smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Fc1cc(Cl)c(Br)c(Cl)c1Br	ZINC000065356406	184328413	/nfs/dbraw/zinc/32/84/13/184328413.db2.gz	SFMSSZCTWYRRKL-UHFFFAOYSA-N	0	0	322.786	4.658	30	0		DJACRN
Cc1c(Cl)c(Br)cc(Br)c1Cl	ZINC000063339648	184280659	/nfs/dbraw/zinc/28/06/59/184280659.db2.gz	LUGMMAYEHXYIFV-UHFFFAOYSA-N	0	0	318.823	4.827	30	0		DJACRN
CC(C)(C)OC(=O)Nc1ccccc1-c1ccc(C=O)s1	ZINC000004312931	181096118	/nfs/dbraw/zinc/09/61/18/181096118.db2.gz	MKWNIZIIBITOQR-UHFFFAOYSA-N	0	0	303.383	4.575	30	0		DJACRN
CCOC(=O)/C=C/c1ccc(-c2cc(Cl)ccc2Cl)o1	ZINC000004294150	181093786	/nfs/dbraw/zinc/09/37/86/181093786.db2.gz	DAILWEDMXATBAQ-VMPITWQZSA-N	0	0	311.164	4.830	30	0		DJACRN
Clc1cc(Br)cc(Cl)c1Br	ZINC000063339655	184280738	/nfs/dbraw/zinc/28/07/38/184280738.db2.gz	RGZMNZRVGVVRHE-UHFFFAOYSA-N	0	0	304.796	4.518	30	0		DJACRN
Fc1c(Cl)cc(Br)c(Cl)c1Br	ZINC000065356414	184328363	/nfs/dbraw/zinc/32/83/63/184328363.db2.gz	IXZJIALQMVUMIN-UHFFFAOYSA-N	0	0	322.786	4.658	30	0		DJACRN
CC(C)(C)OC(=O)NC1CCC(c2ccc(Cl)cc2)CC1	ZINC000116548610	563700995	/nfs/dbraw/zinc/70/09/95/563700995.db2.gz	AWACZJQTWOCLML-UHFFFAOYSA-N	0	0	309.837	4.891	30	0		DJACRN
CC(C)(C)OC(=O)Nc1cccc(-c2ccc(C=O)s2)c1	ZINC000004312934	181096027	/nfs/dbraw/zinc/09/60/27/181096027.db2.gz	WYFDOHJONYDAQH-UHFFFAOYSA-N	0	0	303.383	4.575	30	0		DJACRN
Fc1cc(Br)c(Cl)c(Br)c1Cl	ZINC000063339643	184280768	/nfs/dbraw/zinc/28/07/68/184280768.db2.gz	APJRSPNDCYZFBN-UHFFFAOYSA-N	0	0	322.786	4.658	30	0		DJACRN
CC(C)(C)OC(=O)Nc1ccc(-c2ccc(C=O)s2)cc1	ZINC000004299129	181094459	/nfs/dbraw/zinc/09/44/59/181094459.db2.gz	YBSBWWHTEDGQCX-UHFFFAOYSA-N	0	0	303.383	4.575	30	0		DJACRN
CC(=O)N(C/C=C/c1ccccc1)Cc1cccc2ccccc21	ZINC000028247647	337107066	/nfs/dbraw/zinc/10/70/66/337107066.db2.gz	BMFPJDQOBBJOSM-DHZHZOJOSA-N	0	0	315.416	4.902	30	0		DJACRN
Fc1c(Cl)cc(Br)c(Br)c1Cl	ZINC000065356387	184328323	/nfs/dbraw/zinc/32/83/23/184328323.db2.gz	YLCYLINWRXUSFU-UHFFFAOYSA-N	0	0	322.786	4.658	30	0		DJACRN
Cc1cc(Br)c(Cl)c(Br)c1Cl	ZINC000065356417	184328238	/nfs/dbraw/zinc/32/82/38/184328238.db2.gz	HTZAZICHDSZNRU-UHFFFAOYSA-N	0	0	318.823	4.827	30	0		DJACRN
Fc1c(Cl)c(Cl)c(Br)cc1Br	ZINC000065356405	184328438	/nfs/dbraw/zinc/32/84/38/184328438.db2.gz	SRBJYHGENJPHOG-UHFFFAOYSA-N	0	0	322.786	4.658	30	0		DJACRN