smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc(C)c1Nc1ncc(C2=CCC(C[NH+]3CCCC3)=[S+]2)n2cncc12	ZINC000028639686	581092964	/nfs/dbraw/zinc/09/29/64/581092964.db2.gz	LZLRLYRVZHHTNI-UHFFFAOYSA-N	2	0	404.563	4.185	1	30		HIEFRP
C[N+]1(CC(=O)c2ccc(-c3ccc(C(=O)C[N+]4(C)CCCC4)cc3)cc2)CCCC1	ZINC000027656911	717115074	/nfs/dbraw/zinc/11/50/74/717115074.db2.gz	QBQZQZQYWGDFCT-UHFFFAOYSA-N	2	0	406.570	4.200	1	30		HIEFRP
CN(C)C(=[NH2+])c1ccc(/C=C2/CCCC/C(=C\c3ccc(C(N)=[NH2+])cc3)C2=O)cc1	ZINC000013803410	581095657	/nfs/dbraw/zinc/09/56/57/581095657.db2.gz	RXIPPQMJCYDVEA-FEVIUGPISA-N	2	0	400.526	4.468	1	30		HIEFRP
Cc1c2cc[nH]c2ccc1Nc1c(C#N)cncc1/C=C/CC[NH+]1CCC([NH3+])CC1	ZINC000045351590	581094068	/nfs/dbraw/zinc/09/40/68/581094068.db2.gz	SZJIXBKHTOPEKG-DUXPYHPUSA-N	2	0	400.530	4.313	1	30		HIEFRP