smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(=O)OC[C@@H]1O[C@@H](n2c(C#N)cc(=O)[nH]c2=O)C[C@H]1OC(C)=O	ZINC000005664270	278219302	/nfs/dbraw/zinc/21/93/02/278219302.db2.gz	ZBTRHDRHWZYQKV-NTZNESFSSA-N	0	2	337.288	-0.809	40	30		EBEBLN
CCOC(=O)C(=O)C(=Cn1c(=O)cc(O)[nH]c1=S)C(=O)OCC	ZINC000005827998	375905958	/nfs/dbraw/zinc/90/59/58/375905958.db2.gz	PMMMDWHZOQYWLX-VOTSOKGWSA-N	0	2	342.329	-0.390	40	30		EBEBLN
CC(=O)OC[C@H]1O[C@@H](n2c(C#N)cc(=O)[nH]c2=O)C[C@H]1OC(C)=O	ZINC000005664107	278219877	/nfs/dbraw/zinc/21/98/77/278219877.db2.gz	ZBTRHDRHWZYQKV-NQBHXWOUSA-N	0	2	337.288	-0.809	40	30		EBEBLN
CCOC(=O)C(=O)C(=Cn1c(O)cc(=O)[nH]c1=S)C(=O)OCC	ZINC000016958370	375996996	/nfs/dbraw/zinc/99/69/96/375996996.db2.gz	PMMMDWHZOQYWLX-SREVYHEPSA-N	0	2	342.329	-0.801	40	30		EBEBLN
CCOC(=O)C(=O)C(=Cn1c(=O)cc(O)[nH]c1=S)C(=O)OCC	ZINC000016958370	375997009	/nfs/dbraw/zinc/99/70/09/375997009.db2.gz	PMMMDWHZOQYWLX-SREVYHEPSA-N	0	2	342.329	-0.801	40	30		EBEBLN
CC(=O)OC[C@@H]1O[C@@H](n2c(C#N)cc(=O)[nH]c2=O)C[C@@H]1OC(C)=O	ZINC000005664293	278219261	/nfs/dbraw/zinc/21/92/61/278219261.db2.gz	ZBTRHDRHWZYQKV-GMXVVIOVSA-N	0	2	337.288	-0.809	40	30		EBEBLN
CC(=O)OC[C@H]1O[C@@H](n2c(C#N)cc(=O)[nH]c2=O)C[C@@H]1OC(C)=O	ZINC000005664137	377330468	/nfs/dbraw/zinc/33/04/68/377330468.db2.gz	ZBTRHDRHWZYQKV-DMDPSCGWSA-N	0	2	337.288	-0.809	40	30		EBEBLN