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(O)(Cc1cccc(-c2cccc3c4ccccc4oc32)c1)[P@@](=O)([O-])O	ZINC000016051958	563020757	/nfs/dbraw/zinc/02/07/57/563020757.db2.gz	BYVXAUZOTGITQZ-UHFFFAOYSA-N	-2	2	448.304	3.797	1	0	in-vivo	IHAFLL
O=P([O-])(O)C(O)(Cc1cccc(-c2cccc3c4ccccc4oc32)c1)[P@](=O)([O-])O	ZINC000016051958	563020758	/nfs/dbraw/zinc/02/07/58/563020758.db2.gz	BYVXAUZOTGITQZ-UHFFFAOYSA-N	-2	2	448.304	3.797	1	0	in-vivo	IHAFLL
O=P([O-])(O)C(O)(Cc1ccc(-c2cccc(-c3ccccc3)c2)cc1)[P@@](=O)([O-])O	ZINC000035049975	563089017	/nfs/dbraw/zinc/08/90/17/563089017.db2.gz	IOIMUNCNRCRRFO-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1ccc(-c2cccc(-c3ccccc3)c2)cc1)[P@](=O)([O-])O	ZINC000035049975	563089018	/nfs/dbraw/zinc/08/90/18/563089018.db2.gz	IOIMUNCNRCRRFO-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1ccc(-c2ccc(-c3ccccc3)cc2)cc1)[P@@](=O)([O-])O	ZINC000029057095	563073486	/nfs/dbraw/zinc/07/34/86/563073486.db2.gz	TYDJIXNWTKNODO-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1ccc(-c2ccc(-c3ccccc3)cc2)cc1)[P@](=O)([O-])O	ZINC000029057095	563073487	/nfs/dbraw/zinc/07/34/87/563073487.db2.gz	TYDJIXNWTKNODO-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
O=P([O-])(O)C(O)(CCc1cccc(-c2cccc(-c3ccccc3)c2)c1)[P@@](=O)([O-])O	ZINC000035049973	563088955	/nfs/dbraw/zinc/08/89/55/563088955.db2.gz	QNXXRRXUOVLIQQ-UHFFFAOYSA-N	-2	2	448.348	3.955	1	0		IHAFLL
O=P([O-])(O)C(O)(CCc1cccc(-c2cccc(-c3ccccc3)c2)c1)[P@](=O)([O-])O	ZINC000035049973	563088959	/nfs/dbraw/zinc/08/89/59/563088959.db2.gz	QNXXRRXUOVLIQQ-UHFFFAOYSA-N	-2	2	448.348	3.955	1	0		IHAFLL
Cc1ccc(/C=C(\c2nc3ccccc3s2)C(P(=O)([O-])O)[P@@](=O)([O-])O)cc1	ZINC000040424534	563102940	/nfs/dbraw/zinc/10/29/40/563102940.db2.gz	PTLNOGYDCQLHTC-JLHYYAGUSA-N	-2	2	425.339	3.827	1	0		IHAFLL
Cc1ccc(/C=C(\c2nc3ccccc3s2)C(P(=O)([O-])O)[P@](=O)([O-])O)cc1	ZINC000040424534	563102941	/nfs/dbraw/zinc/10/29/41/563102941.db2.gz	PTLNOGYDCQLHTC-JLHYYAGUSA-N	-2	2	425.339	3.827	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1cccc(-c2ccccc2-c2ccccc2)c1)[P@@](=O)([O-])O	ZINC000035049986	563088970	/nfs/dbraw/zinc/08/89/70/563088970.db2.gz	LCGQOLJUEOSVFW-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1cccc(-c2ccccc2-c2ccccc2)c1)[P@](=O)([O-])O	ZINC000035049986	563088972	/nfs/dbraw/zinc/08/89/72/563088972.db2.gz	LCGQOLJUEOSVFW-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
C/C(=C\CC(P(=O)([O-])O)[P@@](=O)([O-])O)CC/C=C(\C)CNc1ccccc1C(=O)[O-]	ZINC000028713753	563063182	/nfs/dbraw/zinc/06/31/82/563063182.db2.gz	MURKFXDJULFOKR-KIYZNAMYSA-N	-3	2	447.361	3.541	1	0		IHAFLL
C/C(=C\CC(P(=O)([O-])O)[P@](=O)([O-])O)CC/C=C(\C)CNc1ccccc1C(=O)[O-]	ZINC000028713753	563063184	/nfs/dbraw/zinc/06/31/84/563063184.db2.gz	MURKFXDJULFOKR-KIYZNAMYSA-N	-3	2	447.361	3.541	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1cccc(-c2cccc(-c3ccccc3)c2)c1)[P@@](=O)([O-])O	ZINC000016051959	563020818	/nfs/dbraw/zinc/02/08/18/563020818.db2.gz	YXQQNSYZOQHKHD-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0	in-vivo	IHAFLL
O=P([O-])(O)C(O)(Cc1cccc(-c2cccc(-c3ccccc3)c2)c1)[P@](=O)([O-])O	ZINC000016051959	563020819	/nfs/dbraw/zinc/02/08/19/563020819.db2.gz	YXQQNSYZOQHKHD-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0	in-vivo	IHAFLL
O=P([O-])(O)C(O)(CCc1cccc(-c2ccc(-c3ccccc3)cc2)c1)[P@@](=O)([O-])O	ZINC000035049974	563088994	/nfs/dbraw/zinc/08/89/94/563088994.db2.gz	DJYAZHMYLDQUNL-UHFFFAOYSA-N	-2	2	448.348	3.955	1	0		IHAFLL
O=P([O-])(O)C(O)(CCc1cccc(-c2ccc(-c3ccccc3)cc2)c1)[P@](=O)([O-])O	ZINC000035049974	563088996	/nfs/dbraw/zinc/08/89/96/563088996.db2.gz	DJYAZHMYLDQUNL-UHFFFAOYSA-N	-2	2	448.348	3.955	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1ccc(-c2ccccc2-c2ccccc2)cc1)[P@@](=O)([O-])O	ZINC000035049989	563089003	/nfs/dbraw/zinc/08/90/03/563089003.db2.gz	GQDOCMQIUPSEIN-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
O=P([O-])(O)C(O)(Cc1ccc(-c2ccccc2-c2ccccc2)cc1)[P@](=O)([O-])O	ZINC000035049989	563089004	/nfs/dbraw/zinc/08/90/04/563089004.db2.gz	GQDOCMQIUPSEIN-UHFFFAOYSA-N	-2	2	434.321	3.565	1	0		IHAFLL
O=P([O-])(O)C(O)(CCc1cccc(-c2ccccc2-c2ccccc2)c1)[P@@](=O)([O-])O	ZINC000035049987	563089028	/nfs/dbraw/zinc/08/90/28/563089028.db2.gz	LUPZZJDPXCBGRW-UHFFFAOYSA-N	-2	2	448.348	3.955	1	0		IHAFLL
O=P([O-])(O)C(O)(CCc1cccc(-c2ccccc2-c2ccccc2)c1)[P@](=O)([O-])O	ZINC000035049987	563089029	/nfs/dbraw/zinc/08/90/29/563089029.db2.gz	LUPZZJDPXCBGRW-UHFFFAOYSA-N	-2	2	448.348	3.955	1	0		IHAFLL