smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ncnc2c1[nH]c(=NN=C1C(=O)NC(=O)NC1=O)n2[C@H]1O[C@@H](CO)[C@H](O)[C@@H]1O	ZINC000008636786	557797799	/nfs/dbraw/zinc/79/77/99/557797799.db2.gz	PQGFECBOKPFDPT-UOCWYQSESA-N	0	2	421.330	-3.846	50	30		HAEALN
Cn1c2nc(NN=C3C(=O)N(C)C(=O)N(C)C3=O)n(C[C@H](O)CO)c2c(=O)[nH]c1=O	ZINC000009849195	571288233	/nfs/dbraw/zinc/28/82/33/571288233.db2.gz	BUETWLAULDWTCN-LURJTMIESA-N	0	2	422.358	-3.405	50	30		HAEALN
Cn1c2nc(NN=C3C(=O)N(C)C(=O)N(C)C3=O)n(C[C@@H](O)CO)c2c(=O)[nH]c1=O	ZINC000009849196	571288193	/nfs/dbraw/zinc/28/81/93/571288193.db2.gz	BUETWLAULDWTCN-ZCFIWIBFSA-N	0	2	422.358	-3.405	50	30		HAEALN
C[C@H](O)Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)n(C)c(=O)n2C	ZINC000010272087	557260570	/nfs/dbraw/zinc/26/05/70/557260570.db2.gz	SXXHKTUAGOSGJP-ZETCQYMHSA-N	0	2	420.386	-2.367	50	30		HAEALN
C[C@@H](O)Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)n(C)c(=O)n2C	ZINC000010272088	557260449	/nfs/dbraw/zinc/26/04/49/557260449.db2.gz	SXXHKTUAGOSGJP-SSDOTTSWSA-N	0	2	420.386	-2.367	50	30		HAEALN