smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O[C@@H]1CN(c2ccncc2)CC[N@@H+](C2CCC3(CC[NH2+]CC3)CC2)C1	ZINC000097463608	219025867	/nfs/dbraw/zinc/02/58/67/219025867.db2.gz	DQUSKEIUTQIBOI-IBGZPJMESA-N	2	3	344.503	1.877	50	0		EDAAHP
O[C@@H]1CN(c2ccncc2)CC[N@H+](C2CCC3(CC[NH2+]CC3)CC2)C1	ZINC000097463608	219025868	/nfs/dbraw/zinc/02/58/68/219025868.db2.gz	DQUSKEIUTQIBOI-IBGZPJMESA-N	2	3	344.503	1.877	50	0		EDAAHP
O[C@H]1CN(c2ccncc2)CC[N@@H+](C2CCC3(CC[NH2+]CC3)CC2)C1	ZINC000217089957	485738392	/nfs/dbraw/zinc/73/83/92/485738392.db2.gz	DQUSKEIUTQIBOI-LJQANCHMSA-N	2	3	344.503	1.877	50	0		EDAAHP
O[C@H]1CN(c2ccncc2)CC[N@H+](C2CCC3(CC[NH2+]CC3)CC2)C1	ZINC000217089957	485738401	/nfs/dbraw/zinc/73/84/01/485738401.db2.gz	DQUSKEIUTQIBOI-LJQANCHMSA-N	2	3	344.503	1.877	50	0		EDAAHP