smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1ccc2c(c1)n(C)c(=O)n2C	ZINC000218125953	568475258	/nfs/dbraw/zinc/47/52/58/568475258.db2.gz	RREBAIRURSVERS-LLVKDONJSA-N	-1	1	401.423	0.006	50	70		HCIAMM
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1ccc2c(c1)n(C)c(=O)n2C	ZINC000218126046	568475227	/nfs/dbraw/zinc/47/52/27/568475227.db2.gz	RREBAIRURSVERS-NSHDSACASA-N	-1	1	401.423	0.006	50	70		HCIAMM
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1ccc(OC)c(OC)c1OC	ZINC000218255037	568476939	/nfs/dbraw/zinc/47/69/39/568476939.db2.gz	VUBRLTBEHUOAOG-LLVKDONJSA-N	-1	1	407.423	0.842	50	70		HCIAMM
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1ccc(OC)c(OC)c1OC	ZINC000218255096	568476946	/nfs/dbraw/zinc/47/69/46/568476946.db2.gz	VUBRLTBEHUOAOG-NSHDSACASA-N	-1	1	407.423	0.842	50	70		HCIAMM
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1coc2ccc(OC)cc2c1=O	ZINC000218270056	568837093	/nfs/dbraw/zinc/83/70/93/568837093.db2.gz	GCMGEWLSNVGYKJ-LLVKDONJSA-N	-1	1	415.402	0.931	50	70		HCIAMM
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1coc2ccc(OC)cc2c1=O	ZINC000218270100	568837185	/nfs/dbraw/zinc/83/71/85/568837185.db2.gz	GCMGEWLSNVGYKJ-NSHDSACASA-N	-1	1	415.402	0.931	50	70		HCIAMM
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1cc(OC)c2c(c1)OCCO2	ZINC000218414354	568480004	/nfs/dbraw/zinc/48/00/04/568480004.db2.gz	CYACIGMWZLCCEI-LLVKDONJSA-N	-1	1	405.407	0.596	50	70		HCIAMM
CCOC(=O)Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1cc(OC)c2c(c1)OCCO2	ZINC000218414432	568479998	/nfs/dbraw/zinc/47/99/98/568479998.db2.gz	CYACIGMWZLCCEI-NSHDSACASA-N	-1	1	405.407	0.596	50	70		HCIAMM