smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1nc2c(c(N)n1)[C@@H](CCc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)CC2	ZINC000001535479	562922561	/nfs/dbraw/zinc/92/25/61/562922561.db2.gz	DSEABRSLDYUZCE-WFASDCNBSA-N	-2	1	427.461	1.351	10	0		IDAEML
Nc1nc2c(c(N)n1)[C@H](CCc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)CC2	ZINC000003789073	562938054	/nfs/dbraw/zinc/93/80/54/562938054.db2.gz	DSEABRSLDYUZCE-DOMZBBRYSA-N	-2	1	427.461	1.351	10	0		IDAEML
Nc1nc2c(c(N)n1)[C@H](CCCc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)CC2	ZINC000003789075	562938011	/nfs/dbraw/zinc/93/80/11/562938011.db2.gz	DSPMDRAVVJOBBC-CJNGLKHVSA-N	-2	1	441.488	1.742	10	0		IDAEML
Nc1nc2c(c(N)n1)[C@@H](CCCc1ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc1)CC2	ZINC000011686992	562979059	/nfs/dbraw/zinc/97/90/59/562979059.db2.gz	DSPMDRAVVJOBBC-BBRMVZONSA-N	-2	1	441.488	1.742	10	0		IDAEML
C[C@H](N[C@H](CCc1ccccc1)C(=O)[O-])C(=O)N1CC2(C[C@H]1C(=O)[O-])SCCS2	ZINC000084689855	563176237	/nfs/dbraw/zinc/17/62/37/563176237.db2.gz	FMMDBLMCSDRUPA-IMJJTQAJSA-N	-2	1	438.571	1.912	10	0		IDAEML