smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@H](C(=O)[O-])c1ccccc1S	98087648	167590927	/nfs/dbraw/zinc/59/09/27/167590927.db2.gz	DBWIVWFUXQEUGV-ZETCQYMHSA-N	-1	2	196.271	2.554	10	0		AFAELM
S=c1[n-]c2cc(S)ccc2s1	22002138	171041307	/nfs/dbraw/zinc/04/13/07/171041307.db2.gz	MLKBUBXJSUWJKU-UHFFFAOYSA-N	-1	2	199.325	2.874	10	0		AFAELM
S=c1[n-]c2c(S)cccc2s1	89195230	171132933	/nfs/dbraw/zinc/13/29/33/171132933.db2.gz	JFISFZKKYWLPPP-UHFFFAOYSA-N	-1	2	199.325	2.874	10	0		AFAELM
Cc1cc(C)cc(NC(=S)[S-])c1	238549298	573866279	/nfs/dbraw/zinc/86/62/79/573866279.db2.gz	BWUIRKDACNTGEM-UHFFFAOYSA-N	-1	2	197.328	2.930	10	0		AFAELM
CC(C)c1ccc(C(=O)[O-])c(S)c1	669372283	538442526	/nfs/dbraw/zinc/44/25/26/538442526.db2.gz	MFZYLLRHOGKDHD-UHFFFAOYSA-N	-1	2	196.271	2.797	10	0		AFAELM
Cc1cccc(NC(=S)[S-])c1C	238533834	573838957	/nfs/dbraw/zinc/83/89/57/573838957.db2.gz	PJARIYGRVGWYSQ-UHFFFAOYSA-N	-1	2	197.328	2.930	10	0		AFAELM
CC(C)c1cccc(C(=O)[O-])c1S	39149024	571905159	/nfs/dbraw/zinc/90/51/59/571905159.db2.gz	WIUYFRZMOAECIZ-UHFFFAOYSA-N	-1	2	196.271	2.797	10	0		AFAELM
S=c1[n-]c2ccc(S)cc2s1	34704210	572106128	/nfs/dbraw/zinc/10/61/28/572106128.db2.gz	DODLCEKJZVKBIT-UHFFFAOYSA-N	-1	2	199.325	2.874	10	0		AFAELM
CCc1ccc(O)c([S-])c1S	238283265	573136812	/nfs/dbraw/zinc/13/68/12/573136812.db2.gz	YZXQNBDEEHMFKQ-UHFFFAOYSA-N	-1	2	186.301	2.532	10	0		AFAELM
CCc1ccc(O)c(S)c1[S-]	238283265	573136819	/nfs/dbraw/zinc/13/68/19/573136819.db2.gz	YZXQNBDEEHMFKQ-UHFFFAOYSA-N	-1	2	186.301	2.532	10	0		AFAELM
[S-]c1ccc(S)cc1Cl	117663423	573355087	/nfs/dbraw/zinc/35/50/87/573355087.db2.gz	JVFRSKZYNIRVCN-UHFFFAOYSA-N	-1	2	176.693	2.917	10	0		AFAELM
[S-]c1ccc(S)c(Cl)c1	117663423	573355093	/nfs/dbraw/zinc/35/50/93/573355093.db2.gz	JVFRSKZYNIRVCN-UHFFFAOYSA-N	-1	2	176.693	2.917	10	0		AFAELM
Cc1ccc(C)c(NC(=S)[S-])c1	238454408	573626599	/nfs/dbraw/zinc/62/65/99/573626599.db2.gz	LZCPMYAKRCATBB-UHFFFAOYSA-N	-1	2	197.328	2.930	10	0		AFAELM
Cc1cc(O)c([S-])c(C)c1S	238472692	573660990	/nfs/dbraw/zinc/66/09/90/573660990.db2.gz	UWMKNNYMNGITRU-UHFFFAOYSA-N	-1	2	186.301	2.586	10	0		AFAELM
Cc1cc(O)c(S)c(C)c1[S-]	238472692	573660997	/nfs/dbraw/zinc/66/09/97/573660997.db2.gz	UWMKNNYMNGITRU-UHFFFAOYSA-N	-1	2	186.301	2.586	10	0		AFAELM