smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc([C@@H](CC(=O)N2CCCCC2)c2c(O)cc(=O)c3c(O)cc(-c4ccccc4)oc2-3)cc1	ZINC000218008604	569882482	/nfs/dbraw/zinc/88/24/82/569882482.db2.gz	OQPRHOIBMJCLIN-JOCHJYFZSA-N	0	2	499.563	5.414	50	70	biogenic	JKIALN
COc1ccc([C@@H](CC(=O)N2CCCCC2)c2c(O)cc(O)c3c(=O)cc(-c4ccccc4)oc32)cc1	ZINC000218008604	569882483	/nfs/dbraw/zinc/88/24/83/569882483.db2.gz	OQPRHOIBMJCLIN-JOCHJYFZSA-N	0	2	499.563	5.414	50	70	biogenic	JKIALN
CC(C)Oc1ccccc1[C@@H]1CC(=O)Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c21	ZINC000217761135	569881477	/nfs/dbraw/zinc/88/14/77/569881477.db2.gz	MSDRTRNIKFWFIC-SFHVURJKSA-N	0	2	458.466	5.099	50	70	biogenic	JKIALN
COc1ccc(-c2cc(O)c3c(=O)cc4c(c-3o2)[C@@H](c2cccc(Cl)c2F)CC(=O)O4)cc1O	ZINC000217830653	569881757	/nfs/dbraw/zinc/88/17/57/569881757.db2.gz	ATVMZFSFGHRHAP-CYBMUJFWSA-N	0	2	482.847	5.113	50	70	biogenic	JKIALN
COc1ccc(-c2cc(=O)c3c(O)cc4c(c3o2)[C@@H](c2cccc(Cl)c2F)CC(=O)O4)cc1O	ZINC000217830653	569881758	/nfs/dbraw/zinc/88/17/58/569881758.db2.gz	ATVMZFSFGHRHAP-CYBMUJFWSA-N	0	2	482.847	5.113	50	70	biogenic	JKIALN
COc1ccc(-c2cc(=O)c3c(O)cc4c(c3o2)[C@H](c2cccc(OC(C)C)c2)CC(=O)O4)cc1O	ZINC000217927436	569882139	/nfs/dbraw/zinc/88/21/39/569882139.db2.gz	POPQUQABUXFEBG-SFHVURJKSA-N	0	2	488.492	5.108	50	70	biogenic	JKIALN
CC(C)C[C@H](CC(=O)NCc1ccccc1)c1c(O)cc(=O)c2c(O)cc(-c3ccccc3)oc1-2	ZINC000217947373	569882183	/nfs/dbraw/zinc/88/21/83/569882183.db2.gz	QLZUMVHMWIJRBY-OAQYLSRUSA-N	0	2	471.553	5.707	50	70	biogenic	JKIALN
CC(C)C[C@H](CC(=O)NCc1ccccc1)c1c(=O)cc(O)c2c(O)cc(-c3ccccc3)oc1-2	ZINC000217947373	569882184	/nfs/dbraw/zinc/88/21/84/569882184.db2.gz	QLZUMVHMWIJRBY-OAQYLSRUSA-N	0	2	471.553	5.707	50	70	biogenic	JKIALN
CC(C)C[C@@H](CC(=O)NCc1ccccc1)c1c(O)cc(=O)c2c(O)cc(-c3ccccc3)oc1-2	ZINC000217947461	569882240	/nfs/dbraw/zinc/88/22/40/569882240.db2.gz	QLZUMVHMWIJRBY-NRFANRHFSA-N	0	2	471.553	5.707	50	70	biogenic	JKIALN
CC(C)C[C@@H](CC(=O)NCc1ccccc1)c1c(=O)cc(O)c2c(O)cc(-c3ccccc3)oc1-2	ZINC000217947461	569882241	/nfs/dbraw/zinc/88/22/41/569882241.db2.gz	QLZUMVHMWIJRBY-NRFANRHFSA-N	0	2	471.553	5.707	50	70	biogenic	JKIALN
CC(C)Oc1ccccc1[C@H]1CC(=O)Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c21	ZINC000217761220	569881461	/nfs/dbraw/zinc/88/14/61/569881461.db2.gz	MSDRTRNIKFWFIC-GOSISDBHSA-N	0	2	458.466	5.099	50	70	biogenic	JKIALN
COc1ccc(-c2cc(=O)c3c(O)cc4c(c3o2)[C@@H](c2cccc(OC(C)C)c2)CC(=O)O4)cc1O	ZINC000217927364	569882101	/nfs/dbraw/zinc/88/21/01/569882101.db2.gz	POPQUQABUXFEBG-GOSISDBHSA-N	0	2	488.492	5.108	50	70	biogenic	JKIALN
COc1ccc(-c2cc(=O)c3c(O)cc4c(c3o2)[C@@H](c2ccccc2OC(C)C)CC(=O)O4)cc1O	ZINC000217740830	569881364	/nfs/dbraw/zinc/88/13/64/569881364.db2.gz	SIGNMSSLSBPXKD-QGZVFWFLSA-N	0	2	488.492	5.108	50	70	biogenic	JKIALN
COc1ccc(-c2cc(O)c3c(=O)cc4c(c-3o2)[C@H](c2cccc(Cl)c2F)CC(=O)O4)cc1O	ZINC000217830732	569881744	/nfs/dbraw/zinc/88/17/44/569881744.db2.gz	ATVMZFSFGHRHAP-ZDUSSCGKSA-N	0	2	482.847	5.113	50	70	biogenic	JKIALN
COc1ccc(-c2cc(=O)c3c(O)cc4c(c3o2)[C@H](c2cccc(Cl)c2F)CC(=O)O4)cc1O	ZINC000217830732	569881745	/nfs/dbraw/zinc/88/17/45/569881745.db2.gz	ATVMZFSFGHRHAP-ZDUSSCGKSA-N	0	2	482.847	5.113	50	70	biogenic	JKIALN
COc1ccc([C@H](CC(=O)N2CCCCC2)c2c(O)cc(=O)c3c(O)cc(-c4ccccc4)oc2-3)cc1	ZINC000218008520	569882459	/nfs/dbraw/zinc/88/24/59/569882459.db2.gz	OQPRHOIBMJCLIN-QFIPXVFZSA-N	0	2	499.563	5.414	50	70	biogenic	JKIALN
COc1ccc([C@H](CC(=O)N2CCCCC2)c2c(O)cc(O)c3c(=O)cc(-c4ccccc4)oc32)cc1	ZINC000218008520	569882460	/nfs/dbraw/zinc/88/24/60/569882460.db2.gz	OQPRHOIBMJCLIN-QFIPXVFZSA-N	0	2	499.563	5.414	50	70	biogenic	JKIALN
COc1ccc(-c2cc(=O)c3c(O)cc4c(c3o2)[C@H](c2ccccc2OC(C)C)CC(=O)O4)cc1O	ZINC000217740920	569881314	/nfs/dbraw/zinc/88/13/14/569881314.db2.gz	SIGNMSSLSBPXKD-KRWDZBQOSA-N	0	2	488.492	5.108	50	70	biogenic	JKIALN