smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCC(O)(CC=C)c1ccc(CN(CCCOC)Cc2ccc(C)cc2)o1	ZINC000036202839	518687462	/nfs/dbraw/zinc/68/74/62/518687462.db2.gz	XVXQKLBJLRPZDE-UHFFFAOYSA-N	0	3	383.532	4.967	10	30		GJEEHN
C=C(C)C(O)(C(=C)C)c1ccc(CN(CCCOC)Cc2ccc(C)cc2)o1	ZINC000036202841	518587449	/nfs/dbraw/zinc/58/74/49/518587449.db2.gz	KZSBRZYCFNVSOD-UHFFFAOYSA-N	0	3	383.532	4.967	10	30		GJEEHN
C[C@@H](CN=C1N=C(Nc2ccc(F)c(Cl)c2)S1)NCCc1ccccc1	ZINC000020550542	570267606	/nfs/dbraw/zinc/26/76/06/570267606.db2.gz	RZCANTYBSYQCHB-ZDUSSCGKSA-N	0	3	390.915	4.571	10	30		GJEEHN
C[C@H](CN=C1N=C(Nc2ccc(F)c(Cl)c2)S1)NCCc1ccccc1	ZINC000020550544	570267667	/nfs/dbraw/zinc/26/76/67/570267667.db2.gz	RZCANTYBSYQCHB-CYBMUJFWSA-N	0	3	390.915	4.571	10	30		GJEEHN
C=CCNCc1cc(Br)c(OCc2ccc(C)cc2)c(OC)c1	ZINC000020873857	570284129	/nfs/dbraw/zinc/28/41/29/570284129.db2.gz	JBWHZYNBLAKYRJ-UHFFFAOYSA-N	0	3	376.294	4.621	10	30		GJEEHN