smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc([N-]C(=S)[S-])cc1	2565030	168254218	/nfs/dbraw/zinc/25/42/18/168254218.db2.gz	XKXOWGIMYHPMBF-UHFFFAOYSA-N	-2	0	199.300	2.322	40	0		AEABRL
O=C([O-])CCCc1cccc([S-])c1	2389587	169337070	/nfs/dbraw/zinc/33/70/70/169337070.db2.gz	VWVUFEAWFARFEF-UHFFFAOYSA-N	-2	0	196.271	2.383	40	0	in-vitro	AEABRL
O=C([O-])CCCc1ccc([S-])cc1	2389589	169337382	/nfs/dbraw/zinc/33/73/82/169337382.db2.gz	ONAHWIVUEWOXEJ-UHFFFAOYSA-N	-2	0	196.271	2.383	40	0	in-vitro	AEABRL
O=C([O-])CCCc1ccccc1[S-]	2389586	169337446	/nfs/dbraw/zinc/33/74/46/169337446.db2.gz	BMULCLHAQQPWSF-UHFFFAOYSA-N	-2	0	196.271	2.383	40	0	in-vitro	AEABRL
O=C([O-])c1ccc(Cl)c([S-])c1	39406594	169357419	/nfs/dbraw/zinc/35/74/19/169357419.db2.gz	HBARLEHZOZVEHS-UHFFFAOYSA-N	-2	0	188.635	2.327	40	0		AEABRL
Oc1ccc([N-]C(=S)[S-])cc1	5841350	171018633	/nfs/dbraw/zinc/01/86/33/171018633.db2.gz	RAKAYNJIIQDVAR-UHFFFAOYSA-N	-2	0	185.273	2.019	40	0		AEABRL
O=C([O-])c1cccc2oc(=S)[n-]c12	95761137	171139094	/nfs/dbraw/zinc/13/90/94/171139094.db2.gz	QNPUJYUTYBZIRT-UHFFFAOYSA-N	-2	0	195.199	2.189	40	0		AEABRL