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)CCCNc1ccc(NCCCC[NH3+])c2c1C(=O)c1ccccc1C2=O	ZINC000028770037	207347856	/nfs/dbraw/zinc/34/78/56/207347856.db2.gz	JXADLOPDGNZPNH-UHFFFAOYSA-N	1	1	394.519	2.976	1	10		GFCFMO
CCCc1cc(I)cc(C[NH2+]CCCN(C)C)c1O	ZINC000028242693	207337249	/nfs/dbraw/zinc/33/72/49/207337249.db2.gz	HISJYEUJUPMBIC-UHFFFAOYSA-N	1	1	376.282	2.991	1	10		GFCFMO
COc1ccc(N2CC[NH+](CCN3C(=O)CC4(CCCC4)CC3=O)CC2)cc1	ZINC000013560108	210069138	/nfs/dbraw/zinc/06/91/38/210069138.db2.gz	FTBUCOBNSRIEMM-UHFFFAOYSA-N	1	1	385.508	2.527	1	10		GFCFMO
C[N@H+]1CC[C@@]23c4c5c(NCc6ccccc6O)ccc4C[C@@H]1[C@@H]2C=C[C@H](O)[C@@H]3O5	ZINC000084669459	222319451	/nfs/dbraw/zinc/31/94/51/222319451.db2.gz	HUZJHIOVMUYRMS-SDAQKBEVSA-N	1	1	390.483	2.810	1	10		GFCFMO
Cc1cc2cc(C(=O)NCCC[NH+]3CCOCC3)c(=O)oc2c2ccccc12	ZINC000073158833	211124388	/nfs/dbraw/zinc/12/43/88/211124388.db2.gz	AHTSSELUFJXDDG-UHFFFAOYSA-N	1	1	380.444	2.707	1	10		GFCFMO