smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCc1cc([N-]S(=O)(=O)c2cc(C)cc(F)c2)n[nH]1	ZINC000159938620	432701360	/nfs/dbraw/zinc/70/13/60/432701360.db2.gz	QIQSEGRTSVOYSH-UHFFFAOYSA-N	-1	0	311.382	3.001	50	70		DGIARM
Cc1nc2sc([C@@H](c3ccsc3)N3CCCC3)c([O-])n2n1	ZINC000218610763	257273899	/nfs/dbraw/zinc/27/38/99/257273899.db2.gz	JIMJMWYCCOFKOI-LLVKDONJSA-N	-1	0	320.443	3.052	50	70		DGIARM
[O-]c1c([C@H](c2ccsc2)[NH+]2CCCCC2)sc2ncnn12	ZINC000218459492	432657598	/nfs/dbraw/zinc/65/75/98/432657598.db2.gz	CXMBMSDURHGBCF-NSHDSACASA-N	-1	0	320.443	3.133	50	70		DGIARM
Cc1nc2sc([C@H](c3ccsc3)N3CCCC3)c([O-])n2n1	ZINC000218610845	257273934	/nfs/dbraw/zinc/27/39/34/257273934.db2.gz	JIMJMWYCCOFKOI-NSHDSACASA-N	-1	0	320.443	3.052	50	70		DGIARM
CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(F)cn2)s1	ZINC000160352957	432716250	/nfs/dbraw/zinc/71/62/50/432716250.db2.gz	ZCGUBZBFLLHVFT-UHFFFAOYSA-N	-1	0	314.407	3.381	50	70		DGIARM
[O-]c1c([C@@H](c2ccsc2)[NH+]2CCCCC2)sc2ncnn12	ZINC000218459402	432659088	/nfs/dbraw/zinc/65/90/88/432659088.db2.gz	CXMBMSDURHGBCF-LLVKDONJSA-N	-1	0	320.443	3.133	50	70		DGIARM
Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccn2nccc2c1	ZINC000217961723	432659194	/nfs/dbraw/zinc/65/91/94/432659194.db2.gz	VJIXJLLQKJWKCD-UHFFFAOYSA-N	-1	0	321.789	3.097	50	70		DGIARM