smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)OCC[C@@H]1c2c(cc3c(c2O)C(=O)c2c(O)cc(O)cc2C3=O)O[C@H]1O	ZINC000005161406	560201101	/nfs/dbraw/zinc/20/11/01/560201101.db2.gz	DYJNRRXQVSJBAA-GSDQLPOLSA-N	0	1	400.339	1.326	1	10	in-vitro	HDCFMN
CC(=O)OCC[C@H]1c2c(cc3c(c2O)C(=O)c2c(O)cc(O)cc2C3=O)O[C@H]1O	ZINC000005161412	560201114	/nfs/dbraw/zinc/20/11/14/560201114.db2.gz	DYJNRRXQVSJBAA-GWNMQOMSSA-N	0	1	400.339	1.326	1	10	in-vitro	HDCFMN
Nc1ccc(CC[C@]2(CO)Oc3cc4oc(CO)cc(=O)c4c(O)c3C[C@H]2O)cc1	ZINC000085593579	291199443	/nfs/dbraw/zinc/19/94/43/291199443.db2.gz	KWBZIBLPBRWJGM-DENIHFKCSA-N	0	1	413.426	1.233	1	10	biogenic,in-vitro	HDCFMN
CC(=O)OCC[C@@H]1c2c(cc3c(c2O)C(=O)c2c(O)cc(O)cc2C3=O)O[C@@H]1O	ZINC000005161404	560201143	/nfs/dbraw/zinc/20/11/43/560201143.db2.gz	DYJNRRXQVSJBAA-YBYGRFCBSA-N	0	1	400.339	1.326	1	10	in-vitro	HDCFMN
COc1cc(CC[C@@H](O)CC(=O)CCc2ccc(O)c(OCN)c2)cc(O)c1O	ZINC000085625553	291195910	/nfs/dbraw/zinc/19/59/10/291195910.db2.gz	UZNKGJJKXAZCCY-MRXNPFEDSA-N	0	1	405.447	1.993	1	10	biogenic,in-vitro	HDCFMN