smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261747465	535021714	/nfs/dbraw/zinc/02/17/14/535021714.db2.gz	KZDSLRYZBIJDBG-MRXNPFEDSA-N	2	2	321.421	2.941	10	5		DFBELP
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261747465	535021719	/nfs/dbraw/zinc/02/17/19/535021719.db2.gz	KZDSLRYZBIJDBG-MRXNPFEDSA-N	2	2	321.421	2.941	10	5		DFBELP
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261747461	535022254	/nfs/dbraw/zinc/02/22/54/535022254.db2.gz	KZDSLRYZBIJDBG-INIZCTEOSA-N	2	2	321.421	2.941	10	5		DFBELP
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261747461	535022260	/nfs/dbraw/zinc/02/22/60/535022260.db2.gz	KZDSLRYZBIJDBG-INIZCTEOSA-N	2	2	321.421	2.941	10	5		DFBELP
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261841630	146287891	/nfs/dbraw/zinc/28/78/91/146287891.db2.gz	ZUURRDCUBSUPLQ-HNNXBMFYSA-N	2	2	307.394	2.553	10	5		DFBELP
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]([NH3+])C(C)(C)C1	ZINC000261841630	146287894	/nfs/dbraw/zinc/28/78/94/146287894.db2.gz	ZUURRDCUBSUPLQ-HNNXBMFYSA-N	2	2	307.394	2.553	10	5		DFBELP
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261841633	146287632	/nfs/dbraw/zinc/28/76/32/146287632.db2.gz	ZUURRDCUBSUPLQ-OAHLLOKOSA-N	2	2	307.394	2.553	10	5		DFBELP
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261841633	146287635	/nfs/dbraw/zinc/28/76/35/146287635.db2.gz	ZUURRDCUBSUPLQ-OAHLLOKOSA-N	2	2	307.394	2.553	10	5		DFBELP