smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC[NH+](C)C[C@@H]1CCN(c2nc(N3CC[C@H](C[N@@H+](C)CCC)C3)nc(C)c2[N+](=O)[O-])C1	ZINC000095446241	569367240	/nfs/dbraw/zinc/36/72/40/569367240.db2.gz	KYMUBVHZOIJLJT-VQTJNVASSA-N	2	0	447.628	3.029	50	5		IGBARP
CCC[NH+](C)C[C@@H]1CCN(c2nc(N3CC[C@@H](C[N@@H+](C)CCC)C3)nc(C)c2[N+](=O)[O-])C1	ZINC000222016946	557138919	/nfs/dbraw/zinc/13/89/19/557138919.db2.gz	KYMUBVHZOIJLJT-PMACEKPBSA-N	2	0	447.628	3.029	50	5		IGBARP
CCC[NH+](C)C[C@H]1CCN(c2nc(N3CC[C@@H](C[N@@H+](C)CCC)C3)nc(C)c2[N+](=O)[O-])C1	ZINC000108143892	557541437	/nfs/dbraw/zinc/54/14/37/557541437.db2.gz	KYMUBVHZOIJLJT-UXHICEINSA-N	2	0	447.628	3.029	50	5		IGBARP
C[N+](C)(CCOC(=O)/C=C/C(=O)OCC[N+](C)(C)Cc1ccccc1)Cc1ccccc1	ZINC000020293451	557005951	/nfs/dbraw/zinc/00/59/51/557005951.db2.gz	ZTZIWSCEBUNUTR-FOCLMDBBSA-N	2	0	440.584	3.182	50	5		IGBARP
CC(C)C[NH+]1CCC(Nc2nc(N)nc(NC3CC[NH+](CC(C)C)CC3)c2[N+](=O)[O-])CC1	ZINC000225650303	569406354	/nfs/dbraw/zinc/40/63/54/569406354.db2.gz	LJZCRKFBEORPGL-UHFFFAOYSA-N	2	0	448.616	3.032	50	5		IGBARP
CCC[NH+](C)C[C@H]1CCN(c2nc(N3CC[C@H](C[N@@H+](C)CCC)C3)nc(C)c2[N+](=O)[O-])C1	ZINC000095446242	569367363	/nfs/dbraw/zinc/36/73/63/569367363.db2.gz	KYMUBVHZOIJLJT-WOJBJXKFSA-N	2	0	447.628	3.029	50	5		IGBARP