smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccccc1Nc1cc(C)[nH+]c2c3ccccc3ccc12	ZINC000000120885	563571711	/nfs/dbraw/zinc/57/17/11/563571711.db2.gz	ZFRJSOYCKAZKSE-UHFFFAOYSA-N	1	1	314.388	5.449	50	5		DKBAMO
COc1ccc(Nc2cc(C)[nH+]c3c4ccccc4ccc23)cc1	ZINC000000136885	563572002	/nfs/dbraw/zinc/57/20/02/563572002.db2.gz	NWQRKFXTZYRQRV-UHFFFAOYSA-N	1	1	314.388	5.449	50	5		DKBAMO
c1ccc2[nH+]c(NCc3c4ccccc4cc4ccccc43)[nH]c2c1	ZINC000004613349	181129823	/nfs/dbraw/zinc/12/98/23/181129823.db2.gz	QSMXDVNPILOGTF-UHFFFAOYSA-N	1	1	323.399	5.481	50	5		DKBAMO
Cc1cc(Nc2ccc(Cl)cc2)c2ccc3ccccc3c2[nH+]1	ZINC000005721949	181277235	/nfs/dbraw/zinc/27/72/35/181277235.db2.gz	GYVADWYDAKHFPA-UHFFFAOYSA-N	1	1	318.807	6.093	50	5		DKBAMO
Cc1cc(Nc2cccc(Cl)c2)c2ccc3ccccc3c2[nH+]1	ZINC000006545663	181352492	/nfs/dbraw/zinc/35/24/92/181352492.db2.gz	GVAOJKPYMWPKAM-UHFFFAOYSA-N	1	1	318.807	6.093	50	5		DKBAMO
CCCC[N@@H+](CC)Cc1c(C)[nH]c2c3ccccc3ccc2c1=O	ZINC000008572538	563949250	/nfs/dbraw/zinc/94/92/50/563949250.db2.gz	KEUVVAPIVWIGCE-UHFFFAOYSA-N	1	1	322.452	5.024	50	5		DKBAMO