smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N@H+](C)Cc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)ccc1O	ZINC000584577187	564086134	/nfs/dbraw/zinc/08/61/34/564086134.db2.gz	CICBOMVEPRQYQZ-UHFFFAOYSA-N	2	2	341.842	4.789	40	10		EJCBLP
CC[N@@H+](C)Cc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)ccc1O	ZINC000584577187	564086135	/nfs/dbraw/zinc/08/61/35/564086135.db2.gz	CICBOMVEPRQYQZ-UHFFFAOYSA-N	2	2	341.842	4.789	40	10		EJCBLP
COc1ccc2c(c1)CCC[N@H+]2CCCCCCC[NH+]1CCCCC1	ZINC000001577060	563393531	/nfs/dbraw/zinc/39/35/31/563393531.db2.gz	PEKCNRKCJWMDBJ-UHFFFAOYSA-N	2	2	344.543	4.884	40	10		EJCBLP
COc1ccc2c(c1)CCC[N@@H+]2CCCCCCC[NH+]1CCCCC1	ZINC000001577060	563393536	/nfs/dbraw/zinc/39/35/36/563393536.db2.gz	PEKCNRKCJWMDBJ-UHFFFAOYSA-N	2	2	344.543	4.884	40	10		EJCBLP