smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC[NH+](CCCC)CCCN1C(=O)C(O)=C(C(C)=O)C1c1ccccc1[N+](=O)[O-]	ZINC000024672073	557328223	/nfs/dbraw/zinc/32/82/23/557328223.db2.gz	ZGTXLVOCJPYKRH-NRFANRHFSA-N	1	3	431.533	4.172	40	30		IIEBHO
C[NH+](C)Cc1ccccc1-c1ccc2n(c1=O)C[C@H]1C[C@@H]2CN(Cc2cccc(C#N)c2)C1	ZINC000004237328	291381769	/nfs/dbraw/zinc/38/17/69/291381769.db2.gz	XYXTUMZCAQKLJP-LADGPHEKSA-N	1	3	438.575	4.068	40	30	biogenic,in-vitro	IIEBHO
CCCC[NH+](CCCC)CCCN1C(=O)C(O)=C(C(C)=O)C1c1ccccc1[N+](=O)[O-]	ZINC000024672080	557328258	/nfs/dbraw/zinc/32/82/58/557328258.db2.gz	ZGTXLVOCJPYKRH-OAQYLSRUSA-N	1	3	431.533	4.172	40	30		IIEBHO