smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[NH+](CC)C[C@H](O)CNc1[nH+]ccc2c(C)c3[nH]c4cc[nH+]cc4c3cc21	ZINC000005139348	204114560	/nfs/dbraw/zinc/11/45/60/204114560.db2.gz	ZAMYMBBINBOWQT-OAHLLOKOSA-N	3	2	377.492	3.687	1	5		GHBFLP
COc1ccc2c(c1)c1cc(OC)c(OC)cc1c1c2C[N@H+]2CCC[C@H]2[C@H]1[NH3+]	ZINC000073296355	222269609	/nfs/dbraw/zinc/26/96/09/222269609.db2.gz	ZGCLYFORSLOCKB-WMZHIEFXSA-N	2	2	378.472	3.997	1	5		GHBFLP
COc1ccc2c(c1)c1cc(OC)c(OC)cc1c1c2C[N@@H+]2CCC[C@H]2[C@H]1[NH3+]	ZINC000073296355	222269611	/nfs/dbraw/zinc/26/96/11/222269611.db2.gz	ZGCLYFORSLOCKB-WMZHIEFXSA-N	2	2	378.472	3.997	1	5		GHBFLP
CC(C)[N+]12CCC(CC1)[C@@H](OC(=O)[C@](C)(c1ccccc1)[NH+]1CCCCC1)C2	ZINC000073160013	208033810	/nfs/dbraw/zinc/03/38/10/208033810.db2.gz	ZXAIBYRKWLCJDI-KKHVISAVSA-N	2	2	385.572	3.948	1	5		GHBFLP
C[C@@](C(=O)OC1CC[N+](C)(C)CC1)(c1ccc(Cl)cc1)[NH+]1CCCCC1	ZINC000073158425	211125238	/nfs/dbraw/zinc/12/52/38/211125238.db2.gz	TXMQKSRNNXQQRH-NRFANRHFSA-N	2	2	379.952	3.823	1	5		GHBFLP
C[NH+](C)CCC[NH+]1CCN(c2c3[nH]c4ccccc4c3[nH+]c3ccccc32)CC1	ZINC000095575652	535833730	/nfs/dbraw/zinc/83/37/30/535833730.db2.gz	ABVLNNAUTIXSKR-UHFFFAOYSA-N	3	2	387.531	3.943	1	5		GHBFLP
C[C@](C(=O)OC1CC[N+](C)(C)CC1)(c1ccc(Cl)cc1)[NH+]1CCCCC1	ZINC000073158422	222267171	/nfs/dbraw/zinc/26/71/71/222267171.db2.gz	TXMQKSRNNXQQRH-OAQYLSRUSA-N	2	2	379.952	3.823	1	5		GHBFLP