smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc(/C=C2/C(=O)[N-]C(=O)NC2=O)c(Br)cc1OCC(=O)[O-]	ZINC000004918568	206215085	/nfs/dbraw/zinc/21/50/85/206215085.db2.gz	HERNEXBIWPIJPF-UHFFFAOYSA-N	-2	1	399.153	0.671	50	10		GCCAML
COc1cc(/C=C2\C(=O)[N-]C(=O)NC2=O)c(Br)cc1OCC(=O)[O-]	ZINC000004918568	206215088	/nfs/dbraw/zinc/21/50/88/206215088.db2.gz	HERNEXBIWPIJPF-UHFFFAOYSA-N	-2	1	399.153	0.671	50	10		GCCAML
CCCCCCN1C(=O)[N-]C(=O)C(=CN[C@@H](Cc2cnc[nH]2)C(=O)[O-])C1=O	ZINC000020567545	210349100	/nfs/dbraw/zinc/34/91/00/210349100.db2.gz	QGDVPDYYFWYBHB-SUIFULHWSA-N	-2	1	377.401	0.538	50	10		GCCAML
O=C([O-])COc1ccc(C=C2C(=O)[N-]C(=S)NC2=O)cc1Br	ZINC000001198432	530137387	/nfs/dbraw/zinc/13/73/87/530137387.db2.gz	SOOXLOAJWAGFDZ-UHFFFAOYSA-N	-2	1	385.195	0.827	50	10		GCCAML
O=C([O-])CC[C@H](NC=C1C(=O)NC(=S)N(c2ccccc2)C1=O)C(=O)[O-]	ZINC000095170317	136177815	/nfs/dbraw/zinc/17/78/15/136177815.db2.gz	RQQXNDQAXFZJOC-IEHMKBBKSA-N	-2	1	377.378	0.226	50	10		GCCAML
O=C([O-])CC[C@@H](NC=C1C(=O)NC(=S)N(c2ccccc2)C1=O)C(=O)[O-]	ZINC000095170318	136177965	/nfs/dbraw/zinc/17/79/65/136177965.db2.gz	RQQXNDQAXFZJOC-HIJJYWJESA-N	-2	1	377.378	0.226	50	10		GCCAML
CCCCCCN1C(=O)[N-]C(=O)C(=CN[C@H](Cc2cnc[nH]2)C(=O)[O-])C1=O	ZINC000020567546	570268323	/nfs/dbraw/zinc/26/83/23/570268323.db2.gz	QGDVPDYYFWYBHB-KIWPFMIBSA-N	-2	1	377.401	0.538	50	10		GCCAML