smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Oc1ccccc1C[N@@H+](Cc1cccnc1)C[C@@H]1CCC[NH+](C2CCCCC2)C1	ZINC000012308900	204396218	/nfs/dbraw/zinc/39/62/18/204396218.db2.gz	QGKBCLGNKHSZCD-QFIPXVFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
Oc1ccccc1C[N@H+](Cc1cccnc1)C[C@@H]1CCC[NH+](C2CCCCC2)C1	ZINC000012308900	204396222	/nfs/dbraw/zinc/39/62/22/204396222.db2.gz	QGKBCLGNKHSZCD-QFIPXVFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
Oc1ccccc1C[NH+](Cc1cccnc1)C[C@@H]1CCC[N@@H+](C2CCCCC2)C1	ZINC000012308900	204396225	/nfs/dbraw/zinc/39/62/25/204396225.db2.gz	QGKBCLGNKHSZCD-QFIPXVFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
Oc1ccccc1C[NH+](Cc1cccnc1)C[C@@H]1CCC[N@H+](C2CCCCC2)C1	ZINC000012308900	204396229	/nfs/dbraw/zinc/39/62/29/204396229.db2.gz	QGKBCLGNKHSZCD-QFIPXVFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
Oc1ccccc1C[N@@H+](Cc1cccnc1)C[C@H]1CCC[NH+](C2CCCCC2)C1	ZINC000012308901	570640183	/nfs/dbraw/zinc/64/01/83/570640183.db2.gz	QGKBCLGNKHSZCD-JOCHJYFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
Oc1ccccc1C[N@H+](Cc1cccnc1)C[C@H]1CCC[NH+](C2CCCCC2)C1	ZINC000012308901	570640187	/nfs/dbraw/zinc/64/01/87/570640187.db2.gz	QGKBCLGNKHSZCD-JOCHJYFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
Oc1ccccc1C[NH+](Cc1cccnc1)C[C@H]1CCC[N@@H+](C2CCCCC2)C1	ZINC000012308901	570640189	/nfs/dbraw/zinc/64/01/89/570640189.db2.gz	QGKBCLGNKHSZCD-JOCHJYFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
Oc1ccccc1C[NH+](Cc1cccnc1)C[C@H]1CCC[N@H+](C2CCCCC2)C1	ZINC000012308901	570640194	/nfs/dbraw/zinc/64/01/94/570640194.db2.gz	QGKBCLGNKHSZCD-JOCHJYFZSA-N	2	1	393.575	4.834	50	10		GJCAMP
C[N@H+]1CCC[C@@H]1CC[NH2+]Cc1cc(-c2ccnc3cc(Cl)ccc32)ccc1O	ZINC000045374698	570990495	/nfs/dbraw/zinc/99/04/95/570990495.db2.gz	HFDHFUIYFUJYFA-LJQANCHMSA-N	2	1	395.934	4.835	50	10		GJCAMP
Cc1cc(N2CCC3(CCC[N@H+]3Cc3ccccc3O)CC2)c2ccccc2[nH+]1	ZINC000072422504	136169807	/nfs/dbraw/zinc/16/98/07/136169807.db2.gz	OSYYGNSMROAAFT-UHFFFAOYSA-N	2	1	387.527	4.884	50	10		GJCAMP
C[N@H+]1CCC[C@H]1CC[NH2+]Cc1cc(-c2ccnc3cc(Cl)ccc32)ccc1O	ZINC000045374700	570990467	/nfs/dbraw/zinc/99/04/67/570990467.db2.gz	HFDHFUIYFUJYFA-IBGZPJMESA-N	2	1	395.934	4.835	50	10		GJCAMP