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+])NN=Cc1cccc(C=NNC(N)=[NH2+])c1	ZINC000003160059	181188582	/nfs/dbraw/zinc/18/85/82/181188582.db2.gz	XMHHBYPIBVIERY-IAGONARPSA-N	2	0	246.278	-0.679	1	30		BBEFRP
NC(=[NH2+])NCCC[C@H]([NH3+])C(=O)N1CCCCC1	ZINC000013529495	181323280	/nfs/dbraw/zinc/32/32/80/181323280.db2.gz	BJEKZAHKFCREOG-VIFPVBQESA-N	2	0	241.339	-0.620	1	30		BBEFRP
NC(=[NH2+])N=NCCCCCN=NC(N)=[NH2+]	ZINC000017002896	181188352	/nfs/dbraw/zinc/18/83/52/181188352.db2.gz	ORERENAVIWMBDV-QGVJZHQLSA-N	2	0	212.261	-0.906	1	30		BBEFRP
C=CCNC(=[NH2+])NCCC[C@H]([NH3+])C(C)=O	ZINC000027300394	166349327	/nfs/dbraw/zinc/34/93/27/166349327.db2.gz	SQSAXRFSMUPPDO-VIFPVBQESA-N	2	0	212.297	-0.227	1	30		BBEFRP
C=CCNC(=[NH2+])NCCC[C@@H]([NH3+])C(C)=O	ZINC000027300398	166348295	/nfs/dbraw/zinc/34/82/95/166348295.db2.gz	SQSAXRFSMUPPDO-SECBINFHSA-N	2	0	212.297	-0.227	1	30		BBEFRP
NC(=[NH2+])NCCC[C@@H]([NH3+])C(=O)N1CCCCC1	ZINC000027557966	181323051	/nfs/dbraw/zinc/32/30/51/181323051.db2.gz	BJEKZAHKFCREOG-SECBINFHSA-N	2	0	241.339	-0.620	1	30		BBEFRP
[NH3+]CC[C@H]1C[NH+]=C(Nc2cccnc2)N1	ZINC000066166390	181410930	/nfs/dbraw/zinc/41/09/30/181410930.db2.gz	CVWCWWMXURGMEP-VIFPVBQESA-N	2	0	205.265	-0.021	1	30		BBEFRP
N#C[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)[C@@H]([NH3+])C1CC[NH2+]CC1	ZINC000095586229	181061698	/nfs/dbraw/zinc/06/16/98/181061698.db2.gz	BVSOWHKXCNTPHK-RHYQMDGZSA-N	2	0	248.330	-0.174	1	30		BBEFRP