smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC=c1c(C)c2cc3nc(c4cc(=O)c5c(C)c(cc6[nH]c(cc1[nH+]2)c(C)c6CC)[nH]c45)[C@@H](CCC(=O)OC)[C@@H]3C	ZINC000028478250	561928784	/nfs/dbraw/zinc/92/87/84/561928784.db2.gz	GMAXFIKWICOTGY-AVRDEDQJSA-N	1	2	548.687	7.302	10	5		KKBELO
O=C(C1CCC1)N1CC[NH+](Cc2c(-c3ccc(F)cc3)nc3ccc(-c4cccc([N+](=O)[O-])c4)cn32)CC1	ZINC000096290046	553742839	/nfs/dbraw/zinc/74/28/39/553742839.db2.gz	XKRBRZRKOOESNI-UHFFFAOYSA-N	1	2	513.573	5.160	10	5		KKBELO
O=C(c1ccc(C(F)(F)F)cc1)N1CC[NH+](Cc2c(-c3ccc(F)cc3)nc3ccc(-c4cccc([N+](=O)[O-])c4)cn32)CC1	ZINC000103408798	555394711	/nfs/dbraw/zinc/39/47/11/555394711.db2.gz	QZGQMGCMEFSTAV-UHFFFAOYSA-N	1	2	603.576	6.692	10	5		KKBELO