smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(C[C@@H]1NC(=O)N(Cc2cccc(F)c2)C1=O)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000217758854	568910356	/nfs/dbraw/zinc/91/03/56/568910356.db2.gz	WUMOGGAJJHRNBD-YTQUADARSA-N	1	1	416.497	2.017	50	70	biogenic	HEIAMO
O=C(CC[C@@H]1NC(=O)N(Cc2ccccc2)C1=O)NC[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000217645358	568901573	/nfs/dbraw/zinc/90/15/73/568901573.db2.gz	WXZHVIJYLUXOLH-SLFFLAALSA-N	1	1	412.534	2.268	50	70	biogenic	HEIAMO
O=C1Nc2ccc(F)cc2[C@@]12[C@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@@H+]12	ZINC000217723921	569039065	/nfs/dbraw/zinc/03/90/65/569039065.db2.gz	CGMVJJVYKAKVQY-KCXPTXFHSA-N	1	1	409.392	2.396	50	70		HEIAMO
O=C1Nc2ccc(F)cc2[C@@]12[C@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@H+]12	ZINC000217723921	569039066	/nfs/dbraw/zinc/03/90/66/569039066.db2.gz	CGMVJJVYKAKVQY-KCXPTXFHSA-N	1	1	409.392	2.396	50	70		HEIAMO
O=C1Nc2ccc(F)cc2[C@]12[C@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@@H+]12	ZINC000217724009	569039055	/nfs/dbraw/zinc/03/90/55/569039055.db2.gz	CGMVJJVYKAKVQY-FBAVSBLXSA-N	1	1	409.392	2.396	50	70		HEIAMO
O=C1Nc2ccc(F)cc2[C@]12[C@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@H+]12	ZINC000217724009	569039056	/nfs/dbraw/zinc/03/90/56/569039056.db2.gz	CGMVJJVYKAKVQY-FBAVSBLXSA-N	1	1	409.392	2.396	50	70		HEIAMO
CC[N@H+]1CCCN(C(=O)[C@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@@H]24)O3)CC1	ZINC000216647230	568466086	/nfs/dbraw/zinc/46/60/86/568466086.db2.gz	LYGNIDUYNAQGKK-FUCAVZNHSA-N	1	1	423.557	2.140	50	70		HEIAMO
COc1ccc(OC)c(N2C[C@H](C(=O)NC[C@@H]3CCC[N@H+]4CCCC[C@H]34)CC2=O)c1	ZINC000217910036	568919017	/nfs/dbraw/zinc/91/90/17/568919017.db2.gz	FWRCJYBVEAARJG-YQVWRLOYSA-N	1	1	415.534	2.437	50	70	biogenic	HEIAMO
CC[N@H+]1CCCN(C(=O)[C@@H]2[C@@H]3C=C[C@@]4(CN(Cc5ccc(C)c(C)c5)C(=O)[C@@H]24)O3)CC1	ZINC000216647292	568466075	/nfs/dbraw/zinc/46/60/75/568466075.db2.gz	LYGNIDUYNAQGKK-OUMCCJGNSA-N	1	1	423.557	2.140	50	70		HEIAMO
COc1cccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@@H]2CCC[N@H+]2[C@@]32c3ccccc3NC2=O)c1	ZINC000217699318	568473593	/nfs/dbraw/zinc/47/35/93/568473593.db2.gz	GMNXXRIOIFEQEK-YWNPBTLJSA-N	1	1	403.438	2.126	50	70		HEIAMO
CC(=O)Nc1cccc2c1ccn2CC(=O)N1CC[NH+](CCc2ccncc2)CC1	ZINC000218270790	568477209	/nfs/dbraw/zinc/47/72/09/568477209.db2.gz	UVFXBVGCSBMTPL-UHFFFAOYSA-N	1	1	405.502	2.382	50	70		HEIAMO
COc1ccc(N2C[C@H](C(=O)NC[C@@H]3CCC[N@H+]4CCCC[C@H]34)CC2=O)c(OC)c1	ZINC000217817119	568914010	/nfs/dbraw/zinc/91/40/10/568914010.db2.gz	ZRKBYTNENHBEQG-YQVWRLOYSA-N	1	1	415.534	2.437	50	70	biogenic	HEIAMO
CC(C)Oc1ccc2nnc(CCC(=O)NC[C@@H]3CCC[N@H+]4CCCC[C@H]34)n2n1	ZINC000217697037	568906815	/nfs/dbraw/zinc/90/68/15/568906815.db2.gz	CTYGFLJDFHPSFA-DLBZAZTESA-N	1	1	400.527	2.225	50	70	biogenic	HEIAMO
O=C(CN1c2cccnc2Sc2ccccc2C1=O)NCCC[NH+]1CCOCC1	ZINC000218292562	568477752	/nfs/dbraw/zinc/47/77/52/568477752.db2.gz	GZIWSCPOEFXZBY-UHFFFAOYSA-N	1	1	412.515	2.032	50	70		HEIAMO
O=C1Nc2ccc(F)cc2[C@]12[C@@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@@H+]12	ZINC000217723841	568473710	/nfs/dbraw/zinc/47/37/10/568473710.db2.gz	CGMVJJVYKAKVQY-SUWCGCSTSA-N	1	1	409.392	2.396	50	70		HEIAMO
O=C1Nc2ccc(F)cc2[C@]12[C@@H]1C(=O)N(c3ccc(F)cc3)C(=O)[C@@H]1[C@@H]1CCC[N@H+]12	ZINC000217723841	568473712	/nfs/dbraw/zinc/47/37/12/568473712.db2.gz	CGMVJJVYKAKVQY-SUWCGCSTSA-N	1	1	409.392	2.396	50	70		HEIAMO