smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC(=N\NC(=S)NCCN1CCCCC1)/C(CC)=N/NC(=S)NCC[NH+]1CCCCC1	ZINC000005572758	521067530	/nfs/dbraw/zinc/06/75/30/521067530.db2.gz	PKTSZWVEIDJBJO-FQHZWJPGSA-N	1	3	482.768	2.418	40	30		JEEBHO
CCC(=N/NC(=S)NCCN1CCCCC1)/C(CC)=N\NC(=S)NCCN1CCCCC1	ZINC000104201312	569842925	/nfs/dbraw/zinc/84/29/25/569842925.db2.gz	PKTSZWVEIDJBJO-DQIQZUARSA-N	1	3	482.768	2.418	40	30		JEEBHO
CCC(=N/NC(=S)NCCN1CCCCC1)/C(CC)=N\NC(=S)NCC[NH+]1CCCCC1	ZINC000104201312	569842927	/nfs/dbraw/zinc/84/29/27/569842927.db2.gz	PKTSZWVEIDJBJO-DQIQZUARSA-N	1	3	482.768	2.418	40	30		JEEBHO