smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=S(=O)(Nc1nc(-c2ccc(Br)cc2)cs1)c1ccccc1	ZINC000005392779	204130825	/nfs/dbraw/zinc/13/08/25/204130825.db2.gz	YMAPIZCESRQBEB-UHFFFAOYSA-N	0	2	395.303	4.373	1	10		GICFLN
O=C([O-])CCc1ccc(-c2ccc(-n3cc[nH+]c3)s2)n1-c1ccc(O)cc1	ZINC000084602092	208093348	/nfs/dbraw/zinc/09/33/48/208093348.db2.gz	KJKMJXDLYNRONJ-UHFFFAOYSA-N	0	2	379.441	4.114	1	10		GICFLN
O=C(Nc1ccc(CCc2ccc(O)c(O)c2)cc1)c1cccc(Cl)c1O	ZINC000096305591	208304459	/nfs/dbraw/zinc/30/44/59/208304459.db2.gz	LDRFMYPQOTVZTR-UHFFFAOYSA-N	0	2	383.831	4.494	1	10		GICFLN
Cc1cc(N)ccc1-n1c(CCC(=O)[O-])ccc1-c1ccc(-n2cc[nH+]c2)cc1	ZINC000084614837	211170462	/nfs/dbraw/zinc/17/04/62/211170462.db2.gz	HRLGGBLFSBCNIV-UHFFFAOYSA-N	0	2	386.455	4.238	1	10		GICFLN
CCCC/C=C/c1c(O)cc2c(c1O)C(=O)c1c(O)c(Cl)c(O)cc1C2=O	ZINC000084690417	222321879	/nfs/dbraw/zinc/32/18/79/222321879.db2.gz	VBCIGIPAGWIVFH-AATRIKPKSA-N	0	2	388.803	4.141	1	10		GICFLN
O=C(OCc1ccccc1)c1sc2c(cc(O)c(O)c2[N+](=O)[O-])c1Cl	ZINC000049068034	581096409	/nfs/dbraw/zinc/09/64/09/581096409.db2.gz	OCQZLJSJWBLRML-UHFFFAOYSA-N	0	2	379.777	4.231	1	10		GICFLN
Cc1cc(O)ccc1-n1c(CCC(=O)[O-])ccc1-c1ccc(-n2cc[nH+]c2)cc1	ZINC000084603499	222318492	/nfs/dbraw/zinc/31/84/92/222318492.db2.gz	MZLPSUVHDZWHFV-UHFFFAOYSA-N	0	2	387.439	4.361	1	10		GICFLN
O=S(=O)(Nc1nc(-c2ccccc2Br)cs1)c1ccccc1	ZINC000095563120	222356383	/nfs/dbraw/zinc/35/63/83/222356383.db2.gz	WYSRMXADGCJJRG-UHFFFAOYSA-N	0	2	395.303	4.373	1	10		GICFLN