smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1c2ccccc2C(=O)C(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)=C1[O-]	ZINC000004776109	482822125	/nfs/dbraw/zinc/82/21/25/482822125.db2.gz	ZPZGPVPZOQHNJA-CMWIYATHSA-N	-1	0	352.295	-1.348	40	30		FAEBRM
O=C1c2ccccc2C(=O)C(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)=C1[O-]	ZINC000004776110	207047461	/nfs/dbraw/zinc/04/74/61/207047461.db2.gz	ZPZGPVPZOQHNJA-DJVITXSYSA-N	-1	0	352.295	-1.348	40	30		FAEBRM
O=C1c2ccccc2C(=O)C(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)=C1[O-]	ZINC000004776111	207047421	/nfs/dbraw/zinc/04/74/21/207047421.db2.gz	ZPZGPVPZOQHNJA-SKMIBJQZSA-N	-1	0	352.295	-1.348	40	30		FAEBRM
O=C1c2ccccc2C(=O)C(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)=C1[O-]	ZINC000004776115	207048326	/nfs/dbraw/zinc/04/83/26/207048326.db2.gz	ZPZGPVPZOQHNJA-NDANIYLUSA-N	-1	0	352.295	-1.348	40	30		FAEBRM
C=CC/C(=N\OS(=O)(=O)[O-])S[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O	ZINC000004917336	204175627	/nfs/dbraw/zinc/17/56/27/204175627.db2.gz	PHZOWSSBXJXFOR-PBBIEIDTSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
C=CC/C(=N\OS(=O)(=O)[O-])S[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O	ZINC000033727601	208098664	/nfs/dbraw/zinc/09/86/64/208098664.db2.gz	PHZOWSSBXJXFOR-UYOCUZTCSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
C=CC/C(=N/OS(=O)(=O)[O-])S[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O	ZINC000033727602	482560827	/nfs/dbraw/zinc/56/08/27/482560827.db2.gz	PHZOWSSBXJXFOR-WBBYFUEUSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
C=CC/C(=N/OS(=O)(=O)[O-])S[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O	ZINC000033727603	482561104	/nfs/dbraw/zinc/56/11/04/482561104.db2.gz	PHZOWSSBXJXFOR-FHSRDTJQSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
CC1(C)O[C@@H]2[C@@H](O1)[C@H](COS(C)(=O)=O)O[C@@H]2n1ncc(=O)[n-]c1=O	ZINC000035349229	482535741	/nfs/dbraw/zinc/53/57/41/482535741.db2.gz	WHZZSEDRSUGQAL-MCNGFCJOSA-N	-1	0	363.348	-1.675	40	30		FAEBRM
CC1(C)O[C@@H]2[C@@H](COS(C)(=O)=O)O[C@H](n3ncc(=O)[n-]c3=O)[C@@H]2O1	ZINC000035349230	482535026	/nfs/dbraw/zinc/53/50/26/482535026.db2.gz	WHZZSEDRSUGQAL-QQRDMOCMSA-N	-1	0	363.348	-1.675	40	30		FAEBRM
CC1(C)O[C@@H]2[C@@H](O1)[C@@H](COS(C)(=O)=O)O[C@@H]2n1ncc(=O)[n-]c1=O	ZINC000035349231	482536065	/nfs/dbraw/zinc/53/60/65/482536065.db2.gz	WHZZSEDRSUGQAL-NEPJDUFXSA-N	-1	0	363.348	-1.675	40	30		FAEBRM
CNNC(=NS(=O)(=O)c1cc(C#N)c(NNC)cc1[S-])NNC	ZINC000073242988	571200699	/nfs/dbraw/zinc/20/06/99/571200699.db2.gz	YUHHOIVGOZTQSR-UHFFFAOYSA-N	-1	0	358.453	-1.114	40	30		FAEBRM
COc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(/C=N\O)c(=O)n1C	ZINC000104267723	209259682	/nfs/dbraw/zinc/25/96/82/209259682.db2.gz	CDNBQQGZZJBNQL-XIZWEGIRSA-N	-1	0	360.323	-3.191	40	30		FAEBRM
C=CCC(=NOS(=O)(=O)[O-])S[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O	ZINC000263605122	657916891	/nfs/dbraw/zinc/91/68/91/657916891.db2.gz	PHZOWSSBXJXFOR-INDGLOLGSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
C=CCC(=NOS(=O)(=O)[O-])S[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O	ZINC000263605123	657917123	/nfs/dbraw/zinc/91/71/23/657917123.db2.gz	PHZOWSSBXJXFOR-IOSJIYNYSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
C=CCC(=NOS(=O)(=O)[O-])S[C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1O	ZINC000263605124	657917069	/nfs/dbraw/zinc/91/70/69/657917069.db2.gz	PHZOWSSBXJXFOR-JTBFQXKRSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
C=CCC(=NOS(=O)(=O)[O-])S[C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O	ZINC000263605125	658404114	/nfs/dbraw/zinc/40/41/14/658404114.db2.gz	PHZOWSSBXJXFOR-YXCNIWHNSA-N	-1	0	359.378	-1.772	40	30		FAEBRM
N#Cc1cccc(S(=O)(=O)N(CC(=O)[O-])[C@@H]2CS(=O)(=O)C[C@@H]2O)c1	ZINC000575420319	483195791	/nfs/dbraw/zinc/19/57/91/483195791.db2.gz	AQLROABMTFTWNS-NEPJUHHUSA-N	-1	0	374.396	-1.209	40	30		FAEBRM
N#Cc1cccc(S(=O)(=O)N(CC(=O)[O-])[C@H]2CS(=O)(=O)C[C@H]2O)c1	ZINC000575420320	483195840	/nfs/dbraw/zinc/19/58/40/483195840.db2.gz	AQLROABMTFTWNS-NWDGAFQWSA-N	-1	0	374.396	-1.209	40	30		FAEBRM
N#Cc1cccc(S(=O)(=O)N(CC(=O)[O-])[C@H]2CS(=O)(=O)C[C@@H]2O)c1	ZINC000575420321	483196437	/nfs/dbraw/zinc/19/64/37/483196437.db2.gz	AQLROABMTFTWNS-RYUDHWBXSA-N	-1	0	374.396	-1.209	40	30		FAEBRM
N#Cc1cccc(S(=O)(=O)N(CC(=O)[O-])[C@@H]2CS(=O)(=O)C[C@H]2O)c1	ZINC000575420322	483195565	/nfs/dbraw/zinc/19/55/65/483195565.db2.gz	AQLROABMTFTWNS-VXGBXAGGSA-N	-1	0	374.396	-1.209	40	30		FAEBRM
C=CC/C(=N\OS(=O)(=O)[O-])S[C@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@H]1O	ZINC000584908928	482599842	/nfs/dbraw/zinc/59/98/42/482599842.db2.gz	PHZOWSSBXJXFOR-GUCBVSFQSA-N	-1	0	359.378	-1.772	40	30	biogenic,in-vitro	FAEBRM