smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCS(=O)(=O)NN1C(=O)/C(=C/c2ccc(Cl)c(Cl)c2)SC1=S	ZINC000013680725	563000908	/nfs/dbraw/zinc/00/09/08/563000908.db2.gz	RSVHLESONZNEEH-WQLSENKSSA-N	0	2	425.384	3.829	1	10		IHCFLN
CCOC(=O)c1ccc(S(=O)(=O)Nc2nc(-c3ccc(OC)cc3O)cs2)cc1	ZINC000003250449	562933341	/nfs/dbraw/zinc/93/33/41/562933341.db2.gz	PRRYYVOHGAYBJR-UHFFFAOYSA-N	0	2	434.495	3.502	1	10		IHCFLN
O=S(=O)(Nc1cc(Sc2nn[nH]n2)c(O)c2ccccc12)c1ccc(Cl)s1	ZINC000084758022	563179546	/nfs/dbraw/zinc/17/95/46/563179546.db2.gz	LHCVLEPEBGSBIM-UHFFFAOYSA-N	0	2	439.931	3.725	1	10		IHCFLN
CCc1cc2c(=O)c(-c3cnn(-c4ccccc4)c3)coc2c(C[NH+]2CCOCC2)c1[O-]	ZINC000023224677	563027129	/nfs/dbraw/zinc/02/71/29/563027129.db2.gz	AKJZEMOOIFNPJR-UHFFFAOYSA-N	0	2	431.492	3.746	3	10		IHCFLN
O=C1CCCN1Cc1c(Br)c(O)c(O)c(Br)c1Br	ZINC000028707379	563062114	/nfs/dbraw/zinc/06/21/14/563062114.db2.gz	VZZUKOXTBHFIKN-UHFFFAOYSA-N	0	2	443.917	3.508	1	10		IHCFLN