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@@H](C)C([O-])=C1C(=O)[C@@H](CC=C(C)C)C(=O)[C@@](O)(CC=C(C)C)C1=O	ZINC000005424425	204208712	/nfs/dbraw/zinc/20/87/12/204208712.db2.gz	VISQWZWNDCYFMY-PZPWOCDFSA-N	-1	2	362.466	3.625	1	30	endogenous,in-man	FHEFLM
CCCCCCCC(=O)N[C@H](c1ccccc1)[C@@H](C)O[P@@](=O)([O-])O	ZINC000043443333	205101913	/nfs/dbraw/zinc/10/19/13/205101913.db2.gz	FPDRUQTXTISTSU-PBHICJAKSA-N	-1	2	357.387	3.702	1	30		FHEFLM
CCCCCCCC(=O)N[C@H](c1ccccc1)[C@@H](C)O[P@](=O)([O-])O	ZINC000043443333	205101918	/nfs/dbraw/zinc/10/19/18/205101918.db2.gz	FPDRUQTXTISTSU-PBHICJAKSA-N	-1	2	357.387	3.702	1	30		FHEFLM
CC(C)=CC[C@H]1C(=O)[C@@](O)(CC=C(C)C)C(=O)C(C(=O)CC(C)C)=C1[O-]	ZINC000100017262	560053882	/nfs/dbraw/zinc/05/38/82/560053882.db2.gz	IEHWDPKFDXJDJL-VFNWGFHPSA-N	-1	2	362.466	3.625	1	30	biogenic,in-vitro	FHEFLM
CC[C@H](C)C([O-])=C1C(=O)[C@H](CC=C(C)C)C(=O)[C@@](O)(CC=C(C)C)C1=O	ZINC000100772820	571817226	/nfs/dbraw/zinc/81/72/26/571817226.db2.gz	VISQWZWNDCYFMY-GXZWQRSESA-N	-1	2	362.466	3.625	1	30	endogenous,in-man	FHEFLM
CC[C@H](C)C([O-])=C1C(=O)[C@@H](CC=C(C)C)C(=O)[C@@](O)(CC=C(C)C)C1=O	ZINC000005424463	204208303	/nfs/dbraw/zinc/20/83/03/204208303.db2.gz	VISQWZWNDCYFMY-ZSDSOXJFSA-N	-1	2	362.466	3.625	1	30	endogenous,in-man	FHEFLM
CC[C@@H](C)C([O-])=C1C(=O)[C@H](CC=C(C)C)C(=O)[C@](O)(CC=C(C)C)C1=O	ZINC000100124797	209208540	/nfs/dbraw/zinc/20/85/40/209208540.db2.gz	VISQWZWNDCYFMY-LRAJWGHMSA-N	-1	2	362.466	3.625	1	30	in-man	FHEFLM
CCCCCCCC(=O)N(C)[C@@H](CO[P@@](=O)([O-])O)c1ccccc1	ZINC000043443226	208304499	/nfs/dbraw/zinc/30/44/99/208304499.db2.gz	XULFVBZQZLYSMA-INIZCTEOSA-N	-1	2	357.387	3.656	1	30		FHEFLM
CCCCCCCC(=O)N(C)[C@@H](CO[P@](=O)([O-])O)c1ccccc1	ZINC000043443226	208304504	/nfs/dbraw/zinc/30/45/04/208304504.db2.gz	XULFVBZQZLYSMA-INIZCTEOSA-N	-1	2	357.387	3.656	1	30		FHEFLM
CC(C)=CC[C@@H]1C(=O)[C@@](O)(CC=C(C)C)C(=O)C(C(=O)CC(C)C)=C1[O-]	ZINC000100017267	210243042	/nfs/dbraw/zinc/24/30/42/210243042.db2.gz	IEHWDPKFDXJDJL-BTYIYWSLSA-N	-1	2	362.466	3.625	1	30	biogenic,in-vitro	FHEFLM
CC[C@@H](C)C([O-])=C1C(=O)[C@H](CC=C(C)C)C(=O)[C@@](O)(CC=C(C)C)C1=O	ZINC000100772819	571817036	/nfs/dbraw/zinc/81/70/36/571817036.db2.gz	VISQWZWNDCYFMY-WIEQDCTASA-N	-1	2	362.466	3.625	1	30	endogenous,in-man	FHEFLM
CC[C@H](C)C([O-])=C1C(=O)[C@@H](CC=C(C)C)C(=O)[C@](O)(CC=C(C)C)C1=O	ZINC000005424462	574412498	/nfs/dbraw/zinc/41/24/98/574412498.db2.gz	VISQWZWNDCYFMY-PDSXEYIOSA-N	-1	2	362.466	3.625	1	30	endogenous,in-man	FHEFLM
CC[C@H](C)C([O-])=C1C(=O)[C@H](CC=C(C)C)C(=O)[C@](O)(CC=C(C)C)C1=O	ZINC000100124803	574417238	/nfs/dbraw/zinc/41/72/38/574417238.db2.gz	VISQWZWNDCYFMY-VFCRVFHLSA-N	-1	2	362.466	3.625	1	30	endogenous,in-man	FHEFLM