smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC[C@@H](P(=O)([O-])[O-])S(=O)(=O)[O-]	ZINC000013746348	560220303	/nfs/dbraw/zinc/22/03/03/560220303.db2.gz	GAGCDEGBGYUQJJ-UTWGVSKESA-N	-3	3	408.497	4.968	1	0	in-vitro	HJAFHL
CC1(C)[C@@H]2CC[C@@]3(C)Oc4cc(O)c(-c5cc(=O)c6c([O-])cc([O-])cc6o5)cc4[C@@H]1[C@@H]23	ZINC000095912676	291273954	/nfs/dbraw/zinc/27/39/54/291273954.db2.gz	WRBXVJKFKHACHK-VGSGKQCPSA-N	-2	3	420.461	4.878	1	0	biogenic,in-vitro	HJAFHL
CC(C)Oc1cc([O-])cc2oc(-c3ccc([O-])c(Cc4ccccc4)c3)c(O)c(=O)c12	ZINC000085569475	291273802	/nfs/dbraw/zinc/27/38/02/291273802.db2.gz	ZPPARCIQTQYNBW-UHFFFAOYSA-N	-2	3	418.445	4.955	1	0	biogenic,in-vitro	HJAFHL
CC(C)=CCC/C(C)=C/CC/C(C)=C/CCC[C@H](P(=O)([O-])[O-])S(=O)(=O)[O-]	ZINC000013746350	560220292	/nfs/dbraw/zinc/22/02/92/560220292.db2.gz	GAGCDEGBGYUQJJ-ANFLJRJNSA-N	-3	3	408.497	4.968	1	0	in-vitro	HJAFHL