smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NC(=[NH2+])NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@H](CO)C(=O)[O-]	ZINC000026830307	527124617	/nfs/dbraw/zinc/12/46/17/527124617.db2.gz	NNRFRJQMBSBXGO-XHNCKOQMSA-N	-1	1	433.422	-4.995	40	30		IAEBMM
NC(=[NH2+])NCCC[C@H](N)C(=O)NCC(=O)N[C@H](CC(=O)[O-])C(=O)N[C@@H](CO)C(=O)[O-]	ZINC000035332954	527125087	/nfs/dbraw/zinc/12/50/87/527125087.db2.gz	NNRFRJQMBSBXGO-YIZRAAEISA-N	-1	1	433.422	-4.995	40	30		IAEBMM
NC(=[NH2+])NCCC[C@H](N)C(=O)NCC(=O)N[C@H](CCC(=O)[O-])C(=O)N[C@H](CO)C(=O)[O-]	ZINC000255969360	569255749	/nfs/dbraw/zinc/25/57/49/569255749.db2.gz	DJXDNYKQOZYOFK-IVZWLZJFSA-N	-1	1	447.449	-4.605	40	30		IAEBMM
NC(=[NH2+])NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCC(=O)[O-])C(=O)N[C@H](CO)C(=O)[O-]	ZINC000255969361	569255758	/nfs/dbraw/zinc/25/57/58/569255758.db2.gz	DJXDNYKQOZYOFK-LPEHRKFASA-N	-1	1	447.449	-4.605	40	30		IAEBMM
NC(=[NH2+])NCCC[C@H](N)C(=O)NCC(=O)N[C@H](CC(=O)[O-])C(=O)N[C@H](CS)C(=O)[O-]	ZINC000644163746	557093570	/nfs/dbraw/zinc/09/35/70/557093570.db2.gz	AEGSIYIIMVBZQU-DJLDLDEBSA-N	-1	1	449.490	-3.848	40	30		IAEBMM
NC(=[NH2+])NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CC(=O)[O-])C(=O)N[C@H](CS)C(=O)[O-]	ZINC000644163747	557093722	/nfs/dbraw/zinc/09/37/22/557093722.db2.gz	AEGSIYIIMVBZQU-XHNCKOQMSA-N	-1	1	449.490	-3.848	40	30		IAEBMM