smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)OC[C@H](O)Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)n(C)c(=O)n2C	ZINC000009849198	519774409	/nfs/dbraw/zinc/77/44/09/519774409.db2.gz	NVHMRWFYWWNQMJ-SNVBAGLBSA-N	0	2	478.466	-1.962	50	30		JAEALN
CC(C)OC[C@@H](O)Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)n(C)c(=O)n2C	ZINC000009849199	519772393	/nfs/dbraw/zinc/77/23/93/519772393.db2.gz	NVHMRWFYWWNQMJ-JTQLQIEISA-N	0	2	478.466	-1.962	50	30		JAEALN
C=CCOC[C@@H](O)Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)n(C)c(=O)n2C	ZINC000009849200	124202200	/nfs/dbraw/zinc/20/22/00/124202200.db2.gz	HPUSDMLXVDWTDT-JTQLQIEISA-N	0	2	476.450	-2.185	50	30		JAEALN
C=CCOC[C@H](O)Cn1c(NN=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)n(C)c(=O)n2C	ZINC000009849201	518997073	/nfs/dbraw/zinc/99/70/73/518997073.db2.gz	HPUSDMLXVDWTDT-SNVBAGLBSA-N	0	2	476.450	-2.185	50	30		JAEALN