smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCC1(CCCC)C(=O)C(=C([O-])C(C)C)C(=O)C(=C([O-])C(C)C)C1=O	ZINC000100768545	211390385	/nfs/dbraw/zinc/39/03/85/211390385.db2.gz	YAAYZDBDAVXWFW-UHFFFAOYSA-N	-2	1	378.509	5.010	1	30		GKEFML
CCCCCCCCCC(=O)N[C@@H](c1cccc2ccccc21)P(=O)([O-])[O-]	ZINC000071341888	205283266	/nfs/dbraw/zinc/28/32/66/205283266.db2.gz	QQNUSDSQHYRTKZ-OAQYLSRUSA-N	-2	1	391.448	5.273	1	30		GKEFML
CC1(C)CCC(C)(C)c2cc(C(=O)/C=C/c3ccc(C(=O)[O-])cc3)c([O-])cc21	ZINC000013815302	221290897	/nfs/dbraw/zinc/29/08/97/221290897.db2.gz	COJYSQDHRBWLLU-JXMROGBWSA-N	-2	1	378.468	5.336	1	30		GKEFML
CC(C)=CCC/C(C)=C/Cc1c(O)ccc(C(=O)/C=C\c2ccc(O)cc2)c1O	ZINC000031394551	291144498	/nfs/dbraw/zinc/14/44/98/291144498.db2.gz	LRSMBOSQWGHYCW-XPFYNQGISA-N	-2	1	392.495	5.935	1	30	biogenic,in-vitro	GKEFML