smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOc1cccc(C[N@@H+]2C[C@@H](NC(=O)c3[nH]c4ccc(Cl)cc4c3C)C[C@H]2C(=O)OC)c1O	ZINC000055074207	569590737	/nfs/dbraw/zinc/59/07/37/569590737.db2.gz	CMGFYYYIFCRZMQ-PXNSSMCTSA-N	1	2	485.968	3.780	10	10		JHCELO
CCOc1cccc(C[N@H+]2C[C@@H](NC(=O)c3[nH]c4ccc(Cl)cc4c3C)C[C@H]2C(=O)OC)c1O	ZINC000055074207	569590738	/nfs/dbraw/zinc/59/07/38/569590738.db2.gz	CMGFYYYIFCRZMQ-PXNSSMCTSA-N	1	2	485.968	3.780	10	10		JHCELO
COc1ccc(N2CC[NH+]([C@@H](CNC(=O)C3CCCCC3)c3ccc4c(c3)OCO4)CC2)cc1	ZINC000016953850	563013248	/nfs/dbraw/zinc/01/32/48/563013248.db2.gz	GZKQFQMTVICWQB-DEOSSOPVSA-N	1	2	465.594	3.984	10	10		JHCELO
COc1ccc(N2CC[NH+]([C@H](CNC(=O)C3CCCCC3)c3ccc4c(c3)OCO4)CC2)cc1	ZINC000016953852	563013246	/nfs/dbraw/zinc/01/32/46/563013246.db2.gz	GZKQFQMTVICWQB-XMMPIXPASA-N	1	2	465.594	3.984	10	10		JHCELO