smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1c(C[NH2+][C@H](C)c2c(Cl)ccc(F)c2Cl)cnn1C	ZINC000160401698	338549826	/nfs/dbraw/zinc/54/98/26/338549826.db2.gz	NADBFGVVRMDFPF-MRVPVSSYSA-N	1	2	316.207	4.025	10	70		DIIELO
Cn1cc([C@H]2CCC[N@@H+]2Cc2cc(Cl)ccc2Cl)cn1	ZINC000160524292	527317480	/nfs/dbraw/zinc/31/74/80/527317480.db2.gz	ZJJOHTFAIFFZEM-OAHLLOKOSA-N	1	2	310.228	4.064	10	70		DIIELO
Cn1cc([C@H]2CCC[N@H+]2Cc2cc(Cl)ccc2Cl)cn1	ZINC000160524292	527317488	/nfs/dbraw/zinc/31/74/88/527317488.db2.gz	ZJJOHTFAIFFZEM-OAHLLOKOSA-N	1	2	310.228	4.064	10	70		DIIELO
CCc1ccc([C@@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)cc1	ZINC000160597073	524025875	/nfs/dbraw/zinc/02/58/75/524025875.db2.gz	MKYLMAQOCKBIBN-GFCCVEGCSA-N	1	2	313.426	4.211	10	70		DIIELO
CCc1ccc([C@H](C)[NH2+]Cc2noc(-c3ccsc3)n2)cc1	ZINC000160597172	524046829	/nfs/dbraw/zinc/04/68/29/524046829.db2.gz	MKYLMAQOCKBIBN-LBPRGKRZSA-N	1	2	313.426	4.211	10	70		DIIELO