smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C/C=C1\C[N+]2(C)CC[C@]34c5cccc(O)c5NC3=C(C=O)[C@H]1C[C@@H]42	ZINC000004000045	181060579	/nfs/dbraw/zinc/06/05/79/181060579.db2.gz	KXHTZJQVMGTREI-UALKHGLQSA-O	1	0	323.416	2.707	40	50		DFGBRO
Cc1ccc(C)c(C2=C(C#N)C(N)=C(C#N)C3=CC[N@@H+](C)C[C@H]32)c1	ZINC000000043582	264009900	/nfs/dbraw/zinc/00/99/00/264009900.db2.gz	RTCWLUVDXRNGIS-GOSISDBHSA-N	1	0	316.408	2.819	40	50		DFGBRO
Cc1ccc(C)c(C2=C(C#N)C(N)=C(C#N)C3=CC[N@@H+](C)C[C@@H]32)c1	ZINC000004634813	264009820	/nfs/dbraw/zinc/00/98/20/264009820.db2.gz	RTCWLUVDXRNGIS-SFHVURJKSA-N	1	0	316.408	2.819	40	50		DFGBRO
COc1ccc2c3c1O[C@@H]1[C@@H](Cl)C=C[C@@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000253504155	560038561	/nfs/dbraw/zinc/03/85/61/560038561.db2.gz	CVLHOXTTXWEUCL-YXCOWNBQSA-N	1	0	317.816	2.748	40	50	biogenic,in-vitro	DFGBRO
COc1ccc2c3c1O[C@@H]1[C@H](Cl)C=C[C@@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000090548555	560045733	/nfs/dbraw/zinc/04/57/33/560045733.db2.gz	CVLHOXTTXWEUCL-WYEVINAZSA-N	1	0	317.816	2.748	40	50	biogenic,in-vitro	DFGBRO
COc1ccc2c3c1O[C@@H]1[C@@H](Cl)C=C[C@H]4[C@@H](C2)[N@@H+](C)CC[C@]314	ZINC000253504149	560038383	/nfs/dbraw/zinc/03/83/83/560038383.db2.gz	CVLHOXTTXWEUCL-HKAKVCCISA-N	1	0	317.816	2.748	40	50	biogenic,in-vitro	DFGBRO