smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[C@@H]2C[C@]3(Cc4cc([N+](=O)[O-])ccc4O)c4ccccc4N[C@@H]3N2C(=O)[C@H](Cc2ccccc2)N1Cc1cc([N+](=O)[O-])ccc1[O-]	ZINC000027212128	561847438	/nfs/dbraw/zinc/84/74/38/561847438.db2.gz	UKEWSTWBIQOCHZ-WCISARMNSA-N	-1	2	635.633	4.401	1	10		KICFLM
O=C1[C@@H]2C[C@@]3(Cc4cc([N+](=O)[O-])ccc4O)c4ccccc4N[C@H]3N2C(=O)[C@H](Cc2ccccc2)N1Cc1cc([N+](=O)[O-])ccc1[O-]	ZINC000027298405	561848638	/nfs/dbraw/zinc/84/86/38/561848638.db2.gz	UKEWSTWBIQOCHZ-XKJABPBFSA-N	-1	2	635.633	4.401	1	10		KICFLM
COc1cc(O)c2c(c1)C(=O)c1cc(C)c([O-])c(-c3c(O)c4c(cc3OC)C(=O)c3cc(C)c(O)cc3C4=O)c1C2=O	ZINC000084603355	562744138	/nfs/dbraw/zinc/74/41/38/562744138.db2.gz	IFLKWZMIHYZTTR-UHFFFAOYSA-N	-1	2	566.518	4.361	1	10		KICFLM
COc1ccc(N2CCN(C(=O)CSc3nc4[nH]ncc4c(=O)n3-c3cccc4ccccc43)CC2)cc1	ZINC000101564448	562811331	/nfs/dbraw/zinc/81/13/31/562811331.db2.gz	SBKHYJRJTDQDIU-UHFFFAOYSA-N	-1	2	526.622	4.075	1	10		KICFLM
COc1cc(O)c2c(c1)C(=O)c1cc(C)c([O-])c(-c3c(OC)cc(O)c4c3C(=O)c3cc(C)c(O)cc3C4=O)c1C2=O	ZINC000200634906	562873395	/nfs/dbraw/zinc/87/33/95/562873395.db2.gz	YZSAXGKYJYWVOD-UHFFFAOYSA-N	-1	2	566.518	4.361	1	10		KICFLM