smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=P([O-])(O)C(CCCCOc1nonc1S(=O)(=O)c1ccccc1)[P@](=O)([O-])O	ZINC000049069681	563201106	/nfs/dbraw/zinc/20/11/06/563201106.db2.gz	MMZZEFWKJCYZRC-UHFFFAOYSA-N	-2	2	456.306	1.133	1	0		JDAFLL
O=P([O-])(O)C(CCCCOc1nonc1S(=O)(=O)c1ccccc1)[P@@](=O)([O-])O	ZINC000049069681	563201107	/nfs/dbraw/zinc/20/11/07/563201107.db2.gz	MMZZEFWKJCYZRC-UHFFFAOYSA-N	-2	2	456.306	1.133	1	0		JDAFLL
C[C@H](Cc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)CC1=Nc2c(=O)nc(N)[nH]c2NC1	ZINC000028260694	563059444	/nfs/dbraw/zinc/05/94/44/563059444.db2.gz	BLLHPJWVVWYMOU-ABAIWWIYSA-N	-2	2	470.486	1.167	1	0		JDAFLL
CCCCCNC(=O)[C@H](Cc1ccc(CC(C(=O)[O-])C(=O)O)cc1)NC(=O)CCC(=O)[O-]	ZINC000013472225	562965733	/nfs/dbraw/zinc/96/57/33/562965733.db2.gz	YARZODACZZOYEL-KRWDZBQOSA-N	-2	2	450.488	1.213	1	0		JDAFLL
C[C@@H](Cc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)CC1=Nc2c(=O)nc(N)[nH]c2NC1	ZINC000028260700	563059393	/nfs/dbraw/zinc/05/93/93/563059393.db2.gz	BLLHPJWVVWYMOU-NHYWBVRUSA-N	-2	2	470.486	1.167	1	0		JDAFLL
C[C@H](Cc1ccc(C(=O)N[C@H](CCC(=O)[O-])C(=O)[O-])cc1)CC1=Nc2c(=O)nc(N)[nH]c2NC1	ZINC000028260706	563059410	/nfs/dbraw/zinc/05/94/10/563059410.db2.gz	BLLHPJWVVWYMOU-IAQYHMDHSA-N	-2	2	470.486	1.167	1	0		JDAFLL
CCCCCNC(=O)[C@@H](Cc1ccc(O/C(=C/C(=O)O)C(=O)[O-])cc1)NC(=O)CCC(=O)[O-]	ZINC000027708801	563049622	/nfs/dbraw/zinc/04/96/22/563049622.db2.gz	ZPRUFKVRBMDPEA-VAFHRPCXSA-N	-2	2	464.471	1.317	1	0		JDAFLL
C[C@@H](Cc1ccc(C(=O)N[C@H](CCC(=O)[O-])C(=O)[O-])cc1)CC1=Nc2c(=O)nc(N)[nH]c2NC1	ZINC000028260712	563059449	/nfs/dbraw/zinc/05/94/49/563059449.db2.gz	BLLHPJWVVWYMOU-XHDPSFHLSA-N	-2	2	470.486	1.167	1	0		JDAFLL
CCCCCNC(=O)[C@@H](Cc1ccc(CC(C(=O)[O-])C(=O)O)cc1)NC(=O)CCC(=O)[O-]	ZINC000027710201	563049745	/nfs/dbraw/zinc/04/97/45/563049745.db2.gz	YARZODACZZOYEL-QGZVFWFLSA-N	-2	2	450.488	1.213	1	0		JDAFLL
CCCCCNC(=O)[C@H](Cc1ccc(O/C(=C/C(=O)O)C(=O)[O-])cc1)NC(=O)CCC(=O)[O-]	ZINC000013472221	562965742	/nfs/dbraw/zinc/96/57/42/562965742.db2.gz	ZPRUFKVRBMDPEA-YKBBIGDRSA-N	-2	2	464.471	1.317	1	0		JDAFLL
Cc1ccccc1S(=O)(=O)[N-]C(=O)Nc1cscc1-c1nc(C(=O)[O-])c(O)c(=O)[nH]1	ZINC000003582324	562927262	/nfs/dbraw/zinc/92/72/62/562927262.db2.gz	DJROWLQHGZHAGX-UHFFFAOYSA-N	-2	2	450.454	1.721	1	0		JDAFLL