smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCc1cc([N-]S(=O)(=O)c2cc(C)cc(F)c2)[nH]n1	ZINC000159938620	432701365	/nfs/dbraw/zinc/70/13/65/432701365.db2.gz	QIQSEGRTSVOYSH-UHFFFAOYSA-N	-1	1	311.382	3.001	50	70		DGIAMM
CCCc1ccc(S(=O)(=O)[N-]c2ccn3nccc3c2)cc1	ZINC000217961925	432658239	/nfs/dbraw/zinc/65/82/39/432658239.db2.gz	PXQKXIMKIFRXCH-UHFFFAOYSA-N	-1	1	315.398	3.088	50	70		DGIAMM
O=C(c1ncccc1[O-])N1CCCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000217867559	432656095	/nfs/dbraw/zinc/65/60/95/432656095.db2.gz	SJAZWODOYXZOPK-CQSZACIVSA-N	-1	1	322.368	3.031	50	70		DGIAMM
O=C(c1ncccc1[O-])N1CCCC[C@H]1c1nc2ccccc2[nH]1	ZINC000217867637	432656060	/nfs/dbraw/zinc/65/60/60/432656060.db2.gz	SJAZWODOYXZOPK-AWEZNQCLSA-N	-1	1	322.368	3.031	50	70		DGIAMM