smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCN(C)CCNC(=O)c1cnn2c1[nH]c(C)c(Cc1ccccc1F)c2=O	ZINC000020136928	568589908	/nfs/dbraw/zinc/58/99/08/568589908.db2.gz	BVFVJMYLMDRHEZ-UHFFFAOYSA-N	0	3	413.497	2.935	10	10		HFCEHN
CNC(=O)c1ccc2c(c1)CCO[C@@H]2CCN1CCN(c2ccc(OC)cc2)CC1	ZINC000013779786	560220432	/nfs/dbraw/zinc/22/04/32/560220432.db2.gz	UDLSEQDYARNKTL-HSZRJFAPSA-N	0	3	409.530	2.881	10	10	in-vitro	HFCEHN
CN(C)c1ccc(CN[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3Nc2nccc(C(C)(C)C)n2)cc1	ZINC000005398596	291220180	/nfs/dbraw/zinc/22/01/80/291220180.db2.gz	HDWXISQPOSGONX-FMWKFLBASA-N	0	3	411.550	2.577	10	10	biogenic	HFCEHN
CCON1C(=O)C[C@@H](C(=O)OC)C12CCN(C/C=C/c1ccc(N(C)C)cc1)CC2	ZINC000072132909	520226380	/nfs/dbraw/zinc/22/63/80/520226380.db2.gz	RFEGOXODTDVYJX-YJJPMGAVSA-N	0	3	415.534	2.573	10	10		HFCEHN