smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1CC[NH+](C[C@@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000084699927	564069742	/nfs/dbraw/zinc/06/97/42/564069742.db2.gz	LOTCCCSVIFXFBL-LJQANCHMSA-N	2	1	345.487	3.581	50	5		EHBAMP
CC1CC[NH+](C[C@@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000084699927	564069743	/nfs/dbraw/zinc/06/97/43/564069743.db2.gz	LOTCCCSVIFXFBL-LJQANCHMSA-N	2	1	345.487	3.581	50	5		EHBAMP
C[NH+](C)CC(C)(C)C[NH2+]Cc1cc(=O)oc2ccc3ccccc3c12	ZINC000057568254	564155026	/nfs/dbraw/zinc/15/50/26/564155026.db2.gz	PXYOFYDLZQEIRU-UHFFFAOYSA-N	2	1	338.451	3.624	50	5		EHBAMP
CC1CC[NH+](C[C@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000084699929	564069745	/nfs/dbraw/zinc/06/97/45/564069745.db2.gz	LOTCCCSVIFXFBL-IBGZPJMESA-N	2	1	345.487	3.581	50	5		EHBAMP
CC1CC[NH+](C[C@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000084699929	564069746	/nfs/dbraw/zinc/06/97/46/564069746.db2.gz	LOTCCCSVIFXFBL-IBGZPJMESA-N	2	1	345.487	3.581	50	5		EHBAMP
CC[NH+]1CCC([NH2+][C@H]2CCCc3c4cc([N+](=O)[O-])ccc4[nH]c32)CC1	ZINC000004477500	563727590	/nfs/dbraw/zinc/72/75/90/563727590.db2.gz	PWBFNNRPJWBPEF-SFHVURJKSA-N	2	1	342.443	3.527	50	5		EHBAMP
CC[NH+]1CCC([NH2+][C@@H]2CCCc3c4cc([N+](=O)[O-])ccc4[nH]c32)CC1	ZINC000005032129	210368361	/nfs/dbraw/zinc/36/83/61/210368361.db2.gz	PWBFNNRPJWBPEF-GOSISDBHSA-N	2	1	342.443	3.527	50	5		EHBAMP
Cc1ccc(N2CCC([NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1	ZINC000095968422	564143220	/nfs/dbraw/zinc/14/32/20/564143220.db2.gz	LEWDZQOOOJFQJV-OAHLLOKOSA-N	2	1	340.427	3.618	50	5		EHBAMP
Cc1ccc(N2CCC([NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)CC2)[nH+]c1	ZINC000095968421	564143195	/nfs/dbraw/zinc/14/31/95/564143195.db2.gz	LEWDZQOOOJFQJV-HNNXBMFYSA-N	2	1	340.427	3.618	50	5		EHBAMP