smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N@@H+]1CCC[C@H]([NH2+][C@H](c2ccc(C)cc2)C2CC2)C1	ZINC000217916936	333125051	/nfs/dbraw/zinc/12/50/51/333125051.db2.gz	HERYCQDETPLFGG-ZWKOTPCHSA-N	2	2	272.436	3.520	10	70		CHIELP
CC[N@H+]1CCC[C@H]([NH2+][C@H](c2ccc(C)cc2)C2CC2)C1	ZINC000217916936	333125052	/nfs/dbraw/zinc/12/50/52/333125052.db2.gz	HERYCQDETPLFGG-ZWKOTPCHSA-N	2	2	272.436	3.520	10	70		CHIELP
c1csc(C2=CC[N@H+](CCC[NH+]3CCCCC3)CC2)c1	ZINC000161364933	526577741	/nfs/dbraw/zinc/57/77/41/526577741.db2.gz	QTVFMPYOZSWRIE-UHFFFAOYSA-N	2	2	290.476	3.713	10	70		CHIELP
c1csc(C2=CC[N@@H+](CCC[NH+]3CCCCC3)CC2)c1	ZINC000161364933	526577744	/nfs/dbraw/zinc/57/77/44/526577744.db2.gz	QTVFMPYOZSWRIE-UHFFFAOYSA-N	2	2	290.476	3.713	10	70		CHIELP
CC[N@@H+]1CCC[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000217917587	333125143	/nfs/dbraw/zinc/12/51/43/333125143.db2.gz	XPLFZZGQFVOZMZ-IRXDYDNUSA-N	2	2	292.854	3.865	10	70		CHIELP
CC[N@H+]1CCC[C@H]([NH2+][C@H](c2ccc(Cl)cc2)C2CC2)C1	ZINC000217917587	333125145	/nfs/dbraw/zinc/12/51/45/333125145.db2.gz	XPLFZZGQFVOZMZ-IRXDYDNUSA-N	2	2	292.854	3.865	10	70		CHIELP
CC[N@@H+]1CCC[C@@H]([NH2+][C@H](c2ccc(C)cc2)C2CC2)C1	ZINC000217917026	333125079	/nfs/dbraw/zinc/12/50/79/333125079.db2.gz	HERYCQDETPLFGG-QZTJIDSGSA-N	2	2	272.436	3.520	10	70		CHIELP
CC[N@H+]1CCC[C@@H]([NH2+][C@H](c2ccc(C)cc2)C2CC2)C1	ZINC000217917026	333125081	/nfs/dbraw/zinc/12/50/81/333125081.db2.gz	HERYCQDETPLFGG-QZTJIDSGSA-N	2	2	272.436	3.520	10	70		CHIELP