smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1ccc([C@@H](c2c[nH]cc2-c2ccccc2Cl)n2cc[nH+]c2)cc1	ZINC000005974406	204159982	/nfs/dbraw/zinc/15/99/82/204159982.db2.gz	SDMAYONUBXMJRC-FQEVSTJZSA-N	1	2	378.819	5.078	1	5		GKBFLO
C[N+](C)(C)c1nc2c(s1)Cc1cc(-c3ccc(Oc4ccccc4)cc3)ccc1-2	ZINC000028465082	207342794	/nfs/dbraw/zinc/34/27/94/207342794.db2.gz	UWMBJMJFCUKWDP-UHFFFAOYSA-N	1	2	399.539	6.370	1	5		GKBFLO
COC(=O)[C@H](c1ccc2c(c1)OC(C)(C)O2)c1c2ccccc2[nH+]c2ccccc21	ZINC000026818907	207318918	/nfs/dbraw/zinc/31/89/18/207318918.db2.gz	GTLRAUMURPBKNZ-JOCHJYFZSA-N	1	2	399.446	5.200	1	5		GKBFLO
COc1ccc2[nH+]c3cc(Cl)ccc3c(Oc3ccc(C(C)=O)cc3)c2c1	ZINC000027524565	207326012	/nfs/dbraw/zinc/32/60/12/207326012.db2.gz	ZWXYIVXXTIUDGO-UHFFFAOYSA-N	1	2	377.827	6.045	1	5		GKBFLO
Cc1cccc2cc(-c3nc4ccccc4c4[nH+]c5ccccc5n43)c(=O)oc12	ZINC000066259336	222139285	/nfs/dbraw/zinc/13/92/85/222139285.db2.gz	OCHBXVIJIKCEDR-UHFFFAOYSA-N	1	2	377.403	5.118	1	5		GKBFLO
CC[NH+](CC)CCCNc1[nH+]ccc2c(C)c3[nH]c4cc[nH+]cc4c3c(C)c21	ZINC000029488361	207363308	/nfs/dbraw/zinc/36/33/08/207363308.db2.gz	LKRRNQQFDSLVKT-UHFFFAOYSA-N	1	2	375.520	5.025	1	5		GKBFLO