smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccccc1CNC(=O)[C@H]([NH3+])C(=O)NO	ZINC000035273394	179279894	/nfs/dbraw/zinc/27/98/94/179279894.db2.gz	OVUGDIXUGOZMJR-VIFPVBQESA-N	1	2	237.259	-0.556	1	30		BBEFLO
Cc1ccccc1CNC(=O)[C@@H]([NH3+])C(=O)NO	ZINC000035273398	179279259	/nfs/dbraw/zinc/27/92/59/179279259.db2.gz	OVUGDIXUGOZMJR-SECBINFHSA-N	1	2	237.259	-0.556	1	30		BBEFLO
[NH2+]=C(NO)NN=Cc1cccc(O)c1O	ZINC000040472262	181200115	/nfs/dbraw/zinc/20/01/15/181200115.db2.gz	PZTGMIVJDJXUOH-ONNFQVAWSA-N	1	2	210.193	-0.065	1	30		BBEFLO
C=CC[NH+](CC=C)[C@@H](CN1CC1)C(N)=O	ZINC000169344923	166337913	/nfs/dbraw/zinc/33/79/13/166337913.db2.gz	ZSRFZMQTTAFOHI-JTQLQIEISA-N	1	2	209.293	-0.170	1	30		BBEFLO
C=CC[NH+](CC=C)[C@H](CN1CC1)C(N)=O	ZINC000169344924	166337537	/nfs/dbraw/zinc/33/75/37/166337537.db2.gz	ZSRFZMQTTAFOHI-SNVBAGLBSA-N	1	2	209.293	-0.170	1	30		BBEFLO