smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)[C@H](CN(C)C)NC(=O)c1cccc2nc3ccc4c(OC)cccc4c3nc21	ZINC000027769926	563047205	/nfs/dbraw/zinc/04/72/05/563047205.db2.gz	IBMHXIHITBJPCY-IBGZPJMESA-N	0	1	432.480	2.778	1	10		IFCFMN
COC(=O)[C@@H](CN(C)C)NC(=O)c1cccc2nc3ccc4c(OC)cccc4c3nc21	ZINC000027769919	563047182	/nfs/dbraw/zinc/04/71/82/563047182.db2.gz	IBMHXIHITBJPCY-LJQANCHMSA-N	0	1	432.480	2.778	1	10		IFCFMN
COc1ccc(N2CCN(CCCCNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1	ZINC000045253269	563126828	/nfs/dbraw/zinc/12/68/28/563126828.db2.gz	MHWHIBSVOPCJKK-UHFFFAOYSA-N	0	1	442.516	2.944	1	10		IFCFMN
COc1ccc(N2CC[NH+](CCn3c([O-])nc4cc(-c5ccccc5)[nH]c4c3=O)CC2)cc1	ZINC000013641883	562998454	/nfs/dbraw/zinc/99/84/54/562998454.db2.gz	ZKPMOYKVGPZQTL-UHFFFAOYSA-N	0	1	445.523	2.928	1	10		IFCFMN
COc1ccc(N2CCN(C(=O)Nc3ccc(OC)c(N4CCN(C)CC4)c3)CC2)cc1	ZINC000000836547	562919339	/nfs/dbraw/zinc/91/93/39/562919339.db2.gz	HCTBJYWMGCQPOS-UHFFFAOYSA-N	0	1	439.560	2.810	1	10		IFCFMN
COc1cc2c3c(n(CCCn4ccnc4)c(=O)c2cc1OC)-c1cc(O)c(O)cc1C3=O	ZINC000095564840	563183151	/nfs/dbraw/zinc/18/31/51/563183151.db2.gz	RILQUXKJUULSIQ-UHFFFAOYSA-N	0	1	447.447	2.928	1	10		IFCFMN
Cc1c(O)c(O)c2c(c1S(=O)(=O)N(C)C)CN(Cc1ccc(F)c(Cl)c1)C2=O	ZINC000095559908	563182057	/nfs/dbraw/zinc/18/20/57/563182057.db2.gz	OBQLMVKKIGHQHY-UHFFFAOYSA-N	0	1	428.869	2.605	1	10		IFCFMN