smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1COC(=O)C1=C1C(=O)NC(=O)NC1=O	ZINC000001589553	342704671	/nfs/dbraw/zinc/70/46/71/342704671.db2.gz	GWMKPMNCTOIDCN-UHFFFAOYSA-N	0	2	224.128	-2.225	40	30		BAEBLN
O=C1CCC(O)=C1C1(O)C(=O)NC(=O)NC1=O	ZINC000005464704	342764238	/nfs/dbraw/zinc/76/42/38/342764238.db2.gz	UDWZOTOVGWAXMB-UHFFFAOYSA-N	0	2	240.171	-1.742	40	30		BAEBLN
N/C(=N\O)c1c(N)[n+]([O-])c2ccccc2[n+]1[O-]	ZINC000100003316	181181614	/nfs/dbraw/zinc/18/16/14/181181614.db2.gz	OXAXXPTUBUZEJA-UHFFFAOYSA-N	0	2	235.203	-1.217	40	30		BAEBLN