smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccccc1C1([NH2+]Cc2ccc(O)c(C[NH+]3CCOCC3)c2)CCCC1	ZINC000012344397	204398745	/nfs/dbraw/zinc/39/87/45/204398745.db2.gz	DIWJYBIFYCTILJ-UHFFFAOYSA-N	2	1	396.531	3.792	40	10		GHCBMP
CN1CCCc2cc(C[N@@H+]3CCCC[C@H]3c3ncc4c(n3)CC[NH+](C)C4)ccc21	ZINC000019590334	207141883	/nfs/dbraw/zinc/14/18/83/207141883.db2.gz	XFKRQXPQANVZJQ-QHCPKHFHSA-N	2	1	391.563	3.574	40	10		GHCBMP
CN1CCCc2cc(C[N@H+]3CCCC[C@H]3c3ncc4c(n3)CC[NH+](C)C4)ccc21	ZINC000019590334	207141888	/nfs/dbraw/zinc/14/18/88/207141888.db2.gz	XFKRQXPQANVZJQ-QHCPKHFHSA-N	2	1	391.563	3.574	40	10		GHCBMP
CN1CCCc2cc(C[NH+]3CCCC[C@H]3c3ncc4c(n3)CC[N@@H+](C)C4)ccc21	ZINC000019590334	207141892	/nfs/dbraw/zinc/14/18/92/207141892.db2.gz	XFKRQXPQANVZJQ-QHCPKHFHSA-N	2	1	391.563	3.574	40	10		GHCBMP
CN1CCCc2cc(C[NH+]3CCCC[C@H]3c3ncc4c(n3)CC[N@H+](C)C4)ccc21	ZINC000019590334	207141896	/nfs/dbraw/zinc/14/18/96/207141896.db2.gz	XFKRQXPQANVZJQ-QHCPKHFHSA-N	2	1	391.563	3.574	40	10		GHCBMP
CN1CCCc2cc(C[N@@H+]3CCCC[C@@H]3c3ncc4c(n3)CC[NH+](C)C4)ccc21	ZINC000019590335	571017392	/nfs/dbraw/zinc/01/73/92/571017392.db2.gz	XFKRQXPQANVZJQ-HSZRJFAPSA-N	2	1	391.563	3.574	40	10		GHCBMP
CN1CCCc2cc(C[N@H+]3CCCC[C@@H]3c3ncc4c(n3)CC[NH+](C)C4)ccc21	ZINC000019590335	571017397	/nfs/dbraw/zinc/01/73/97/571017397.db2.gz	XFKRQXPQANVZJQ-HSZRJFAPSA-N	2	1	391.563	3.574	40	10		GHCBMP
CN1CCCc2cc(C[NH+]3CCCC[C@@H]3c3ncc4c(n3)CC[N@@H+](C)C4)ccc21	ZINC000019590335	571017400	/nfs/dbraw/zinc/01/74/00/571017400.db2.gz	XFKRQXPQANVZJQ-HSZRJFAPSA-N	2	1	391.563	3.574	40	10		GHCBMP
CN1CCCc2cc(C[NH+]3CCCC[C@@H]3c3ncc4c(n3)CC[N@H+](C)C4)ccc21	ZINC000019590335	571017403	/nfs/dbraw/zinc/01/74/03/571017403.db2.gz	XFKRQXPQANVZJQ-HSZRJFAPSA-N	2	1	391.563	3.574	40	10		GHCBMP