smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CON=[N+](O)C(C)N([O-])N=[O+]C	225410113	168074965	/nfs/dbraw/zinc/07/49/65/168074965.db2.gz	SEXBUBXPPXQKRL-UHFFFAOYSA-N	1	3	180.164	0.163	50	10		ACCAHO
Cc1nonc1[N+](=O)NC#N	100046031	169005382	/nfs/dbraw/zinc/00/53/82/169005382.db2.gz	GNISYVIHFMWNTQ-TWGQIWQCSA-N	1	3	153.101	0.453	50	10		ACCAHO
C[NH+](C)Cc1cc(C[NH3+])ccc1[O-]	108369582	343752972	/nfs/dbraw/zinc/75/29/72/343752972.db2.gz	PNGIPLHNNCFGMG-UHFFFAOYSA-N	1	3	180.251	0.913	50	10		ACCAHO