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@H]1CC[C@@H](Cc2cc(COc3ccccc3)on2)O[C@@H]1C[NH2+]C1CCNCC1	ZINC000077262995	291213917	/nfs/dbraw/zinc/21/39/17/291213917.db2.gz	JMSKFVGWXPIWCZ-ILWGZMRPSA-N	1	3	401.507	2.046	10	0		HEAEHO
COC(=O)[C@@H](C)NC(=O)C1CCN(C2CC[NH+](CCCc3ccccc3)CC2)CC1	ZINC000011874178	558291777	/nfs/dbraw/zinc/29/17/77/558291777.db2.gz	QQXQZCLSZVXKSJ-LJQANCHMSA-N	1	3	415.578	2.473	10	0		HEAEHO
C[NH+](C)[C@@H]1CCN(Cc2cccnc2)C[C@@H]1CCC(=O)NCCN1CCCCC1	ZINC000012248075	558362059	/nfs/dbraw/zinc/36/20/59/558362059.db2.gz	DXMYHHUJMPUXED-FCHUYYIVSA-N	1	3	401.599	2.216	10	0		HEAEHO