smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ccc(CS(=O)(=O)N2CCN(S(N)(=O)=O)CC2)cc1	ZINC000040348076	685114354	/nfs/dbraw/zinc/11/43/54/685114354.db2.gz	HQLRDWVJNQTWIB-UHFFFAOYSA-N	0	0	334.423	-1.080	10	10		EACERN
CS(=O)(=O)CS(=O)(=O)N(CC(N)=O)Cc1ccc(N)cc1	ZINC000129939024	685065851	/nfs/dbraw/zinc/06/58/51/685065851.db2.gz	JLPACOPWCCMTCP-UHFFFAOYSA-N	0	0	335.407	-1.112	10	10		EACERN
CN(C)N=Nc1nc2c(c(=O)n(C)c(=O)n2C)n1C[C@@H](O)CO	ZINC000254738468	686427568	/nfs/dbraw/zinc/42/75/68/686427568.db2.gz	ZFIGJLVPWKXGGB-SSDOTTSWSA-N	0	0	325.329	-1.653	10	10		EACERN
CN(C)N=Nc1nc2c(c(=O)n(C)c(=O)n2C)n1C[C@H](O)CO	ZINC000254738472	685130827	/nfs/dbraw/zinc/13/08/27/685130827.db2.gz	ZFIGJLVPWKXGGB-ZETCQYMHSA-N	0	0	325.329	-1.653	10	10		EACERN