smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ccc(OP(=O)([O-])[O-])cc1	2558168	169292297	/nfs/dbraw/zinc/29/22/97/169292297.db2.gz	FXZCCINCKDATPA-UHFFFAOYSA-N	-2	0	189.107	0.740	50	10	in-vitro	ACCARL
O=C([O-])c1cc(O)c([O-])c([N+](=O)[O-])c1	27977563	169356613	/nfs/dbraw/zinc/35/66/13/169356613.db2.gz	HDPSONAKHMNQPA-UHFFFAOYSA-N	-2	0	199.118	0.704	50	10		ACCARL
O=C([O-])c1ccc(C(=O)[O-])c(O)c1O	337530	169357705	/nfs/dbraw/zinc/35/77/05/169357705.db2.gz	OHLSHRJUBRUKAN-UHFFFAOYSA-N	-2	0	198.130	0.494	50	10	in-vitro	ACCARL
O=C([O-])c1cc(O)c(O)cc1C(=O)[O-]	901686	342941964	/nfs/dbraw/zinc/94/19/64/342941964.db2.gz	YZBCICVNBHNLTK-UHFFFAOYSA-N	-2	0	198.130	0.494	50	10	in-vitro	ACCARL
O=Cc1cc(C=O)c([O-])c(O)c1[O-]	75575830	371649149	/nfs/dbraw/zinc/64/91/49/371649149.db2.gz	RUJNFDVEPQRMOS-UHFFFAOYSA-N	-2	0	182.131	0.428	50	10		ACCARL