smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CNC(=[NH2+])NCCCc1c[nH]c[nH+]1	29215425	166069187	/nfs/dbraw/zinc/06/91/87/166069187.db2.gz	BDCZRBRMRNIOFR-UHFFFAOYSA-N	2	2	181.243	-0.124	1	30		ABEFLP
CNC(=[NH2+])NCCCc1c[nH+]c[nH]1	29215425	166069188	/nfs/dbraw/zinc/06/91/88/166069188.db2.gz	BDCZRBRMRNIOFR-UHFFFAOYSA-N	2	2	181.243	-0.124	1	30		ABEFLP
[NH3+][C@@H](Cc1c[nH+]c[nH]1)C(=O)CS	169321739	169248195	/nfs/dbraw/zinc/24/81/95/169248195.db2.gz	UYZPKWHAOSHZBE-LURJTMIESA-N	2	2	185.252	-0.222	1	30		ABEFLP