smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc(CN(CC[NH+](C)C)C[C@@H]2CCC[N@H+](Cc3ccccc3F)C2)c1O	ZINC000020912446	525921869	/nfs/dbraw/zinc/92/18/69/525921869.db2.gz	QCKBVHRBPYWQCC-HXUWFJFHSA-N	2	0	429.580	3.816	10	10		IHCERP
CC[NH+](CC)CCOc1ccc(OCC[NH+](CC)CC)c2c1C(=O)c1ccccc1C2=O	ZINC000027523712	563042884	/nfs/dbraw/zinc/04/28/84/563042884.db2.gz	WNOAZUFOZKQFQU-UHFFFAOYSA-N	2	0	438.568	3.903	10	10		IHCERP
CC[NH+](CC)CCNc1cccc2c1C(=O)c1c(NCC[NH+](CC)CC)cccc1C2=O	ZINC000027994631	563049041	/nfs/dbraw/zinc/04/90/41/563049041.db2.gz	XMGKUIJRUVUUOI-UHFFFAOYSA-N	2	0	436.600	3.969	10	10		IHCERP
C[NH+](C)CCCCNc1ccc(NCCCC[NH+](C)C)c2c1C(=O)c1ccccc1C2=O	ZINC000031438826	563083292	/nfs/dbraw/zinc/08/32/92/563083292.db2.gz	VOMRWNYXCKZHQJ-UHFFFAOYSA-N	2	0	436.600	3.969	10	10		IHCERP
COc1cccc(CN(CC[NH+](C)C)C[C@H]2CCC[N@H+](Cc3ccccc3F)C2)c1O	ZINC000020912449	525919513	/nfs/dbraw/zinc/91/95/13/525919513.db2.gz	QCKBVHRBPYWQCC-FQEVSTJZSA-N	2	0	429.580	3.816	10	10		IHCERP
CC[NH+](CC)CCOc1ccc2c(c1)C(=O)c1cc(OCC[NH+](CC)CC)ccc1C2=O	ZINC000027523218	563042896	/nfs/dbraw/zinc/04/28/96/563042896.db2.gz	NIZOWMDMNDXEEV-UHFFFAOYSA-N	2	0	438.568	3.903	10	10		IHCERP