smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(N2CCCN(Cc3cccc(CC[NH3+])c3)CC2)cc[nH+]1	ZINC000072170596	191067786	/nfs/dbraw/zinc/06/77/86/191067786.db2.gz	CEMYTQOIIIINBJ-UHFFFAOYSA-N	2	3	324.472	2.604	50	0		DFAAHP
C[C@@H](C1CCN(Cc2cccc(CC[NH3+])c2)CC1)[NH+]1CCCC1	ZINC000072457479	191172409	/nfs/dbraw/zinc/17/24/09/191172409.db2.gz	DWTZBMCMKKCDRI-KRWDZBQOSA-N	2	3	315.505	2.884	50	0		DFAAHP
Cc1c[nH+]ccc1N1CCCN(Cc2ccc(CC[NH3+])cc2)CC1	ZINC000077340044	426127502	/nfs/dbraw/zinc/12/75/02/426127502.db2.gz	KKVMWEWVRAGMSU-UHFFFAOYSA-N	2	3	324.472	2.604	50	0		DFAAHP
C[C@@H](C1CCN(Cc2ccc(CC[NH3+])cc2)CC1)[NH+]1CCCC1	ZINC000072473360	191175461	/nfs/dbraw/zinc/17/54/61/191175461.db2.gz	IKXOAORAJSQMHU-KRWDZBQOSA-N	2	3	315.505	2.884	50	0		DFAAHP
CC(C)N1CCC[C@H](C[N@H+](C)Cc2cccc(CC[NH3+])c2)C1	ZINC000072151032	191055309	/nfs/dbraw/zinc/05/53/09/191055309.db2.gz	OGVNLJAHNQVZND-LJQANCHMSA-N	2	3	303.494	2.740	50	0		DFAAHP
CC(C)N1CCC[C@H](C[N@@H+](C)Cc2cccc(CC[NH3+])c2)C1	ZINC000072151032	191055312	/nfs/dbraw/zinc/05/53/12/191055312.db2.gz	OGVNLJAHNQVZND-LJQANCHMSA-N	2	3	303.494	2.740	50	0		DFAAHP
C[C@H](C1CCN(Cc2ccc(CC[NH3+])cc2)CC1)[NH+]1CCCC1	ZINC000072473361	426015462	/nfs/dbraw/zinc/01/54/62/426015462.db2.gz	IKXOAORAJSQMHU-QGZVFWFLSA-N	2	3	315.505	2.884	50	0		DFAAHP
[NH3+]CCc1ccc(CN2CCC(C[NH+]3CCCCC3)CC2)cc1	ZINC000077437305	426133544	/nfs/dbraw/zinc/13/35/44/426133544.db2.gz	MFKYHZCGNMKNEH-UHFFFAOYSA-N	2	3	315.505	2.886	50	0		DFAAHP
[NH3+]CCc1cccc(CN2CCC(C[NH+]3CCCCC3)CC2)c1	ZINC000077439173	426132875	/nfs/dbraw/zinc/13/28/75/426132875.db2.gz	CSWRXQOTBLBCOI-UHFFFAOYSA-N	2	3	315.505	2.886	50	0		DFAAHP
CC(C)N1CCC[C@@H](C[N@H+](C)Cc2cccc(CC[NH3+])c2)C1	ZINC000072151033	191055536	/nfs/dbraw/zinc/05/55/36/191055536.db2.gz	OGVNLJAHNQVZND-IBGZPJMESA-N	2	3	303.494	2.740	50	0		DFAAHP
CC(C)N1CCC[C@@H](C[N@@H+](C)Cc2cccc(CC[NH3+])c2)C1	ZINC000072151033	191055540	/nfs/dbraw/zinc/05/55/40/191055540.db2.gz	OGVNLJAHNQVZND-IBGZPJMESA-N	2	3	303.494	2.740	50	0		DFAAHP
C[C@H](C1CCN(Cc2cccc(CC[NH3+])c2)CC1)[NH+]1CCCC1	ZINC000072457481	191172559	/nfs/dbraw/zinc/17/25/59/191172559.db2.gz	DWTZBMCMKKCDRI-QGZVFWFLSA-N	2	3	315.505	2.884	50	0		DFAAHP