smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCCN2CCCC2)CC1	ZINC000119444048	431692895	/nfs/dbraw/zinc/69/28/95/431692895.db2.gz	ZIWHIZOSDZOWRY-IBGZPJMESA-N	2	3	321.553	3.449	10	0		DGAEHP
C[C@H]1CCCC[N@H+]1CCC1CC[NH+](CCCN2CCCC2)CC1	ZINC000119444048	431692901	/nfs/dbraw/zinc/69/29/01/431692901.db2.gz	ZIWHIZOSDZOWRY-IBGZPJMESA-N	2	3	321.553	3.449	10	0		DGAEHP
C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000309731673	533850261	/nfs/dbraw/zinc/85/02/61/533850261.db2.gz	SEGFFNVWANYCDZ-GSEOLPGOSA-N	2	3	315.505	3.004	10	0		DGAEHP
C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCCN2CCCC2)CC1	ZINC000119443936	431692043	/nfs/dbraw/zinc/69/20/43/431692043.db2.gz	ZIWHIZOSDZOWRY-LJQANCHMSA-N	2	3	321.553	3.449	10	0		DGAEHP
C[C@@H]1CCCC[N@H+]1CCC1CC[NH+](CCCN2CCCC2)CC1	ZINC000119443936	431692049	/nfs/dbraw/zinc/69/20/49/431692049.db2.gz	ZIWHIZOSDZOWRY-LJQANCHMSA-N	2	3	321.553	3.449	10	0		DGAEHP
[NH3+]C1CCC([NH2+]C[C@@H]2CCCCN(Cc3ccccc3)C2)CC1	ZINC000261540818	432431218	/nfs/dbraw/zinc/43/12/18/432431218.db2.gz	FHIHWXMYNXIAIN-HDYDNRTBSA-N	2	3	315.505	3.148	10	0		DGAEHP
C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000309731671	279255182	/nfs/dbraw/zinc/25/51/82/279255182.db2.gz	SEGFFNVWANYCDZ-BTHPGYMESA-N	2	3	315.505	3.004	10	0		DGAEHP
[NH3+]C1CCC([NH2+]C[C@H]2CCCCN(Cc3ccccc3)C2)CC1	ZINC000261540819	432431470	/nfs/dbraw/zinc/43/14/70/432431470.db2.gz	FHIHWXMYNXIAIN-XEVCZEQESA-N	2	3	315.505	3.148	10	0		DGAEHP
C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]12	ZINC000309731678	279255153	/nfs/dbraw/zinc/25/51/53/279255153.db2.gz	SEGFFNVWANYCDZ-VBSBHUPXSA-N	2	3	315.505	3.004	10	0		DGAEHP
C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]12	ZINC000309731676	278169109	/nfs/dbraw/zinc/16/91/09/278169109.db2.gz	SEGFFNVWANYCDZ-RSPOEFSDSA-N	2	3	315.505	3.004	10	0		DGAEHP