smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)c1cnn2c1[nH]c(C[NH+]1CCC(C[NH+]3CCOCC3)CC1)cc2=O	ZINC000727833121	1076264574	/nfs/dbraw/zinc/26/45/74/1076264574.db2.gz	NDYDJSADORYYHG-UHFFFAOYSA-N	2	0	403.483	1.156	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NC[C@@H]3CCC[N@@H+]3CCOC)cc2F)CC1	ZINC000732464014	1075751601	/nfs/dbraw/zinc/75/16/01/1075751601.db2.gz	YKOCXXQRWVDDKM-IBGZPJMESA-N	2	0	421.561	1.878	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NC[C@@H]3C[N@@H+]4CCC[C@H]4CO3)cc2F)CC1	ZINC000730126940	1076458398	/nfs/dbraw/zinc/45/83/98/1076458398.db2.gz	VXMHDNYTMXDPIH-RBUKOAKNSA-N	2	0	419.545	1.630	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]3C[N@@H+]4CCC[C@H]4CO3)cc2F)CC1	ZINC000730126939	1076458345	/nfs/dbraw/zinc/45/83/45/1076458345.db2.gz	VXMHDNYTMXDPIH-OALUTQOASA-N	2	0	419.545	1.630	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]3C[N@@H+]4CCC[C@@H]4CO3)cc2F)CC1	ZINC000730126938	1076458497	/nfs/dbraw/zinc/45/84/97/1076458497.db2.gz	VXMHDNYTMXDPIH-MOPGFXCFSA-N	2	0	419.545	1.630	20	10		HDCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)N(C)CC[NH+]3CCCC3)CC2)cc1	ZINC000733038849	1075961536	/nfs/dbraw/zinc/96/15/36/1075961536.db2.gz	QMUMALZFBKUMLM-UHFFFAOYSA-N	2	0	403.571	1.945	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NCC3([NH+](C)C)CCOCC3)cc2F)CC1	ZINC000733848474	1076218290	/nfs/dbraw/zinc/21/82/90/1076218290.db2.gz	XHUVYMBXDMCNJE-UHFFFAOYSA-N	2	0	421.561	1.878	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NC3CC[NH+](CCOC)CC3)cc2F)CC1	ZINC000730124135	1076465268	/nfs/dbraw/zinc/46/52/68/1076465268.db2.gz	VGUKSIKKYPSGHM-UHFFFAOYSA-N	2	0	421.561	1.878	20	10		HDCDRP
CC[N@H+](CCNC(=O)C(=O)NCc1ccc(N2CC[NH+](CC)CC2)c(F)c1)C1CC1	ZINC000804224202	1075775189	/nfs/dbraw/zinc/77/51/89/1075775189.db2.gz	NKDCNBXBMCFNOD-UHFFFAOYSA-N	2	0	419.545	1.184	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)N(CCOC)CC[NH+](C)C)cc2F)CC1	ZINC000730132235	1076460089	/nfs/dbraw/zinc/46/00/89/1076460089.db2.gz	AFAQBSASIMLCAX-UHFFFAOYSA-N	2	0	409.550	1.687	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]3CCC[N@@H+]3CCOC)cc2F)CC1	ZINC000732464016	1075751872	/nfs/dbraw/zinc/75/18/72/1075751872.db2.gz	YKOCXXQRWVDDKM-LJQANCHMSA-N	2	0	421.561	1.878	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NC[C@@H]3C[N@@H+]4CCC[C@@H]4CO3)cc2F)CC1	ZINC000730126941	1076458613	/nfs/dbraw/zinc/45/86/13/1076458613.db2.gz	VXMHDNYTMXDPIH-RTBURBONSA-N	2	0	419.545	1.630	20	10		HDCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NCCNc3cc[nH+]cc3)cc2F)CC1	ZINC000730133498	1076460068	/nfs/dbraw/zinc/46/00/68/1076460068.db2.gz	WCMZHBZZPUSPLL-UHFFFAOYSA-N	2	0	400.502	1.696	20	10		HDCDRP