smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCN1C(=O)[C@@H]2[C@H](C1=O)[C@H](CCSC)N[C@@]21c2ccccc2N(Cc2ccccc2Cl)C1=O	ZINC000217595918	571601853	/nfs/dbraw/zinc/60/18/53/571601853.db2.gz	IAIXAIAYQAHPPU-XUTUTRJZSA-N	0	1	512.075	4.208	50	70		KIIAMN
COc1cc([C@H]2CC(=O)Oc3cc(=O)c4c(O)cc(-c5ccc(OC)c(O)c5)oc-4c32)cc2c1OCO2	ZINC000217663823	571602229	/nfs/dbraw/zinc/60/22/29/571602229.db2.gz	UKTRGKIOKNNHBK-CQSZACIVSA-N	0	1	504.447	4.058	50	70		KIIAMN
COc1cc([C@@H]2CC(=O)Oc3cc(=O)c4c(O)cc(-c5ccc(OC)c(O)c5)oc-4c32)cc2c1OCO2	ZINC000217663900	571602357	/nfs/dbraw/zinc/60/23/57/571602357.db2.gz	UKTRGKIOKNNHBK-AWEZNQCLSA-N	0	1	504.447	4.058	50	70		KIIAMN
COc1ccc(-c2cc(O)c3c(=O)cc4c(c-3o2)[C@H](c2cc(OC)c(OC)cc2OC)CC(=O)O4)cc1O	ZINC000217664423	571602201	/nfs/dbraw/zinc/60/22/01/571602201.db2.gz	LHIDUTOWRRLPAK-HNNXBMFYSA-N	0	1	520.490	4.347	50	70		KIIAMN
COc1ccc(-c2cc(O)c3c(=O)cc4c(c-3o2)[C@@H](c2cc(OC)c(OC)cc2OC)CC(=O)O4)cc1O	ZINC000217664509	571602209	/nfs/dbraw/zinc/60/22/09/571602209.db2.gz	LHIDUTOWRRLPAK-OAHLLOKOSA-N	0	1	520.490	4.347	50	70		KIIAMN
COc1ccc2occ([C@@H]3CC(=O)Oc4cc(=O)c5c(O)cc(-c6ccc(OC)c(O)c6)oc-5c43)c(=O)c2c1	ZINC000217748084	571602514	/nfs/dbraw/zinc/60/25/14/571602514.db2.gz	GQVOMSIBGDMIRI-HNNXBMFYSA-N	0	1	528.469	4.436	50	70		KIIAMN
COc1ccc2occ([C@H]3CC(=O)Oc4cc(=O)c5c(O)cc(-c6ccc(OC)c(O)c6)oc-5c43)c(=O)c2c1	ZINC000217748160	571602534	/nfs/dbraw/zinc/60/25/34/571602534.db2.gz	GQVOMSIBGDMIRI-OAHLLOKOSA-N	0	1	528.469	4.436	50	70		KIIAMN