smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#Cc1c2c(cnc1N1CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@@H+]3CC3CC3)C1)C[NH2+]CCC2	ZINC001164751280	720810010	/nfs/dbraw/zinc/81/00/10/720810010.db2.gz	XZQFLJBXZMKLGV-KKLQWCBXSA-N	2	0	432.576	1.960	20	30		IDEDRP
Cn1nnc2c1CCN(c1ncc3c(c1C#N)CCC[NH2+]C3)[C@H]2COCC[NH+]1CCCC1	ZINC001164712298	720166527	/nfs/dbraw/zinc/16/65/27/720166527.db2.gz	FKTHIUKSURVXQM-NRFANRHFSA-N	2	0	436.564	1.334	20	30		IDEDRP
Cn1nnc2c1CCN(c1ncc3c(c1C#N)CCC[NH2+]C3)[C@@H]2COCC[NH+]1CCCC1	ZINC001164712301	720166591	/nfs/dbraw/zinc/16/65/91/720166591.db2.gz	FKTHIUKSURVXQM-OAQYLSRUSA-N	2	0	436.564	1.334	20	30		IDEDRP
N#Cc1c2c(cnc1N1CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@@H+]3CC3CC3)C1)C[NH2+]CCC2	ZINC001164751279	720809943	/nfs/dbraw/zinc/80/99/43/720809943.db2.gz	XZQFLJBXZMKLGV-JXHRLWIKSA-N	2	0	432.576	1.960	20	30		IDEDRP
N#Cc1c2c(cnc1N1CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@@H+]3CC3CC3)C1)C[NH2+]CCC2	ZINC001164751281	720809846	/nfs/dbraw/zinc/80/98/46/720809846.db2.gz	XZQFLJBXZMKLGV-QMHWCDLVSA-N	2	0	432.576	1.960	20	30		IDEDRP
N#Cc1c2c(cnc1N1CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@@H+]3CC3CC3)C1)C[NH2+]CCC2	ZINC001164751278	720809721	/nfs/dbraw/zinc/80/97/21/720809721.db2.gz	XZQFLJBXZMKLGV-GREBRCKQSA-N	2	0	432.576	1.960	20	30		IDEDRP