smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1c2ccccc2[nH+]c2c3cccnc3ccc12	ZINC000003826528	187247065	/nfs/dbraw/zinc/24/70/65/187247065.db2.gz	RHRDMKUIKRPSNC-UHFFFAOYSA-N	1	0	245.285	3.518	1	10		BHCFRO
CN(C)c1ccc(N[N+](=O)c2ccccc2)cc1	ZINC000004096371	560193918	/nfs/dbraw/zinc/19/39/18/560193918.db2.gz	AVLLFBZLCFQWSX-ICFOKQHNSA-N	1	0	241.294	3.678	1	10	in-vitro	BHCFRO
O=C1N=c2ccccc2=C1NNc1cccc[nH+]1	ZINC000102819469	183253196	/nfs/dbraw/zinc/25/31/96/183253196.db2.gz	RAKUQDIILFQMQB-MSUUIHNZSA-N	1	0	238.250	3.684	1	10		BHCFRO
O=C1N=c2ccccc2=C1NNc1cccc[nH+]1	ZINC000102819472	183253498	/nfs/dbraw/zinc/25/34/98/183253498.db2.gz	RAKUQDIILFQMQB-WUKNDPDISA-N	1	0	238.250	3.684	1	10		BHCFRO
C[NH+](C)[C@]1(C)C=CC(/N=N/c2ccccc2)=CC1	ZINC000083406857	368337077	/nfs/dbraw/zinc/33/70/77/368337077.db2.gz	PKTQOPZIKSCWCB-XNSRXUQDSA-N	1	0	241.338	3.934	2	10		BHCFRO
C[NH+](C)[C@@]1(C)C=CC(/N=N/c2ccccc2)=CC1	ZINC000083406862	368337189	/nfs/dbraw/zinc/33/71/89/368337189.db2.gz	PKTQOPZIKSCWCB-MWWIPNPYSA-N	1	0	241.338	3.934	2	10		BHCFRO