smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
c1ccn2c(c1)[nH+]c1c2ccc2ccccc12	ZINC000000050690	384455027	/nfs/dbraw/zinc/45/50/27/384455027.db2.gz	BJDLHZXTOXTTGB-UHFFFAOYSA-N	1	2	218.259	3.641	50	5		BHBALO
Cc1cc2[nH+]c3ccccc3n2c2ccccc12	ZINC000001273199	178303445	/nfs/dbraw/zinc/30/34/45/178303445.db2.gz	VPBZGPHGDZYQDE-UHFFFAOYSA-N	1	2	232.286	3.949	50	5		BHBALO
CCc1nc2ccccc2c2[nH+]c3ccccc3n21	ZINC000001403780	172013284	/nfs/dbraw/zinc/01/32/84/172013284.db2.gz	WKUBCDANAQGKKX-UHFFFAOYSA-N	1	2	247.301	3.598	50	5		BHBALO
COc1cccc2[nH+]cc3c4ccccc4[nH]c3c21	ZINC000019910176	368373182	/nfs/dbraw/zinc/37/31/82/368373182.db2.gz	RDJHUARFADFOGE-UHFFFAOYSA-N	1	2	248.285	3.878	50	5		BHBALO
c1ccc2c(c1)[nH+]c(N1CCCC1)c1ccccc21	ZINC000137604628	384539031	/nfs/dbraw/zinc/53/90/31/384539031.db2.gz	WFGNCEDOPKGFRM-UHFFFAOYSA-N	1	2	248.329	3.988	50	5		BHBALO