smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CCN2c3ccc(/C=C4/C(=O)[N-]C(=O)N(C)C4=O)cc3CC3(C(=O)N(C)C(=O)N(C)C3=O)[C@@H]2C1	ZINC000009487893	523931025	/nfs/dbraw/zinc/93/10/25/523931025.db2.gz	QVXGRVDKXSNWIX-MJSCBBHESA-N	-1	3	494.508	-0.509	50	10		JBCAHM
COC(=O)c1nc(O)c2c(c1C(=O)OC)C(=O)c1c(=O)[n-]c(C(=O)OC)c(C(=O)OC)c1C2=O	ZINC000012296530	522386779	/nfs/dbraw/zinc/38/67/79/522386779.db2.gz	YYHLACNFNPJJCY-UHFFFAOYSA-N	-1	3	474.334	-0.190	50	10	biogenic	JBCAHM
CN1CCN2c3ccc(NC=C4C(=O)N(C)C(=O)N(C)C4=O)cc3CC3(C(=O)[N-]C(=O)NC3=O)[C@@H]2C1	ZINC000016956872	556187655	/nfs/dbraw/zinc/18/76/55/556187655.db2.gz	CTVHNTQXJHVYLU-INIZCTEOSA-N	-1	3	495.496	-0.938	50	10		JBCAHM