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](NC(=O)c2ccc(Nc3cc[nH+]c4cc5ccccc5cc34)cc2)C1	ZINC000031501319	558751107	/nfs/dbraw/zinc/75/11/07/558751107.db2.gz	BLQZAHQMWSVYBH-HSZRJFAPSA-N	2	1	424.548	5.346	40	5		HKBBMP
CC[N@H+]1CCC[C@@H](NC(=O)c2ccc(Nc3cc[nH+]c4cc5ccccc5cc34)cc2)C1	ZINC000031501319	558751110	/nfs/dbraw/zinc/75/11/10/558751110.db2.gz	BLQZAHQMWSVYBH-HSZRJFAPSA-N	2	1	424.548	5.346	40	5		HKBBMP
CC[N@@H+]1CCC[C@H](NC(=O)c2ccc(Nc3cc[nH+]c4cc5ccccc5cc34)cc2)C1	ZINC000031501322	558751156	/nfs/dbraw/zinc/75/11/56/558751156.db2.gz	BLQZAHQMWSVYBH-QHCPKHFHSA-N	2	1	424.548	5.346	40	5		HKBBMP
CC[N@H+]1CCC[C@H](NC(=O)c2ccc(Nc3cc[nH+]c4cc5ccccc5cc34)cc2)C1	ZINC000031501322	558751159	/nfs/dbraw/zinc/75/11/59/558751159.db2.gz	BLQZAHQMWSVYBH-QHCPKHFHSA-N	2	1	424.548	5.346	40	5		HKBBMP
CC[NH+](CC)CCNC(=O)c1ccc(Nc2cc[nH+]c3cc4ccccc4cc23)cc1	ZINC000035183257	558788948	/nfs/dbraw/zinc/78/89/48/558788948.db2.gz	ISHRVDFFILRBLY-UHFFFAOYSA-N	2	1	412.537	5.203	40	5		HKBBMP