smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]1CN(Cc2ccc3ccc4cccc5ccc2c3c45)C[C@H](C)O1	ZINC000016663117	563819753	/nfs/dbraw/zinc/81/97/53/563819753.db2.gz	MEXAEAFRVORBOA-IYBDPMFKSA-N	0	3	329.443	5.193	50	5		EKBAHN
C[C@@H]1CN(Cc2ccc3ccc4cccc5ccc2c3c45)C[C@@H](C)O1	ZINC000019635074	212053119	/nfs/dbraw/zinc/05/31/19/212053119.db2.gz	MEXAEAFRVORBOA-HZPDHXFCSA-N	0	3	329.443	5.193	50	5		EKBAHN
C[C@H]1CN(Cc2ccc3ccc4cccc5ccc2c3c45)C[C@H](C)O1	ZINC000019635082	202015853	/nfs/dbraw/zinc/01/58/53/202015853.db2.gz	MEXAEAFRVORBOA-HOTGVXAUSA-N	0	3	329.443	5.193	50	5		EKBAHN
Clc1c2ccccc2c(CNCc2ccccn2)c2ccccc12	ZINC000095377566	218310389	/nfs/dbraw/zinc/31/03/89/218310389.db2.gz	SBBAIYWNTXWUJX-UHFFFAOYSA-N	0	3	332.834	5.331	50	5		EKBAHN
C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1	ZINC000237418884	257945004	/nfs/dbraw/zinc/94/50/04/257945004.db2.gz	PIUNUZCIZNAJIW-CQSZACIVSA-N	0	3	338.432	5.174	50	5		EKBAHN
C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1	ZINC000237568521	564083267	/nfs/dbraw/zinc/08/32/67/564083267.db2.gz	PIUNUZCIZNAJIW-AWEZNQCLSA-N	0	3	338.432	5.174	50	5		EKBAHN