smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c(C)c1	ZINC000217565905	568472793	/nfs/dbraw/zinc/47/27/93/568472793.db2.gz	ZJJGWZQWROXYET-CGXNFDGLSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c(C)c1	ZINC000217565905	568472794	/nfs/dbraw/zinc/47/27/94/568472794.db2.gz	ZJJGWZQWROXYET-CGXNFDGLSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c1	ZINC000217452236	568472207	/nfs/dbraw/zinc/47/22/07/568472207.db2.gz	LKISCTNMRXYASH-CGXNFDGLSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c1	ZINC000217452236	568472209	/nfs/dbraw/zinc/47/22/09/568472209.db2.gz	LKISCTNMRXYASH-CGXNFDGLSA-N	1	2	422.912	3.792	40	70		HHIBLO
CCc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)cc1	ZINC000217583441	568472938	/nfs/dbraw/zinc/47/29/38/568472938.db2.gz	YFMMOCVQZBMPGN-CGXNFDGLSA-N	1	2	422.912	3.738	40	70		HHIBLO
CCc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)cc1	ZINC000217583441	568472939	/nfs/dbraw/zinc/47/29/39/568472939.db2.gz	YFMMOCVQZBMPGN-CGXNFDGLSA-N	1	2	422.912	3.738	40	70		HHIBLO
COc1ccc2c(c1)[C@@]1(C(=O)N2)[C@H](C(=O)c2ccco2)[C@@H](c2ccc(F)cc2)C[N@@H+]1C	ZINC000217718079	568473576	/nfs/dbraw/zinc/47/35/76/568473576.db2.gz	FNXTVAHVEYQKHE-GQOCTPOGSA-N	1	2	420.440	3.803	40	70		HHIBLO
COc1ccc2c(c1)[C@@]1(C(=O)N2)[C@H](C(=O)c2ccco2)[C@@H](c2ccc(F)cc2)C[N@H+]1C	ZINC000217718079	568473578	/nfs/dbraw/zinc/47/35/78/568473578.db2.gz	FNXTVAHVEYQKHE-GQOCTPOGSA-N	1	2	420.440	3.803	40	70		HHIBLO
C[N@@H+]1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)c2ccccn2)[C@@]12C(=O)Nc1ccc(F)cc12	ZINC000217779322	568473824	/nfs/dbraw/zinc/47/38/24/568473824.db2.gz	SPNNTYNWHYVRGR-GQOCTPOGSA-N	1	2	419.431	3.736	40	70		HHIBLO
C[N@H+]1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)c2ccccn2)[C@@]12C(=O)Nc1ccc(F)cc12	ZINC000217779322	568473825	/nfs/dbraw/zinc/47/38/25/568473825.db2.gz	SPNNTYNWHYVRGR-GQOCTPOGSA-N	1	2	419.431	3.736	40	70		HHIBLO
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c1	ZINC000217452147	568472165	/nfs/dbraw/zinc/47/21/65/568472165.db2.gz	LKISCTNMRXYASH-MXEMCNAFSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1cc(C)cc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c1	ZINC000217452147	568472166	/nfs/dbraw/zinc/47/21/66/568472166.db2.gz	LKISCTNMRXYASH-MXEMCNAFSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)cc1C	ZINC000217479193	568472290	/nfs/dbraw/zinc/47/22/90/568472290.db2.gz	PNWRSFZTCKAQCO-CGXNFDGLSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)cc1C	ZINC000217479193	568472291	/nfs/dbraw/zinc/47/22/91/568472291.db2.gz	PNWRSFZTCKAQCO-CGXNFDGLSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c(C)c1	ZINC000217565818	568472748	/nfs/dbraw/zinc/47/27/48/568472748.db2.gz	ZJJGWZQWROXYET-MXEMCNAFSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)c(C)c1	ZINC000217565818	568472749	/nfs/dbraw/zinc/47/27/49/568472749.db2.gz	ZJJGWZQWROXYET-MXEMCNAFSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@@H+]4[C@@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)cc1C	ZINC000217479110	568472279	/nfs/dbraw/zinc/47/22/79/568472279.db2.gz	PNWRSFZTCKAQCO-MXEMCNAFSA-N	1	2	422.912	3.792	40	70		HHIBLO
Cc1ccc(N2C(=O)[C@@H]3[C@H]4CCC[N@H+]4[C@@H](C(=O)c4ccc(Cl)cc4)[C@H]3C2=O)cc1C	ZINC000217479110	568472281	/nfs/dbraw/zinc/47/22/81/568472281.db2.gz	PNWRSFZTCKAQCO-MXEMCNAFSA-N	1	2	422.912	3.792	40	70		HHIBLO