smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H](NCc1cn(C)nc1C(F)(F)F)c1ccc(F)c(F)c1	ZINC000159792343	525548759	/nfs/dbraw/zinc/54/87/59/525548759.db2.gz	JVYRGVOGBLPWBC-MRVPVSSYSA-N	0	1	319.277	3.568	50	70		DHIAMN
Cc1ccsc1CN(C)Cc1cnc(N2CCCC2)s1	ZINC000218437293	563716148	/nfs/dbraw/zinc/71/61/48/563716148.db2.gz	JMTSPSPUJFWMHG-UHFFFAOYSA-N	0	1	307.488	3.745	50	70		DHIAMN
CCc1nc(CN[C@@H](c2ccc(F)cc2F)C(C)(C)C)n[nH]1	ZINC000160502880	522347419	/nfs/dbraw/zinc/34/74/19/522347419.db2.gz	RQJKVUIRQCLBRM-HNNXBMFYSA-N	0	1	308.376	3.522	50	70		DHIAMN
CCc1nc(CN[C@H](c2ccc(F)cc2F)C(C)(C)C)n[nH]1	ZINC000160502999	522354715	/nfs/dbraw/zinc/35/47/15/522354715.db2.gz	RQJKVUIRQCLBRM-OAHLLOKOSA-N	0	1	308.376	3.522	50	70		DHIAMN
C[C@H](NCc1cn(C)nc1C(F)(F)F)c1ccc(F)c(F)c1	ZINC000159792206	525475297	/nfs/dbraw/zinc/47/52/97/525475297.db2.gz	JVYRGVOGBLPWBC-QMMMGPOBSA-N	0	1	319.277	3.568	50	70		DHIAMN