smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1[n-]n(-c2ccccc2)c(=O)c1C=Nc1ccc(Cl)c(C(=O)[O-])c1	ZINC000100193767	570501129	/nfs/dbraw/zinc/50/11/29/570501129.db2.gz	NHSVFSCYJZNTRM-IXJMWADBSA-N	-2	1	355.781	3.779	50	30		FHEAML
Cc1[n-]n(-c2ccccc2)c(=O)c1C=Nc1ccc(Cl)c(C(=O)[O-])c1	ZINC000018209212	570876717	/nfs/dbraw/zinc/87/67/17/570876717.db2.gz	NHSVFSCYJZNTRM-VYXQJKENSA-N	-2	1	355.781	3.779	50	30		FHEAML
O=C([O-])c1ccc(COc2ccc(Br)cc2/C=N/[O-])cc1	ZINC000004670335	207036489	/nfs/dbraw/zinc/03/64/89/207036489.db2.gz	ZLIWESDIWXYOGS-CAOOACKPSA-N	-2	1	350.168	3.534	50	30		FHEAML
O=c1c(N=Nc2ccccc2[O-])c(-c2ccccc2)[n-]n1-c1ccccc1	ZINC000012376587	570740607	/nfs/dbraw/zinc/74/06/07/570740607.db2.gz	RZVOKVQKBDAHCP-ATJXCDBQSA-N	-2	1	356.385	3.611	50	30		FHEAML
O=c1c(N=Nc2ccccc2[O-])c(-c2ccccc2)[n-]n1-c1ccccc1	ZINC000100005872	222231944	/nfs/dbraw/zinc/23/19/44/222231944.db2.gz	RZVOKVQKBDAHCP-BSYVCWPDSA-N	-2	1	356.385	3.611	50	30		FHEAML
O=c1c(N=Nc2ccccc2[O-])c(-c2ccccc2)[n-]n1-c1ccccc1	ZINC000252462401	571279207	/nfs/dbraw/zinc/27/92/07/571279207.db2.gz	RZVOKVQKBDAHCP-UHFFFAOYSA-N	-2	1	356.385	3.611	50	30		FHEAML