smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(/C=C/C(=O)c2cc(Cl)ccc2O)cc1F	ZINC000039047164	183014008	/nfs/dbraw/zinc/01/40/08/183014008.db2.gz	FLHJWPPFFOMBLA-GORDUTHDSA-N	0	2	306.720	4.089	1	30		DIEFLN
N#Cc1c(=O)[nH]c(-c2ccccn2)cc1-c1ccc(Cl)cc1	ZINC000083214705	185220233	/nfs/dbraw/zinc/22/02/33/185220233.db2.gz	NTMOJASHOMIATH-UHFFFAOYSA-N	0	2	307.740	4.041	1	30		DIEFLN
CC(=NNc1ccnc2cc(Cl)ccc21)c1ccc(O)cc1	ZINC000005479921	181248130	/nfs/dbraw/zinc/24/81/30/181248130.db2.gz	KHNDMUDJXXCKOW-JAIQZWGSSA-N	0	2	311.772	4.430	1	30		DIEFLN
CCCCCCCCC[C@@]1(c2ccccc2)OC(=O)NC1=O	ZINC000044070122	183393792	/nfs/dbraw/zinc/39/37/92/183393792.db2.gz	YLTYTVMUCPQFQH-SFHVURJKSA-N	0	2	303.402	4.289	1	30		DIEFLN
CC1=C(O)[C@@](C)(Cc2ccc(C(F)(F)F)cc2)SC1=O	ZINC000013678502	181877563	/nfs/dbraw/zinc/87/75/63/181877563.db2.gz	AKPMYHFJKUFWJG-CYBMUJFWSA-N	0	2	302.317	4.112	1	30		DIEFLN
CCCCCCCCC[C@]1(c2ccccc2)OC(=O)NC1=O	ZINC000044070125	183393773	/nfs/dbraw/zinc/39/37/73/183393773.db2.gz	YLTYTVMUCPQFQH-GOSISDBHSA-N	0	2	303.402	4.289	1	30		DIEFLN
O/N=C(\CSc1ccncc1)c1cc(Cl)sc1Cl	ZINC000095578753	185380637	/nfs/dbraw/zinc/38/06/37/185380637.db2.gz	TWKCNFRBCCKQNB-OQLLNIDSSA-N	0	2	319.238	4.421	1	30		DIEFLN
COc1ccc(/C=C/C(=O)c2cc3ccoc3cc2O)cc1OC	ZINC000103275848	185443321	/nfs/dbraw/zinc/44/33/21/185443321.db2.gz	QIHACMVQZJWATD-HWKANZROSA-N	0	2	324.332	4.052	1	30		DIEFLN