smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Oc1ccc2c(c1)c1ccccc1c1c2[C@H](O)[C@@H]2CCC[N@H+]2C1	ZINC000066259098	184399251	/nfs/dbraw/zinc/39/92/51/184399251.db2.gz	SOAYCUPONIFPGN-AZUAARDMSA-N	1	1	305.377	3.710	1	5		DHBFMO
C[N@H+]1CCC[C@H]1CCNc1ccc2oc3ccccc3c(=O)c2c1	ZINC000015935764	182026012	/nfs/dbraw/zinc/02/60/12/182026012.db2.gz	HWMYZAFWKLKYER-HNNXBMFYSA-N	1	1	322.408	3.842	3	5		DHBFMO
C[NH+]1CCN(c2c3[nH]c4ccccc4c3nc3ccccc32)CC1	ZINC000095575142	185380431	/nfs/dbraw/zinc/38/04/31/185380431.db2.gz	GBRZHHMCHBIKOS-UHFFFAOYSA-N	1	1	316.408	3.621	1	5		DHBFMO
CCc1ccc([N+](=O)[O-])cc1Nc1[nH]cc(-c2cccnc2)[nH+]1	ZINC000040429014	183065872	/nfs/dbraw/zinc/06/58/72/183065872.db2.gz	PBPXQQRWBHUZJU-UHFFFAOYSA-N	1	1	309.329	3.686	1	5		DHBFMO
C[N@H+]1CCC[C@@H]1CCNc1ccc2oc3ccccc3c(=O)c2c1	ZINC000015935763	182025956	/nfs/dbraw/zinc/02/59/56/182025956.db2.gz	HWMYZAFWKLKYER-OAHLLOKOSA-N	1	1	322.408	3.842	3	5		DHBFMO
C[N@H+]1CCC[C@@H]1CCNc1ccc2c(c1)oc1ccccc1c2=O	ZINC000015935760	182025476	/nfs/dbraw/zinc/02/54/76/182025476.db2.gz	HDPRCSYTSRPGLU-OAHLLOKOSA-N	1	1	322.408	3.842	3	5		DHBFMO
C[N@H+]1CCC[C@H]1CCNc1ccc2c(c1)oc1ccccc1c2=O	ZINC000015935761	182025050	/nfs/dbraw/zinc/02/50/50/182025050.db2.gz	HDPRCSYTSRPGLU-HNNXBMFYSA-N	1	1	322.408	3.842	3	5		DHBFMO