smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(C=Nc2ccc3nc(C)[nH]c3c2)o1	ZINC000005322610	180076605	/nfs/dbraw/zinc/07/66/05/180076605.db2.gz	MITAUMDRXJCWBH-NVNXTCNLSA-N	0	1	239.278	3.523	1	30		BHEFMN
Cc1nc2ccc(N=Cc3cccs3)cc2[nH]1	ZINC000005940881	180076939	/nfs/dbraw/zinc/07/69/39/180076939.db2.gz	PXLBYEFMDVMUAG-ZSOIEALJSA-N	0	1	241.319	3.683	1	30		BHEFMN
C=CCCCC[C@]1(C)SC(=O)C(C)=C1O	ZINC000013678488	187251333	/nfs/dbraw/zinc/25/13/33/187251333.db2.gz	VHYQZNQCEOCRPW-LBPRGKRZSA-N	0	1	226.341	3.597	1	30		BHEFMN
Cc1nc2ccc(N=Cc3ccc(C)cc3)cc2[nH]1	ZINC000028652001	188283808	/nfs/dbraw/zinc/28/38/08/188283808.db2.gz	GCBORUQPAAPZGJ-YVLHZVERSA-N	0	1	249.317	3.930	1	30		BHEFMN
N#Cc1ccc2nc(C=Cc3ccccc3)[nH]c2c1	ZINC000028869380	181130959	/nfs/dbraw/zinc/13/09/59/181130959.db2.gz	FARVTWKKNLTOMZ-VQHVLOKHSA-N	0	1	245.285	3.605	1	30		BHEFMN
CC1=C(O)[C@@](C)(CC2CCCCC2)SC1=O	ZINC000101032234	168088501	/nfs/dbraw/zinc/08/85/01/168088501.db2.gz	KAXPGECXKUZZJW-CYBMUJFWSA-N	0	1	240.368	3.821	1	30		BHEFMN
CC1=C(O)[C@](C)(CC2CCCCC2)SC1=O	ZINC000101032235	168088516	/nfs/dbraw/zinc/08/85/16/168088516.db2.gz	KAXPGECXKUZZJW-ZDUSSCGKSA-N	0	1	240.368	3.821	1	30		BHEFMN
CCCC/C=C/[C@]1(C)SC(=O)C(C)=C1O	ZINC000101122611	188323101	/nfs/dbraw/zinc/32/31/01/188323101.db2.gz	ZTFVKDBRMHIWTA-GUOLPTJISA-N	0	1	226.341	3.597	1	30		BHEFMN
Cc1ccc(C(=O)CC=Nc2ccccn2)cc1	ZINC000101728999	178352410	/nfs/dbraw/zinc/35/24/10/178352410.db2.gz	RIMSZFLGKGNZGP-IVYHHUKSSA-N	0	1	238.290	3.691	1	30		BHEFMN