smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[O-]c1c2ncn(-c3ccccc3)c2ccc1O	ZINC000003832355	183284347	/nfs/dbraw/zinc/28/43/47/183284347.db2.gz	SMKKNSYFQFENDV-UHFFFAOYSA-N	-1	1	226.235	2.437	1	10		BECFMM
COc1cc2c(cc1[O-])-c1nccc(C)c1C2=O	ZINC000006071996	175022375	/nfs/dbraw/zinc/02/23/75/175022375.db2.gz	MAADJTUAJPSECP-UHFFFAOYSA-N	-1	1	241.246	2.316	1	10		BECFMM
O=C1[N-]C(=S)C(=Cc2ccncc2)S1	ZINC000095554465	188320244	/nfs/dbraw/zinc/32/02/44/188320244.db2.gz	URJAQOHIAKIVRY-ALCCZGGFSA-N	-1	1	222.294	2.206	1	10		BECFMM
O=c1oc2cc([O-])c(O)cc2c2cc(F)ccc12	ZINC000025963829	188282893	/nfs/dbraw/zinc/28/28/93/188282893.db2.gz	DYFXUXQNEFOUSN-UHFFFAOYSA-N	-1	1	246.193	2.497	1	10		BECFMM
O=C1[N-]C(=S)S/C1=C\Cc1ccccc1	ZINC000040862916	188293062	/nfs/dbraw/zinc/29/30/62/188293062.db2.gz	AXEFNOIXCFPBMX-CLFYSBASSA-N	-1	1	235.333	2.261	1	10		BECFMM
O=C(Cc1ccc(O)cc1)c1ccc([O-])c(O)c1	ZINC000028714130	182037928	/nfs/dbraw/zinc/03/79/28/182037928.db2.gz	NQAHFWYZPRKZGH-UHFFFAOYSA-N	-1	1	244.246	2.229	1	10		BECFMM
Oc1c(N=Nc2nn[n-]n2)ccc2ccccc21	ZINC000006576417	183253337	/nfs/dbraw/zinc/25/33/37/183253337.db2.gz	WTOMASUNAPBPMR-OUKQBFOZSA-N	-1	1	240.226	2.474	1	10		BECFMM