smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CC[NH+]1CCC2(CC1)C[C@@H]([NH2+]Cc1ccoc1)c1ccccc1O2	ZINC000096079799	564066487	/nfs/dbraw/zinc/06/64/87/564066487.db2.gz	HYSSDXLIQWFPBQ-LJQANCHMSA-N	2	1	338.451	3.914	40	30		EHEBMP
C[NH+](C)CC[N+](=O)C(c1ccccc1)C12CC3CC(CC(C3)C1)C2	ZINC000008656044	563634661	/nfs/dbraw/zinc/63/46/61/563634661.db2.gz	QRGIEPPIPNRNHB-ATJXCDBQSA-N	2	1	326.484	3.764	40	30		EHEBMP
C[NH+](C)CC[N+](=O)C(c1ccccc1)C12CC3CC(CC(C3)C1)C2	ZINC000005884685	563553283	/nfs/dbraw/zinc/55/32/83/563553283.db2.gz	QRGIEPPIPNRNHB-BSYVCWPDSA-N	2	1	326.484	3.764	40	30		EHEBMP
C=CC[NH+]1CCC2(CC1)C[C@H]([NH2+]Cc1ccoc1)c1ccccc1O2	ZINC000096079798	564066507	/nfs/dbraw/zinc/06/65/07/564066507.db2.gz	HYSSDXLIQWFPBQ-IBGZPJMESA-N	2	1	338.451	3.914	40	30		EHEBMP