smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCCCCCCCCC(=O)O[C@H](CO)COP(=O)([O-])[O-]	ZINC000040165178	571759202	/nfs/dbraw/zinc/75/92/02/571759202.db2.gz	LPQBQFLKBCPNAV-GOSISDBHSA-N	-2	0	410.488	4.481	10	30	endogenous,in-man	HIEERL
CCCCCCCC(=O)OC[C@@H](COP(=O)([O-])[O-])OC(=O)CCCCCCC	ZINC000036178999	541108505	/nfs/dbraw/zinc/10/85/05/541108505.db2.gz	XYSBQYUENLDGMI-KRWDZBQOSA-N	-2	0	424.471	4.272	10	30		HIEERL
CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)([O-])[O-])NC(C)=O	ZINC000056870937	519985211	/nfs/dbraw/zinc/98/52/11/519985211.db2.gz	HWPZKJVGDYNEAW-QUDYQQOWSA-N	-2	0	421.515	4.219	10	30	in-vitro	HIEERL
CCCCCCCCCCCCCCCC(=O)OC[C@H](O)COP(=O)([O-])[O-]	ZINC000008218993	557776438	/nfs/dbraw/zinc/77/64/38/557776438.db2.gz	YNDYKPRNFWPPFU-SFHVURJKSA-N	-2	0	410.488	4.481	10	30	in-vitro	HIEERL
[N-]=[N+]=Nc1ccc(C=Cc2ccc(N=[N+]=[N-])cc2S(=O)(=O)[O-])c(S(=O)(=O)[O-])c1	ZINC000031302698	526391688	/nfs/dbraw/zinc/39/16/88/526391688.db2.gz	XHPWRTXYJFNZAW-UPHRSURJSA-N	-2	0	422.404	4.234	10	30		HIEERL
CCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCC	ZINC000036179002	541108699	/nfs/dbraw/zinc/10/86/99/541108699.db2.gz	XYSBQYUENLDGMI-QGZVFWFLSA-N	-2	0	424.471	4.272	10	30	in-vitro	HIEERL