smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc(N[C@H](c2ccc(C(C)C)cc2)[P@](=O)([O-])O)c1	ZINC000012526546	563797438	/nfs/dbraw/zinc/79/74/38/563797438.db2.gz	XNJSPVRQWUYJHT-KRWDZBQOSA-N	-2	1	319.341	4.407	50	0		DIAAML
Cc1cccc(N[C@H](c2ccc(C(C)C)cc2)P(=O)([O-])[O-])c1	ZINC000012526546	563797440	/nfs/dbraw/zinc/79/74/40/563797440.db2.gz	XNJSPVRQWUYJHT-KRWDZBQOSA-N	-2	1	319.341	4.407	50	0		DIAAML
CCc1ccc(N[C@@H](c2ccc(C)cc2C)P(=O)([O-])[O-])cc1	ZINC000012540645	563800018	/nfs/dbraw/zinc/80/00/18/563800018.db2.gz	ZRNHPTWDBAZALF-QGZVFWFLSA-N	-2	1	319.341	4.154	50	0		DIAAML
Cc1ccc(C(O)=CC(=O)c2ccc3ccccc3c2[O-])cc1	ZINC000100811524	563603060	/nfs/dbraw/zinc/60/30/60/563603060.db2.gz	OFLYODVLPDSQIN-UHFFFAOYSA-N	-2	1	304.345	4.310	50	0		DIAAML
Cc1cccc(N[C@@H](c2ccc(C(C)C)cc2)[P@](=O)([O-])O)c1	ZINC000012526547	563797829	/nfs/dbraw/zinc/79/78/29/563797829.db2.gz	XNJSPVRQWUYJHT-QGZVFWFLSA-N	-2	1	319.341	4.407	50	0		DIAAML
Cc1cccc(N[C@@H](c2ccc(C(C)C)cc2)P(=O)([O-])[O-])c1	ZINC000012526547	563797831	/nfs/dbraw/zinc/79/78/31/563797831.db2.gz	XNJSPVRQWUYJHT-QGZVFWFLSA-N	-2	1	319.341	4.407	50	0		DIAAML
O=C1[N-]C(=S)SC1=Cc1cc(Cl)c([O-])c(Cl)c1	ZINC000017124084	182076394	/nfs/dbraw/zinc/07/63/94/182076394.db2.gz	GSJQEDCPPJYLPN-CLTKARDFSA-N	-2	1	306.195	4.028	50	0		DIAAML
COc1ccc(C([O-])=CC(=O)c2ccc3ccccc3c2[O-])cc1	ZINC000003984263	181060777	/nfs/dbraw/zinc/06/07/77/181060777.db2.gz	JRHSIUOBVWRNOS-UHFFFAOYSA-N	-2	1	320.344	4.010	50	0	biogenic	DIAAML
CC(C)c1ccc(N[C@H](c2cccc(F)c2)P(=O)([O-])[O-])cc1	ZINC000024769747	182391110	/nfs/dbraw/zinc/39/11/10/182391110.db2.gz	DXCNJARZTPCTIW-INIZCTEOSA-N	-2	1	323.304	4.238	50	0		DIAAML
CCc1ccc(N[C@H](c2ccc(C)cc2C)P(=O)([O-])[O-])cc1	ZINC000012540647	563799985	/nfs/dbraw/zinc/79/99/85/563799985.db2.gz	ZRNHPTWDBAZALF-KRWDZBQOSA-N	-2	1	319.341	4.154	50	0		DIAAML
CC(C)c1ccc(N[C@@H](c2cccc(F)c2)P(=O)([O-])[O-])cc1	ZINC000024769738	182390770	/nfs/dbraw/zinc/39/07/70/182390770.db2.gz	DXCNJARZTPCTIW-MRXNPFEDSA-N	-2	1	323.304	4.238	50	0		DIAAML