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+]C1CC[NH+]([C@H](C)c2ccncc2)CC1)c1ccccc1O	ZINC000156846799	564148881	/nfs/dbraw/zinc/14/88/81/564148881.db2.gz	NYWVMZISQIREEO-UZLBHIALSA-N	2	2	339.483	4.054	50	10		EICALP
CC[C@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccncc2)CC1)c1ccccc1O	ZINC000156846495	563961418	/nfs/dbraw/zinc/96/14/18/563961418.db2.gz	NYWVMZISQIREEO-JXFKEZNVSA-N	2	2	339.483	4.054	50	10		EICALP
CC[C@@H]([NH2+]C1CC[NH+]([C@H](C)c2ccncc2)CC1)c1ccccc1O	ZINC000156846933	564148889	/nfs/dbraw/zinc/14/88/89/564148889.db2.gz	NYWVMZISQIREEO-OXQOHEQNSA-N	2	2	339.483	4.054	50	10		EICALP
Cc1cc(C[NH2+][C@H](C)Cn2cc[nH+]c2)c(C)n1-c1ccc(Cl)cc1	ZINC000030909839	563911762	/nfs/dbraw/zinc/91/17/62/563911762.db2.gz	GZRXJTAIOHVCJH-CQSZACIVSA-N	2	2	342.874	4.122	50	10		EICALP
CC[NH2+]Cc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)ccc1O	ZINC000005139697	210398034	/nfs/dbraw/zinc/39/80/34/210398034.db2.gz	VRXFDHAGFYWGHT-UHFFFAOYSA-N	2	2	327.815	4.447	50	10	world	EICALP
Cc1cc(C[NH2+][C@@H](C)Cn2cc[nH+]c2)c(C)n1-c1ccc(Cl)cc1	ZINC000030909837	563911838	/nfs/dbraw/zinc/91/18/38/563911838.db2.gz	GZRXJTAIOHVCJH-AWEZNQCLSA-N	2	2	342.874	4.122	50	10		EICALP
CC[C@@H]([NH2+]C1CC[NH+]([C@@H](C)c2ccncc2)CC1)c1ccccc1O	ZINC000156846653	564148876	/nfs/dbraw/zinc/14/88/76/564148876.db2.gz	NYWVMZISQIREEO-OXJNMPFZSA-N	2	2	339.483	4.054	50	10		EICALP