smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#C/C(=C\c1ccc(C(=O)[O-])cc1)S(=O)(=O)c1ccc(Cl)cc1	ZINC000000111932	956860971	/nfs/dbraw/zinc/86/09/71/956860971.db2.gz	LLIDUTGPHCGJJX-OQLLNIDSSA-N	-1	0	347.779	3.377	50	50		EGGARM
C[C@@H](Oc1ccc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc1)C(=O)[O-]	ZINC000004740730	956870424	/nfs/dbraw/zinc/87/04/24/956870424.db2.gz	UJTQLOVNAOXUFE-XTCQQWIJSA-N	-1	0	333.347	3.479	50	50		EGGARM
Cc1cccc(NC(=O)/C(C#N)=C\c2ccc(OCC(=O)[O-])cc2)c1	ZINC000004723657	956871208	/nfs/dbraw/zinc/87/12/08/956871208.db2.gz	QZUYJPFSKWLJEV-GDNBJRDFSA-N	-1	0	336.347	3.004	50	50		EGGARM
CCOc1ccc(NC(=O)/C(C#N)=C/c2ccc(C(=O)[O-])cc2)cc1	ZINC000004705171	948772354	/nfs/dbraw/zinc/77/23/54/948772354.db2.gz	LJALXTXDAJZKLD-RVDMUPIBSA-N	-1	0	336.347	3.329	50	50		EGGARM
C[C@H](Oc1ccc(/C=C(/C#N)c2nc3ccccc3[nH]2)cc1)C(=O)[O-]	ZINC000004740729	956870667	/nfs/dbraw/zinc/87/06/67/956870667.db2.gz	UJTQLOVNAOXUFE-GVIGZQTCSA-N	-1	0	333.347	3.479	50	50		EGGARM
Cc1ccc(S(=O)(=O)/C(C#N)=C\c2ccc(C(=O)[O-])cc2)cc1	ZINC000031783761	967501819	/nfs/dbraw/zinc/50/18/19/967501819.db2.gz	WLNMTKOSGCMDHZ-YBEGLDIGSA-N	-1	0	327.361	3.032	50	50		EGGARM
O=C([O-])c1ccccc1C(=O)NNc1ccc(Cl)cc1Cl	ZINC000002569419	956866105	/nfs/dbraw/zinc/86/61/05/956866105.db2.gz	VJBDXJJENVZVMA-UHFFFAOYSA-N	-1	0	325.151	3.449	50	50		EGGARM