smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1c(C[N@@H+]2C[C@H]3C[C@H](Cn4c(=O)cccc43)C2)cc(=O)c(O)c1C[NH+]1C[C@@]2(C)C[C@@H]1CC(C)(C)C2	ZINC000217562967	569880312	/nfs/dbraw/zinc/88/03/12/569880312.db2.gz	BMWNCWWOEBAAQB-KJIDJHTKSA-N	2	1	492.664	3.273	40	70		JGIBMP
Cn1c(C[NH+]2C[C@H]3C[C@H](Cn4c(=O)cccc43)C2)cc(=O)c(O)c1C[N@@H+]1C[C@@]2(C)C[C@@H]1CC(C)(C)C2	ZINC000217562967	569880313	/nfs/dbraw/zinc/88/03/13/569880313.db2.gz	BMWNCWWOEBAAQB-KJIDJHTKSA-N	2	1	492.664	3.273	40	70		JGIBMP
Cn1c(C[NH+]2C[C@H]3C[C@H](Cn4c(=O)cccc43)C2)cc(=O)c(O)c1C[N@H+]1C[C@@]2(C)C[C@@H]1CC(C)(C)C2	ZINC000217562967	569880314	/nfs/dbraw/zinc/88/03/14/569880314.db2.gz	BMWNCWWOEBAAQB-KJIDJHTKSA-N	2	1	492.664	3.273	40	70		JGIBMP