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)c1cccc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)c1[O-]	ZINC000067956090	432047970	/nfs/dbraw/zinc/04/79/70/432047970.db2.gz	SJKMZVCBVGZCPQ-UHFFFAOYSA-N	1	3	302.462	3.265	50	10		DGCAHO
CC(C)(C)c1cccc(C[N@H+]2CCC3(C2)CC[NH2+]CC3)c1[O-]	ZINC000067956090	432047972	/nfs/dbraw/zinc/04/79/72/432047972.db2.gz	SJKMZVCBVGZCPQ-UHFFFAOYSA-N	1	3	302.462	3.265	50	10		DGCAHO
Cc1ccc([O-])c(C[NH+]2CCC([C@H](C)[NH+]3CCCC3)CC2)c1	ZINC000065494319	184355061	/nfs/dbraw/zinc/35/50/61/184355061.db2.gz	OOLYABGRRYIVJK-INIZCTEOSA-N	1	3	302.462	3.397	50	10		DGCAHO
COc1cccc(CN(C)C2CC(C)(C)[NH2+]C(C)(C)C2)c1O	ZINC000065374355	184331224	/nfs/dbraw/zinc/33/12/24/184331224.db2.gz	NAAGOUVJWGYRJW-UHFFFAOYSA-N	1	3	306.450	3.142	50	10		DGCAHO
Cc1ccc([O-])c(C[NH+]2CCC([C@@H](C)[NH+]3CCCC3)CC2)c1	ZINC000065494315	184354765	/nfs/dbraw/zinc/35/47/65/184354765.db2.gz	OOLYABGRRYIVJK-MRXNPFEDSA-N	1	3	302.462	3.397	50	10		DGCAHO