smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(-c2noc(CNC(=O)CSc3ccc(Cl)cc3)n2)c(OC)c1	ZINC000217984127	568474417	/nfs/dbraw/zinc/47/44/17/568474417.db2.gz	GYIUXAUDRWFLGU-UHFFFAOYSA-N	0	0	419.890	3.816	40	70		HHIBRN
CC(C)n1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)Cn2c(=O)cccc23)c2ccccc21	ZINC000218035499	568474760	/nfs/dbraw/zinc/47/47/60/568474760.db2.gz	LSIMZGVKUSROAI-AZUAARDMSA-N	0	0	403.526	3.962	40	70		HHIBRN
CCc1ccc(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)cc1	ZINC000218309325	568478234	/nfs/dbraw/zinc/47/82/34/568478234.db2.gz	OLFXFMJJVLFPEX-UHFFFAOYSA-N	0	0	416.587	3.887	40	70		HHIBRN
CC[C@@H](NC(=O)[C@@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218462133	568480664	/nfs/dbraw/zinc/48/06/64/568480664.db2.gz	ZNZBHWHFFZPYTE-OXQOHEQNSA-N	0	0	406.523	3.865	40	70		HHIBRN
C[C@H](C(=O)Nc1ccc(OC2CCCC2)cc1)N(c1ccc(F)cc1)S(C)(=O)=O	ZINC000218459277	568480681	/nfs/dbraw/zinc/48/06/81/568480681.db2.gz	NEGZSSWQDKTFDZ-OAHLLOKOSA-N	0	0	420.506	3.940	40	70		HHIBRN
C[C@H](CCc1ccccc1)NC(=O)[C@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O	ZINC000218473437	568480782	/nfs/dbraw/zinc/48/07/82/568480782.db2.gz	GHPPRUVMIZNXQG-CVEARBPZSA-N	0	0	408.951	3.632	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)[C@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)cc1C	ZINC000218477810	568480899	/nfs/dbraw/zinc/48/08/99/568480899.db2.gz	MIXJCGUZLMHCMW-HOTGVXAUSA-N	0	0	408.951	3.989	40	70		HHIBRN
CCS(=O)(=O)Nc1ccc(C(=O)NCCCc2ccc(OC(C)C)cc2)cc1	ZINC000218639857	568482651	/nfs/dbraw/zinc/48/26/51/568482651.db2.gz	ZYMHIVPJSQLOFU-UHFFFAOYSA-N	0	0	404.532	3.598	40	70		HHIBRN
CC[C@@H](Oc1ccc(OC)cc1)C(=O)N(C)Cc1nc(-c2ccc(OC)cc2)no1	ZINC000218760645	568483294	/nfs/dbraw/zinc/48/32/94/568483294.db2.gz	ZSRGZPZZPNRREU-LJQANCHMSA-N	0	0	411.458	3.570	40	70		HHIBRN
CCOC[C@]1(C(N)=S)[C@@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218509713	568879832	/nfs/dbraw/zinc/87/98/32/568879832.db2.gz	GLCYBRZDBGUJKR-ZJOUEHCJSA-N	0	0	403.569	3.552	40	70		HHIBRN
COc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000218128889	568475434	/nfs/dbraw/zinc/47/54/34/568475434.db2.gz	LVALWQSQLYMLKI-MRXNPFEDSA-N	0	0	401.459	3.753	40	70		HHIBRN
CS(=O)(=O)N(CC(=O)NC1CCCCCCC1)c1cccc(C(F)(F)F)c1	ZINC000218261624	568477098	/nfs/dbraw/zinc/47/70/98/568477098.db2.gz	ATZFKMBDASMLAN-UHFFFAOYSA-N	0	0	406.470	3.701	40	70		HHIBRN
Cc1cc(C)cc(N([C@@H](C)C(=O)NCc2cccc(OC(C)C)c2)S(C)(=O)=O)c1	ZINC000218373901	568479445	/nfs/dbraw/zinc/47/94/45/568479445.db2.gz	UFJAYKZYNUCHAU-SFHVURJKSA-N	0	0	418.559	3.562	40	70		HHIBRN
C[C@@H](C(=O)NCc1ccc(Cl)cc1Cl)N(c1ccc(F)cc1)S(C)(=O)=O	ZINC000218447511	568480431	/nfs/dbraw/zinc/48/04/31/568480431.db2.gz	CRHXNFQYJPXNEB-NSHDSACASA-N	0	0	419.305	3.603	40	70		HHIBRN
CC(C)Oc1cccc(NC(=O)[C@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)c1	ZINC000218472389	568480767	/nfs/dbraw/zinc/48/07/67/568480767.db2.gz	LXYYIZZZLTXKHI-AWEZNQCLSA-N	0	0	410.923	3.920	40	70		HHIBRN
Cc1c(NS(=O)(=O)c2ccccc2)cccc1C(=O)NCCN(C)c1ccccc1	ZINC000218584381	568482042	/nfs/dbraw/zinc/48/20/42/568482042.db2.gz	VTSAMXDQNJPRAA-UHFFFAOYSA-N	0	0	423.538	3.662	40	70		HHIBRN
Cc1cc(C(=O)NCCCc2cccc(OC(C)C)c2)ccc1NS(C)(=O)=O	ZINC000218595541	568482261	/nfs/dbraw/zinc/48/22/61/568482261.db2.gz	HZVZXGGFBIWGDA-UHFFFAOYSA-N	0	0	404.532	3.516	40	70		HHIBRN
CCN(c1ccc(C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)cc1)S(C)(=O)=O	ZINC000218780291	568483555	/nfs/dbraw/zinc/48/35/55/568483555.db2.gz	UPQRZUNIHYCHCQ-SFHVURJKSA-N	0	0	402.516	3.505	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O	ZINC000218288537	568477674	/nfs/dbraw/zinc/47/76/74/568477674.db2.gz	RLZYXIHKIZGPOC-QFBILLFUSA-N	0	0	416.543	3.568	40	70		HHIBRN
Cc1ccc(N([C@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)cc1	ZINC000218355374	568479106	/nfs/dbraw/zinc/47/91/06/568479106.db2.gz	VUNWQNHSNIBDFJ-MRXNPFEDSA-N	0	0	408.951	3.552	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)[C@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1C	ZINC000218370025	568479320	/nfs/dbraw/zinc/47/93/20/568479320.db2.gz	HFSVXCHSDCLHHV-MOPGFXCFSA-N	0	0	402.560	3.952	40	70		HHIBRN
CC(C)Oc1ccc(NC(=O)[C@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)cc1	ZINC000218472215	568480729	/nfs/dbraw/zinc/48/07/29/568480729.db2.gz	DBARTFVUIMBDLJ-AWEZNQCLSA-N	0	0	410.923	3.920	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2C)cc1C	ZINC000218623773	568482512	/nfs/dbraw/zinc/48/25/12/568482512.db2.gz	ICWOIGIJHIDTHC-SFHVURJKSA-N	0	0	400.544	3.887	40	70		HHIBRN
Cc1cccc(O[C@@H](C)C(=O)NCc2nc(-c3cccc(Br)c3)no2)c1	ZINC000218690846	568482938	/nfs/dbraw/zinc/48/29/38/568482938.db2.gz	XCRIZZZRJXJZSE-ZDUSSCGKSA-N	0	0	416.275	3.891	40	70		HHIBRN
Cc1ccc(C)c(N(CCCC(=O)NCCCc2ccc(F)cc2)S(C)(=O)=O)c1	ZINC000218746781	568483287	/nfs/dbraw/zinc/48/32/87/568483287.db2.gz	DDROMKXQHRXNEJ-UHFFFAOYSA-N	0	0	420.550	3.738	40	70		HHIBRN
Cc1cccc(CN2CCO[C@@H]2c2cn(Cc3cccc(Br)c3)nn2)c1	ZINC000216777146	568467113	/nfs/dbraw/zinc/46/71/13/568467113.db2.gz	XPFWCTSNRYEFGS-HXUWFJFHSA-N	0	0	413.319	3.928	40	70		HHIBRN
COc1ccc(CN2CCO[C@H]2c2cn(Cc3cccc(C(F)(F)F)c3)nn2)cc1	ZINC000216779243	568467190	/nfs/dbraw/zinc/46/71/90/568467190.db2.gz	LCCBERFUPVKDJJ-FQEVSTJZSA-N	0	0	418.419	3.885	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)[C@H](C)Sc3ccccc3)n2)c(OC)c1	ZINC000218063923	568474918	/nfs/dbraw/zinc/47/49/18/568474918.db2.gz	GBEVEAFQGSHNGS-AWEZNQCLSA-N	0	0	413.499	3.893	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)[C@@H](C)Sc3ccc(C)cc3)n2)c(OC)c1	ZINC000218143565	568475824	/nfs/dbraw/zinc/47/58/24/568475824.db2.gz	ISRHSOQKWBFOKL-CQSZACIVSA-N	0	0	413.499	3.859	40	70		HHIBRN
Cc1ccc(C)c(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)c1	ZINC000218240239	568476746	/nfs/dbraw/zinc/47/67/46/568476746.db2.gz	WMNCZQFSTUVXHU-UHFFFAOYSA-N	0	0	416.587	3.942	40	70		HHIBRN
CC[C@@H](NC(=O)[C@@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218277832	568477339	/nfs/dbraw/zinc/47/73/39/568477339.db2.gz	OXJZKAYLRCKELB-DYESRHJHSA-N	0	0	418.559	3.734	40	70		HHIBRN
Cc1ccc2c(c1)[C@H](NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O)CC(C)(C)O2	ZINC000218288286	568477653	/nfs/dbraw/zinc/47/76/53/568477653.db2.gz	ZPUIZTOGWKPBSM-QFBILLFUSA-N	0	0	416.543	3.568	40	70		HHIBRN
Cc1ccc(OCCNC(=O)c2ccc(N(C)S(=O)(=O)c3ccccc3)cc2)cc1	ZINC000218303932	568478097	/nfs/dbraw/zinc/47/80/97/568478097.db2.gz	UZHKADXBNOLVBL-UHFFFAOYSA-N	0	0	424.522	3.629	40	70		HHIBRN
COc1ccc(CN(C)C(=O)c2ccc(N(C)S(=O)(=O)c3ccccc3)cc2)cc1	ZINC000218303254	568478128	/nfs/dbraw/zinc/47/81/28/568478128.db2.gz	XSCSLYQQJWVOPI-UHFFFAOYSA-N	0	0	424.522	3.793	40	70		HHIBRN
Cc1ccc(N([C@@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)cc1	ZINC000218355301	568479018	/nfs/dbraw/zinc/47/90/18/568479018.db2.gz	VUNWQNHSNIBDFJ-INIZCTEOSA-N	0	0	408.951	3.552	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@H](C)N(c2cc(C)cc(C)c2)S(C)(=O)=O)c1	ZINC000218374691	568479432	/nfs/dbraw/zinc/47/94/32/568479432.db2.gz	IJVTWMFCUPFMSE-OALUTQOASA-N	0	0	402.560	3.952	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@H]2CC(C)(C)Oc3ccc(C)cc32)cc1	ZINC000218442312	568480474	/nfs/dbraw/zinc/48/04/74/568480474.db2.gz	CCCURRYYODXXOV-IBGZPJMESA-N	0	0	416.543	3.813	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)[C@H](C)N(c2ccc(F)cc2)S(C)(=O)=O)cc1	ZINC000218465068	568480737	/nfs/dbraw/zinc/48/07/37/568480737.db2.gz	OCTOKLDICBNGJG-KRWDZBQOSA-N	0	0	420.550	3.853	40	70		HHIBRN
Cc1ccc(OC[C@@H](C)NC(=O)c2cccc(NS(=O)(=O)c3ccccc3)c2)cc1	ZINC000218573569	568481892	/nfs/dbraw/zinc/48/18/92/568481892.db2.gz	ACMOCARDXYVUBE-GOSISDBHSA-N	0	0	424.522	3.993	40	70		HHIBRN
Cc1ccccc1OC[C@@H](C)NC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000218573368	568481922	/nfs/dbraw/zinc/48/19/22/568481922.db2.gz	YHHPKYZJCDDAGB-GOSISDBHSA-N	0	0	424.522	3.993	40	70		HHIBRN
Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NCCCc1ccc(F)cc1	ZINC000218625486	568482545	/nfs/dbraw/zinc/48/25/45/568482545.db2.gz	OMAHPYJFNPXXNK-UHFFFAOYSA-N	0	0	418.534	3.671	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CCCOc3ccc(Cl)cc3)n2)cc1	ZINC000218738463	568483252	/nfs/dbraw/zinc/48/32/52/568483252.db2.gz	ISYUJDBQHSWPKG-UHFFFAOYSA-N	0	0	401.850	3.874	40	70		HHIBRN
O=C1CS[C@H](c2cn(Cc3ccc(C(F)(F)F)cc3)nn2)N1Cc1ccco1	ZINC000216686005	568466384	/nfs/dbraw/zinc/46/63/84/568466384.db2.gz	AOWSRAAJWNDPNI-QGZVFWFLSA-N	0	0	408.405	3.712	40	70		HHIBRN
Cc1cc(C)cc(N2C(=O)[C@H]3C(=C(C(=O)c4ccc(Cl)cc4)N4CCC[C@H]34)C2O)c1	ZINC000217452236	568472206	/nfs/dbraw/zinc/47/22/06/568472206.db2.gz	LKISCTNMRXYASH-CGXNFDGLSA-N	0	0	422.912	3.792	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)[C@@H](C)Sc3ccccc3)n2)c(OC)c1	ZINC000218063849	568474807	/nfs/dbraw/zinc/47/48/07/568474807.db2.gz	GBEVEAFQGSHNGS-CQSZACIVSA-N	0	0	413.499	3.893	40	70		HHIBRN
COc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000218128815	568475339	/nfs/dbraw/zinc/47/53/39/568475339.db2.gz	LVALWQSQLYMLKI-INIZCTEOSA-N	0	0	401.459	3.753	40	70		HHIBRN
Cc1ccc(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)cc1C	ZINC000218244382	568476843	/nfs/dbraw/zinc/47/68/43/568476843.db2.gz	AOUDYGMFUPIUBH-UHFFFAOYSA-N	0	0	416.587	3.942	40	70		HHIBRN
Cc1ccc2c(c1)[C@@H](NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O)CC(C)(C)O2	ZINC000218288140	568477680	/nfs/dbraw/zinc/47/76/80/568477680.db2.gz	ZPUIZTOGWKPBSM-APWZRJJASA-N	0	0	416.543	3.568	40	70		HHIBRN
Cc1ccc(C)c(N([C@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218549968	568481613	/nfs/dbraw/zinc/48/16/13/568481613.db2.gz	JYQAVAWEJWYLBT-RBUKOAKNSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc(C)c(N([C@@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218545732	568481630	/nfs/dbraw/zinc/48/16/30/568481630.db2.gz	XTQXTEGVAHZLMR-KRWDZBQOSA-N	0	0	422.978	3.860	40	70		HHIBRN
COc1ccccc1CCCNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000218572605	568481926	/nfs/dbraw/zinc/48/19/26/568481926.db2.gz	LWECSVAWMFWUOM-UHFFFAOYSA-N	0	0	424.522	3.859	40	70		HHIBRN
Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(NS(C)(=O)=O)c(C)c1)CC(C)(C)O2	ZINC000218597416	568482270	/nfs/dbraw/zinc/48/22/70/568482270.db2.gz	FRZVRIJNYJFLKZ-SFHVURJKSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc(C(=O)NCCN(C)c2ccccc2)cc1NS(=O)(=O)c1ccccc1	ZINC000218592255	568482290	/nfs/dbraw/zinc/48/22/90/568482290.db2.gz	VXGSFTLFPYUNFP-UHFFFAOYSA-N	0	0	423.538	3.662	40	70		HHIBRN
CCOc1cc(CNC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)ccc1OC	ZINC000217195896	568470898	/nfs/dbraw/zinc/47/08/98/568470898.db2.gz	XEXDWTJNYDPDLS-HKWRFOASSA-N	0	0	420.465	3.774	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)[C@H](C)SCc3ccccc3)n2)c(OC)c1	ZINC000218073698	568474987	/nfs/dbraw/zinc/47/49/87/568474987.db2.gz	SAAQWMDESMPIGK-AWEZNQCLSA-N	0	0	413.499	3.692	40	70		HHIBRN
CS(=O)(=O)N(CC(=O)NC1CCCCCCC1)c1ccc(Cl)c(Cl)c1	ZINC000218297188	568478033	/nfs/dbraw/zinc/47/80/33/568478033.db2.gz	OPMFOESLPRMXAY-UHFFFAOYSA-N	0	0	407.363	3.989	40	70		HHIBRN
CCOc1ccc(CNC(=O)CN2c3cccc4cccc(c34)C2=O)cc1OCC	ZINC000218315618	568478247	/nfs/dbraw/zinc/47/82/47/568478247.db2.gz	YUUVZJDRBYLUOI-UHFFFAOYSA-N	0	0	404.466	3.914	40	70		HHIBRN
Cc1ccc(OC[C@@H](C)NC(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)cc1	ZINC000218406737	568479856	/nfs/dbraw/zinc/47/98/56/568479856.db2.gz	NTOVBJYJGFVYEY-GOSISDBHSA-N	0	0	424.522	3.993	40	70		HHIBRN
CC(C)Oc1cccc(NC(=O)[C@@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)c1	ZINC000218472330	568480753	/nfs/dbraw/zinc/48/07/53/568480753.db2.gz	LXYYIZZZLTXKHI-CQSZACIVSA-N	0	0	410.923	3.920	40	70		HHIBRN
Cc1ccc(C)c(N([C@@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)c1	ZINC000218545555	568481597	/nfs/dbraw/zinc/48/15/97/568481597.db2.gz	UVPFLTPJLYOXIY-KRWDZBQOSA-N	0	0	422.978	3.860	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@@H](C)N(c2cc(C)ccc2C)S(C)(=O)=O)c1	ZINC000218545219	568481599	/nfs/dbraw/zinc/48/15/99/568481599.db2.gz	WYZKJXQNYNGCKU-RTBURBONSA-N	0	0	402.560	3.952	40	70		HHIBRN
O=C(NCCCc1ccc(F)cc1)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000218572505	568481886	/nfs/dbraw/zinc/48/18/86/568481886.db2.gz	XVWLVLQZLNAEDH-UHFFFAOYSA-N	0	0	412.486	3.989	40	70		HHIBRN
CCN(c1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)cc1)S(C)(=O)=O	ZINC000218781650	568483538	/nfs/dbraw/zinc/48/35/38/568483538.db2.gz	WEJLXEMIJJWIAG-LJQANCHMSA-N	0	0	416.543	3.813	40	70		HHIBRN
CCOC[C@@]1(C(N)=S)[C@H](c2ccc(CC)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218583369	568882652	/nfs/dbraw/zinc/88/26/52/568882652.db2.gz	FMMKLOTYYQNMIB-RZUBCFFCSA-N	0	0	417.596	3.806	40	70		HHIBRN
Fc1ccc(N2CCO[C@@H]2c2cn(Cc3cccc(Br)c3)nn2)cc1	ZINC000216771498	568466943	/nfs/dbraw/zinc/46/69/43/568466943.db2.gz	KKRCZYZMHBLHMF-GOSISDBHSA-N	0	0	403.255	3.763	40	70		HHIBRN
Cc1ccc(CN2CCO[C@@H]2c2cn(Cc3cccc(Br)c3)nn2)cc1	ZINC000216775256	568467108	/nfs/dbraw/zinc/46/71/08/568467108.db2.gz	UOTFBHOYBWBGNU-HXUWFJFHSA-N	0	0	413.319	3.928	40	70		HHIBRN
COc1cccc(-c2noc(CNC(=O)CSCc3ccccc3Cl)n2)c1	ZINC000218032452	568474698	/nfs/dbraw/zinc/47/46/98/568474698.db2.gz	CTDVRMSJJZAJQE-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
CCc1ccccc1N(CC(=O)NCCCc1ccc(C(C)C)cc1)S(C)(=O)=O	ZINC000218246933	568476866	/nfs/dbraw/zinc/47/68/66/568476866.db2.gz	GUHFFOCYMVENIG-UHFFFAOYSA-N	0	0	416.587	3.887	40	70		HHIBRN
CC[C@H](NC(=O)[C@@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218277630	568477284	/nfs/dbraw/zinc/47/72/84/568477284.db2.gz	PTPZBYPQWNQWMQ-UTKZUKDTSA-N	0	0	418.559	3.734	40	70		HHIBRN
CC[C@H](NC(=O)[C@@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218277944	568477322	/nfs/dbraw/zinc/47/73/22/568477322.db2.gz	OXJZKAYLRCKELB-UTKZUKDTSA-N	0	0	418.559	3.734	40	70		HHIBRN
CCOc1ccc(N([C@@H](C)C(=O)Nc2ccc(OC(C)C)cc2)S(C)(=O)=O)cc1	ZINC000218293573	568477820	/nfs/dbraw/zinc/47/78/20/568477820.db2.gz	XJSNDPIBPSGXTH-INIZCTEOSA-N	0	0	420.531	3.666	40	70		HHIBRN
CN(Cc1ccccc1)C(=O)c1ccccc1N(Cc1ccccc1)S(C)(=O)=O	ZINC000218312896	568478258	/nfs/dbraw/zinc/47/82/58/568478258.db2.gz	VTEBOSGCRRCPOZ-UHFFFAOYSA-N	0	0	408.523	3.925	40	70		HHIBRN
Cc1ccc(N([C@@H](C)C(=O)NCc2cccc(OC(C)C)c2)S(C)(=O)=O)cc1C	ZINC000218364743	568479264	/nfs/dbraw/zinc/47/92/64/568479264.db2.gz	NNHNGBWJRYTILK-SFHVURJKSA-N	0	0	418.559	3.562	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@@H](C)N(c2cc(C)cc(C)c2)S(C)(=O)=O)c1	ZINC000218374456	568479393	/nfs/dbraw/zinc/47/93/93/568479393.db2.gz	IJVTWMFCUPFMSE-RTBURBONSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1cc(C)cc(N([C@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218379060	568479451	/nfs/dbraw/zinc/47/94/51/568479451.db2.gz	DVOVUWZBSGNJNM-RBUKOAKNSA-N	0	0	402.560	3.952	40	70		HHIBRN
COc1cccc(-c2noc(CN(C)C(=O)[C@@H](C)Oc3ccc(Cl)cc3)n2)c1	ZINC000218681794	568482875	/nfs/dbraw/zinc/48/28/75/568482875.db2.gz	BYRRODNWBSQOBV-CYBMUJFWSA-N	0	0	401.850	3.825	40	70		HHIBRN
Cc1cccc(O[C@H](C)C(=O)NCc2nc(-c3cccc(Br)c3)no2)c1	ZINC000218690930	568482933	/nfs/dbraw/zinc/48/29/33/568482933.db2.gz	XCRIZZZRJXJZSE-CYBMUJFWSA-N	0	0	416.275	3.891	40	70		HHIBRN
C[C@@H](Oc1ccc(F)cc1)C(=O)NCc1nc(-c2cccc(Br)c2)no1	ZINC000218705794	568483029	/nfs/dbraw/zinc/48/30/29/568483029.db2.gz	WGKWVEIAWLTBMN-LLVKDONJSA-N	0	0	420.238	3.722	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)CCCN(c2ccc(F)cc2)S(C)(=O)=O)c1	ZINC000218743869	568483178	/nfs/dbraw/zinc/48/31/78/568483178.db2.gz	ALYPGAZBHCLJEX-QGZVFWFLSA-N	0	0	406.523	3.866	40	70		HHIBRN
CCOC[C@@]1(C(N)=S)[C@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218509630	568879889	/nfs/dbraw/zinc/87/98/89/568879889.db2.gz	GLCYBRZDBGUJKR-SVFBPWRDSA-N	0	0	403.569	3.552	40	70		HHIBRN
COc1ccccc1N1CCO[C@@H]1c1cn(Cc2cccc(Br)c2)nn1	ZINC000216763944	568466737	/nfs/dbraw/zinc/46/67/37/568466737.db2.gz	CCDRTTPYPLXPKR-LJQANCHMSA-N	0	0	415.291	3.633	40	70		HHIBRN
Cc1ccc(CN2CCO[C@H]2c2cn(Cc3cccc(Br)c3)nn2)cc1	ZINC000216775301	568467095	/nfs/dbraw/zinc/46/70/95/568467095.db2.gz	UOTFBHOYBWBGNU-FQEVSTJZSA-N	0	0	413.319	3.928	40	70		HHIBRN
COc1ccc(CN2CCO[C@@H]2c2cn(Cc3cccc(C(F)(F)F)c3)nn2)cc1	ZINC000216779197	568467224	/nfs/dbraw/zinc/46/72/24/568467224.db2.gz	LCCBERFUPVKDJJ-HXUWFJFHSA-N	0	0	418.419	3.885	40	70		HHIBRN
COc1ccc2c(c1)[C@@]1(C(=O)N2)[C@H](C(=O)c2ccco2)[C@@H](c2ccc(F)cc2)CN1C	ZINC000217718079	568473574	/nfs/dbraw/zinc/47/35/74/568473574.db2.gz	FNXTVAHVEYQKHE-GQOCTPOGSA-N	0	0	420.440	3.803	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1	ZINC000218292664	568477867	/nfs/dbraw/zinc/47/78/67/568477867.db2.gz	QDHWOAWWAIQYBV-SFHVURJKSA-N	0	0	402.560	3.714	40	70		HHIBRN
Cc1cc(C)cc(N([C@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218375080	568479422	/nfs/dbraw/zinc/47/94/22/568479422.db2.gz	FUKDQSQYTCNVEM-QGZVFWFLSA-N	0	0	422.978	3.860	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)cc1	ZINC000218442402	568480464	/nfs/dbraw/zinc/48/04/64/568480464.db2.gz	MCIWVCXYSFJVEE-LJQANCHMSA-N	0	0	416.543	3.813	40	70		HHIBRN
CCS(=O)(=O)Nc1ccc(C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1	ZINC000218639648	568482666	/nfs/dbraw/zinc/48/26/66/568482666.db2.gz	CROUIXBJMWTHCO-UHFFFAOYSA-N	0	0	408.479	3.932	40	70		HHIBRN
CN(C)S(=O)(=O)N(C)c1ccc(C(=O)Nc2ccc(OC3CCCC3)cc2)cc1	ZINC000218769751	568483503	/nfs/dbraw/zinc/48/35/03/568483503.db2.gz	XBCWGGMAXYTKRE-UHFFFAOYSA-N	0	0	417.531	3.503	40	70		HHIBRN
O=C(CCn1c2ccccc2c2c1CCCC2)N1C[C@H]2C[C@@H](C1)Cn1c(=O)cccc12	ZINC000217791827	568473914	/nfs/dbraw/zinc/47/39/14/568473914.db2.gz	NDOXNLXJQPIPIR-RBUKOAKNSA-N	0	0	415.537	3.718	40	70		HHIBRN
COc1ccccc1/C=C/C(=O)NCc1nc(-c2cccc(Br)c2)no1	ZINC000217969155	568474336	/nfs/dbraw/zinc/47/43/36/568474336.db2.gz	XDHUYHHHSVMCRP-MDZDMXLPSA-N	0	0	414.259	3.837	40	70		HHIBRN
C[C@@H](Sc1ccc(Cl)cc1)C(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000217985475	568474407	/nfs/dbraw/zinc/47/44/07/568474407.db2.gz	CVYMFTIVPFMQHN-CYBMUJFWSA-N	0	0	424.975	3.660	40	70		HHIBRN
COc1cccc(-c2noc(CNC(=O)CSCc3ccc(Cl)cc3)n2)c1	ZINC000218045636	568474916	/nfs/dbraw/zinc/47/49/16/568474916.db2.gz	RCYOFTBYYRUFNH-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
COc1ccc(/C=C/C(=O)N(C)Cc2nc(-c3cccc(C)c3)no2)c(OC)c1OC	ZINC000218190502	568476132	/nfs/dbraw/zinc/47/61/32/568476132.db2.gz	AJZLWRIBIBMFIQ-ZRDIBKRKSA-N	0	0	423.469	3.743	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O	ZINC000218288428	568477664	/nfs/dbraw/zinc/47/76/64/568477664.db2.gz	RLZYXIHKIZGPOC-VQIMIIECSA-N	0	0	416.543	3.568	40	70		HHIBRN
CCOc1ccc(N([C@H](C)C(=O)Nc2ccc(OC(C)C)cc2)S(C)(=O)=O)cc1	ZINC000218293620	568477875	/nfs/dbraw/zinc/47/78/75/568477875.db2.gz	XJSNDPIBPSGXTH-MRXNPFEDSA-N	0	0	420.531	3.666	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)[C@@H](C)N(c2ccc(F)cc2)S(C)(=O)=O)cc1	ZINC000218464971	568480618	/nfs/dbraw/zinc/48/06/18/568480618.db2.gz	OCTOKLDICBNGJG-QGZVFWFLSA-N	0	0	420.550	3.853	40	70		HHIBRN
Cc1ccc(C(=O)NCCCc2ccc(Cl)cc2)cc1S(=O)(=O)N1CCCC1	ZINC000218510453	568481260	/nfs/dbraw/zinc/48/12/60/568481260.db2.gz	UPEPAUIDDQWJHM-UHFFFAOYSA-N	0	0	420.962	3.796	40	70		HHIBRN
Cc1c(NS(C)(=O)=O)cccc1C(=O)NCCCc1cccc(OC(C)C)c1	ZINC000218578242	568482031	/nfs/dbraw/zinc/48/20/31/568482031.db2.gz	OEZAOXJQERZRIF-UHFFFAOYSA-N	0	0	404.532	3.516	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CCCOc3ccc(C)cc3)n2)c(OC)c1	ZINC000218733299	568483055	/nfs/dbraw/zinc/48/30/55/568483055.db2.gz	QFEICQVVADHELV-UHFFFAOYSA-N	0	0	411.458	3.538	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)CCCN(c2ccc(F)cc2)S(C)(=O)=O)cc1C	ZINC000218745500	568483285	/nfs/dbraw/zinc/48/32/85/568483285.db2.gz	RVRDBVBOWNOQTI-KRWDZBQOSA-N	0	0	406.523	3.866	40	70		HHIBRN
CCN(c1ccc(C(=O)NCCCc2cccc(OC(C)C)c2)cc1)S(C)(=O)=O	ZINC000218779700	568483491	/nfs/dbraw/zinc/48/34/91/568483491.db2.gz	GMCPBOGOGRQSPI-UHFFFAOYSA-N	0	0	418.559	3.622	40	70		HHIBRN
O=C(CSc1ccccc1)NCc1nc(-c2cccc(Br)c2)no1	ZINC000217974328	568474422	/nfs/dbraw/zinc/47/44/22/568474422.db2.gz	CDTLIQAFTZCHBX-UHFFFAOYSA-N	0	0	404.289	3.908	40	70		HHIBRN
Cc1cccc(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)c1C	ZINC000218282329	568477469	/nfs/dbraw/zinc/47/74/69/568477469.db2.gz	HREWPJDADAMEIY-UHFFFAOYSA-N	0	0	416.587	3.942	40	70		HHIBRN
C[C@H](C(=O)Nc1ccc(OC2CCCC2)cc1)N(c1ccccc1)S(C)(=O)=O	ZINC000218286170	568477560	/nfs/dbraw/zinc/47/75/60/568477560.db2.gz	GNQMMUOALQJVES-MRXNPFEDSA-N	0	0	402.516	3.801	40	70		HHIBRN
CN(c1ccccc1C(=O)Nc1ccccc1C(=O)c1ccccc1)S(C)(=O)=O	ZINC000218341478	568478681	/nfs/dbraw/zinc/47/86/81/568478681.db2.gz	MIVAKTZZPOHSQU-UHFFFAOYSA-N	0	0	408.479	3.566	40	70		HHIBRN
Cc1ccc(N([C@H](C)C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)S(C)(=O)=O)cc1	ZINC000218357954	568479137	/nfs/dbraw/zinc/47/91/37/568479137.db2.gz	AJLYDVYFGWRUNA-VQIMIIECSA-N	0	0	416.543	3.568	40	70		HHIBRN
Cc1ccc(N([C@@H](C)C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)S(C)(=O)=O)cc1	ZINC000218357872	568479147	/nfs/dbraw/zinc/47/91/47/568479147.db2.gz	AJLYDVYFGWRUNA-QFBILLFUSA-N	0	0	416.543	3.568	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@H](C)N(c2cc(C)cc(C)c2)S(C)(=O)=O)c1	ZINC000218374616	568479401	/nfs/dbraw/zinc/47/94/01/568479401.db2.gz	IJVTWMFCUPFMSE-MOPGFXCFSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccccc1OC[C@@H](C)NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	ZINC000218406554	568479819	/nfs/dbraw/zinc/47/98/19/568479819.db2.gz	NQXRDTKQXPGPMH-GOSISDBHSA-N	0	0	424.522	3.993	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)cc1	ZINC000218441068	568480436	/nfs/dbraw/zinc/48/04/36/568480436.db2.gz	PNBWJZZXEXYCLU-SFHVURJKSA-N	0	0	402.516	3.505	40	70		HHIBRN
Cc1ccc(C)c(N([C@H](C)C(=O)NCc2cccc(OC(C)C)c2)S(C)(=O)=O)c1	ZINC000218544709	568481658	/nfs/dbraw/zinc/48/16/58/568481658.db2.gz	VWDYHMZIAPJXKC-GOSISDBHSA-N	0	0	418.559	3.562	40	70		HHIBRN
CCS(=O)(=O)Nc1ccc(C(=O)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)cc1	ZINC000218641775	568482646	/nfs/dbraw/zinc/48/26/46/568482646.db2.gz	OTOGOWOYFMBHKO-SFHVURJKSA-N	0	0	402.516	3.789	40	70		HHIBRN
CN1C[C@H](c2ccc(F)cc2)[C@@H](C(=O)c2ccccn2)[C@@]12C(=O)Nc1ccc(F)cc12	ZINC000217779322	568473823	/nfs/dbraw/zinc/47/38/23/568473823.db2.gz	SPNNTYNWHYVRGR-GQOCTPOGSA-N	0	0	419.431	3.736	40	70		HHIBRN
Cc1ccccc1OCC(=O)N(C)Cc1nc(-c2cccc(Br)c2)no1	ZINC000217829064	568474055	/nfs/dbraw/zinc/47/40/55/568474055.db2.gz	MFLVVUNBGNKILK-UHFFFAOYSA-N	0	0	416.275	3.845	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)CSCc3ccccc3)n2)c(OC)c1	ZINC000218012843	568474603	/nfs/dbraw/zinc/47/46/03/568474603.db2.gz	HDEVJHIHJCUJCT-UHFFFAOYSA-N	0	0	413.499	3.646	40	70		HHIBRN
COc1ccc(-c2nc(C)c(C(=O)N3C[C@H]4C[C@@H](C3)Cn3c(=O)cccc34)s2)cc1	ZINC000218018954	568474691	/nfs/dbraw/zinc/47/46/91/568474691.db2.gz	ITYHXBJXFPBNSQ-DOTOQJQBSA-N	0	0	421.522	3.548	40	70		HHIBRN
COc1ccc(CSCC(=O)N(C)Cc2nc(-c3ccc(OC)cc3)no2)cc1	ZINC000218118163	568475202	/nfs/dbraw/zinc/47/52/02/568475202.db2.gz	YFTRVCIRYVNKFU-UHFFFAOYSA-N	0	0	413.499	3.646	40	70		HHIBRN
COc1ccc(CSCC(=O)NCc2nc(-c3ccccc3Cl)no2)cc1	ZINC000218117549	568475285	/nfs/dbraw/zinc/47/52/85/568475285.db2.gz	NNJZJACFJXFZEL-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
Cc1cccc(-c2noc(CNC(=O)c3ccc(I)cc3)n2)c1	ZINC000218215368	568476497	/nfs/dbraw/zinc/47/64/97/568476497.db2.gz	TVOUWVVBRICZAI-UHFFFAOYSA-N	0	0	419.222	3.580	40	70		HHIBRN
O=C(NCCCN1CCCc2ccccc21)c1ccccc1I	ZINC000218219303	568476532	/nfs/dbraw/zinc/47/65/32/568476532.db2.gz	YKHGTTXWCZQQHM-UHFFFAOYSA-N	0	0	420.294	3.864	40	70		HHIBRN
CC[C@@H](NC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218277701	568477334	/nfs/dbraw/zinc/47/73/34/568477334.db2.gz	PTPZBYPQWNQWMQ-LAUBAEHRSA-N	0	0	418.559	3.734	40	70		HHIBRN
COc1ccc(CN(C)C(=O)c2ccccc2N(C)S(=O)(=O)c2ccccc2)cc1	ZINC000218346486	568478798	/nfs/dbraw/zinc/47/87/98/568478798.db2.gz	QPKWBEJNSLYURI-UHFFFAOYSA-N	0	0	424.522	3.793	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218365358	568479251	/nfs/dbraw/zinc/47/92/51/568479251.db2.gz	GKNRQGQQFWFYEY-RBUKOAKNSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)[C@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)cc1C	ZINC000218385937	568479619	/nfs/dbraw/zinc/47/96/19/568479619.db2.gz	NZXQCTIBRBULSP-CVEARBPZSA-N	0	0	408.951	3.989	40	70		HHIBRN
C[C@H](CCc1ccccc1)NC(=O)[C@@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O	ZINC000218473294	568480722	/nfs/dbraw/zinc/48/07/22/568480722.db2.gz	GHPPRUVMIZNXQG-HZPDHXFCSA-N	0	0	408.951	3.632	40	70		HHIBRN
Cc1cc(C(=O)Nc2ccccc2C(=O)c2ccccc2)ccc1NS(C)(=O)=O	ZINC000218595432	568482248	/nfs/dbraw/zinc/48/22/48/568482248.db2.gz	MWHSYZDSOBGSLO-UHFFFAOYSA-N	0	0	408.479	3.850	40	70		HHIBRN
O=C(c1cc(-c2ccncc2)nc2ccccc21)N1C[C@H]2C[C@@H](C1)Cn1c(=O)cccc12	ZINC000218004272	568474558	/nfs/dbraw/zinc/47/45/58/568474558.db2.gz	GWXXCPFWNKFKOV-PKOBYXMFSA-N	0	0	422.488	3.718	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CSCc3ccccc3Cl)n2)cc1	ZINC000218032551	568474707	/nfs/dbraw/zinc/47/47/07/568474707.db2.gz	ZOJXFQYZWTVXGS-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
CC(C)c1ccc(N(CC(=O)N[C@@H](C)CCc2ccccc2)S(C)(=O)=O)cc1	ZINC000218247195	568476827	/nfs/dbraw/zinc/47/68/27/568476827.db2.gz	SYWGJTWPVDZEAQ-SFHVURJKSA-N	0	0	402.560	3.714	40	70		HHIBRN
CCOc1ccc(N([C@H](C)C(=O)N[C@@H](C)c2cc(C)ccc2C)S(C)(=O)=O)cc1	ZINC000218294131	568477895	/nfs/dbraw/zinc/47/78/95/568477895.db2.gz	RINRIQMNKXCISA-ZWKOTPCHSA-N	0	0	418.559	3.734	40	70		HHIBRN
Cc1ccc(N([C@@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)cc1C	ZINC000218365624	568479297	/nfs/dbraw/zinc/47/92/97/568479297.db2.gz	XMJCWCNDXOEOCE-KRWDZBQOSA-N	0	0	422.978	3.860	40	70		HHIBRN
Cc1cc(C)cc(N([C@@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218378998	568479490	/nfs/dbraw/zinc/47/94/90/568479490.db2.gz	DVOVUWZBSGNJNM-OALUTQOASA-N	0	0	402.560	3.952	40	70		HHIBRN
C[C@@H](C(=O)Nc1ccc(OC2CCCC2)cc1)N(c1ccc(F)cc1)S(C)(=O)=O	ZINC000218459203	568480672	/nfs/dbraw/zinc/48/06/72/568480672.db2.gz	NEGZSSWQDKTFDZ-HNNXBMFYSA-N	0	0	420.506	3.940	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)c2ccc(C)c(S(=O)(=O)N3CCCC3)c2)cc1C	ZINC000218513112	568481275	/nfs/dbraw/zinc/48/12/75/568481275.db2.gz	HQHVDIPPDURTSB-GOSISDBHSA-N	0	0	400.544	3.887	40	70		HHIBRN
O=C(NCCCc1ccc(F)cc1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000218634269	568482624	/nfs/dbraw/zinc/48/26/24/568482624.db2.gz	LEWKQYDUNJRVRJ-UHFFFAOYSA-N	0	0	424.925	3.626	40	70		HHIBRN
CCCOc1ccccc1CCCNC(=O)c1ccc(NS(=O)(=O)CC)cc1	ZINC000218640543	568482678	/nfs/dbraw/zinc/48/26/78/568482678.db2.gz	SOGBQIRUEUQYCJ-UHFFFAOYSA-N	0	0	404.532	3.600	40	70		HHIBRN
Cc1cc(C)cc(OCC(=O)NCc2nc(-c3cccc(Br)c3)no2)c1	ZINC000218696724	568482920	/nfs/dbraw/zinc/48/29/20/568482920.db2.gz	JDZGOPNMXBOFFW-UHFFFAOYSA-N	0	0	416.275	3.811	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)[C@@H](C)Oc3ccc(Cl)cc3)n2)cc1	ZINC000218681905	568482930	/nfs/dbraw/zinc/48/29/30/568482930.db2.gz	VKBGZHIWFKDVBK-CYBMUJFWSA-N	0	0	401.850	3.825	40	70		HHIBRN
CCOC[C@@]1(C(N)=S)[C@@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218509812	568879877	/nfs/dbraw/zinc/87/98/77/568879877.db2.gz	GLCYBRZDBGUJKR-IRFCIJBXSA-N	0	0	403.569	3.552	40	70		HHIBRN
COc1ccc(CCCNC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)cc1	ZINC000217168766	568470797	/nfs/dbraw/zinc/47/07/97/568470797.db2.gz	LYRSLRUWSSDCAP-XLNRJJMWSA-N	0	0	404.466	3.808	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)CSc3ccc(C)cc3)n2)c(OC)c1	ZINC000217979411	568474451	/nfs/dbraw/zinc/47/44/51/568474451.db2.gz	IVAVGZUHLORDQT-UHFFFAOYSA-N	0	0	413.499	3.813	40	70		HHIBRN
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C(=C/c1ccco1)c1ccccc1	ZINC000218101302	568475112	/nfs/dbraw/zinc/47/51/12/568475112.db2.gz	IVANPTFSBNZFAW-LTGZKZEYSA-N	0	0	422.506	3.660	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218365510	568479281	/nfs/dbraw/zinc/47/92/81/568479281.db2.gz	GKNRQGQQFWFYEY-OALUTQOASA-N	0	0	402.560	3.952	40	70		HHIBRN
CC(C)Oc1cccc(CNC(=O)[C@@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218382143	568479536	/nfs/dbraw/zinc/47/95/36/568479536.db2.gz	HVCVKADNZLBCAM-OAHLLOKOSA-N	0	0	424.950	3.598	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)c2ccc(C)c(S(=O)(=O)N3CCCC3)c2)cc1C	ZINC000218513176	568481219	/nfs/dbraw/zinc/48/12/19/568481219.db2.gz	HQHVDIPPDURTSB-SFHVURJKSA-N	0	0	400.544	3.887	40	70		HHIBRN
CCCOc1ccccc1CCCNC(=O)c1cccc(NS(C)(=O)=O)c1C	ZINC000218578941	568482010	/nfs/dbraw/zinc/48/20/10/568482010.db2.gz	XKKCIDUSHNGTEE-UHFFFAOYSA-N	0	0	404.532	3.518	40	70		HHIBRN
Cc1ccc(C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000218587052	568482162	/nfs/dbraw/zinc/48/21/62/568482162.db2.gz	SWMVWNGCKQQINF-UHFFFAOYSA-N	0	0	408.479	3.850	40	70		HHIBRN
COc1ccc(OCCCC(=O)NCc2nc(-c3ccccc3Cl)no2)cc1	ZINC000218742735	568483250	/nfs/dbraw/zinc/48/32/50/568483250.db2.gz	DSXGQPTUMXREOJ-UHFFFAOYSA-N	0	0	401.850	3.874	40	70		HHIBRN
CCCCOC(=O)c1ccc(Nc2cc(N3CCN(C)CC3)nc(SC)n2)cc1	ZINC000216852796	568468329	/nfs/dbraw/zinc/46/83/29/568468329.db2.gz	WSBOLHWHAUSKKQ-UHFFFAOYSA-N	0	0	415.563	3.651	40	70		HHIBRN
O=C(/C=C/c1ccc(F)cc1)NCc1nc(-c2cccc(Br)c2)no1	ZINC000217915189	568474287	/nfs/dbraw/zinc/47/42/87/568474287.db2.gz	FIRHHUBUQHMIPN-RMKNXTFCSA-N	0	0	402.223	3.968	40	70		HHIBRN
Cc1ccc(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)c(C)c1	ZINC000218237828	568476750	/nfs/dbraw/zinc/47/67/50/568476750.db2.gz	JRQJDOKSKFSBCD-UHFFFAOYSA-N	0	0	416.587	3.942	40	70		HHIBRN
Cc1ccc(N([C@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)cc1C	ZINC000218365689	568479331	/nfs/dbraw/zinc/47/93/31/568479331.db2.gz	XMJCWCNDXOEOCE-QGZVFWFLSA-N	0	0	422.978	3.860	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)[C@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1C	ZINC000218370104	568479333	/nfs/dbraw/zinc/47/93/33/568479333.db2.gz	HFSVXCHSDCLHHV-OALUTQOASA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc(N([C@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)cc1C	ZINC000218365851	568479335	/nfs/dbraw/zinc/47/93/35/568479335.db2.gz	ZTYZNVLSCIXCGX-QGZVFWFLSA-N	0	0	422.978	3.860	40	70		HHIBRN
Cc1ccc(OC[C@H](C)NC(=O)c2ccc(NS(=O)(=O)c3ccccc3)cc2)cc1	ZINC000218406818	568479867	/nfs/dbraw/zinc/47/98/67/568479867.db2.gz	NTOVBJYJGFVYEY-SFHVURJKSA-N	0	0	424.522	3.993	40	70		HHIBRN
C[C@H](NC(=O)[C@H]1CN(S(=O)(=O)c2ccccc2)c2ccccc2O1)c1ccccc1	ZINC000218436188	568480358	/nfs/dbraw/zinc/48/03/58/568480358.db2.gz	GQUQDHWPWJTGMY-HTAPYJJXSA-N	0	0	422.506	3.520	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)NCCCc2ccc(OC(C)C)cc2)cc1	ZINC000218440549	568480439	/nfs/dbraw/zinc/48/04/39/568480439.db2.gz	SUSVFKMWOYSEEL-UHFFFAOYSA-N	0	0	418.559	3.622	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)NCCCc2ccc(C(C)C)cc2)cc1	ZINC000218445659	568480459	/nfs/dbraw/zinc/48/04/59/568480459.db2.gz	NWXSLZLKOXCULT-UHFFFAOYSA-N	0	0	402.560	3.959	40	70		HHIBRN
O=C(c1cc2c(ccc3ccccc23)o1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000218495765	568480948	/nfs/dbraw/zinc/48/09/48/568480948.db2.gz	OYYKFKDUQIDRMG-UHFFFAOYSA-N	0	0	420.490	3.733	40	70		HHIBRN
Cc1ccc(C)c(N([C@@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218549892	568481601	/nfs/dbraw/zinc/48/16/01/568481601.db2.gz	JYQAVAWEJWYLBT-OALUTQOASA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1ccc(NS(C)(=O)=O)c(C)c1	ZINC000218597599	568482260	/nfs/dbraw/zinc/48/22/60/568482260.db2.gz	GRFWMKGECHHJKU-SFHVURJKSA-N	0	0	402.516	3.707	40	70		HHIBRN
CCN(c1ccc(C(=O)N[C@H]2CC(C)(C)Oc3ccc(C)cc32)cc1)S(C)(=O)=O	ZINC000218781537	568483561	/nfs/dbraw/zinc/48/35/61/568483561.db2.gz	BSOXTGRLWWHKAD-IBGZPJMESA-N	0	0	416.543	3.813	40	70		HHIBRN
Cc1cc(C)cc(N2C(=O)[C@H]3C(=C(C(=O)c4ccc(Cl)cc4)N4CCC[C@H]34)C2O)c1	ZINC000217452147	568472162	/nfs/dbraw/zinc/47/21/62/568472162.db2.gz	LKISCTNMRXYASH-MXEMCNAFSA-N	0	0	422.912	3.792	40	70		HHIBRN
Cc1ccc(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)cc1	ZINC000218235615	568476721	/nfs/dbraw/zinc/47/67/21/568476721.db2.gz	ODIQUMFBWHHRKT-UHFFFAOYSA-N	0	0	402.560	3.633	40	70		HHIBRN
Cc1cc(C)cc(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)c1	ZINC000218242340	568476730	/nfs/dbraw/zinc/47/67/30/568476730.db2.gz	BKQODEZAZIEBDL-UHFFFAOYSA-N	0	0	416.587	3.942	40	70		HHIBRN
CC[C@H](NC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218277762	568477333	/nfs/dbraw/zinc/47/73/33/568477333.db2.gz	PTPZBYPQWNQWMQ-UWJYYQICSA-N	0	0	418.559	3.734	40	70		HHIBRN
CCOc1ccc(N([C@@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)S(C)(=O)=O)cc1	ZINC000218295857	568478047	/nfs/dbraw/zinc/47/80/47/568478047.db2.gz	PJKGQMBPXOOHAV-ROUUACIJSA-N	0	0	418.559	3.734	40	70		HHIBRN
Cc1ccc(N([C@@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)cc1	ZINC000218355158	568479029	/nfs/dbraw/zinc/47/90/29/568479029.db2.gz	KSMSAHIGPDTZOK-INIZCTEOSA-N	0	0	408.951	3.552	40	70		HHIBRN
CN(CCCNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)c1ccccc1	ZINC000218408066	568479794	/nfs/dbraw/zinc/47/97/94/568479794.db2.gz	HIQHYBGSSKMCCS-UHFFFAOYSA-N	0	0	423.538	3.744	40	70		HHIBRN
C[C@H](C(=O)N[C@@H](C)CCc1ccccc1)N(c1cccc(Cl)c1)S(C)(=O)=O	ZINC000218473226	568480778	/nfs/dbraw/zinc/48/07/78/568480778.db2.gz	GHPPRUVMIZNXQG-JKSUJKDBSA-N	0	0	408.951	3.632	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)[C@@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)cc1C	ZINC000218477659	568480841	/nfs/dbraw/zinc/48/08/41/568480841.db2.gz	MIXJCGUZLMHCMW-JKSUJKDBSA-N	0	0	408.951	3.989	40	70		HHIBRN
COc1ccc(Cl)cc1N([C@H](C)C(=O)NC1CCCCCCC1)S(C)(=O)=O	ZINC000218485662	568481027	/nfs/dbraw/zinc/48/10/27/568481027.db2.gz	MNFIGGAAVUNFQF-CQSZACIVSA-N	0	0	416.971	3.732	40	70		HHIBRN
Cc1ccc(C(=O)NCCCc2ccc(OC(C)C)cc2)cc1NS(C)(=O)=O	ZINC000218587238	568482118	/nfs/dbraw/zinc/48/21/18/568482118.db2.gz	HKWZWKZEAWAQOD-UHFFFAOYSA-N	0	0	404.532	3.516	40	70		HHIBRN
CCCOc1ccccc1CCCNC(=O)c1ccc(N(CC)S(C)(=O)=O)cc1	ZINC000218780496	568483512	/nfs/dbraw/zinc/48/35/12/568483512.db2.gz	DXECRGIPQUVNQC-UHFFFAOYSA-N	0	0	418.559	3.624	40	70		HHIBRN
Fc1ccc(N2CCO[C@H]2c2cn(Cc3cccc(Br)c3)nn2)cc1	ZINC000216771541	568467007	/nfs/dbraw/zinc/46/70/07/568467007.db2.gz	KKRCZYZMHBLHMF-SFHVURJKSA-N	0	0	403.255	3.763	40	70		HHIBRN
Cc1cc(C)cc(N([C@@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)c1	ZINC000218374803	568479443	/nfs/dbraw/zinc/47/94/43/568479443.db2.gz	FGHSFZFKGARJHU-KRWDZBQOSA-N	0	0	422.978	3.860	40	70		HHIBRN
C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)N(c1ccc(F)cc1)S(C)(=O)=O	ZINC000218448299	568480538	/nfs/dbraw/zinc/48/05/38/568480538.db2.gz	ZQKQDCFNIGJREJ-NSHDSACASA-N	0	0	404.385	3.638	40	70		HHIBRN
Cc1c(NS(C)(=O)=O)cccc1C(=O)NCCCc1ccc(OC(C)C)cc1	ZINC000218578343	568481970	/nfs/dbraw/zinc/48/19/70/568481970.db2.gz	XDCOLVVSIXYWHX-UHFFFAOYSA-N	0	0	404.532	3.516	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1cccc(NS(C)(=O)=O)c1C	ZINC000218579961	568482014	/nfs/dbraw/zinc/48/20/14/568482014.db2.gz	WZPAAYQAFKPBLV-SFHVURJKSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)CCCN(c2ccc(F)cc2)S(C)(=O)=O)c1	ZINC000218743917	568483179	/nfs/dbraw/zinc/48/31/79/568483179.db2.gz	ALYPGAZBHCLJEX-KRWDZBQOSA-N	0	0	406.523	3.866	40	70		HHIBRN
CC[C@H](NC(=O)[C@H](CC)Oc1ccc(OC)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000218759416	568483297	/nfs/dbraw/zinc/48/32/97/568483297.db2.gz	PRKCWAQMZDUVPW-PMACEKPBSA-N	0	0	405.516	3.524	40	70		HHIBRN
COc1cccc(N2CCO[C@@H]2c2cn(Cc3cccc(Br)c3)nn2)c1	ZINC000216765826	568466861	/nfs/dbraw/zinc/46/68/61/568466861.db2.gz	CWGHXIOYAMMDQZ-LJQANCHMSA-N	0	0	415.291	3.633	40	70		HHIBRN
COc1ccc2c(c1)[C@@H](NC(=O)c1cc(OC)c(OC)c(OC)c1)CC(C)(C)O2	ZINC000218128623	568475412	/nfs/dbraw/zinc/47/54/12/568475412.db2.gz	PVYFDUIGZREFRT-INIZCTEOSA-N	0	0	401.459	3.753	40	70		HHIBRN
COc1ccc(/C=C/C(=O)NCCCN2CCCc3ccccc32)c(OC)c1OC	ZINC000218191633	568476163	/nfs/dbraw/zinc/47/61/63/568476163.db2.gz	WLYOGZBNYDONND-WYMLVPIESA-N	0	0	410.514	3.685	40	70		HHIBRN
CN(Cc1nc(-c2cccs2)no1)C(=O)CN1c2cccc3cccc(c23)C1=O	ZINC000218321809	568478369	/nfs/dbraw/zinc/47/83/69/568478369.db2.gz	QYBOLKIEJGFXMI-UHFFFAOYSA-N	0	0	404.451	3.570	40	70		HHIBRN
Cc1cc(C)cc(N([C@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)c1	ZINC000218374887	568479373	/nfs/dbraw/zinc/47/93/73/568479373.db2.gz	FGHSFZFKGARJHU-QGZVFWFLSA-N	0	0	422.978	3.860	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218382401	568479521	/nfs/dbraw/zinc/47/95/21/568479521.db2.gz	CMFYYOUWCYZZIF-JKSUJKDBSA-N	0	0	408.951	3.989	40	70		HHIBRN
CC[C@@H](NC(=O)[C@@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218462465	568480684	/nfs/dbraw/zinc/48/06/84/568480684.db2.gz	KATOUGBKSGKTCR-OXQOHEQNSA-N	0	0	406.523	3.865	40	70		HHIBRN
O=C(NCCCc1ccc(F)cc1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000218523477	568481465	/nfs/dbraw/zinc/48/14/65/568481465.db2.gz	YLDPEXFLMPWUDQ-UHFFFAOYSA-N	0	0	424.925	3.626	40	70		HHIBRN
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCc1ccc(C(C)(C)C)cc1	ZINC000218537809	568481557	/nfs/dbraw/zinc/48/15/57/568481557.db2.gz	WWGJOHYMHPVQJT-UHFFFAOYSA-N	0	0	414.571	3.756	40	70		HHIBRN
COc1ccc(OCCCC(=O)N(C)Cc2nc(-c3cccc(OC)c3)no2)cc1	ZINC000218743140	568483240	/nfs/dbraw/zinc/48/32/40/568483240.db2.gz	OVMNMEDHLIAHSU-UHFFFAOYSA-N	0	0	411.458	3.571	40	70		HHIBRN
CN1C(=O)c2ccccc2N(C)[C@H]1c1cn(Cc2cccc(C(F)(F)F)c2)nn1	ZINC000216758555	568466759	/nfs/dbraw/zinc/46/67/59/568466759.db2.gz	GQCZLIGILVMJTM-GOSISDBHSA-N	0	0	401.392	3.566	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)[C@H](C)Sc3ccc(C)cc3)n2)c(OC)c1	ZINC000218143637	568475771	/nfs/dbraw/zinc/47/57/71/568475771.db2.gz	ISRHSOQKWBFOKL-AWEZNQCLSA-N	0	0	413.499	3.859	40	70		HHIBRN
COc1ccc(/C=C/C(=O)NCc2ccc(OC(C)C)c(OC)c2)c(OC)c1OC	ZINC000218184870	568476019	/nfs/dbraw/zinc/47/60/19/568476019.db2.gz	UBVRNDFPXMYAOH-FMIVXFBMSA-N	0	0	415.486	3.838	40	70		HHIBRN
Cc1cc(C)cc(N([C@@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218375008	568479395	/nfs/dbraw/zinc/47/93/95/568479395.db2.gz	FUKDQSQYTCNVEM-KRWDZBQOSA-N	0	0	422.978	3.860	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)[C@H](C)Oc3ccc(Cl)cc3)n2)cc1	ZINC000218681976	568482907	/nfs/dbraw/zinc/48/29/07/568482907.db2.gz	VKBGZHIWFKDVBK-ZDUSSCGKSA-N	0	0	401.850	3.825	40	70		HHIBRN
COc1cccc(-c2noc(CN(C)C(=O)[C@H](C)Oc3ccc(Cl)cc3)n2)c1	ZINC000218681853	568482918	/nfs/dbraw/zinc/48/29/18/568482918.db2.gz	BYRRODNWBSQOBV-ZDUSSCGKSA-N	0	0	401.850	3.825	40	70		HHIBRN
CC[C@@H](Oc1ccc(OC)cc1)C(=O)N[C@@H](CC)c1ccc(S(C)(=O)=O)cc1	ZINC000218759331	568483306	/nfs/dbraw/zinc/48/33/06/568483306.db2.gz	PRKCWAQMZDUVPW-VQTJNVASSA-N	0	0	405.516	3.524	40	70		HHIBRN
COc1cccc(-c2noc(CNC(=O)CSCc3cccc(Cl)c3)n2)c1	ZINC000218039301	568474743	/nfs/dbraw/zinc/47/47/43/568474743.db2.gz	ALYZHQMBLIBEPT-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
COc1ccc(/C=C/C(=O)N(C)Cc2nc(-c3ccc(C)cc3)no2)c(OC)c1OC	ZINC000218190727	568476206	/nfs/dbraw/zinc/47/62/06/568476206.db2.gz	XWZHZDPSAGCDKJ-ACCUITESSA-N	0	0	423.469	3.743	40	70		HHIBRN
Cc1cccc(N(CC(=O)Nc2ccccc2C(=O)c2ccccc2)S(C)(=O)=O)c1	ZINC000218230985	568476638	/nfs/dbraw/zinc/47/66/38/568476638.db2.gz	CKNNKLCMOZSIOQ-UHFFFAOYSA-N	0	0	422.506	3.631	40	70		HHIBRN
CS(=O)(=O)N(CC(=O)NC1CCCCCCC1)c1cc(Cl)cc(Cl)c1	ZINC000218261839	568477063	/nfs/dbraw/zinc/47/70/63/568477063.db2.gz	ULLNAAAMJBDLEY-UHFFFAOYSA-N	0	0	407.363	3.989	40	70		HHIBRN
COc1ccc(CCCNC(=O)CN2c3cccc4cccc(c34)C2=O)cc1OC	ZINC000218317751	568478318	/nfs/dbraw/zinc/47/83/18/568478318.db2.gz	WPZVXZMLXJIZSN-UHFFFAOYSA-N	0	0	404.466	3.566	40	70		HHIBRN
C[C@H](C(=O)NCc1ccc(Cl)cc1Cl)N(c1ccc(F)cc1)S(C)(=O)=O	ZINC000218447578	568480429	/nfs/dbraw/zinc/48/04/29/568480429.db2.gz	CRHXNFQYJPXNEB-LLVKDONJSA-N	0	0	419.305	3.603	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)NCCCc2cccc(OC(C)C)c2)cc1	ZINC000218440424	568480435	/nfs/dbraw/zinc/48/04/35/568480435.db2.gz	VJBQQUHFFIHJCT-UHFFFAOYSA-N	0	0	418.559	3.622	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1cccc(NS(C)(=O)=O)c1C	ZINC000218580037	568481997	/nfs/dbraw/zinc/48/19/97/568481997.db2.gz	WZPAAYQAFKPBLV-GOSISDBHSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc(OCCNC(=O)c2cccc(NS(=O)(=O)c3ccccc3)c2C)cc1	ZINC000218584271	568482022	/nfs/dbraw/zinc/48/20/22/568482022.db2.gz	FMXVQZBLXJKPLL-UHFFFAOYSA-N	0	0	424.522	3.913	40	70		HHIBRN
Cc1ccc(C(=O)NCCCc2cccc(OC(C)C)c2)cc1NS(C)(=O)=O	ZINC000218587143	568482135	/nfs/dbraw/zinc/48/21/35/568482135.db2.gz	LMCVULVNWPFFNL-UHFFFAOYSA-N	0	0	404.532	3.516	40	70		HHIBRN
CCCOc1ccccc1CCCNC(=O)c1ccc(NS(C)(=O)=O)c(C)c1	ZINC000218596405	568482258	/nfs/dbraw/zinc/48/22/58/568482258.db2.gz	GZFGLGQJYRAEPX-UHFFFAOYSA-N	0	0	404.532	3.518	40	70		HHIBRN
Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(NS(C)(=O)=O)c(C)c1)CC(C)(C)O2	ZINC000218597500	568482262	/nfs/dbraw/zinc/48/22/62/568482262.db2.gz	FRZVRIJNYJFLKZ-GOSISDBHSA-N	0	0	402.516	3.707	40	70		HHIBRN
CC[C@@H](Oc1ccc(OC)cc1)C(=O)N(C)Cc1nc(-c2cccc(OC)c2)no1	ZINC000218760528	568483339	/nfs/dbraw/zinc/48/33/39/568483339.db2.gz	UZLIXSMQYWHASA-LJQANCHMSA-N	0	0	411.458	3.570	40	70		HHIBRN
CC[C@H](Oc1ccc(OC)cc1)C(=O)NCc1nc(-c2ccccc2Cl)no1	ZINC000218760137	568483345	/nfs/dbraw/zinc/48/33/45/568483345.db2.gz	OGYQFRXPPBLXEA-KRWDZBQOSA-N	0	0	401.850	3.872	40	70		HHIBRN
COc1ccccc1N1CCO[C@H]1c1cn(Cc2cccc(C(F)(F)F)c2)nn1	ZINC000216764103	568466866	/nfs/dbraw/zinc/46/68/66/568466866.db2.gz	ZZZMQDRDEOZRFJ-IBGZPJMESA-N	0	0	404.392	3.889	40	70		HHIBRN
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C/c1ccc(C(C)(C)C)cc1	ZINC000217949954	568474301	/nfs/dbraw/zinc/47/43/01/568474301.db2.gz	WMOAGFIAFVAHBF-MDWZMJQESA-N	0	0	412.555	3.837	40	70		HHIBRN
CC[C@H](NC(=O)CSCc1ccc(OC)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000218116902	568475218	/nfs/dbraw/zinc/47/52/18/568475218.db2.gz	GTHNFGMUHWNHDS-IBGZPJMESA-N	0	0	407.557	3.599	40	70		HHIBRN
Cc1cccc(N(CC(=O)NCCCc2ccc(C(C)C)cc2)S(C)(=O)=O)c1	ZINC000218232905	568476706	/nfs/dbraw/zinc/47/67/06/568476706.db2.gz	UKMCSKKILRKBJU-UHFFFAOYSA-N	0	0	402.560	3.633	40	70		HHIBRN
CC(C)c1ccc(N(CC(=O)N[C@H](C)CCc2ccccc2)S(C)(=O)=O)cc1	ZINC000218247256	568476812	/nfs/dbraw/zinc/47/68/12/568476812.db2.gz	SYWGJTWPVDZEAQ-GOSISDBHSA-N	0	0	402.560	3.714	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)CN(c2ccccc2Cl)S(C)(=O)=O)cc1	ZINC000218249801	568476829	/nfs/dbraw/zinc/47/68/29/568476829.db2.gz	PRGXUOTVBCHLKT-UHFFFAOYSA-N	0	0	422.978	3.978	40	70		HHIBRN
Cc1ccccc1OC[C@H](C)NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	ZINC000218406643	568479862	/nfs/dbraw/zinc/47/98/62/568479862.db2.gz	NQXRDTKQXPGPMH-SFHVURJKSA-N	0	0	424.522	3.993	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)CN(c2ccc(F)c(F)c2)S(C)(=O)=O)cc1	ZINC000218435600	568480372	/nfs/dbraw/zinc/48/03/72/568480372.db2.gz	FGLPWAWKPUKLIL-UHFFFAOYSA-N	0	0	424.513	3.603	40	70		HHIBRN
CCCOc1ccccc1CCCNC(=O)c1ccc(N(C)S(=O)(=O)CC)cc1	ZINC000218441280	568480438	/nfs/dbraw/zinc/48/04/38/568480438.db2.gz	GVTKUZITUIRQSC-UHFFFAOYSA-N	0	0	418.559	3.624	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)c3cc4cccc(OC)c4o3)n2)c(OC)c1	ZINC000218619649	568482546	/nfs/dbraw/zinc/48/25/46/568482546.db2.gz	QADPBJGUSDKACQ-UHFFFAOYSA-N	0	0	423.425	3.781	40	70		HHIBRN
CCS(=O)(=O)Nc1ccc(C(=O)NCCCc2cccc(OC(C)C)c2)cc1	ZINC000218639749	568482669	/nfs/dbraw/zinc/48/26/69/568482669.db2.gz	SXWAXGDTVKLFHH-UHFFFAOYSA-N	0	0	404.532	3.598	40	70		HHIBRN
COc1ccc(O[C@@H](C)C(=O)N(C)Cc2nc(-c3ccccc3Cl)no2)cc1	ZINC000218753697	568483304	/nfs/dbraw/zinc/48/33/04/568483304.db2.gz	OWDLZUOEJRIYSU-ZDUSSCGKSA-N	0	0	401.850	3.825	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)CCCN(c2ccc(F)cc2)S(C)(=O)=O)cc1C	ZINC000218745448	568483337	/nfs/dbraw/zinc/48/33/37/568483337.db2.gz	RVRDBVBOWNOQTI-QGZVFWFLSA-N	0	0	406.523	3.866	40	70		HHIBRN
COc1cccc(N2CCO[C@H]2c2cn(Cc3cccc(C(F)(F)F)c3)nn2)c1	ZINC000216765980	568466863	/nfs/dbraw/zinc/46/68/63/568466863.db2.gz	ZJMYYAAGPRUPDR-IBGZPJMESA-N	0	0	404.392	3.889	40	70		HHIBRN
COc1ccc(CSCC(=O)NCc2nc(-c3ccc(Cl)cc3)no2)cc1	ZINC000218117610	568475275	/nfs/dbraw/zinc/47/52/75/568475275.db2.gz	HPJLLUWHEKYJAV-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
C[C@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N(c1ccccc1)S(C)(=O)=O	ZINC000218285610	568477572	/nfs/dbraw/zinc/47/75/72/568477572.db2.gz	PZKRAKDBYPYIRM-QGZVFWFLSA-N	0	0	422.506	3.711	40	70		HHIBRN
CCOc1ccc(N([C@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)S(C)(=O)=O)cc1	ZINC000218295905	568478054	/nfs/dbraw/zinc/47/80/54/568478054.db2.gz	PJKGQMBPXOOHAV-ZWKOTPCHSA-N	0	0	418.559	3.734	40	70		HHIBRN
O=C(CN1C(=O)c2cccc3cccc1c23)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000218320835	568478323	/nfs/dbraw/zinc/47/83/23/568478323.db2.gz	PJROWRCGEBPOBE-UHFFFAOYSA-N	0	0	418.840	3.820	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)cc1	ZINC000218442488	568480433	/nfs/dbraw/zinc/48/04/33/568480433.db2.gz	MCIWVCXYSFJVEE-IBGZPJMESA-N	0	0	416.543	3.813	40	70		HHIBRN
COc1ccc(Cl)cc1N([C@@H](C)C(=O)NC1CCCCCCC1)S(C)(=O)=O	ZINC000218485589	568481007	/nfs/dbraw/zinc/48/10/07/568481007.db2.gz	MNFIGGAAVUNFQF-AWEZNQCLSA-N	0	0	416.971	3.732	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)c2ccc(C)c(S(=O)(=O)N3CCCC3)c2)c1	ZINC000218510203	568481266	/nfs/dbraw/zinc/48/12/66/568481266.db2.gz	SMUDMIGWMRQHEZ-SFHVURJKSA-N	0	0	400.544	3.887	40	70		HHIBRN
Cc1cc(C(=O)NCCN(C)c2ccccc2)ccc1NS(=O)(=O)c1ccccc1	ZINC000218602233	568482395	/nfs/dbraw/zinc/48/23/95/568482395.db2.gz	LEPGDQIXQAXXAQ-UHFFFAOYSA-N	0	0	423.538	3.662	40	70		HHIBRN
O=C1CS[C@@H](c2cn(Cc3cccc(C(F)(F)F)c3)nn2)N1Cc1ccco1	ZINC000216685171	568466340	/nfs/dbraw/zinc/46/63/40/568466340.db2.gz	YQEAYKDUVQODIO-KRWDZBQOSA-N	0	0	408.405	3.712	40	70		HHIBRN
CC(C)Cc1ccc(-c2cc(C(=O)N3C[C@H]4C[C@@H](C3)Cn3c(=O)cccc34)[nH]n2)cc1	ZINC000217585613	568472945	/nfs/dbraw/zinc/47/29/45/568472945.db2.gz	ZDYMPTOUDDDDGL-AZUAARDMSA-N	0	0	416.525	3.696	40	70		HHIBRN
CC[C@@H](NC(=O)CSCc1ccc(OC)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000218116824	568475292	/nfs/dbraw/zinc/47/52/92/568475292.db2.gz	GTHNFGMUHWNHDS-LJQANCHMSA-N	0	0	407.557	3.599	40	70		HHIBRN
CC[C@H](NC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218278060	568477318	/nfs/dbraw/zinc/47/73/18/568477318.db2.gz	OXJZKAYLRCKELB-UWJYYQICSA-N	0	0	418.559	3.734	40	70		HHIBRN
Cc1ccc(-c2noc(CN(C)C(=O)CN3c4cccc5cccc(c45)C3=O)n2)cc1	ZINC000218321260	568478391	/nfs/dbraw/zinc/47/83/91/568478391.db2.gz	RWDVVNMPPWRUED-UHFFFAOYSA-N	0	0	412.449	3.817	40	70		HHIBRN
CC[C@H](NC(=O)[C@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218462364	568480691	/nfs/dbraw/zinc/48/06/91/568480691.db2.gz	ZNZBHWHFFZPYTE-JXFKEZNVSA-N	0	0	406.523	3.865	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)c2ccc(C)c(S(=O)(=O)N3CCCC3)c2)c1	ZINC000218510126	568481217	/nfs/dbraw/zinc/48/12/17/568481217.db2.gz	SMUDMIGWMRQHEZ-GOSISDBHSA-N	0	0	400.544	3.887	40	70		HHIBRN
Cc1ccc2c(c1)[C@H](NC(=O)c1ccc(C)c(NS(C)(=O)=O)c1)CC(C)(C)O2	ZINC000218588148	568482136	/nfs/dbraw/zinc/48/21/36/568482136.db2.gz	OKXQKFLCQBHVPZ-GOSISDBHSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1cc(C(=O)NCCCc2ccc(OC(C)C)cc2)ccc1NS(C)(=O)=O	ZINC000218595646	568482255	/nfs/dbraw/zinc/48/22/55/568482255.db2.gz	QLEJMLFFZHTWFM-UHFFFAOYSA-N	0	0	404.532	3.516	40	70		HHIBRN
Cc1ccc(OCCNC(=O)c2ccc(C)c(NS(=O)(=O)c3ccccc3)c2)cc1	ZINC000218592160	568482287	/nfs/dbraw/zinc/48/22/87/568482287.db2.gz	ZCDIBZFDBVNTEG-UHFFFAOYSA-N	0	0	424.522	3.913	40	70		HHIBRN
Cc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)NCCCc1ccccc1Cl	ZINC000218621202	568482484	/nfs/dbraw/zinc/48/24/84/568482484.db2.gz	FLLSDPJRAXOSOR-UHFFFAOYSA-N	0	0	420.962	3.796	40	70		HHIBRN
Cc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)NCCCc1ccc(Cl)cc1	ZINC000218621299	568482538	/nfs/dbraw/zinc/48/25/38/568482538.db2.gz	RIEZZSXEPFEAGB-UHFFFAOYSA-N	0	0	420.962	3.796	40	70		HHIBRN
CCS(=O)(=O)Nc1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)cc1	ZINC000218641710	568482644	/nfs/dbraw/zinc/48/26/44/568482644.db2.gz	OTOGOWOYFMBHKO-GOSISDBHSA-N	0	0	402.516	3.789	40	70		HHIBRN
CCOC[C@@]1(C(N)=S)[C@@H](c2ccc(CC)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218583487	568882650	/nfs/dbraw/zinc/88/26/50/568882650.db2.gz	FMMKLOTYYQNMIB-JAXLGGSGSA-N	0	0	417.596	3.806	40	70		HHIBRN
O=C1CS[C@H](c2cn(Cc3ccccc3C(F)(F)F)nn2)N1Cc1ccco1	ZINC000216685892	568466341	/nfs/dbraw/zinc/46/63/41/568466341.db2.gz	JERNTXILBKBVLC-QGZVFWFLSA-N	0	0	408.405	3.712	40	70		HHIBRN
CN1c2ccc(C(=O)NCCSC(C)(C)C)cc2-c2ccccc2S1(=O)=O	ZINC000216890794	568469168	/nfs/dbraw/zinc/46/91/68/568469168.db2.gz	HNJKJSSPCCKELR-UHFFFAOYSA-N	0	0	404.557	3.754	40	70		HHIBRN
O=C(NCCCN1CCCc2ccccc21)c1ccc(I)cc1	ZINC000218216175	568476508	/nfs/dbraw/zinc/47/65/08/568476508.db2.gz	DHLMPHPEDGCDHD-UHFFFAOYSA-N	0	0	420.294	3.864	40	70		HHIBRN
Cc1ccc(Cl)cc1N(CC(=O)Nc1cccc(OC(C)C)c1)S(C)(=O)=O	ZINC000218268888	568477169	/nfs/dbraw/zinc/47/71/69/568477169.db2.gz	RBWHEXHFCOMDSD-UHFFFAOYSA-N	0	0	410.923	3.840	40	70		HHIBRN
Cc1cccc(N(CC(=O)N2CCC(Cc3ccccc3)CC2)S(C)(=O)=O)c1C	ZINC000218280561	568477289	/nfs/dbraw/zinc/47/72/89/568477289.db2.gz	OFLSGFDGWHTROC-UHFFFAOYSA-N	0	0	414.571	3.551	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218382318	568479453	/nfs/dbraw/zinc/47/94/53/568479453.db2.gz	CMFYYOUWCYZZIF-HZPDHXFCSA-N	0	0	408.951	3.989	40	70		HHIBRN
CC[C@H](NC(=O)[C@@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218462534	568480701	/nfs/dbraw/zinc/48/07/01/568480701.db2.gz	KATOUGBKSGKTCR-UZLBHIALSA-N	0	0	406.523	3.865	40	70		HHIBRN
CC(C)Oc1ccc(NC(=O)[C@@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)cc1	ZINC000218472112	568480786	/nfs/dbraw/zinc/48/07/86/568480786.db2.gz	DBARTFVUIMBDLJ-CQSZACIVSA-N	0	0	410.923	3.920	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@H](C)N(c2cc(C)ccc2C)S(C)(=O)=O)c1	ZINC000218545378	568481602	/nfs/dbraw/zinc/48/16/02/568481602.db2.gz	WYZKJXQNYNGCKU-MOPGFXCFSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc2c(c1)[C@H](NC(=O)c1cccc(NS(C)(=O)=O)c1C)CC(C)(C)O2	ZINC000218579861	568482033	/nfs/dbraw/zinc/48/20/33/568482033.db2.gz	FBZAVHRCZZLTMO-GOSISDBHSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1ccc(NS(C)(=O)=O)c(C)c1	ZINC000218597678	568482259	/nfs/dbraw/zinc/48/22/59/568482259.db2.gz	GRFWMKGECHHJKU-GOSISDBHSA-N	0	0	402.516	3.707	40	70		HHIBRN
CC(=O)Oc1ccc2c(c1)Cc1cc(OC(C)=O)ccc1C21OC(=O)c2ccccc21	ZINC000216644206	568827728	/nfs/dbraw/zinc/82/77/28/568827728.db2.gz	HGBXLULNVRRWPU-UHFFFAOYSA-N	0	0	414.413	3.904	40	70		HHIBRN
COc1ccccc1N1CCO[C@H]1c1cn(Cc2cccc(Br)c2)nn1	ZINC000216763986	568466716	/nfs/dbraw/zinc/46/67/16/568466716.db2.gz	CCDRTTPYPLXPKR-IBGZPJMESA-N	0	0	415.291	3.633	40	70		HHIBRN
COc1cccc(N2CCO[C@@H]2c2cn(Cc3cccc(C(F)(F)F)c3)nn2)c1	ZINC000216765933	568466855	/nfs/dbraw/zinc/46/68/55/568466855.db2.gz	ZJMYYAAGPRUPDR-LJQANCHMSA-N	0	0	404.392	3.889	40	70		HHIBRN
Cc1cccc(CN2CCO[C@H]2c2cn(Cc3cccc(Br)c3)nn2)c1	ZINC000216777195	568467082	/nfs/dbraw/zinc/46/70/82/568467082.db2.gz	XPFWCTSNRYEFGS-FQEVSTJZSA-N	0	0	413.319	3.928	40	70		HHIBRN
C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)Cn1c(=O)cccc12)c1ccc(C[C@@H]2CCCC2=O)cc1	ZINC000217949744	568474307	/nfs/dbraw/zinc/47/43/07/568474307.db2.gz	JFSPMRQRQOMWKL-XODARUQUSA-N	0	0	418.537	3.509	40	70		HHIBRN
Cc1ccccc1N(CC(=O)NCCCc1ccc(C(C)C)cc1)S(C)(=O)=O	ZINC000218230293	568476589	/nfs/dbraw/zinc/47/65/89/568476589.db2.gz	FXKIOUSTSTUBTR-UHFFFAOYSA-N	0	0	402.560	3.633	40	70		HHIBRN
O=C(CN1C(=O)c2cccc3cccc1c23)NCc1nc(-c2ccccc2Cl)no1	ZINC000218320735	568478368	/nfs/dbraw/zinc/47/83/68/568478368.db2.gz	LNRRZUMQBHSCII-UHFFFAOYSA-N	0	0	418.840	3.820	40	70		HHIBRN
Cc1ccc(OCCNC(=O)c2ccccc2N(C)S(=O)(=O)c2ccccc2)cc1	ZINC000218347699	568478952	/nfs/dbraw/zinc/47/89/52/568478952.db2.gz	VRLKEJVSAWMPDV-UHFFFAOYSA-N	0	0	424.522	3.629	40	70		HHIBRN
Cc1ccc(N([C@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)cc1	ZINC000218355232	568479085	/nfs/dbraw/zinc/47/90/85/568479085.db2.gz	KSMSAHIGPDTZOK-MRXNPFEDSA-N	0	0	408.951	3.552	40	70		HHIBRN
Cc1ccc(N([C@H](C)C(=O)NCc2cccc(OC(C)C)c2)S(C)(=O)=O)cc1C	ZINC000218364825	568479267	/nfs/dbraw/zinc/47/92/67/568479267.db2.gz	NNHNGBWJRYTILK-GOSISDBHSA-N	0	0	418.559	3.562	40	70		HHIBRN
Cc1cc(C)cc(N([C@H](C)C(=O)NCc2cccc(OC(C)C)c2)S(C)(=O)=O)c1	ZINC000218373991	568479408	/nfs/dbraw/zinc/47/94/08/568479408.db2.gz	UFJAYKZYNUCHAU-GOSISDBHSA-N	0	0	418.559	3.562	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218382481	568479564	/nfs/dbraw/zinc/47/95/64/568479564.db2.gz	CMFYYOUWCYZZIF-CVEARBPZSA-N	0	0	408.951	3.989	40	70		HHIBRN
CC[C@@H](NC(=O)[C@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218462287	568480676	/nfs/dbraw/zinc/48/06/76/568480676.db2.gz	ZNZBHWHFFZPYTE-OXJNMPFZSA-N	0	0	406.523	3.865	40	70		HHIBRN
Cc1ccc(C(=O)NCCCc2ccccc2Cl)cc1S(=O)(=O)N1CCCC1	ZINC000218510338	568481241	/nfs/dbraw/zinc/48/12/41/568481241.db2.gz	CNQXNBTYKMOQNZ-UHFFFAOYSA-N	0	0	420.962	3.796	40	70		HHIBRN
Cc1ccc(OC[C@H](C)NC(=O)c2cccc(NS(=O)(=O)c3ccccc3)c2)cc1	ZINC000218573649	568481889	/nfs/dbraw/zinc/48/18/89/568481889.db2.gz	ACMOCARDXYVUBE-SFHVURJKSA-N	0	0	424.522	3.993	40	70		HHIBRN
CC[C@H](NC(=O)CCCOc1ccc(OC)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000218742326	568483226	/nfs/dbraw/zinc/48/32/26/568483226.db2.gz	DNTUCKDEGGJGOE-FQEVSTJZSA-N	0	0	405.516	3.525	40	70		HHIBRN
CCN(c1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)cc1)S(C)(=O)=O	ZINC000218780212	568483499	/nfs/dbraw/zinc/48/34/99/568483499.db2.gz	UPQRZUNIHYCHCQ-GOSISDBHSA-N	0	0	402.516	3.505	40	70		HHIBRN
CCN(c1ccc(C(=O)NCCCc2ccc(OC(C)C)cc2)cc1)S(C)(=O)=O	ZINC000218779797	568483541	/nfs/dbraw/zinc/48/35/41/568483541.db2.gz	OCODMRGIDSNCAG-UHFFFAOYSA-N	0	0	418.559	3.622	40	70		HHIBRN
CCOC[C@]1(C(N)=S)[C@@H](c2ccc(CC)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218583431	568882592	/nfs/dbraw/zinc/88/25/92/568882592.db2.gz	FMMKLOTYYQNMIB-ONTIZHBOSA-N	0	0	417.596	3.806	40	70		HHIBRN
Cc1ccc(N2C(=O)[C@H]3C(=C(C(=O)c4ccc(Cl)cc4)N4CCC[C@H]34)C2O)cc1C	ZINC000217479193	568472288	/nfs/dbraw/zinc/47/22/88/568472288.db2.gz	PNWRSFZTCKAQCO-CGXNFDGLSA-N	0	0	422.912	3.792	40	70		HHIBRN
C[C@H](Sc1ccc(Cl)cc1)C(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000217985568	568474420	/nfs/dbraw/zinc/47/44/20/568474420.db2.gz	CVYMFTIVPFMQHN-ZDUSSCGKSA-N	0	0	424.975	3.660	40	70		HHIBRN
CN(c1ccc(C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000218334153	568478562	/nfs/dbraw/zinc/47/85/62/568478562.db2.gz	UWKFQAHSABAZCG-UHFFFAOYSA-N	0	0	408.479	3.566	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)cc1	ZINC000218442237	568480471	/nfs/dbraw/zinc/48/04/71/568480471.db2.gz	CCCURRYYODXXOV-LJQANCHMSA-N	0	0	416.543	3.813	40	70		HHIBRN
Cc1c(NS(C)(=O)=O)cccc1C(=O)Nc1ccccc1C(=O)c1ccccc1	ZINC000218578142	568481971	/nfs/dbraw/zinc/48/19/71/568481971.db2.gz	IBOUNUIMHKEDQU-UHFFFAOYSA-N	0	0	408.479	3.850	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)CCCOc3ccccc3)n2)c(OC)c1	ZINC000218728600	568483069	/nfs/dbraw/zinc/48/30/69/568483069.db2.gz	IHGKZGRILHECBA-UHFFFAOYSA-N	0	0	411.458	3.571	40	70		HHIBRN
CC[C@@H](NC(=O)CCCOc1ccc(OC)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000218742266	568483175	/nfs/dbraw/zinc/48/31/75/568483175.db2.gz	DNTUCKDEGGJGOE-HXUWFJFHSA-N	0	0	405.516	3.525	40	70		HHIBRN
CC[C@@H](Oc1ccc(OC)cc1)C(=O)NCc1nc(-c2ccccc2Cl)no1	ZINC000218760093	568483298	/nfs/dbraw/zinc/48/32/98/568483298.db2.gz	OGYQFRXPPBLXEA-QGZVFWFLSA-N	0	0	401.850	3.872	40	70		HHIBRN
CCN(c1ccc(C(=O)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)cc1)S(C)(=O)=O	ZINC000218781733	568483506	/nfs/dbraw/zinc/48/35/06/568483506.db2.gz	WEJLXEMIJJWIAG-IBGZPJMESA-N	0	0	416.543	3.813	40	70		HHIBRN
CCOC[C@]1(C(N)=S)[C@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218509549	568879836	/nfs/dbraw/zinc/87/98/36/568879836.db2.gz	GLCYBRZDBGUJKR-DYXWJJEUSA-N	0	0	403.569	3.552	40	70		HHIBRN
O=C1CS[C@@H](c2cn(Cc3ccc(C(F)(F)F)cc3)nn2)N1Cc1ccco1	ZINC000216685962	568466387	/nfs/dbraw/zinc/46/63/87/568466387.db2.gz	AOWSRAAJWNDPNI-KRWDZBQOSA-N	0	0	408.405	3.712	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CSCc3cccc(Cl)c3)n2)cc1	ZINC000218039417	568474751	/nfs/dbraw/zinc/47/47/51/568474751.db2.gz	XYBFXTZTELNDEZ-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
CCOc1ccc(CNC(=O)/C=C/c2ccc(OC)c(OC)c2OC)cc1OCC	ZINC000218184752	568476006	/nfs/dbraw/zinc/47/60/06/568476006.db2.gz	OJXRFPVNCRBTSJ-JLHYYAGUSA-N	0	0	415.486	3.839	40	70		HHIBRN
Cc1ccccc1N(CC(=O)Nc1ccccc1C(=O)c1ccccc1)S(C)(=O)=O	ZINC000218228259	568476607	/nfs/dbraw/zinc/47/66/07/568476607.db2.gz	UIJDNTKALWQXKU-UHFFFAOYSA-N	0	0	422.506	3.631	40	70		HHIBRN
Cc1ccc(N(CC(=O)Nc2ccccc2C(=O)c2ccccc2)S(C)(=O)=O)cc1	ZINC000218233617	568476734	/nfs/dbraw/zinc/47/67/34/568476734.db2.gz	DDJAXXDMCLARPZ-UHFFFAOYSA-N	0	0	422.506	3.631	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)cc1	ZINC000218252790	568476837	/nfs/dbraw/zinc/47/68/37/568476837.db2.gz	VBPKTBXGYZIXAE-UHFFFAOYSA-N	0	0	422.978	3.978	40	70		HHIBRN
CC[C@@H](NC(=O)[C@@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218277580	568477325	/nfs/dbraw/zinc/47/73/25/568477325.db2.gz	PTPZBYPQWNQWMQ-DYESRHJHSA-N	0	0	418.559	3.734	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1	ZINC000218292579	568477758	/nfs/dbraw/zinc/47/77/58/568477758.db2.gz	QDHWOAWWAIQYBV-GOSISDBHSA-N	0	0	402.560	3.714	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)[C@@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)cc1C	ZINC000218385782	568479629	/nfs/dbraw/zinc/47/96/29/568479629.db2.gz	NZXQCTIBRBULSP-HZPDHXFCSA-N	0	0	408.951	3.989	40	70		HHIBRN
C[C@H](NC(=O)[C@@H]1CN(S(=O)(=O)c2ccccc2)c2ccccc2O1)c1ccccc1	ZINC000218436025	568480319	/nfs/dbraw/zinc/48/03/19/568480319.db2.gz	GQUQDHWPWJTGMY-JTSKRJEESA-N	0	0	422.506	3.520	40	70		HHIBRN
CC[C@H](NC(=O)[C@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218462693	568480655	/nfs/dbraw/zinc/48/06/55/568480655.db2.gz	KATOUGBKSGKTCR-JXFKEZNVSA-N	0	0	406.523	3.865	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)[C@@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)cc1C	ZINC000218477586	568480828	/nfs/dbraw/zinc/48/08/28/568480828.db2.gz	MIXJCGUZLMHCMW-HZPDHXFCSA-N	0	0	408.951	3.989	40	70		HHIBRN
Cc1ccc(C)c(N([C@@H](C)C(=O)NCc2cccc(OC(C)C)c2)S(C)(=O)=O)c1	ZINC000218544626	568481628	/nfs/dbraw/zinc/48/16/28/568481628.db2.gz	VWDYHMZIAPJXKC-SFHVURJKSA-N	0	0	418.559	3.562	40	70		HHIBRN
Cc1ccc(N(CCCC(=O)NCCCc2ccc(F)cc2)S(C)(=O)=O)cc1C	ZINC000218558408	568481769	/nfs/dbraw/zinc/48/17/69/568481769.db2.gz	LWJKZXDMOILHPP-UHFFFAOYSA-N	0	0	420.550	3.738	40	70		HHIBRN
Cc1ccc2c(c1)[C@@H](NC(=O)c1cccc(NS(C)(=O)=O)c1C)CC(C)(C)O2	ZINC000218579786	568482011	/nfs/dbraw/zinc/48/20/11/568482011.db2.gz	FBZAVHRCZZLTMO-SFHVURJKSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)c1ccc(C)c(NS(C)(=O)=O)c1	ZINC000218588306	568482138	/nfs/dbraw/zinc/48/21/38/568482138.db2.gz	ZVSHTMZZNUEWNN-GOSISDBHSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc(C)c(NS(C)(=O)=O)c1)CC(C)(C)O2	ZINC000218588078	568482141	/nfs/dbraw/zinc/48/21/41/568482141.db2.gz	OKXQKFLCQBHVPZ-SFHVURJKSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)c1ccc(C)c(NS(C)(=O)=O)c1	ZINC000218588234	568482142	/nfs/dbraw/zinc/48/21/42/568482142.db2.gz	ZVSHTMZZNUEWNN-SFHVURJKSA-N	0	0	402.516	3.707	40	70		HHIBRN
Cc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1C(=O)N[C@H](C)c1ccccc1	ZINC000218631756	568482668	/nfs/dbraw/zinc/48/26/68/568482668.db2.gz	BDIPIVBVZBKAAZ-GOSISDBHSA-N	0	0	400.544	3.907	40	70		HHIBRN
COc1cccc(-c2noc(CNC(=O)CCCOc3ccc(Cl)cc3)n2)c1	ZINC000218738385	568483181	/nfs/dbraw/zinc/48/31/81/568483181.db2.gz	OILYDQVXCWEWTR-UHFFFAOYSA-N	0	0	401.850	3.874	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CSCc3ccc(C)cc3)n2)c(OC)c1	ZINC000218025424	568474586	/nfs/dbraw/zinc/47/45/86/568474586.db2.gz	GMOXXAHTKSADBJ-UHFFFAOYSA-N	0	0	413.499	3.612	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)CCSc3ccccc3)n2)c(OC)c1	ZINC000218085190	568475046	/nfs/dbraw/zinc/47/50/46/568475046.db2.gz	GIXXOCRRYZTLPH-UHFFFAOYSA-N	0	0	413.499	3.895	40	70		HHIBRN
COc1cc(C(=O)N(C)Cc2nc(-c3ccccc3Cl)no2)cc(OC)c1OC	ZINC000218130199	568475375	/nfs/dbraw/zinc/47/53/75/568475375.db2.gz	APWAFDMIYQUIBN-UHFFFAOYSA-N	0	0	417.849	3.688	40	70		HHIBRN
CC(C)c1ccc(CCCNC(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)cc1	ZINC000218251183	568476825	/nfs/dbraw/zinc/47/68/25/568476825.db2.gz	JXRUIFISHJHPOA-UHFFFAOYSA-N	0	0	422.978	3.978	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)[C@@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1C	ZINC000218369956	568479249	/nfs/dbraw/zinc/47/92/49/568479249.db2.gz	HFSVXCHSDCLHHV-RBUKOAKNSA-N	0	0	402.560	3.952	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1	ZINC000218440314	568480454	/nfs/dbraw/zinc/48/04/54/568480454.db2.gz	ZKNJQTVZHYCXBN-UHFFFAOYSA-N	0	0	422.506	3.956	40	70		HHIBRN
C[C@H](C(=O)Nc1ccccc1C(F)(F)F)N(c1ccc(F)cc1)S(C)(=O)=O	ZINC000218448373	568480554	/nfs/dbraw/zinc/48/05/54/568480554.db2.gz	ZQKQDCFNIGJREJ-LLVKDONJSA-N	0	0	404.385	3.638	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)[C@H](C)N(c2cccc(Cl)c2)S(C)(=O)=O)cc1C	ZINC000218477732	568480866	/nfs/dbraw/zinc/48/08/66/568480866.db2.gz	MIXJCGUZLMHCMW-CVEARBPZSA-N	0	0	408.951	3.989	40	70		HHIBRN
Cc1ccc(C(=O)Nc2cccc(OC(C)C)c2)cc1S(=O)(=O)N1CCCC1	ZINC000218509111	568481204	/nfs/dbraw/zinc/48/12/04/568481204.db2.gz	KZNGVQGKFQYINV-UHFFFAOYSA-N	0	0	402.516	3.819	40	70		HHIBRN
Cc1ccccc1CNC(=O)c1ccc(C)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000218515111	568481268	/nfs/dbraw/zinc/48/12/68/568481268.db2.gz	NRFYQZVUYBJJRS-UHFFFAOYSA-N	0	0	400.544	3.798	40	70		HHIBRN
Cc1ccc(C)c(N([C@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218545818	568481609	/nfs/dbraw/zinc/48/16/09/568481609.db2.gz	XTQXTEGVAHZLMR-QGZVFWFLSA-N	0	0	422.978	3.860	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2C)cc1C	ZINC000218623705	568482514	/nfs/dbraw/zinc/48/25/14/568482514.db2.gz	ICWOIGIJHIDTHC-GOSISDBHSA-N	0	0	400.544	3.887	40	70		HHIBRN
Cc1ccc(OCCNC(=O)CCCN2c3cccc4cccc(c34)S2(=O)=O)cc1	ZINC000218652397	568482783	/nfs/dbraw/zinc/48/27/83/568482783.db2.gz	XHBUAZXWXIZMHP-UHFFFAOYSA-N	0	0	424.522	3.632	40	70		HHIBRN
COc1ccc(O[C@H](C)C(=O)N(C)Cc2nc(-c3ccccc3Cl)no2)cc1	ZINC000218753737	568483303	/nfs/dbraw/zinc/48/33/03/568483303.db2.gz	OWDLZUOEJRIYSU-CYBMUJFWSA-N	0	0	401.850	3.825	40	70		HHIBRN
O=C1CS[C@@H](c2cn(Cc3ccccc3C(F)(F)F)nn2)N1Cc1ccco1	ZINC000216685844	568466391	/nfs/dbraw/zinc/46/63/91/568466391.db2.gz	JERNTXILBKBVLC-KRWDZBQOSA-N	0	0	408.405	3.712	40	70		HHIBRN
CN1C(=O)c2ccccc2N(C)[C@@H]1c1cn(Cc2cccc(C(F)(F)F)c2)nn1	ZINC000216758509	568466736	/nfs/dbraw/zinc/46/67/36/568466736.db2.gz	GQCZLIGILVMJTM-SFHVURJKSA-N	0	0	401.392	3.566	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O	ZINC000218288391	568477683	/nfs/dbraw/zinc/47/76/83/568477683.db2.gz	RLZYXIHKIZGPOC-APWZRJJASA-N	0	0	416.543	3.568	40	70		HHIBRN
Cc1ccc([C@@H](C)NC(=O)[C@@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)cc1C	ZINC000218369874	568479291	/nfs/dbraw/zinc/47/92/91/568479291.db2.gz	HFSVXCHSDCLHHV-RTBURBONSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)[C@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)cc1C	ZINC000218386036	568479586	/nfs/dbraw/zinc/47/95/86/568479586.db2.gz	NZXQCTIBRBULSP-HOTGVXAUSA-N	0	0	408.951	3.989	40	70		HHIBRN
COc1ccc(-c2noc(CN(C)C(=O)Cc3ccc(Cl)cc3)n2)c(OC)c1	ZINC000218531625	568481482	/nfs/dbraw/zinc/48/14/82/568481482.db2.gz	BQFSZVZVFVQOTK-UHFFFAOYSA-N	0	0	401.850	3.608	40	70		HHIBRN
CCS(=O)(=O)Nc1ccc(C(=O)N[C@H]2CC(C)(C)Oc3ccc(C)cc32)cc1	ZINC000218641600	568482647	/nfs/dbraw/zinc/48/26/47/568482647.db2.gz	ATNIDPQWCFDWII-SFHVURJKSA-N	0	0	402.516	3.789	40	70		HHIBRN
Cc1ccc(OCC(=O)NCc2nc(-c3cccc(Br)c3)no2)cc1C	ZINC000218723699	568483086	/nfs/dbraw/zinc/48/30/86/568483086.db2.gz	VYVXTTFYCBVXNY-UHFFFAOYSA-N	0	0	416.275	3.811	40	70		HHIBRN
CC[C@@H](NC(=O)[C@H](CC)Oc1ccc(OC)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000218759369	568483278	/nfs/dbraw/zinc/48/32/78/568483278.db2.gz	PRKCWAQMZDUVPW-UXHICEINSA-N	0	0	405.516	3.524	40	70		HHIBRN
CCN(c1ccc(C(=O)Nc2ccccc2C(=O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000218779604	568483533	/nfs/dbraw/zinc/48/35/33/568483533.db2.gz	UMWLNJVANZWHNP-UHFFFAOYSA-N	0	0	422.506	3.956	40	70		HHIBRN
COc1ccccc1N1CCO[C@@H]1c1cn(Cc2cccc(C(F)(F)F)c2)nn1	ZINC000216764057	568466835	/nfs/dbraw/zinc/46/68/35/568466835.db2.gz	ZZZMQDRDEOZRFJ-LJQANCHMSA-N	0	0	404.392	3.889	40	70		HHIBRN
COc1ccc(/C=C/C(=O)NCc2nc(-c3cccc(Br)c3)no2)cc1	ZINC000217921261	568474335	/nfs/dbraw/zinc/47/43/35/568474335.db2.gz	KSSQNKYREBVTDG-JXMROGBWSA-N	0	0	414.259	3.837	40	70		HHIBRN
Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O	ZINC000218288485	568477658	/nfs/dbraw/zinc/47/76/58/568477658.db2.gz	RLZYXIHKIZGPOC-LPHOPBHVSA-N	0	0	416.543	3.568	40	70		HHIBRN
CCOc1ccc(N([C@@H](C)C(=O)N[C@@H](C)c2cc(C)ccc2C)S(C)(=O)=O)cc1	ZINC000218294074	568477818	/nfs/dbraw/zinc/47/78/18/568477818.db2.gz	RINRIQMNKXCISA-ROUUACIJSA-N	0	0	418.559	3.734	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218382558	568479480	/nfs/dbraw/zinc/47/94/80/568479480.db2.gz	CMFYYOUWCYZZIF-HOTGVXAUSA-N	0	0	408.951	3.989	40	70		HHIBRN
C[C@@H](NC(=O)[C@H]1CN(S(=O)(=O)c2ccccc2)c2ccccc2O1)c1ccccc1	ZINC000218436106	568480314	/nfs/dbraw/zinc/48/03/14/568480314.db2.gz	GQUQDHWPWJTGMY-VGOFRKELSA-N	0	0	422.506	3.520	40	70		HHIBRN
CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)cc1	ZINC000218440991	568480458	/nfs/dbraw/zinc/48/04/58/568480458.db2.gz	PNBWJZZXEXYCLU-GOSISDBHSA-N	0	0	402.516	3.505	40	70		HHIBRN
COc1cccc(CCCNC(=O)c2cccc(NS(=O)(=O)c3ccccc3)c2)c1	ZINC000218572705	568481915	/nfs/dbraw/zinc/48/19/15/568481915.db2.gz	AVCSJTHCRPYYAC-UHFFFAOYSA-N	0	0	424.522	3.859	40	70		HHIBRN
Cc1ccc(OCCNC(=O)c2ccc(NS(=O)(=O)c3ccccc3)c(C)c2)cc1	ZINC000218602126	568482361	/nfs/dbraw/zinc/48/23/61/568482361.db2.gz	VQSMITMSKYNCGD-UHFFFAOYSA-N	0	0	424.522	3.913	40	70		HHIBRN
C[C@H](Oc1ccc(F)cc1)C(=O)NCc1nc(-c2cccc(Br)c2)no1	ZINC000218705877	568482977	/nfs/dbraw/zinc/48/29/77/568482977.db2.gz	WGKWVEIAWLTBMN-NSHDSACASA-N	0	0	420.238	3.722	40	70		HHIBRN
COc1ccc(OCCCC(=O)N(C)Cc2nc(-c3ccc(OC)cc3)no2)cc1	ZINC000218743208	568483246	/nfs/dbraw/zinc/48/32/46/568483246.db2.gz	KTAPBBLPJITEHZ-UHFFFAOYSA-N	0	0	411.458	3.571	40	70		HHIBRN
COc1ccc(OCCCC(=O)NCc2nc(-c3ccc(Cl)cc3)no2)cc1	ZINC000218742784	568483258	/nfs/dbraw/zinc/48/32/58/568483258.db2.gz	UZLUUIUHXADXTE-UHFFFAOYSA-N	0	0	401.850	3.874	40	70		HHIBRN
CCOC[C@]1(C(N)=S)[C@H](c2ccc(CC)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1	ZINC000218583285	568882606	/nfs/dbraw/zinc/88/26/06/568882606.db2.gz	FMMKLOTYYQNMIB-URVUXULASA-N	0	0	417.596	3.806	40	70		HHIBRN
Cc1ccc(N2C(=O)[C@H]3C(=C(C(=O)c4ccc(Cl)cc4)N4CCC[C@H]34)C2O)cc1C	ZINC000217479110	568472278	/nfs/dbraw/zinc/47/22/78/568472278.db2.gz	PNWRSFZTCKAQCO-MXEMCNAFSA-N	0	0	422.912	3.792	40	70		HHIBRN
Cc1cccc(C)c1N(CC(=O)NCCCc1ccc(C(C)C)cc1)S(C)(=O)=O	ZINC000218273600	568477203	/nfs/dbraw/zinc/47/72/03/568477203.db2.gz	JHSZSIBGCLUKFS-UHFFFAOYSA-N	0	0	416.587	3.942	40	70		HHIBRN
C[C@@H](C(=O)Nc1ccc(OC2CCCC2)cc1)N(c1ccccc1)S(C)(=O)=O	ZINC000218286133	568477558	/nfs/dbraw/zinc/47/75/58/568477558.db2.gz	GNQMMUOALQJVES-INIZCTEOSA-N	0	0	402.516	3.801	40	70		HHIBRN
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H](C)N(c1ccccc1)S(C)(=O)=O)CC(C)(C)O2	ZINC000218288231	568477682	/nfs/dbraw/zinc/47/76/82/568477682.db2.gz	ZPUIZTOGWKPBSM-LPHOPBHVSA-N	0	0	416.543	3.568	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218365441	568479305	/nfs/dbraw/zinc/47/93/05/568479305.db2.gz	GKNRQGQQFWFYEY-MOPGFXCFSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc(N([C@@H](C)C(=O)NCCCc2ccc(Cl)cc2)S(C)(=O)=O)cc1C	ZINC000218365792	568479306	/nfs/dbraw/zinc/47/93/06/568479306.db2.gz	ZTYZNVLSCIXCGX-KRWDZBQOSA-N	0	0	422.978	3.860	40	70		HHIBRN
CC(C)Oc1cccc(CNC(=O)[C@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)c1	ZINC000218382219	568479544	/nfs/dbraw/zinc/47/95/44/568479544.db2.gz	HVCVKADNZLBCAM-HNNXBMFYSA-N	0	0	424.950	3.598	40	70		HHIBRN
CC[C@H](NC(=O)[C@@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)c(C)c1	ZINC000218462204	568480633	/nfs/dbraw/zinc/48/06/33/568480633.db2.gz	ZNZBHWHFFZPYTE-UZLBHIALSA-N	0	0	406.523	3.865	40	70		HHIBRN
C[C@@H](CCc1ccccc1)NC(=O)[C@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O	ZINC000218473370	568480745	/nfs/dbraw/zinc/48/07/45/568480745.db2.gz	GHPPRUVMIZNXQG-HOTGVXAUSA-N	0	0	408.951	3.632	40	70		HHIBRN
Cc1ccc(C(=O)Nc2ccc(OC(C)C)cc2)cc1S(=O)(=O)N1CCCC1	ZINC000218509033	568481277	/nfs/dbraw/zinc/48/12/77/568481277.db2.gz	NJCKKIHOZSDRAP-UHFFFAOYSA-N	0	0	402.516	3.819	40	70		HHIBRN
COc1ccc(CCCNC(=O)c2cccc(NS(=O)(=O)c3ccccc3)c2)cc1	ZINC000218572812	568481864	/nfs/dbraw/zinc/48/18/64/568481864.db2.gz	CVCRTMSBYCCPOA-UHFFFAOYSA-N	0	0	424.522	3.859	40	70		HHIBRN
CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc(OC)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000218759283	568483331	/nfs/dbraw/zinc/48/33/31/568483331.db2.gz	PRKCWAQMZDUVPW-WOJBJXKFSA-N	0	0	405.516	3.524	40	70		HHIBRN
CCN(c1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)cc1)S(C)(=O)=O	ZINC000218781461	568483495	/nfs/dbraw/zinc/48/34/95/568483495.db2.gz	BSOXTGRLWWHKAD-LJQANCHMSA-N	0	0	416.543	3.813	40	70		HHIBRN
O=C1CS[C@H](c2cn(Cc3cccc(C(F)(F)F)c3)nn2)N1Cc1ccco1	ZINC000216685218	568466419	/nfs/dbraw/zinc/46/64/19/568466419.db2.gz	YQEAYKDUVQODIO-QGZVFWFLSA-N	0	0	408.405	3.712	40	70		HHIBRN
COc1cccc(N2CCO[C@H]2c2cn(Cc3cccc(Br)c3)nn2)c1	ZINC000216765875	568466845	/nfs/dbraw/zinc/46/68/45/568466845.db2.gz	CWGHXIOYAMMDQZ-IBGZPJMESA-N	0	0	415.291	3.633	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)c3ccc(Cl)cc3Cl)n2)c(OC)c1	ZINC000217857016	568474093	/nfs/dbraw/zinc/47/40/93/568474093.db2.gz	QFSBLDRIXKBCST-UHFFFAOYSA-N	0	0	408.241	3.991	40	70		HHIBRN
COc1cccc(-c2noc(CN(C)C(=O)c3ccc(Br)cc3)n2)c1	ZINC000217871124	568474234	/nfs/dbraw/zinc/47/42/34/568474234.db2.gz	QIHCEBXLULWVGG-UHFFFAOYSA-N	0	0	402.248	3.780	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CSCc3ccccc3C)n2)c(OC)c1	ZINC000218019070	568474637	/nfs/dbraw/zinc/47/46/37/568474637.db2.gz	APVXPQHRBWYICK-UHFFFAOYSA-N	0	0	413.499	3.612	40	70		HHIBRN
C[C@@H](C(=O)Nc1ccccc1C(=O)c1ccccc1)N(c1ccccc1)S(C)(=O)=O	ZINC000218285555	568477539	/nfs/dbraw/zinc/47/75/39/568477539.db2.gz	PZKRAKDBYPYIRM-KRWDZBQOSA-N	0	0	422.506	3.711	40	70		HHIBRN
Cc1cccc(-c2noc(CN(C)C(=O)CN3c4cccc5cccc(c45)C3=O)n2)c1	ZINC000218321141	568478297	/nfs/dbraw/zinc/47/82/97/568478297.db2.gz	GZDRHTVKZWSYGD-UHFFFAOYSA-N	0	0	412.449	3.817	40	70		HHIBRN
CCN(Cc1nc(-c2cccs2)no1)C(=O)CN1c2cccc3cccc(c23)C1=O	ZINC000218321908	568478349	/nfs/dbraw/zinc/47/83/49/568478349.db2.gz	IBKHBBFJYYEVPU-UHFFFAOYSA-N	0	0	418.478	3.960	40	70		HHIBRN
C[C@@H](NC(=O)[C@@H]1CN(S(=O)(=O)c2ccccc2)c2ccccc2O1)c1ccccc1	ZINC000218435938	568480308	/nfs/dbraw/zinc/48/03/08/568480308.db2.gz	GQUQDHWPWJTGMY-VGSWGCGISA-N	0	0	422.506	3.520	40	70		HHIBRN
Cc1ccc(C(=O)NCCCc2ccc(F)cc2)cc1S(=O)(=O)N1CCCCC1	ZINC000218504917	568481078	/nfs/dbraw/zinc/48/10/78/568481078.db2.gz	BEZKZUBMRFKRRO-UHFFFAOYSA-N	0	0	418.534	3.671	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@@H](C)N(c2cc(C)ccc2C)S(C)(=O)=O)c1	ZINC000218545298	568481665	/nfs/dbraw/zinc/48/16/65/568481665.db2.gz	WYZKJXQNYNGCKU-RBUKOAKNSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccccc1OC[C@H](C)NC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000218573451	568481852	/nfs/dbraw/zinc/48/18/52/568481852.db2.gz	YHHPKYZJCDDAGB-SFHVURJKSA-N	0	0	424.522	3.993	40	70		HHIBRN
CCCOc1ccccc1CCCNC(=O)c1ccc(C)c(NS(C)(=O)=O)c1	ZINC000218587436	568482117	/nfs/dbraw/zinc/48/21/17/568482117.db2.gz	YIPDYBWUYFDPBI-UHFFFAOYSA-N	0	0	404.532	3.518	40	70		HHIBRN
CCS(=O)(=O)Nc1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3ccc(C)cc32)cc1	ZINC000218641517	568482660	/nfs/dbraw/zinc/48/26/60/568482660.db2.gz	ATNIDPQWCFDWII-GOSISDBHSA-N	0	0	402.516	3.789	40	70		HHIBRN
CC[C@H](Oc1ccc(OC)cc1)C(=O)N(C)Cc1nc(-c2ccc(OC)cc2)no1	ZINC000218760686	568483380	/nfs/dbraw/zinc/48/33/80/568483380.db2.gz	ZSRGZPZZPNRREU-IBGZPJMESA-N	0	0	411.458	3.570	40	70		HHIBRN
O=C(COc1ccc(Cl)cc1)NCc1nc(-c2cccc(Br)c2)no1	ZINC000217833505	568474113	/nfs/dbraw/zinc/47/41/13/568474113.db2.gz	HJEHYCHNMJHFKA-UHFFFAOYSA-N	0	0	422.666	3.848	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CSCc3ccc(Cl)cc3)n2)cc1	ZINC000218045733	568474871	/nfs/dbraw/zinc/47/48/71/568474871.db2.gz	CJQFSDJDQKPEKX-UHFFFAOYSA-N	0	0	403.891	3.948	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)[C@@H](C)SCc3ccccc3)n2)c(OC)c1	ZINC000218073620	568475065	/nfs/dbraw/zinc/47/50/65/568475065.db2.gz	SAAQWMDESMPIGK-CQSZACIVSA-N	0	0	413.499	3.692	40	70		HHIBRN
COc1ccc(CSCC(=O)N(C)Cc2nc(-c3cccc(OC)c3)no2)cc1	ZINC000218118065	568475265	/nfs/dbraw/zinc/47/52/65/568475265.db2.gz	HYLDPPHHGUDEJU-UHFFFAOYSA-N	0	0	413.499	3.646	40	70		HHIBRN
COc1ccc2c(c1)[C@H](NC(=O)c1cc(OC)c(OC)c(OC)c1)CC(C)(C)O2	ZINC000218128705	568475330	/nfs/dbraw/zinc/47/53/30/568475330.db2.gz	PVYFDUIGZREFRT-MRXNPFEDSA-N	0	0	401.459	3.753	40	70		HHIBRN
COc1ccc(-c2noc(CNC(=O)CCSc3ccc(C)cc3)n2)c(OC)c1	ZINC000218151132	568475878	/nfs/dbraw/zinc/47/58/78/568475878.db2.gz	DMFZRCNAMSMKCQ-UHFFFAOYSA-N	0	0	413.499	3.861	40	70		HHIBRN
CC[C@@H](NC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218278004	568477327	/nfs/dbraw/zinc/47/73/27/568477327.db2.gz	OXJZKAYLRCKELB-LAUBAEHRSA-N	0	0	418.559	3.734	40	70		HHIBRN
Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](C)N(c1ccccc1)S(C)(=O)=O)CC(C)(C)O2	ZINC000218288172	568477639	/nfs/dbraw/zinc/47/76/39/568477639.db2.gz	ZPUIZTOGWKPBSM-VQIMIIECSA-N	0	0	416.543	3.568	40	70		HHIBRN
COc1cc(CNC(=O)CN2c3cccc4cccc(c34)C2=O)ccc1OC(C)C	ZINC000218315722	568478244	/nfs/dbraw/zinc/47/82/44/568478244.db2.gz	OIWQXCFLALSLQB-UHFFFAOYSA-N	0	0	404.466	3.912	40	70		HHIBRN
Cc1ccc(C)c([C@@H](C)NC(=O)[C@@H](C)N(c2ccc(C)c(C)c2)S(C)(=O)=O)c1	ZINC000218365271	568479293	/nfs/dbraw/zinc/47/92/93/568479293.db2.gz	GKNRQGQQFWFYEY-RTBURBONSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@@H](C)N(c2cc(C)cc(C)c2)S(C)(=O)=O)c1	ZINC000218374551	568479382	/nfs/dbraw/zinc/47/93/82/568479382.db2.gz	IJVTWMFCUPFMSE-RBUKOAKNSA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc([C@H](C)NC(=O)[C@@H](C)N(c2ccc(Cl)cc2)S(C)(=O)=O)cc1C	ZINC000218385854	568479588	/nfs/dbraw/zinc/47/95/88/568479588.db2.gz	NZXQCTIBRBULSP-JKSUJKDBSA-N	0	0	408.951	3.989	40	70		HHIBRN
COc1ccccc1CCCNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	ZINC000218406349	568479896	/nfs/dbraw/zinc/47/98/96/568479896.db2.gz	OQGCGPCTTJMGDH-UHFFFAOYSA-N	0	0	424.522	3.859	40	70		HHIBRN
CC[C@@H](NC(=O)[C@H](C)N(c1ccc(F)cc1)S(C)(=O)=O)c1ccc(C)cc1C	ZINC000218462611	568480700	/nfs/dbraw/zinc/48/07/00/568480700.db2.gz	KATOUGBKSGKTCR-OXJNMPFZSA-N	0	0	406.523	3.865	40	70		HHIBRN
Cc1ccc(C)c([C@H](C)NC(=O)[C@H](C)N(c2cc(C)ccc2C)S(C)(=O)=O)c1	ZINC000218545448	568481621	/nfs/dbraw/zinc/48/16/21/568481621.db2.gz	WYZKJXQNYNGCKU-OALUTQOASA-N	0	0	402.560	3.952	40	70		HHIBRN
Cc1ccc(C)c(N([C@H](C)C(=O)NCCCc2ccccc2Cl)S(C)(=O)=O)c1	ZINC000218545631	568481634	/nfs/dbraw/zinc/48/16/34/568481634.db2.gz	UVPFLTPJLYOXIY-QGZVFWFLSA-N	0	0	422.978	3.860	40	70		HHIBRN
CC[C@H](Oc1ccc(OC)cc1)C(=O)N(C)Cc1nc(-c2cccc(OC)c2)no1	ZINC000218760576	568483321	/nfs/dbraw/zinc/48/33/21/568483321.db2.gz	UZLIXSMQYWHASA-IBGZPJMESA-N	0	0	411.458	3.570	40	70		HHIBRN