smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@@H+]1CC[C@@H]2[C@@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747879	370244971	/nfs/dbraw/zinc/24/49/71/370244971.db2.gz	IYCFHXCRFYYJHY-DZGCQCFKSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[N@H+]1CC[C@@H]2[C@@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747879	370244973	/nfs/dbraw/zinc/24/49/73/370244973.db2.gz	IYCFHXCRFYYJHY-DZGCQCFKSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@@H]2[C@@H](CC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747879	370244980	/nfs/dbraw/zinc/24/49/80/370244980.db2.gz	IYCFHXCRFYYJHY-DZGCQCFKSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@@H]2[C@@H](CC[N@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747879	370244985	/nfs/dbraw/zinc/24/49/85/370244985.db2.gz	IYCFHXCRFYYJHY-DZGCQCFKSA-N	2	1	275.352	2.121	50	5		CEBAMP
CC[NH+](CC)CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC000002933146	169845041	/nfs/dbraw/zinc/84/50/41/169845041.db2.gz	KUSUGDZWVLICCN-UHFFFAOYSA-N	2	1	265.357	2.416	50	5		CEBAMP
C[N@@H+]1CC[C@H]2[C@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996026	185060355	/nfs/dbraw/zinc/06/03/55/185060355.db2.gz	IYCFHXCRFYYJHY-HIFRSBDPSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[N@H+]1CC[C@H]2[C@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996026	185060357	/nfs/dbraw/zinc/06/03/57/185060357.db2.gz	IYCFHXCRFYYJHY-HIFRSBDPSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@H]2[C@H](CC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996026	185060358	/nfs/dbraw/zinc/06/03/58/185060358.db2.gz	IYCFHXCRFYYJHY-HIFRSBDPSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@H]2[C@H](CC[N@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996026	185060360	/nfs/dbraw/zinc/06/03/60/185060360.db2.gz	IYCFHXCRFYYJHY-HIFRSBDPSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[N@@H+]1CC[C@@H]2[C@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996025	185060511	/nfs/dbraw/zinc/06/05/11/185060511.db2.gz	IYCFHXCRFYYJHY-UKRRQHHQSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[N@H+]1CC[C@@H]2[C@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996025	185060513	/nfs/dbraw/zinc/06/05/13/185060513.db2.gz	IYCFHXCRFYYJHY-UKRRQHHQSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@@H]2[C@H](CC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996025	185060514	/nfs/dbraw/zinc/06/05/14/185060514.db2.gz	IYCFHXCRFYYJHY-UKRRQHHQSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@@H]2[C@H](CC[N@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000095996025	185060516	/nfs/dbraw/zinc/06/05/16/185060516.db2.gz	IYCFHXCRFYYJHY-UKRRQHHQSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[N@@H+]1CC[C@H]2[C@@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747931	370244910	/nfs/dbraw/zinc/24/49/10/370244910.db2.gz	IYCFHXCRFYYJHY-ZFWWWQNUSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[N@H+]1CC[C@H]2[C@@H](CC[NH+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747931	370244915	/nfs/dbraw/zinc/24/49/15/370244915.db2.gz	IYCFHXCRFYYJHY-ZFWWWQNUSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@H]2[C@@H](CC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747931	370244919	/nfs/dbraw/zinc/24/49/19/370244919.db2.gz	IYCFHXCRFYYJHY-ZFWWWQNUSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+]1CC[C@H]2[C@@H](CC[N@H+]2Cc2cccc([N+](=O)[O-])c2)C1	ZINC000221747931	370244925	/nfs/dbraw/zinc/24/49/25/370244925.db2.gz	IYCFHXCRFYYJHY-ZFWWWQNUSA-N	2	1	275.352	2.121	50	5		CEBAMP
C[NH+](C)CC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1	ZINC000069492700	362974173	/nfs/dbraw/zinc/97/41/73/362974173.db2.gz	QENBHPUBWHXBQJ-UHFFFAOYSA-N	2	1	283.397	2.430	50	5		CEBAMP