smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc2nc3cc(Nc4ccc([NH+](C)C)cc4)c(N)cc3nc2c1	ZINC000004786911	570606652	/nfs/dbraw/zinc/60/66/52/570606652.db2.gz	UEXSLTSNOSBPBX-UHFFFAOYSA-N	1	2	372.476	4.241	10	5		FIBELO
C[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1ccccc1[N+](=O)[O-]	ZINC000038038908	211365588	/nfs/dbraw/zinc/36/55/88/211365588.db2.gz	SYZVTGHQAXGMST-SNVBAGLBSA-N	1	2	353.191	4.347	10	5		FIBELO
Cc1cc(Nc2ccc([NH+](C)C)cc2)c([N+](=O)[O-])cc1Br	ZINC000098181364	222230319	/nfs/dbraw/zinc/23/03/19/222230319.db2.gz	IHFVUYAOKYZLMZ-UHFFFAOYSA-N	1	2	350.216	4.475	10	5		FIBELO
C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(Cl)c1	ZINC000120377268	568110563	/nfs/dbraw/zinc/11/05/63/568110563.db2.gz	RRCQKLMSLOVHJA-NSHDSACASA-N	1	2	358.785	4.149	10	5		FIBELO
O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ncc(-c3ccccc3)cn1)CCC2	ZINC000193289615	1120671129	/nfs/dbraw/zinc/67/11/29/1120671129.db2.gz	OLSVICWQPWERMT-HXUWFJFHSA-N	1	2	360.417	4.219	10	5		FIBELO
O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ncc(-c3ccccc3)cn1)CCC2	ZINC000193289625	1120670424	/nfs/dbraw/zinc/67/04/24/1120670424.db2.gz	OLSVICWQPWERMT-FQEVSTJZSA-N	1	2	360.417	4.219	10	5		FIBELO