smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc([C@H]2Nc3c(C)c(C(=O)[O-])ccc3[C@H]3C=CC[C@@H]32)cc1	ZINC000000478733	180803869	/nfs/dbraw/zinc/80/38/69/180803869.db2.gz	PTVNBGNXUYSSTK-ABSDTBQOSA-N	-1	0	319.404	4.828	1	10		DJCFRM
CCc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(C(=O)[O-])cc1)N2	ZINC000004168354	181081127	/nfs/dbraw/zinc/08/11/27/181081127.db2.gz	XSXZVZNFOJWNCU-ZWOKBUDYSA-N	-1	0	319.404	4.774	1	10		DJCFRM
CC(C)c1c(O)c([O-])c2c(c1C=O)C=C1[C@]2(C)CCCC1(C)C	ZINC000013451924	290936653	/nfs/dbraw/zinc/93/66/53/290936653.db2.gz	MLZIUWDMOAACSJ-FQEVSTJZSA-N	-1	0	314.425	4.899	1	10	biogenic,in-vitro	DJCFRM
Cc1oc(C(=O)[O-])cc1COc1cccc(-c2ccccc2)c1	ZINC000169343478	197744358	/nfs/dbraw/zinc/74/43/58/197744358.db2.gz	CPGKLQGURLZCPO-UHFFFAOYSA-N	-1	0	308.333	4.532	1	10		DJCFRM
CCc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(C(=O)[O-])cc1)N2	ZINC000002478183	180926532	/nfs/dbraw/zinc/92/65/32/180926532.db2.gz	XSXZVZNFOJWNCU-QKLQHJQFSA-N	-1	0	319.404	4.774	1	10		DJCFRM
Cc1ccc([C@H]2Nc3ccc(C(=O)[O-])cc3[C@@H]3C=CC[C@H]32)cc1	ZINC000016424954	182043854	/nfs/dbraw/zinc/04/38/54/182043854.db2.gz	VSRZDWAATYOPFA-GPMSIDNRSA-N	-1	0	305.377	4.520	1	10		DJCFRM
O=C([O-])c1cccc(-n2c(-c3ccccc3)cc3c2CCCC3)c1	ZINC000039194349	183015045	/nfs/dbraw/zinc/01/50/45/183015045.db2.gz	UKBQGDXFASMLHR-UHFFFAOYSA-N	-1	0	317.388	4.721	1	10		DJCFRM
CC1(C)CCOc2ccc(/N=N/c3ccc(C(=O)[O-])cc3)cc21	ZINC000040465507	183071961	/nfs/dbraw/zinc/07/19/61/183071961.db2.gz	IXDMRCQDZUOVOB-FMQUCBEESA-N	-1	0	310.353	4.860	1	10		DJCFRM
Cc1ccc([C@H]2Nc3ccc(C(=O)[O-])cc3[C@@H]3C=CC[C@@H]32)c(C)c1	ZINC000049035462	183703947	/nfs/dbraw/zinc/70/39/47/183703947.db2.gz	AHKUREVOSVZKAB-FUHIMQAGSA-N	-1	0	319.404	4.828	1	10		DJCFRM