smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])C(=O)C=C([O-])c1cn(Cc2ccc(F)cc2)c2c(F)cccc2c1=O	ZINC000101673344	208395484	/nfs/dbraw/zinc/39/54/84/208395484.db2.gz	AZZOZCBKBCEJEZ-IUXPMGMMSA-N	-2	3	385.322	3.037	1	30		GGEFHL
CCc1ccc(C#Cc2ccc(S(=O)(=O)[N-][C@@H](C(=O)[O-])C(C)C)s2)cc1	ZINC000013797370	209164189	/nfs/dbraw/zinc/16/41/89/209164189.db2.gz	ZDCLAWKUXDCGDW-GOSISDBHSA-N	-2	3	391.514	3.098	1	30		GGEFHL
C=C(C)[C@H](O)COc1ccc(-c2cc(=O)c3c([O-])c(OC)c([O-])cc3o2)cc1	ZINC000084587386	212150073	/nfs/dbraw/zinc/15/00/73/212150073.db2.gz	RSFSMBFMVJOURC-MRXNPFEDSA-N	-2	3	384.384	3.196	1	30		GGEFHL
Cc1cc([O-])c2c3c1C(=O)C=C1[C@H]3c3c(c([O-])cc([O-])c3C(=O)C1(C)C)C2=O	ZINC000101719297	211404966	/nfs/dbraw/zinc/40/49/66/211404966.db2.gz	IONFRYWOAORJAZ-CQSZACIVSA-N	-3	3	376.364	3.133	1	30		GGEFHL
CC(C)(CNC(=O)c1ccccc1[O-])CC1=C([O-])c2ccccc2C(=O)C1=O	ZINC000073198075	211125782	/nfs/dbraw/zinc/12/57/82/211125782.db2.gz	FJGRCAJVHMWTCH-UHFFFAOYSA-N	-2	3	379.412	3.430	1	30		GGEFHL
CC(C)(CNC(=O)c1ccccc1[O-])CC1=C([O-])C(=O)c2ccccc2C1=O	ZINC000073198075	211125786	/nfs/dbraw/zinc/12/57/86/211125786.db2.gz	FJGRCAJVHMWTCH-UHFFFAOYSA-N	-2	3	379.412	3.430	1	30		GGEFHL
C=C(C)[C@@H](O)COc1ccc(-c2cc(=O)c3c([O-])c(OC)c([O-])cc3o2)cc1	ZINC000084587394	212149950	/nfs/dbraw/zinc/14/99/50/212149950.db2.gz	RSFSMBFMVJOURC-INIZCTEOSA-N	-2	3	384.384	3.196	1	30		GGEFHL