smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)NCCc3cnc[nH]3)[C@@H]21	ZINC000217739751	569881350	/nfs/dbraw/zinc/88/13/50/569881350.db2.gz	MPTZPOOXSCCUNO-JOCHJYFZSA-N	0	1	461.478	1.901	50	70	biogenic	JDIAMN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)NCCc3cnc[nH]3)[C@H]21	ZINC000217739668	569881371	/nfs/dbraw/zinc/88/13/71/569881371.db2.gz	MPTZPOOXSCCUNO-QFIPXVFZSA-N	0	1	461.478	1.901	50	70	biogenic	JDIAMN
COc1ccc(S(=O)(=O)N2CCN(Cc3c(O)c(=O)cc(CN4CCCCC4)n3C)CC2)cc1	ZINC000218535739	569883461	/nfs/dbraw/zinc/88/34/61/569883461.db2.gz	WUGWTDLYHSGYGR-UHFFFAOYSA-N	0	1	490.626	1.592	50	70		JDIAMN
COc1ccc(CCc2nnc(NC(=O)C[C@@H]3NC(=O)c4ccccc4NC3=O)[nH]2)cc1OC	ZINC000217620355	569880639	/nfs/dbraw/zinc/88/06/39/569880639.db2.gz	AGCVJFDZCYTURO-INIZCTEOSA-N	0	1	464.482	1.686	50	70	biogenic	JDIAMN
COc1ccc(CCc2n[nH]c(NC(=O)C[C@@H]3NC(=O)c4ccccc4NC3=O)n2)cc1OC	ZINC000217620355	569880640	/nfs/dbraw/zinc/88/06/40/569880640.db2.gz	AGCVJFDZCYTURO-INIZCTEOSA-N	0	1	464.482	1.686	50	70	biogenic	JDIAMN