smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(NCCCN1CCN(c2cc[nH+]cc2)CC1)C(=O)NCCCN1CCN(c2cc[nH+]cc2)CC1	ZINC000514367205	1068612136	/nfs/dbraw/zinc/61/21/36/1068612136.db2.gz	UGYLTHWZINFEKI-UHFFFAOYSA-N	2	3	494.644	0.433	20	0		JCADHP
CC[NH+]1CCC(NCCOCCOCCOCCOCCOCCOCCOCC[NH3+])CC1	ZINC001169229610	1069977735	/nfs/dbraw/zinc/97/77/35/1069977735.db2.gz	DVZUCOXIGIAWFR-UHFFFAOYSA-N	2	3	479.659	0.135	20	0		JCADHP
CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)C(N)=O	ZINC001172108526	1068241859	/nfs/dbraw/zinc/24/18/59/1068241859.db2.gz	AXXYIGJSUKXNKT-GVUKCBQMSA-N	2	3	478.682	0.706	20	0		JCADHP
CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)C(N)=O	ZINC001172108530	1068242644	/nfs/dbraw/zinc/24/26/44/1068242644.db2.gz	AXXYIGJSUKXNKT-WVYKEMLSSA-N	2	3	478.682	0.706	20	0		JCADHP
COCCC[NH+]1CCC(NCCOCCOCCOCCOCCOCCOCC[NH3+])CC1	ZINC001172249366	1068245622	/nfs/dbraw/zinc/24/56/22/1068245622.db2.gz	CXQWBRCDGKGOJZ-UHFFFAOYSA-N	2	3	479.659	0.135	20	0		JCADHP
CN1CCN(c2ccncc2C(=O)N([C@@H](O)OC(C)(C)C)[C@H]2C[C@@H]([C@H](O)[NH+](C)C)CC[C@@H]2[NH3+])CC1	ZINC001199357817	1069822511	/nfs/dbraw/zinc/82/25/11/1069822511.db2.gz	BWQVBGICLCBNGF-KLNYNADPSA-N	2	3	492.665	0.743	20	0		JCADHP
CN1CCN(c2ccncc2C(=O)N([C@H](O)OC(C)(C)C)[C@H]2C[C@@H]([C@H](O)[NH+](C)C)CC[C@@H]2[NH3+])CC1	ZINC001199357826	1069822367	/nfs/dbraw/zinc/82/23/67/1069822367.db2.gz	BWQVBGICLCBNGF-RISXONROSA-N	2	3	492.665	0.743	20	0		JCADHP
CN1CCN(c2ccncc2C(=O)N([C@@H](O)OC(C)(C)C)[C@H]2C[C@@H]([C@@H](O)[NH+](C)C)CC[C@@H]2[NH3+])CC1	ZINC001199357827	1069822715	/nfs/dbraw/zinc/82/27/15/1069822715.db2.gz	BWQVBGICLCBNGF-WHOJULOUSA-N	2	3	492.665	0.743	20	0		JCADHP
CN1CCN(c2ccncc2C(=O)N([C@H](O)OC(C)(C)C)[C@H]2C[C@@H]([C@@H](O)[NH+](C)C)CC[C@@H]2[NH3+])CC1	ZINC001199357831	1069822737	/nfs/dbraw/zinc/82/27/37/1069822737.db2.gz	BWQVBGICLCBNGF-XNTBCBLESA-N	2	3	492.665	0.743	20	0		JCADHP