smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cnn(C)c1	ZINC000159465133	323333832	/nfs/dbraw/zinc/33/38/32/323333832.db2.gz	LQJQPDISYGNTJX-SFHVURJKSA-N	2	0	342.491	2.198	40	70		EEIBRP
CC[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC)CC2)nc1)c1cnn(C)c1	ZINC000159465262	323333877	/nfs/dbraw/zinc/33/38/77/323333877.db2.gz	LQJQPDISYGNTJX-GOSISDBHSA-N	2	0	342.491	2.198	40	70		EEIBRP
C[C@@H]1C[N@H+](C[C@@H]2CCCO2)CC[C@@H]1[NH2+]CCc1ccc2c(c1)OCO2	ZINC000161140111	463403357	/nfs/dbraw/zinc/40/33/57/463403357.db2.gz	MMEZOPIAQKQLAW-NJAFHUGGSA-N	2	0	346.471	2.437	40	70		EEIBRP