smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C(CCCC[NH+]1CC[N+]2(CCCC2)CC1)CCCN1CC[N+]2(CCCC2)CC1	ZINC000029416549	717119498	/nfs/dbraw/zinc/11/94/98/717119498.db2.gz	PTXWZAQFMZTZCP-UHFFFAOYSA-N	3	2	392.676	3.179	1	5		GGBFLP
C(CCCC[NH+]1CC[N+]2(CCCC2)CC1)CCC[NH+]1CC[N+]2(CCCC2)CC1	ZINC000029416549	717119499	/nfs/dbraw/zinc/11/94/99/717119499.db2.gz	PTXWZAQFMZTZCP-UHFFFAOYSA-N	4	2	392.676	3.179	1	5		GGBFLP
CN(C)CC[NH2+]Cc1c2ccccc2c(C[NH2+]CC[NH+](C)C)c2ccccc21	ZINC000019365206	207117874	/nfs/dbraw/zinc/11/78/74/207117874.db2.gz	NQNIIYOBGWAPDR-UHFFFAOYSA-N	3	2	378.564	3.295	1	5	in-vitro	GGBFLP
Cc1c2c3cc(NC(=O)[C@@H]([NH3+])Cc4c[nH+]c[nH]4)ccc3n(C)c2nc2ccccc12	ZINC000095558805	208232269	/nfs/dbraw/zinc/23/22/69/208232269.db2.gz	IVGQFGJDFSGJPU-SFHVURJKSA-N	2	2	398.470	3.420	1	5		GGBFLP
COc1ccc2[nH]c3nc4cc[nH+]c(NCCC[NH2+]CCC[NH3+])c4c(C)c3c2c1	ZINC000028878603	207350051	/nfs/dbraw/zinc/35/00/51/207350051.db2.gz	SUCKSKAMGZCBIV-UHFFFAOYSA-N	3	2	392.507	3.322	1	5		GGBFLP