smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1NC(=S)N(C2CCCCC2)C(=O)C1=CNCCN1CC[NH2+]CC1	ZINC000020189032	220317941	/nfs/dbraw/zinc/31/79/41/220317941.db2.gz	IRSFQSYDNWQKEQ-WYMLVPIESA-N	1	0	365.503	-0.059	50	10		FBCARO
Cc1ccccc1N1C(=O)[N-]C(=O)C(=CNCCN2CC[NH2+]CC2)C1=O	ZINC000100753436	132233134	/nfs/dbraw/zinc/23/31/34/132233134.db2.gz	QBRSOLDMMBVYRT-WYMLVPIESA-N	1	0	357.414	-0.043	50	10		FBCARO
COc1ccc(N2C(=O)[N-]C(=O)C(=CNCCN3CC[NH2+]CC3)C2=O)cc1	ZINC000100761102	132233130	/nfs/dbraw/zinc/23/31/30/132233130.db2.gz	LUQFCCTZEFMOFB-NTCAYCPXSA-N	1	0	373.413	-0.343	50	10		FBCARO
COc1ccccc1N1C(=O)[N-]C(=O)C(=CNCCN2CC[NH2+]CC2)C1=O	ZINC000100769082	132233202	/nfs/dbraw/zinc/23/32/02/132233202.db2.gz	KRDWXAPCOVCCPD-OUKQBFOZSA-N	1	0	373.413	-0.343	50	10		FBCARO
COc1cccc(N2C(=O)[N-]C(=O)C(=CNCCN3CC[NH2+]CC3)C2=O)c1	ZINC000100781608	132233152	/nfs/dbraw/zinc/23/31/52/132233152.db2.gz	GYNJXQHWVDYUII-NTCAYCPXSA-N	1	0	373.413	-0.343	50	10		FBCARO