smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
c1ccc2c(c1)[nH+]c(N1CCCCC1)c1ccccc21	ZINC000035938052	570232990	/nfs/dbraw/zinc/23/29/90/570232990.db2.gz	CRPZJMIZBLMWCK-UHFFFAOYSA-N	1	2	262.356	4.378	50	5		CIBALO
c1ccc2c(c1)[nH+]c1ccccc1c2Cc1ccncc1	ZINC000005422181	170097505	/nfs/dbraw/zinc/09/75/05/170097505.db2.gz	UEEVOHOQPJRVIB-UHFFFAOYSA-N	1	2	270.335	4.374	50	5		CIBALO
O=[N+]([O-])c1ccc(Nc2ccc([NH+]3CCCCC3)cc2)cc1	ZINC000089793189	135060932	/nfs/dbraw/zinc/06/09/32/135060932.db2.gz	UCJOSEPUZUQMIC-UHFFFAOYSA-N	1	2	297.358	4.329	50	5		CIBALO
CCSc1nc2ccccc2c2[nH+]c3ccccc3n21	ZINC000003489575	567175986	/nfs/dbraw/zinc/17/59/86/567175986.db2.gz	FOJRXDAJKTZFGO-UHFFFAOYSA-N	1	2	279.368	4.148	50	5		CIBALO
FC(F)(F)c1nc2ccccc2c2[nH+]c3ccccc3n21	ZINC000000535603	570383252	/nfs/dbraw/zinc/38/32/52/570383252.db2.gz	LTFQPQOHQSKMQL-UHFFFAOYSA-N	1	2	287.244	4.055	50	5		CIBALO
CC(C)(C)c1cn2c3ccc4ccccc4c3[nH]c2[nH+]1	ZINC000005624957	170121531	/nfs/dbraw/zinc/12/15/31/170121531.db2.gz	KUNLKKODBHSRAN-UHFFFAOYSA-N	1	2	263.344	4.266	50	5		CIBALO