smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Fc1cc(Br)c(F)c(Br)c1Cl	ZINC000063339612	184280582	/nfs/dbraw/zinc/28/05/82/184280582.db2.gz	YESWCYILHSPCQL-UHFFFAOYSA-N	0	0	306.331	4.143	30	0		DIACRN
Cc1cc(Br)c(F)c(Br)c1Cl	ZINC000065356418	184328114	/nfs/dbraw/zinc/32/81/14/184328114.db2.gz	APYZTQUAIBBWBX-UHFFFAOYSA-N	0	0	302.368	4.313	30	0		DIACRN
Cc1c(F)c(Br)cc(Br)c1Cl	ZINC000065356411	184328503	/nfs/dbraw/zinc/32/85/03/184328503.db2.gz	OUVSLFYCIBQCES-UHFFFAOYSA-N	0	0	302.368	4.313	30	0		DIACRN
CC(C)(C)c1cc(Br)cc(Br)c1N	ZINC000034497717	563449880	/nfs/dbraw/zinc/44/98/80/563449880.db2.gz	RZSNBOTYWWDTTP-UHFFFAOYSA-N	0	0	307.029	4.091	30	0		DIACRN
Fc1c(F)c(Br)cc(Br)c1Cl	ZINC000065356402	184328184	/nfs/dbraw/zinc/32/81/84/184328184.db2.gz	IUVQNZOZJXHTQX-UHFFFAOYSA-N	0	0	306.331	4.143	30	0		DIACRN
Cc1c(F)cc(Cl)c(Br)c1Br	ZINC000079387446	185167726	/nfs/dbraw/zinc/16/77/26/185167726.db2.gz	QCKYGDLOXCHXTC-UHFFFAOYSA-N	0	0	302.368	4.313	30	0		DIACRN
CON(Cc1c(F)cccc1Cl)C(=O)Nc1ccccc1	ZINC000004290500	181092897	/nfs/dbraw/zinc/09/28/97/181092897.db2.gz	QEOSHHCSBSGYHP-UHFFFAOYSA-N	0	0	308.740	4.075	30	0		DIACRN
Fc1cc(Cl)c(Br)c(F)c1Br	ZINC000063339617	184280668	/nfs/dbraw/zinc/28/06/68/184280668.db2.gz	QROOHHUFJJNZDS-UHFFFAOYSA-N	0	0	306.331	4.143	30	0		DIACRN
Nc1cccc(-c2nc(-c3cc4ccccc4oc3=O)cs2)c1	ZINC000004245303	1056019364	/nfs/dbraw/zinc/01/93/64/1056019364.db2.gz	GSKFUAQQLWHLIW-UHFFFAOYSA-N	0	0	320.373	4.166	30	0		DIACRN
CCOC(=O)/C=C/c1ccc(-c2ccccc2Br)o1	ZINC000004294153	181093603	/nfs/dbraw/zinc/09/36/03/181093603.db2.gz	MSJYOIQIXAOGFN-CSKARUKUSA-N	0	0	321.170	4.285	30	0		DIACRN
Nc1c(Br)cc(Cl)c(Cl)c1Br	ZINC000015444558	182002336	/nfs/dbraw/zinc/00/23/36/182002336.db2.gz	XVEDJCXLDJZAHI-UHFFFAOYSA-N	0	0	319.811	4.101	30	0		DIACRN
Cc1cc(Cl)c(Br)c(F)c1Br	ZINC000067802775	563458028	/nfs/dbraw/zinc/45/80/28/563458028.db2.gz	DYKPPPSSEGNIGV-UHFFFAOYSA-N	0	0	302.368	4.313	30	0		DIACRN
COc1ccc(OC)c(-c2csc(-c3cccc(N)c3)n2)c1	ZINC000004245323	190619383	/nfs/dbraw/zinc/61/93/83/190619383.db2.gz	GWUPWGXZUKEIMT-UHFFFAOYSA-N	0	0	312.394	4.077	30	0		DIACRN
Fc1cc(Cl)c(F)c(Br)c1Br	ZINC000067800016	563456996	/nfs/dbraw/zinc/45/69/96/563456996.db2.gz	BMGADNCJESAMHV-UHFFFAOYSA-N	0	0	306.331	4.143	30	0		DIACRN
COc1cccc(-c2nc3sc4ccccc4n3c2C=O)c1	ZINC000001527939	563757257	/nfs/dbraw/zinc/75/72/57/563757257.db2.gz	HJELRLBFNDDTIR-UHFFFAOYSA-N	0	0	308.362	4.037	30	0		DIACRN
Fc1cc(Br)c(Cl)c(Br)c1F	ZINC000065356399	184328208	/nfs/dbraw/zinc/32/82/08/184328208.db2.gz	PLCXRTNHKJPKMU-UHFFFAOYSA-N	0	0	306.331	4.143	30	0		DIACRN
COc1ccc(-c2csc(-c3cccc(N)c3)n2)cc1OC	ZINC000004245325	1056020023	/nfs/dbraw/zinc/02/00/23/1056020023.db2.gz	YIBUESDYAJGVKC-UHFFFAOYSA-N	0	0	312.394	4.077	30	0		DIACRN
O=C(Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1)c1ccccc1	ZINC000145383094	563924292	/nfs/dbraw/zinc/92/42/92/563924292.db2.gz	KEOYVANAKHOAIR-UHFFFAOYSA-N	0	0	324.767	4.151	30	0		DIACRN
O=C(Oc1cccc(OCc2ccccc2)c1)c1ccccc1	ZINC000038304503	563923965	/nfs/dbraw/zinc/92/39/65/563923965.db2.gz	YUDYCOFGRDGKDZ-UHFFFAOYSA-N	0	0	304.345	4.485	30	0		DIACRN
COc1ccc(-c2csc(-c3cccc(N)c3)n2)c(OC)c1	ZINC000004245324	1056019684	/nfs/dbraw/zinc/01/96/84/1056019684.db2.gz	ZQVDSSVNKGMZLX-UHFFFAOYSA-N	0	0	312.394	4.077	30	0		DIACRN