smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ncc(C(C)(C)C)o1	ZINC000159487542	525611192	/nfs/dbraw/zinc/61/11/92/525611192.db2.gz	VJJHKGXMKVDENQ-WDEREUQCSA-N	1	2	308.372	4.662	20	70		DJIDLO
CCc1nc([C@@H](C)[NH2+][C@H](CC)c2ccc(F)cc2F)cs1	ZINC000160905428	522427296	/nfs/dbraw/zinc/42/72/96/522427296.db2.gz	YCHJCPRDCGEMGG-QMTHXVAHSA-N	1	2	310.413	4.786	20	70		DJIDLO
c1ccc([C@@H]2C[C@H](Nc3ccc4ccccc4[nH+]3)CCO2)cc1	ZINC000160602806	334877465	/nfs/dbraw/zinc/87/74/65/334877465.db2.gz	RVLIMJJOICDWTP-MJGOQNOKSA-N	1	2	304.393	4.567	20	70		DJIDLO
CCc1nc([C@H](C)[NH2+][C@@H](CC)c2ccc(F)cc2F)cs1	ZINC000160905327	522454573	/nfs/dbraw/zinc/45/45/73/522454573.db2.gz	YCHJCPRDCGEMGG-HZMBPMFUSA-N	1	2	310.413	4.786	20	70		DJIDLO
c1ccc([C@H]2C[C@@H](Nc3ccc4ccccc4[nH+]3)CCO2)cc1	ZINC000160603223	334877534	/nfs/dbraw/zinc/87/75/34/334877534.db2.gz	RVLIMJJOICDWTP-PKOBYXMFSA-N	1	2	304.393	4.567	20	70		DJIDLO
C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ncc(C(C)(C)C)o1	ZINC000159487289	525533029	/nfs/dbraw/zinc/53/30/29/525533029.db2.gz	VJJHKGXMKVDENQ-QWRGUYRKSA-N	1	2	308.372	4.662	20	70		DJIDLO
C[C@@H]([NH2+][C@@H](C)c1ncc(C(C)(C)C)o1)c1cccc(F)c1F	ZINC000159487413	525622865	/nfs/dbraw/zinc/62/28/65/525622865.db2.gz	VJJHKGXMKVDENQ-MNOVXSKESA-N	1	2	308.372	4.662	20	70		DJIDLO
C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1ncc(C(C)(C)C)o1	ZINC000159487658	525662053	/nfs/dbraw/zinc/66/20/53/525662053.db2.gz	VJJHKGXMKVDENQ-GHMZBOCLSA-N	1	2	308.372	4.662	20	70		DJIDLO
c1ccc([C@@H]2C[C@@H](Nc3ccc4ccccc4[nH+]3)CCO2)cc1	ZINC000160603072	334877304	/nfs/dbraw/zinc/87/73/04/334877304.db2.gz	RVLIMJJOICDWTP-HKUYNNGSSA-N	1	2	304.393	4.567	20	70		DJIDLO
Cc1ccc(-c2ccsc2C(=O)Nc2cc[nH+]c(C)c2)cc1	ZINC000218590281	340496759	/nfs/dbraw/zinc/49/67/59/340496759.db2.gz	GUQOBUTWMUPQKD-UHFFFAOYSA-N	1	2	308.406	4.679	20	70		DJIDLO
CCc1nc([C@H](C)[NH2+][C@H](CC)c2ccc(F)cc2F)cs1	ZINC000160905556	522457644	/nfs/dbraw/zinc/45/76/44/522457644.db2.gz	YCHJCPRDCGEMGG-IINYFYTJSA-N	1	2	310.413	4.786	20	70		DJIDLO
CCc1nc([C@@H](C)[NH2+][C@@H](CC)c2ccc(F)cc2F)cs1	ZINC000160905188	522423579	/nfs/dbraw/zinc/42/35/79/522423579.db2.gz	YCHJCPRDCGEMGG-YGRLFVJLSA-N	1	2	310.413	4.786	20	70		DJIDLO