smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCNC(=O)c1noc2c1C[N@H+](Cc1cc(Cl)c(O)cc1O)CC2	ZINC000169311782	206251050	/nfs/dbraw/zinc/25/10/50/206251050.db2.gz	QEUHHJSQQWEODS-UHFFFAOYSA-N	1	2	351.790	2.047	1	10		FECFLO
CCNC(=O)c1noc2c1C[N@@H+](Cc1cc(Cl)c(O)cc1O)CC2	ZINC000169311782	206251055	/nfs/dbraw/zinc/25/10/55/206251055.db2.gz	QEUHHJSQQWEODS-UHFFFAOYSA-N	1	2	351.790	2.047	1	10		FECFLO
CC1=C(C(=O)N2CC[NH+](CCO)CC2)Sc2cc(Cl)ccc2N1	ZINC000103220021	222326769	/nfs/dbraw/zinc/32/67/69/222326769.db2.gz	QJIXREXQJCGLET-UHFFFAOYSA-N	1	2	353.875	2.226	1	10		FECFLO
COc1cc(N(C)Cc2cccc3[nH+]c(N)nc(N)c23)cc(OC)c1OC	ZINC000013740541	211056585	/nfs/dbraw/zinc/05/65/85/211056585.db2.gz	RJJKDQLFIKMANF-UHFFFAOYSA-N	1	2	369.425	2.456	1	10		FECFLO