smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C#CCN1C=[NH+][C@H](c2ccc(O)cc2Cl)[C@@H]1c1ccc(O)cc1Cl	ZINC000040420814	581094239	/nfs/dbraw/zinc/09/42/39/581094239.db2.gz	WOXKYLUKPGPICT-MSOLQXFVSA-N	-1	2	361.228	4.164	1	30		FIEFLM
CCCCCCCCCCCC[C@@H]1OC[C@@H](CO[P@@](=O)([O-])O)O1	ZINC000036179257	541108830	/nfs/dbraw/zinc/10/88/30/541108830.db2.gz	RDMIFINBVKZJSN-JKSUJKDBSA-N	-1	2	352.408	4.148	1	30		FIEFLM
CCCCCCCCCCCC[C@@H]1OC[C@@H](CO[P@](=O)([O-])O)O1	ZINC000036179257	541108835	/nfs/dbraw/zinc/10/88/35/541108835.db2.gz	RDMIFINBVKZJSN-JKSUJKDBSA-N	-1	2	352.408	4.148	1	30		FIEFLM
C#CCN1C=[NH+][C@H](c2ccc(O)cc2Cl)[C@H]1c1ccc(O)cc1Cl	ZINC000040420818	581094185	/nfs/dbraw/zinc/09/41/85/581094185.db2.gz	WOXKYLUKPGPICT-QZTJIDSGSA-N	-1	2	361.228	4.164	1	30		FIEFLM
C#CCN1C=[NH+][C@@H](c2ccc(O)cc2Cl)[C@H]1c1ccc(O)cc1Cl	ZINC000040420820	581094308	/nfs/dbraw/zinc/09/43/08/581094308.db2.gz	WOXKYLUKPGPICT-ZWKOTPCHSA-N	-1	2	361.228	4.164	1	30		FIEFLM
Cc1cccc(CCc2cccc(CC=C3C(=O)C(=O)C=C([O-])C3O)c2)c1	ZINC000014951907	581092975	/nfs/dbraw/zinc/09/29/75/581092975.db2.gz	KZIRNWJDVDIAKO-UHFFFAOYSA-N	-1	2	362.425	4.119	1	30		FIEFLM
Cc1cccc(CCc2cccc(CC=C3C(=O)C([O-])=CC(=O)C3O)c2)c1	ZINC000014951907	581092977	/nfs/dbraw/zinc/09/29/77/581092977.db2.gz	KZIRNWJDVDIAKO-UHFFFAOYSA-N	-1	2	362.425	4.119	1	30		FIEFLM
CCCCCCCCCCCC[C@H]1OC[C@@H](CO[P@@](=O)([O-])O)O1	ZINC000036179260	541108868	/nfs/dbraw/zinc/10/88/68/541108868.db2.gz	RDMIFINBVKZJSN-HOTGVXAUSA-N	-1	2	352.408	4.148	1	30		FIEFLM
CCCCCCCCCCCC[C@H]1OC[C@@H](CO[P@](=O)([O-])O)O1	ZINC000036179260	541108872	/nfs/dbraw/zinc/10/88/72/541108872.db2.gz	RDMIFINBVKZJSN-HOTGVXAUSA-N	-1	2	352.408	4.148	1	30		FIEFLM
C#CCN1C=[NH+][C@@H](c2ccc(O)cc2Cl)[C@@H]1c1ccc(O)cc1Cl	ZINC000040420816	581094278	/nfs/dbraw/zinc/09/42/78/581094278.db2.gz	WOXKYLUKPGPICT-ROUUACIJSA-N	-1	2	361.228	4.164	1	30		FIEFLM
CCCCCCCCCCCC[C@@H]1OC[C@H](CO[P@@](=O)([O-])O)O1	ZINC000036179250	541108725	/nfs/dbraw/zinc/10/87/25/541108725.db2.gz	RDMIFINBVKZJSN-HZPDHXFCSA-N	-1	2	352.408	4.148	1	30		FIEFLM
CCCCCCCCCCCC[C@@H]1OC[C@H](CO[P@](=O)([O-])O)O1	ZINC000036179250	541108730	/nfs/dbraw/zinc/10/87/30/541108730.db2.gz	RDMIFINBVKZJSN-HZPDHXFCSA-N	-1	2	352.408	4.148	1	30		FIEFLM
CCCCCCCCCCCC[C@H]1OC[C@H](CO[P@@](=O)([O-])O)O1	ZINC000036179254	541108928	/nfs/dbraw/zinc/10/89/28/541108928.db2.gz	RDMIFINBVKZJSN-CVEARBPZSA-N	-1	2	352.408	4.148	1	30		FIEFLM
CCCCCCCCCCCC[C@H]1OC[C@H](CO[P@](=O)([O-])O)O1	ZINC000036179254	541108933	/nfs/dbraw/zinc/10/89/33/541108933.db2.gz	RDMIFINBVKZJSN-CVEARBPZSA-N	-1	2	352.408	4.148	1	30		FIEFLM