smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc([C@@H]2Cc3c(c(=O)c4cc(Cl)ccc4n3O)/C(=N/CCC[NH+](C)C)C2)cc1	ZINC000027092426	563039344	/nfs/dbraw/zinc/03/93/44/563039344.db2.gz	GWSXRAPGOHEMFJ-XHFLNROESA-N	1	3	437.971	4.671	1	30		IJEFHO
C[NH2+]Cc1cc(C#CCCN2CCN(C(C)C)CC2)ccc1Oc1ccc(SC)cc1	ZINC000028825142	563066245	/nfs/dbraw/zinc/06/62/45/563066245.db2.gz	BJWZNXSSJMLUNB-UHFFFAOYSA-N	1	3	437.653	4.688	1	30	in-vitro	IJEFHO
Cc1ccc([C@H]2Cc3c(c(=O)c4cc(Cl)ccc4n3O)/C(=N/CCC[NH+](C)C)C2)cc1	ZINC000027092420	563039294	/nfs/dbraw/zinc/03/92/94/563039294.db2.gz	GWSXRAPGOHEMFJ-BJKXRTFMSA-N	1	3	437.971	4.671	1	30		IJEFHO
Cc1c2cc[nH]c2ccc1Nc1c(C#N)cncc1/C=C/CC[NH+]1CCC(N(C)C)CC1	ZINC000045358092	563132832	/nfs/dbraw/zinc/13/28/32/563132832.db2.gz	CLAXUCQFRATVEQ-GQCTYLIASA-N	1	3	428.584	4.916	1	30		IJEFHO