smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1Nc2c(cccc2C(F)(F)F)[C@@]12[C@H]1C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@@H+]12	ZINC000217728415	569881243	/nfs/dbraw/zinc/88/12/43/569881243.db2.gz	JACTYZJSKFLAHC-QNFHRHJVSA-N	1	2	475.854	3.790	50	70		JHIALO
O=C1Nc2c(cccc2C(F)(F)F)[C@@]12[C@H]1C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@H+]12	ZINC000217728415	569881244	/nfs/dbraw/zinc/88/12/44/569881244.db2.gz	JACTYZJSKFLAHC-QNFHRHJVSA-N	1	2	475.854	3.790	50	70		JHIALO
O=C1Nc2c(cccc2C(F)(F)F)[C@]12[C@H]1C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@@H+]12	ZINC000217728497	569881283	/nfs/dbraw/zinc/88/12/83/569881283.db2.gz	JACTYZJSKFLAHC-FSBGXSNOSA-N	1	2	475.854	3.790	50	70		JHIALO
O=C1Nc2c(cccc2C(F)(F)F)[C@]12[C@H]1C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@H+]12	ZINC000217728497	569881284	/nfs/dbraw/zinc/88/12/84/569881284.db2.gz	JACTYZJSKFLAHC-FSBGXSNOSA-N	1	2	475.854	3.790	50	70		JHIALO
Cc1[nH+]c2cc(NC(=O)C[C@@H]3NC(=O)c4ccccc4NC3=O)ccc2n1CCc1ccccc1	ZINC000218027460	569882463	/nfs/dbraw/zinc/88/24/63/569882463.db2.gz	QIFYDSCLMUTDTC-QHCPKHFHSA-N	1	2	467.529	3.667	50	70	biogenic	JHIALO
COc1cc2c(cc1OC)CN(Cc1cc(=O)c(O)c(C[N@H+](C)Cc3ccccc3)o1)CC2	ZINC000217606145	569880494	/nfs/dbraw/zinc/88/04/94/569880494.db2.gz	DBYFWNMSFGETLI-UHFFFAOYSA-N	1	2	450.535	3.553	50	70	biogenic	JHIALO
COc1cc2c(cc1OC)CN(Cc1cc(=O)c(O)c(C[N@@H+](C)Cc3ccccc3)o1)CC2	ZINC000217606145	569880495	/nfs/dbraw/zinc/88/04/95/569880495.db2.gz	DBYFWNMSFGETLI-UHFFFAOYSA-N	1	2	450.535	3.553	50	70	biogenic	JHIALO