smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@H]([NH2+][C@H]1COc2ccccc21)c1ccc(F)cc1F	ZINC000160837513	522760109	/nfs/dbraw/zinc/76/01/09/522760109.db2.gz	ICZQBRQTVCQDKO-HOTGVXAUSA-N	1	1	289.325	4.139	10	70		CIIEMO
CC[C@@H]([NH2+][C@@H]1COc2ccccc21)c1ccc(F)cc1F	ZINC000160837369	522929719	/nfs/dbraw/zinc/92/97/19/522929719.db2.gz	ICZQBRQTVCQDKO-HZPDHXFCSA-N	1	1	289.325	4.139	10	70		CIIEMO
CC[C@@H]([NH2+][C@H]1COc2ccccc21)c1ccc(F)cc1F	ZINC000160837651	522954334	/nfs/dbraw/zinc/95/43/34/522954334.db2.gz	ICZQBRQTVCQDKO-CVEARBPZSA-N	1	1	289.325	4.139	10	70		CIIEMO
CC[C@H]([NH2+][C@@H]1COc2ccccc21)c1ccc(F)cc1F	ZINC000160837251	522723487	/nfs/dbraw/zinc/72/34/87/522723487.db2.gz	ICZQBRQTVCQDKO-JKSUJKDBSA-N	1	1	289.325	4.139	10	70		CIIEMO
CC1(Cl)C[NH+](C(c2ccccc2)c2ccccc2)C1	ZINC000218247297	570308925	/nfs/dbraw/zinc/30/89/25/570308925.db2.gz	BJNFCYWEFNNULQ-UHFFFAOYSA-N	1	1	271.791	4.089	10	70		CIIEMO