smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)/C=[NH+]\c1ccc(S(=O)(=O)c2ccc(/[NH+]=C\N(C)C)cc2)cc1	ZINC000100701519	206224589	/nfs/dbraw/zinc/22/45/89/206224589.db2.gz	XTFUZNKOLZFZEW-AXPXABNXSA-N	2	0	358.467	2.962	40	30		FFEBRP
CCCOC(=O)C[N+](C)(C)CCCCCC[N+](C)(C)CC(=O)OCCC	ZINC000005431068	506440662	/nfs/dbraw/zinc/44/06/62/506440662.db2.gz	NIIFTSQJRPHRCJ-UHFFFAOYSA-N	2	0	374.566	2.606	40	30		FFEBRP
Cc1cc[n+](CC(=O)CCc2ccc(C(=O)C[n+]3ccc(C)cc3)cc2)cc1	ZINC000001559970	525702034	/nfs/dbraw/zinc/70/20/34/525702034.db2.gz	GXJIMXZNGIRFKA-UHFFFAOYSA-N	2	0	374.484	2.963	40	30		FFEBRP
CN(C)/C=[NH+]/c1ccc(S(=O)(=O)c2ccc(/[NH+]=C\N(C)C)cc2)cc1	ZINC000100701520	206224516	/nfs/dbraw/zinc/22/45/16/206224516.db2.gz	XTFUZNKOLZFZEW-LRVMPXQBSA-N	2	0	358.467	2.962	40	30		FFEBRP
C=CCN1CCc2cc(-c3cncn3[C@@H](C)CN3CCOCC3)ccc21	ZINC000019719369	263375493	/nfs/dbraw/zinc/37/54/93/263375493.db2.gz	OQJFOQOMATVBOK-KRWDZBQOSA-N	2	0	352.482	2.992	40	30		FFEBRP
C=CCN1CCc2cc(-c3cncn3[C@H](C)CN3CCOCC3)ccc21	ZINC000019719370	263375499	/nfs/dbraw/zinc/37/54/99/263375499.db2.gz	OQJFOQOMATVBOK-QGZVFWFLSA-N	2	0	352.482	2.992	40	30		FFEBRP