O-])C1CC1	1602728736	971396301	/nfs/dbraw/zinc/39/63/01/971396301.db2.gz	AAIDHUAIIDDIJZ-SSDOTTSWSA-N	-1	2	199.206	0.331	20	30		ACEDLM
C=CCONC(=O)C(C)(C)C(=O)[O-]	1602729023	971399431	/nfs/dbraw/zinc/39/94/31/971399431.db2.gz	YSGHXZNRZRRYFN-UHFFFAOYSA-N	-1	2	187.195	0.331	20	30		ACEDLM
O=C([O-])c1cnc(/C=N/O)s1	253388102	526402352	/nfs/dbraw/zinc/40/23/52/526402352.db2.gz	HSFADGKEDQBIDN-FARCUNLSSA-N	-1	2	172.165	0.649	20	30		ACEDLM