smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)N1CCC[C@@H]1C(=O)NCC(N)=O	ZINC000004556705	556001166	/nfs/dbraw/zinc/00/11/66/556001166.db2.gz	JQESMPDJSXFGSA-MELADBBJSA-N	1	3	440.549	-2.300	50	0		IAAAHO
OCCN1CCOCCOCCOCC[NH+](CCO)CCOCCOCCOCC1	ZINC000005119008	556636870	/nfs/dbraw/zinc/63/68/70/556636870.db2.gz	JAKGTZGTDDDHSH-UHFFFAOYSA-N	1	3	438.562	-1.312	50	0		IAAAHO
CC(C)C[C@H](N)C(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)N1CCC[C@H]1C(=O)NCC(N)=O	ZINC000015721435	519366601	/nfs/dbraw/zinc/36/66/01/519366601.db2.gz	JQESMPDJSXFGSA-IHRRRGAJSA-N	1	3	440.549	-2.300	50	0		IAAAHO