smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1CC[NH+]=C1c1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(C4=[NH+]CCN4C)cc3)c([N+](=O)[O-])c2)cc1	ZINC000001718924	551690623	/nfs/dbraw/zinc/69/06/23/551690623.db2.gz	APKIFJFYAFOIFV-UHFFFAOYSA-N	2	0	525.569	3.483	40	5		KGBBRP
CC[NH+](CC)CCOC(=O)c1ccc(C)c2oc3c(C)c(=O)c(N)c(C(=O)OCC[NH+](CC)CC)c-3nc12	ZINC000005124476	552494246	/nfs/dbraw/zinc/49/42/46/552494246.db2.gz	XNGJLDOCTPZNFD-UHFFFAOYSA-N	2	0	526.634	3.489	40	5		KGBBRP
CC[NH+](CC)CCOC(=O)c1cc2cc3cc(C(=O)OCC[NH+](CC)CC)c(=O)oc3c(C)c2oc1=O	ZINC000005496714	552503656	/nfs/dbraw/zinc/50/36/56/552503656.db2.gz	DYRLCHREYKGIFF-UHFFFAOYSA-N	2	0	514.575	3.205	40	5		KGBBRP
C[NH+](C)CCn1c(=O)c2ccc3c4ccc5c(=O)n(CC[NH+](C)C)c(=O)c6ccc(c7ccc(c1=O)c2c37)c4c56	ZINC000028640637	553843393	/nfs/dbraw/zinc/84/33/93/553843393.db2.gz	SGTIPCSEJAOIMZ-UHFFFAOYSA-N	2	0	532.600	3.086	40	5		KGBBRP
CN(C)c1nc(-c2ccc([N+](=O)[O-])cc2)[n+](CC[n+]2sc(N(C)C)nc2-c2ccc([N+](=O)[O-])cc2)s1	ZINC000103888157	571368666	/nfs/dbraw/zinc/36/86/66/571368666.db2.gz	KZZUVDBKQYPBTM-UHFFFAOYSA-N	2	0	528.620	3.157	40	5		KGBBRP