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)c(C2=C(C#N)C(N)=C(C#N)C3=CC[N@H+](C)C[C@H]32)c1	ZINC000000043582	264009904	/nfs/dbraw/zinc/00/99/04/264009904.db2.gz	RTCWLUVDXRNGIS-GOSISDBHSA-N	1	1	316.408	2.819	40	50		DFGBMO
O=C(C[NH+]1CCCCC1)N/N=C/c1c(Cl)cccc1Cl	ZINC000020248589	398409298	/nfs/dbraw/zinc/40/92/98/398409298.db2.gz	YVTSKMYKTBDTCF-RQZCQDPDSA-N	1	1	314.216	2.929	40	50		DFGBMO
COc1ccc2c3c1O[C@@H]1[C@H](Cl)C=C[C@@H]4[C@H](C2)[N@H+](C)CC[C@@]314	ZINC000004972552	560200261	/nfs/dbraw/zinc/20/02/61/560200261.db2.gz	CVLHOXTTXWEUCL-QQCQHEPOSA-N	1	1	317.816	2.748	40	50	biogenic,in-vitro	DFGBMO
Cc1ccc(C)c(C2=C(C#N)C(N)=C(C#N)C3=CC[N@H+](C)C[C@@H]32)c1	ZINC000004634813	264009822	/nfs/dbraw/zinc/00/98/22/264009822.db2.gz	RTCWLUVDXRNGIS-SFHVURJKSA-N	1	1	316.408	2.819	40	50		DFGBMO
COc1ccc2c3c1O[C@@H]1[C@H](Cl)C=C[C@H]4[C@@H](C2)[N@H+](C)CC[C@]314	ZINC000201160979	560036393	/nfs/dbraw/zinc/03/63/93/560036393.db2.gz	CVLHOXTTXWEUCL-QDQNSEEQSA-N	1	1	317.816	2.748	40	50	biogenic,in-vitro	DFGBMO
COc1ccc2c3c1O[C@@H]1[C@@H](Cl)C=C[C@@H]4[C@@H](C2)[N@H+](C)CC[C@]314	ZINC000253504155	560038562	/nfs/dbraw/zinc/03/85/62/560038562.db2.gz	CVLHOXTTXWEUCL-YXCOWNBQSA-N	1	1	317.816	2.748	40	50	biogenic,in-vitro	DFGBMO
COc1ccc2c3c1O[C@@H]1[C@H](Cl)C=C[C@@H]4[C@@H](C2)[N@H+](C)CC[C@]314	ZINC000090548555	560045734	/nfs/dbraw/zinc/04/57/34/560045734.db2.gz	CVLHOXTTXWEUCL-WYEVINAZSA-N	1	1	317.816	2.748	40	50	biogenic,in-vitro	DFGBMO
COc1ccc2c3c1O[C@@H]1[C@@H](Cl)C=C[C@H]4[C@@H](C2)[N@H+](C)CC[C@]314	ZINC000253504149	560038384	/nfs/dbraw/zinc/03/83/84/560038384.db2.gz	CVLHOXTTXWEUCL-HKAKVCCISA-N	1	1	317.816	2.748	40	50	biogenic,in-vitro	DFGBMO