smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(Cl)c(C[C@@H]2c3cc(O)c(Cl)cc3CC[N@@H+]2C)c1	ZINC000045228785	208328381	/nfs/dbraw/zinc/32/83/81/208328381.db2.gz	CIZJWUMBIRRKGW-QGZVFWFLSA-N	-1	2	352.261	4.479	1	0		FIAFLM
COc1ccc(Cl)c(C[C@H]2c3cc(O)c(Cl)cc3CC[N@@H+]2C)c1	ZINC000045228782	208326494	/nfs/dbraw/zinc/32/64/94/208326494.db2.gz	CIZJWUMBIRRKGW-KRWDZBQOSA-N	-1	2	352.261	4.479	1	0		FIAFLM
CC(C)Cc1sc(-c2ccccc2)nc1-c1ccc([P@@](=O)([O-])O)o1	ZINC000066112020	221242016	/nfs/dbraw/zinc/24/20/16/221242016.db2.gz	XDMLNJVXGLKUEC-UHFFFAOYSA-N	-1	2	363.375	4.072	1	0		FIAFLM
CC(C)Cc1sc(-c2ccccc2)nc1-c1ccc([P@](=O)([O-])O)o1	ZINC000066112020	221242019	/nfs/dbraw/zinc/24/20/19/221242019.db2.gz	XDMLNJVXGLKUEC-UHFFFAOYSA-N	-1	2	363.375	4.072	1	0		FIAFLM
Cc1ccccc1S(=O)(=O)Nc1sc(-c2ccccc2)cc1C(=O)[O-]	ZINC000013589566	220077204	/nfs/dbraw/zinc/07/72/04/220077204.db2.gz	KWYHVHVYBREZJX-UHFFFAOYSA-N	-1	2	373.455	4.223	1	0		FIAFLM
CC(C)Cc1sc(-c2cccs2)nc1-c1ccc([P@@](=O)([O-])O)o1	ZINC000066112021	221241993	/nfs/dbraw/zinc/24/19/93/221241993.db2.gz	PLWOWHGZXIBBOZ-UHFFFAOYSA-N	-1	2	369.404	4.133	1	0		FIAFLM
CC(C)Cc1sc(-c2cccs2)nc1-c1ccc([P@](=O)([O-])O)o1	ZINC000066112021	221241995	/nfs/dbraw/zinc/24/19/95/221241995.db2.gz	PLWOWHGZXIBBOZ-UHFFFAOYSA-N	-1	2	369.404	4.133	1	0		FIAFLM