smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc2c(cc1O)[C@H](Cc1ccc([O-])c(Oc3ccc(C[C@@H]4c5cc(OC)c(OC)cc5CC[N+]4(C)C)cc3)c1)[N+](C)(C)CC2	ZINC000247635429	291545618	/nfs/dbraw/zinc/54/56/18/291545618.db2.gz	DHQVMBLXXYEWEX-SAIUNTKASA-P	1	3	640.821	6.749	10	5		KKBEHO
COc1cc2c(cc1O)[C@@H](Cc1ccc([O-])c(Oc3ccc(C[C@@H]4c5cc(OC)c(OC)cc5CC[N+]4(C)C)cc3)c1)[N+](C)(C)CC2	ZINC000247635418	291545653	/nfs/dbraw/zinc/54/56/53/291545653.db2.gz	DHQVMBLXXYEWEX-CZNDPXEESA-P	1	3	640.821	6.749	10	5		KKBEHO
COc1ccc2cc1Oc1cc3c(cc1OC)CCN(C)[C@H]3Cc1ccc(cc1)Oc1c(OC)c(OC)cc3c1[C@@H](C2)[N+](C)(C)CC3	ZINC000056898772	717130566	/nfs/dbraw/zinc/13/05/66/717130566.db2.gz	GMAJRXOYQVZSRJ-IOWSJCHKSA-N	1	3	637.797	7.307	10	5	in-man	KKBEHO
C[N+](CCN(CCN(CCN(Cc1ccccc1)Cc1ccccc1)Cc1ccccc1)Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1	ZINC000159521271	717154621	/nfs/dbraw/zinc/15/46/21/717154621.db2.gz	BQOMRNIDXZYZSU-UHFFFAOYSA-N	1	3	702.023	9.540	10	5		KKBEHO