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]1C[C@H]2CC[C@H](O)C[C@H]2N1Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000008679901	204283538	/nfs/dbraw/zinc/28/35/38/204283538.db2.gz	KZAWBAONFXVOLN-PMXSJFBMSA-N	1	1	387.524	1.715	3	10		GDCFMO
C=C1C(=O)OC2=C1C[C@@]1(O)[C@H]3Cc4ccc(O)c5c4[C@@]1(CC[N@@H+]3CC1CC1)[C@H]2O5	ZINC000028088016	207334492	/nfs/dbraw/zinc/33/44/92/207334492.db2.gz	QTMBORSBMGILGD-LNKMKMDRSA-N	1	1	393.439	1.933	1	10		GDCFMO
COc1ccc(N2CC[NH+](CCn3c(=O)[nH]c4sccc4c3=O)CC2)cc1	ZINC000029469265	207362988	/nfs/dbraw/zinc/36/29/88/207362988.db2.gz	WXTOGNWSCLQJMQ-UHFFFAOYSA-N	1	1	386.477	1.582	1	10		GDCFMO
CN(C)CCNc1nnc(NCC[NH+](C)C)c2c1C(=O)c1ccccc1C2=O	ZINC000000599205	206307834	/nfs/dbraw/zinc/30/78/34/206307834.db2.gz	OTVNDYNVDGMDMZ-UHFFFAOYSA-N	1	1	382.468	1.199	1	10		GDCFMO