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)NCCNC(=O)c1ccc2c(c1)C(=O)c1cc(C(=O)NCCNC(=O)[C@@H]([NH3+])CCCNC(N)=[NH2+])ccc1C2=O	ZINC000049833185	562687586	/nfs/dbraw/zinc/68/75/86/562687586.db2.gz	LWHMZXKSXOZJTB-ZEQRLZLVSA-N	3	3	692.782	-2.665	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCCNC(=O)c1ccc2c(c1)C(=O)c1cc(C(=O)NCCNC(=O)[C@@H](N)CCCNC(N)=[NH2+])ccc1C2=O	ZINC000049833185	562687585	/nfs/dbraw/zinc/68/75/85/562687585.db2.gz	LWHMZXKSXOZJTB-ZEQRLZLVSA-N	2	3	692.782	-2.665	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCCNC(=O)c1ccc2c(c1)C(=O)c1ccc(C(=O)NCCNC(=O)[C@@H]([NH3+])CCCNC(N)=[NH2+])cc1C2=O	ZINC000049841085	562688026	/nfs/dbraw/zinc/68/80/26/562688026.db2.gz	QVYRCXMPGSOIMQ-ZEQRLZLVSA-N	3	3	692.782	-2.665	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCCNC(=O)c1ccc2c(c1)C(=O)c1ccc(C(=O)NCCNC(=O)[C@@H](N)CCCNC(N)=[NH2+])cc1C2=O	ZINC000049841085	562688025	/nfs/dbraw/zinc/68/80/25/562688025.db2.gz	QVYRCXMPGSOIMQ-ZEQRLZLVSA-N	2	3	692.782	-2.665	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CCNC(=O)[C@@H]([NH3+])CCCNC(N)=[NH2+])cc1C2=O	ZINC000049841182	562688061	/nfs/dbraw/zinc/68/80/61/562688061.db2.gz	ACMGEEZJVIQSKY-ZEQRLZLVSA-N	3	3	692.782	-1.467	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CCNC(=O)[C@@H](N)CCCNC(N)=[NH2+])cc1C2=O	ZINC000049841182	562688060	/nfs/dbraw/zinc/68/80/60/562688060.db2.gz	ACMGEEZJVIQSKY-ZEQRLZLVSA-N	2	3	692.782	-1.467	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CNC(=O)[C@@H](N)CCCNC(N)=[NH2+])cc1C2=O	ZINC000049889219	562691908	/nfs/dbraw/zinc/69/19/08/562691908.db2.gz	VUFPPHKRSROETE-VXKWHMMOSA-N	2	3	664.728	-2.247	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCCC(=O)Nc1ccc2c(c1)C(=O)c1cc(NC(=O)CCNC(=O)[C@@H]([NH3+])CCCNC(N)=[NH2+])ccc1C2=O	ZINC000049898554	562692643	/nfs/dbraw/zinc/69/26/43/562692643.db2.gz	JPLUTSOEDBHITH-ZEQRLZLVSA-N	3	3	692.782	-1.467	1	10		KACFHP
NC(=[NH2+])NCCC[C@H](N)C(=O)NCCC(=O)Nc1ccc2c(c1)C(=O)c1cc(NC(=O)CCNC(=O)[C@@H](N)CCCNC(N)=[NH2+])ccc1C2=O	ZINC000049898554	562692642	/nfs/dbraw/zinc/69/26/42/562692642.db2.gz	JPLUTSOEDBHITH-ZEQRLZLVSA-N	2	3	692.782	-1.467	1	10		KACFHP
N[C@H](CCC[NH3+])C(=O)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CNC(=O)[C@H](N)CCC[NH3+])cc1C2=O	ZINC000653726150	562909119	/nfs/dbraw/zinc/90/91/19/562909119.db2.gz	LGRNRAHIZASTDX-FGZHOGPDSA-N	2	3	580.646	-1.296	1	10		KACFHP
N[C@H](CCC[NH3+])C(=O)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CNC(=O)[C@@H](N)CCC[NH3+])cc1C2=O	ZINC000653726151	562909108	/nfs/dbraw/zinc/90/91/08/562909108.db2.gz	LGRNRAHIZASTDX-SZPZYZBQSA-N	2	3	580.646	-1.296	1	10		KACFHP
N[C@@H](CCC[NH3+])C(=O)NCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CNC(=O)[C@@H](N)CCC[NH3+])cc1C2=O	ZINC000653726152	562909095	/nfs/dbraw/zinc/90/90/95/562909095.db2.gz	LGRNRAHIZASTDX-VXKWHMMOSA-N	2	3	580.646	-1.296	1	10		KACFHP