smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
c1nc(N2CCOCC2)sc1CN(C[C@@H]1CCCO1)CC1CC[NH+](C2CCCC2)CC1	ZINC000012372906	526599758	/nfs/dbraw/zinc/59/97/58/526599758.db2.gz	RUXHCXURSFTXFH-QFIPXVFZSA-N	1	3	448.677	3.615	10	0		IHAEHO
CCC[C@H](NCCc1cc(F)cc(F)c1)C(=O)Nc1cn(C(C)(C)C[NH+]2CCCC2)cn1	ZINC000071341805	563162636	/nfs/dbraw/zinc/16/26/36/563162636.db2.gz	ZPHGFZZXUVZVFX-NRFANRHFSA-N	1	3	447.574	3.932	10	0		IHAEHO
Cc1ccccc1C[NH+]1CCC(Oc2ccc(C(=O)NCCN(C)C)cc2Cl)CC1	ZINC000012477486	525138023	/nfs/dbraw/zinc/13/80/23/525138023.db2.gz	BCTPROIHGRWCLZ-UHFFFAOYSA-N	1	3	429.992	3.983	10	0		IHAEHO
O[C@@H](COc1cccc(CNCc2ccc3nsnc3c2)c1)C[NH+]1CCCCCC1	ZINC000012835768	527660877	/nfs/dbraw/zinc/66/08/77/527660877.db2.gz	UWOQJKYCJPPRAS-HXUWFJFHSA-N	1	3	426.586	3.597	10	0		IHAEHO
O[C@H](COc1cccc(CNCc2ccc3nsnc3c2)c1)C[NH+]1CCCCCC1	ZINC000012835771	526291329	/nfs/dbraw/zinc/29/13/29/526291329.db2.gz	UWOQJKYCJPPRAS-FQEVSTJZSA-N	1	3	426.586	3.597	10	0		IHAEHO