smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)(C)[C@H]1CCC[N@H+](C[C@@H](O)COCc2ccccc2F)CC1	ZINC000217224135	241242831	/nfs/dbraw/zinc/24/28/31/241242831.db2.gz	ROCDGOMQWCEUJC-ZWKOTPCHSA-N	1	0	337.479	3.851	20	70		EHIDRO
CC(C)(C)[C@@H]1CCC[N@H+](C[C@@H](O)COCc2ccccc2F)CC1	ZINC000217224130	535073192	/nfs/dbraw/zinc/07/31/92/535073192.db2.gz	ROCDGOMQWCEUJC-QZTJIDSGSA-N	1	0	337.479	3.851	20	70		EHIDRO
CC(C)(C)[C@@H]1CCC[N@H+](C[C@@H](O)COCc2cccs2)CC1	ZINC000217224081	535073795	/nfs/dbraw/zinc/07/37/95/535073795.db2.gz	QNEYGSJOMSWCQT-HZPDHXFCSA-N	1	0	325.518	3.774	20	70		EHIDRO
CC(C)(C)[C@H]1CCC[N@H+](C[C@@H](O)COCc2cccs2)CC1	ZINC000217224089	241242256	/nfs/dbraw/zinc/24/22/56/241242256.db2.gz	QNEYGSJOMSWCQT-JKSUJKDBSA-N	1	0	325.518	3.774	20	70		EHIDRO
C[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)C(=O)Nc1ccc2c(c1)OCCCO2	ZINC000218743235	241343702	/nfs/dbraw/zinc/34/37/02/241343702.db2.gz	DGXWPBKOZWIIQD-WBTNSWJXSA-N	1	0	346.471	3.589	20	70		EHIDRO
CC(=O)NC[C@@H]1CCC[N@@H+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1	ZINC000216792495	241212392	/nfs/dbraw/zinc/21/23/92/241212392.db2.gz	FEWGJIVXTGJDPV-JSGCOSHPSA-N	1	0	328.378	3.615	20	70		EHIDRO
COc1ccccc1[C@H](C)NC(=O)[C@H](C)[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C	ZINC000218742700	241344683	/nfs/dbraw/zinc/34/46/83/241344683.db2.gz	VPMWSUCKWJFYAG-AAEZLKGMSA-N	1	0	332.488	3.675	20	70		EHIDRO