smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(/C=C/c1cc(O)ccc1O)c1ccc([O-])cc1[O-]	ZINC000039023199	174161948	/nfs/dbraw/zinc/16/19/48/174161948.db2.gz	SCYSZHQHDOOZQM-ORCRQEGFSA-N	-2	3	272.256	2.405	1	30		CEEFHL
O=C1c2ccc([O-])cc2O/C1=C\c1cc(O)c([O-])c(O)c1	ZINC000072177204	176334372	/nfs/dbraw/zinc/33/43/72/176334372.db2.gz	SBVOOJGJEOGEBY-ACAGNQJTSA-N	-2	3	286.239	2.125	1	30	in-vitro	CEEFHL
O=C(/C=C1\C(=O)Nc2ccccc21)c1ccc([O-])cc1[O-]	ZINC000071330053	176124530	/nfs/dbraw/zinc/12/45/30/176124530.db2.gz	FWSWDXQVXDSDAX-WQLSENKSSA-N	-2	3	281.267	2.316	1	30		CEEFHL
CC(=O)N([O-])CC[C@H]1c2ccccc2CO[P@@]1(=O)[O-]	ZINC000072108182	176317066	/nfs/dbraw/zinc/31/70/66/176317066.db2.gz	STZOZLTXXYHYPZ-LBPRGKRZSA-N	-2	3	285.236	2.071	1	30		CEEFHL
CCCCCCCCC(P(=O)([O-])[O-])P(=O)([O-])[O-]	ZINC000034803925	581096809	/nfs/dbraw/zinc/09/68/09/581096809.db2.gz	OZKFUXZUWPRXHB-UHFFFAOYSA-N	-4	3	288.217	2.419	1	30		CEEFHL
CC(=O)N([O-])CC[C@@H]1c2ccccc2CO[P@@]1(=O)[O-]	ZINC000072108181	176317314	/nfs/dbraw/zinc/31/73/14/176317314.db2.gz	STZOZLTXXYHYPZ-GFCCVEGCSA-N	-2	3	285.236	2.071	1	30		CEEFHL