smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(-n2cc[nH+]c2)cc1	ZINC000057347281	571342541	/nfs/dbraw/zinc/34/25/41/571342541.db2.gz	IDIRTSFNUQERHA-CYBMUJFWSA-N	2	2	356.813	4.285	50	5		FIBALP
O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC([NH+]4CCCCC4)CC3)o2)cc1	ZINC000023279910	211382837	/nfs/dbraw/zinc/38/28/37/211382837.db2.gz	PWNYYHNNJFSYMU-UHFFFAOYSA-N	2	2	369.465	4.305	50	5		FIBALP
O=[N+]([O-])c1cc(C[NH2+]C2CC[NH+](Cc3ccccc3)CC2)ccc1Cl	ZINC000058165466	221101667	/nfs/dbraw/zinc/10/16/67/221101667.db2.gz	CEBRXNQZZWRVAQ-UHFFFAOYSA-N	2	2	359.857	4.002	50	5		FIBALP
C[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(-n2cc[nH+]c2)cc1	ZINC000057347275	571342534	/nfs/dbraw/zinc/34/25/34/571342534.db2.gz	IDIRTSFNUQERHA-ZDUSSCGKSA-N	2	2	356.813	4.285	50	5		FIBALP