smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)[N-][N+](=O)c1ccccc1	104193437	167341800	/nfs/dbraw/zinc/34/18/00/167341800.db2.gz	PXLUEWJRYWSFLE-UHFFFAOYSA-N	0	1	194.190	2.437	40	10		AECBMN
C[NH2+]Cc1c([O-])ccc2ccccc12	1679612	168016998	/nfs/dbraw/zinc/01/69/98/168016998.db2.gz	GNDLETZYLAVKLN-UHFFFAOYSA-N	0	1	187.242	2.265	40	10		AECBMN
C[C@@H]([NH3+])c1cc(Cl)ccc1[O-]	24863133	168370500	/nfs/dbraw/zinc/37/05/00/168370500.db2.gz	IHDFZQZUBQSKDM-RXMQYKEDSA-N	0	1	171.627	2.065	40	10		AECBMN
C[C@H]([NH3+])c1cc(Cl)ccc1[O-]	24863137	168554925	/nfs/dbraw/zinc/55/49/25/168554925.db2.gz	IHDFZQZUBQSKDM-YFKPBYRVSA-N	0	1	171.627	2.065	40	10		AECBMN