smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(N2C(=O)[C@H](N3C(=O)C=CC3=O)[C@@H]2C=O)cc1	ZINC000005843508	181288281	/nfs/dbraw/zinc/28/82/81/181288281.db2.gz	LIGPYBFRILLHOR-SMDDNHRTSA-N	0	2	300.270	-0.097	1	30		DBEFLN
NC(=[NH2+])NC(=O)c1nc(Cl)c(NCCC(=O)[O-])nc1N	ZINC000073170125	191287873	/nfs/dbraw/zinc/28/78/73/191287873.db2.gz	DIBNYHUXZPZTGK-UHFFFAOYSA-N	0	2	301.694	-0.988	1	30		DBEFLN
COc1ccc(N2C(=O)[C@@H](N3C(=O)C=CC3=O)[C@@H]2C=O)cc1	ZINC000006411292	181338976	/nfs/dbraw/zinc/33/89/76/181338976.db2.gz	LIGPYBFRILLHOR-FZMZJTMJSA-N	0	2	300.270	-0.097	1	30		DBEFLN
COc1ccc(N2C(=O)[C@H](N3C(=O)C=CC3=O)[C@H]2C=O)cc1	ZINC000006411290	181338938	/nfs/dbraw/zinc/33/89/38/181338938.db2.gz	LIGPYBFRILLHOR-BXUZGUMPSA-N	0	2	300.270	-0.097	1	30		DBEFLN