smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc2nc([C@H]3CCCN3C(=O)c3nc(C(C)C)cs3)[nH]c21	ZINC000218755079	206373731	/nfs/dbraw/zinc/37/37/31/206373731.db2.gz	WSAURZTUTMDMEW-OAHLLOKOSA-N	0	1	354.479	4.429	50	70		FIIAMN
Cc1nc2sc([C@H](c3ccsc3)[N@H+](C)C3CCCCC3)c([O-])n2n1	ZINC000218613621	206371672	/nfs/dbraw/zinc/37/16/72/206371672.db2.gz	SOLPWHHRSMQULX-AWEZNQCLSA-N	0	1	362.524	4.220	50	70		FIIAMN
CC[C@H](NC(=O)Cc1ccc(O)c(Cl)c1)c1nc2ccc(C)cc2[nH]1	ZINC000217531455	206364672	/nfs/dbraw/zinc/36/46/72/206364672.db2.gz	XKAJOWOUFGOBCW-AWEZNQCLSA-N	0	1	357.841	4.040	50	70		FIIAMN
CC(C)c1nc2ccc(NC(=O)CC3(n4cccc4)CCOCC3)cc2[nH]1	ZINC000218237738	519869401	/nfs/dbraw/zinc/86/94/01/519869401.db2.gz	BTSYOFNRIMTWLE-UHFFFAOYSA-N	0	1	366.465	4.022	50	70		FIIAMN
Cc1cccc2nc([C@@H]3CCCN3C(=O)c3nc(C(C)C)cs3)[nH]c21	ZINC000218755035	568250088	/nfs/dbraw/zinc/25/00/88/568250088.db2.gz	WSAURZTUTMDMEW-HNNXBMFYSA-N	0	1	354.479	4.429	50	70		FIIAMN
Cc1nc2sc([C@H](c3ccccc3)[N@H+](C)C3CCCCC3)c([O-])n2n1	ZINC000218297730	209665127	/nfs/dbraw/zinc/66/51/27/209665127.db2.gz	MWGXLXTZEFROFL-INIZCTEOSA-N	0	1	356.495	4.159	50	70		FIIAMN
Cc1nc2sc([C@@H](c3ccsc3)[N@H+](C)C3CCCCC3)c([O-])n2n1	ZINC000218613541	568242426	/nfs/dbraw/zinc/24/24/26/568242426.db2.gz	SOLPWHHRSMQULX-CQSZACIVSA-N	0	1	362.524	4.220	50	70		FIIAMN
CC(C)C[C@H](NC(=O)c1[nH]nc2c1CCCCC2)c1nc2ccccc2[nH]1	ZINC000218144999	568218789	/nfs/dbraw/zinc/21/87/89/568218789.db2.gz	PEAUNEJJWYQRIU-SFHVURJKSA-N	0	1	365.481	4.072	50	70		FIIAMN
Cc1nc2sc([C@@H](c3ccccc3)[N@H+](C)C3CCCCC3)c([O-])n2n1	ZINC000218297679	568226965	/nfs/dbraw/zinc/22/69/65/568226965.db2.gz	MWGXLXTZEFROFL-MRXNPFEDSA-N	0	1	356.495	4.159	50	70		FIIAMN