smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)C[NH2+]Cc1c(O)ccc2ccc(=O)oc21	ZINC000013674211	167008498	/nfs/dbraw/zinc/00/84/98/167008498.db2.gz	ACZKCYZJXQFNPK-UHFFFAOYSA-N	1	2	247.294	2.244	1	10		BECFLO
CC=C1C(N)=C(SC)N[NH+]=C1c1ccccc1	ZINC000028655294	187255620	/nfs/dbraw/zinc/25/56/20/187255620.db2.gz	CLLDDXHLSGCRFN-ZDUSSCGKSA-N	1	2	245.351	2.082	1	10		BECFLO
Oc1cc2[nH+]cn(-c3ccccc3)c2cc1O	ZINC000013798317	183263022	/nfs/dbraw/zinc/26/30/22/183263022.db2.gz	FUGNZKDWKNTIQF-UHFFFAOYSA-N	1	2	226.235	2.437	1	10		BECFLO
Cn1cc2c3c1cccc3[C@H]1OCC[N@H+](C)[C@@H]1C2	ZINC000027561851	173106293	/nfs/dbraw/zinc/10/62/93/173106293.db2.gz	DRJWBVXPWDSRDR-UKRRQHHQSA-N	1	2	242.322	2.106	1	10		BECFLO
Cn1cc2c3c1cccc3[C@H]1OCC[N@@H+](C)[C@@H]1C2	ZINC000027561851	173106297	/nfs/dbraw/zinc/10/62/97/173106297.db2.gz	DRJWBVXPWDSRDR-UKRRQHHQSA-N	1	2	242.322	2.106	1	10		BECFLO
CC=C1C(N)=C(SC)N[NH+]=C1c1ccccc1	ZINC000028655297	188109838	/nfs/dbraw/zinc/10/98/38/188109838.db2.gz	CLLDDXHLSGCRFN-CYBMUJFWSA-N	1	2	245.351	2.082	1	10		BECFLO
C[C@H](Cc1ccc(N)cc1)n1cc[nH+]c1	ZINC000028465315	188110586	/nfs/dbraw/zinc/11/05/86/188110586.db2.gz	UMIJCQZWIPWUPE-SNVBAGLBSA-N	1	2	201.273	2.269	1	10		BECFLO