smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCNC(=S)NN=c1nc(N2CCOCC2)nc(N2CCOCC2)[n-]1	ZINC000006073515	212080910	/nfs/dbraw/zinc/08/09/10/212080910.db2.gz	OKUIGRQBEPJUEJ-UHFFFAOYSA-N	-1	3	380.478	-0.478	50	30		GBEAHM
CC1(C)O[C@H]2[C@@H](O1)[C@@H](n1cnc3c1nc[n-]c3=O)O[C@H]2COS(C)(=O)=O	ZINC000034201462	520613343	/nfs/dbraw/zinc/61/33/43/520613343.db2.gz	BIHMALHFZFJBCY-YTDXRRJTSA-N	-1	3	386.386	-0.487	50	30	biogenic	GBEAHM
Nc1[nH]c(=O)[n-]c(=O)c1N=Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000100846327	526840124	/nfs/dbraw/zinc/84/01/24/526840124.db2.gz	ILIIWLNAPNZMRR-YBFXNURJSA-N	-1	3	380.386	-0.504	50	30		GBEAHM
CC1(C)O[C@@H]2[C@H](COS(C)(=O)=O)O[C@@H](n3cnc4c3nc[n-]c4=O)[C@H]2O1	ZINC000105611076	570930720	/nfs/dbraw/zinc/93/07/20/570930720.db2.gz	BIHMALHFZFJBCY-ZLGIUQBVSA-N	-1	3	386.386	-0.074	50	30	biogenic	GBEAHM
CC1(C)O[C@@H]2[C@H](COS(C)(=O)=O)O[C@H](n3cnc4c3nc[n-]c4=O)[C@H]2O1	ZINC000105611080	570930694	/nfs/dbraw/zinc/93/06/94/570930694.db2.gz	BIHMALHFZFJBCY-DTITTZBUSA-N	-1	3	386.386	-0.074	50	30	biogenic	GBEAHM