smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)cc1)c1ccc(F)cc1Cl	ZINC000159989905	531801294	/nfs/dbraw/zinc/80/12/94/531801294.db2.gz	HDLJZXQIKVWCKA-GFCCVEGCSA-N	-1	3	377.796	2.336	20	70		GEIDHM
O=S(=O)(Cc1cc(Cl)ccc1F)[N-]C[C@H](O)COc1ccc(F)cc1	ZINC000159964362	531799076	/nfs/dbraw/zinc/79/90/76/531799076.db2.gz	MJGDBTMXABTWIN-AWEZNQCLSA-N	-1	3	391.823	2.478	20	70		GEIDHM
O=C(NCCNC(=O)c1ccccc1)NCc1ccc([O-])c(Br)c1	ZINC000159441912	531781378	/nfs/dbraw/zinc/78/13/78/531781378.db2.gz	ZAGYWZPUSHPYDR-UHFFFAOYSA-N	-1	3	392.253	2.384	20	70		GEIDHM
C[C@H](CO)C[N-]S(=O)(=O)c1ccc(Br)cc1C(F)(F)F	ZINC000159732653	531791775	/nfs/dbraw/zinc/79/17/75/531791775.db2.gz	PNDOCXNZSKWZRH-ZETCQYMHSA-N	-1	3	376.194	2.375	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)cc1)c1ccc(Cl)cc1F	ZINC000159989492	531802398	/nfs/dbraw/zinc/80/23/98/531802398.db2.gz	ZJHZMLPMQCIMQS-LBPRGKRZSA-N	-1	3	377.796	2.336	20	70		GEIDHM
CC(C)CSCCCNC(=O)[C@H](C)[N-]S(=O)(=O)c1ccccc1F	ZINC000160699452	531815343	/nfs/dbraw/zinc/81/53/43/531815343.db2.gz	YTAANXBBHQTYIU-ZDUSSCGKSA-N	-1	3	376.519	2.388	20	70		GEIDHM
CC(C)(C)c1nc(CCNC(=O)C[N-]S(=O)(=O)c2cccs2)cs1	ZINC000160690421	531815388	/nfs/dbraw/zinc/81/53/88/531815388.db2.gz	PFQZKURCBVWOFW-UHFFFAOYSA-N	-1	3	387.552	2.139	20	70		GEIDHM
O=C1CCc2cc(Br)c(S(=O)(=O)[N-]Cc3ccncc3)cc2N1	ZINC000159557751	531785249	/nfs/dbraw/zinc/78/52/49/531785249.db2.gz	KNECJFHVFHXKAN-UHFFFAOYSA-N	-1	3	396.266	2.207	20	70		GEIDHM
O=S(=O)([N-]CCNc1nccc(C(F)(F)F)n1)c1ccc(F)cc1F	ZINC000159602575	531787617	/nfs/dbraw/zinc/78/76/17/531787617.db2.gz	JHYZBCKXFCKWIV-UHFFFAOYSA-N	-1	3	382.314	2.164	20	70		GEIDHM
C[N-]S(=O)(=O)c1ccc(CNC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)s1	ZINC000159671882	531789154	/nfs/dbraw/zinc/78/91/54/531789154.db2.gz	ABOIDZQSTPGOMN-YPMHNXCESA-N	-1	3	386.445	2.354	20	70		GEIDHM
C[C@H]1CCN(S(=O)(=O)c2ccc([N-]S(C)(=O)=O)c(F)c2)C[C@H](C)C1	ZINC000159711624	531791049	/nfs/dbraw/zinc/79/10/49/531791049.db2.gz	XCIXHCNRUYYLMP-NWDGAFQWSA-N	-1	3	378.491	2.254	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)cc1)c1ccc(Cl)cc1F	ZINC000159989354	531802747	/nfs/dbraw/zinc/80/27/47/531802747.db2.gz	ZJHZMLPMQCIMQS-GFCCVEGCSA-N	-1	3	377.796	2.336	20	70		GEIDHM
CCc1ccc(S(=O)(=O)[N-]c2ccc(OC[C@@H](O)CN(C)C)cc2)s1	ZINC000160120127	531805682	/nfs/dbraw/zinc/80/56/82/531805682.db2.gz	PUQZIZBLIHKWGG-AWEZNQCLSA-N	-1	3	384.523	2.413	20	70		GEIDHM
CC(C)C[C@H](CO)NC(=O)CC[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000160665019	531814226	/nfs/dbraw/zinc/81/42/26/531814226.db2.gz	LNUZSYSQBOVUOH-LLVKDONJSA-N	-1	3	397.324	2.185	20	70		GEIDHM
CCCC1(CNC(=O)C[N-]S(=O)(=O)c2ccc(Br)s2)CC1	ZINC000160657030	531814978	/nfs/dbraw/zinc/81/49/78/531814978.db2.gz	TZCWKOZFPJZDSJ-UHFFFAOYSA-N	-1	3	395.344	2.485	20	70		GEIDHM
Cc1nc(-c2ccc(S(=O)(=O)[N-]C[C@@H](O)COCC3CC3)s2)cs1	ZINC000160667666	531814993	/nfs/dbraw/zinc/81/49/93/531814993.db2.gz	CGBKPERRMLRICU-GFCCVEGCSA-N	-1	3	388.536	2.246	20	70		GEIDHM
CC(=O)Nc1cc(F)c(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)CC2)cc1Cl	ZINC000161367068	531832244	/nfs/dbraw/zinc/83/22/44/531832244.db2.gz	RUPPWKHJSZLQSI-XYPYZODXSA-N	-1	3	378.853	2.267	20	70		GEIDHM
O=S(=O)([N-][C@@H]1CCN(c2ccccn2)C1)c1ccc(Br)s1	ZINC000159370520	531780458	/nfs/dbraw/zinc/78/04/58/531780458.db2.gz	HDCWSIJKSWILIR-SNVBAGLBSA-N	-1	3	388.312	2.463	20	70		GEIDHM
C[C@H](C[C@H](O)c1ccccc1)NC(=O)CC[N-]S(=O)(=O)c1cccs1	ZINC000159459462	531782590	/nfs/dbraw/zinc/78/25/90/531782590.db2.gz	KLIDOEXOCRVVCZ-HIFRSBDPSA-N	-1	3	382.507	2.045	20	70		GEIDHM
COc1ccc(Br)c(S(=O)(=O)[N-]CC2(O)CCCCC2)c1	ZINC000159816966	531796239	/nfs/dbraw/zinc/79/62/39/531796239.db2.gz	ZQJALUQWUMYKMN-UHFFFAOYSA-N	-1	3	378.288	2.431	20	70		GEIDHM
Cc1cccc(OC[C@H](O)C[N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)c1	ZINC000159918856	531800244	/nfs/dbraw/zinc/80/02/44/531800244.db2.gz	VZSFIWKBQBFRFG-LLVKDONJSA-N	-1	3	375.368	2.131	20	70		GEIDHM
CNC(=O)COc1cccc(CC(=O)Nc2cc(Br)ccc2[O-])c1	ZINC000160050241	531804551	/nfs/dbraw/zinc/80/45/51/531804551.db2.gz	IEXXVXLCOYTTPB-UHFFFAOYSA-N	-1	3	393.237	2.461	20	70		GEIDHM
CCc1ccc(S(=O)(=O)[N-]c2ccc(OC[C@H](O)CN(C)C)cc2)s1	ZINC000160119994	531806807	/nfs/dbraw/zinc/80/68/07/531806807.db2.gz	PUQZIZBLIHKWGG-CQSZACIVSA-N	-1	3	384.523	2.413	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)c(F)c1)c1cccc(Cl)c1F	ZINC000161295854	531829358	/nfs/dbraw/zinc/82/93/58/531829358.db2.gz	NJYCCYQKMRMIIY-SECBINFHSA-N	-1	3	395.786	2.476	20	70		GEIDHM
O=S(=O)([N-]CCNc1nccc(C(F)(F)F)n1)c1cc(F)cc(F)c1	ZINC000159594951	531787729	/nfs/dbraw/zinc/78/77/29/531787729.db2.gz	MLEBXVVESZFHRI-UHFFFAOYSA-N	-1	3	382.314	2.164	20	70		GEIDHM
C[N-]S(=O)(=O)c1ccc(CNC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)s1	ZINC000159671744	531790358	/nfs/dbraw/zinc/79/03/58/531790358.db2.gz	ABOIDZQSTPGOMN-DGCLKSJQSA-N	-1	3	386.445	2.354	20	70		GEIDHM
O=C(c1sccc1S(=O)(=O)[N-]C1CCCCCC1)N1CCC[C@@H](O)C1	ZINC000159931301	531799420	/nfs/dbraw/zinc/79/94/20/531799420.db2.gz	AFVURJJWSHYGDF-CQSZACIVSA-N	-1	3	386.539	2.346	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1cccc(C(F)(F)F)c1)c1cccs1	ZINC000159955332	531799862	/nfs/dbraw/zinc/79/98/62/531799862.db2.gz	JNDSNSGPCWLLKM-LLVKDONJSA-N	-1	3	381.397	2.485	20	70		GEIDHM
CC(=O)NCc1ccc(S(=O)(=O)[N-]CCOc2ccccc2Cl)s1	ZINC000160061839	531803614	/nfs/dbraw/zinc/80/36/14/531803614.db2.gz	YVHLMEHAUPUOBJ-UHFFFAOYSA-N	-1	3	388.898	2.395	20	70		GEIDHM
O=C(NC1CC1)[C@H]1CCCN1C(=O)NCc1ccc([O-])c(Br)c1	ZINC000160037692	531804412	/nfs/dbraw/zinc/80/44/12/531804412.db2.gz	BLOBIQVBLVAIAD-CYBMUJFWSA-N	-1	3	382.258	2.107	20	70		GEIDHM
O=C(CC[N-]S(=O)(=O)c1cccs1)N[C@H]1CCOC2(CCCCC2)C1	ZINC000161007411	531822064	/nfs/dbraw/zinc/82/20/64/531822064.db2.gz	KRBQORUFRLFPLR-AWEZNQCLSA-N	-1	3	386.539	2.415	20	70		GEIDHM
Cc1cc(S(=O)(=O)[N-]c2ccc(OC[C@@H](O)CN(C)C)cc2)c(C)s1	ZINC000160111498	531807034	/nfs/dbraw/zinc/80/70/34/531807034.db2.gz	KSGOMWXWLDHDBA-HNNXBMFYSA-N	-1	3	384.523	2.467	20	70		GEIDHM
COc1cccc(Cl)c1CC(=O)NCC[N-]S(=O)(=O)c1cccs1	ZINC000160786171	531816921	/nfs/dbraw/zinc/81/69/21/531816921.db2.gz	ZZPPFRKCSDYSOA-UHFFFAOYSA-N	-1	3	388.898	2.047	20	70		GEIDHM
CC[C@H](CS(=O)(=O)c1ccccc1)[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000160863527	531819423	/nfs/dbraw/zinc/81/94/23/531819423.db2.gz	LLCBENXPZZZILN-GFCCVEGCSA-N	-1	3	389.445	2.496	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)cc1)c1cccc(Cl)c1F	ZINC000159994241	531801903	/nfs/dbraw/zinc/80/19/03/531801903.db2.gz	GAONQFDICKXNPR-NSHDSACASA-N	-1	3	377.796	2.336	20	70		GEIDHM
CC(C)CCn1ccc(NC(=O)NCC[N-]S(=O)(=O)c2cccs2)n1	ZINC000160531359	531811256	/nfs/dbraw/zinc/81/12/56/531811256.db2.gz	KXZVDKGHDAPUQL-UHFFFAOYSA-N	-1	3	385.515	2.091	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COCC1CC1)c1cc(C(F)(F)F)ccc1Cl	ZINC000160691453	531815247	/nfs/dbraw/zinc/81/52/47/531815247.db2.gz	XXGJTASJJSWJDR-LLVKDONJSA-N	-1	3	387.807	2.425	20	70		GEIDHM
CCOCCC1(CNC(=O)C[N-]S(=O)(=O)c2ccc(Cl)s2)CC1	ZINC000159420673	531781684	/nfs/dbraw/zinc/78/16/84/531781684.db2.gz	UBLKFZZPEXKTKP-UHFFFAOYSA-N	-1	3	380.919	2.003	20	70		GEIDHM
Cc1noc(C)c1S(=O)(=O)[N-]C[C@H](O)COc1cccc(Cl)c1Cl	ZINC000160013353	531802055	/nfs/dbraw/zinc/80/20/55/531802055.db2.gz	TZQFHZHANQQCFY-JTQLQIEISA-N	-1	3	395.264	2.316	20	70		GEIDHM
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)[N-]CCCc1ccccc1	ZINC000160011038	531802199	/nfs/dbraw/zinc/80/21/99/531802199.db2.gz	QSAQCVLXKYAPCT-UHFFFAOYSA-N	-1	3	382.869	2.115	20	70		GEIDHM
CCCCn1ncc(NC(=O)NCC[N-]S(=O)(=O)c2cccs2)c1C	ZINC000160642533	531814404	/nfs/dbraw/zinc/81/44/04/531814404.db2.gz	JPMNCSKBJGVGKQ-UHFFFAOYSA-N	-1	3	385.515	2.153	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)c(F)c1)c1cc(F)ccc1Cl	ZINC000161294297	531830030	/nfs/dbraw/zinc/83/00/30/531830030.db2.gz	HZDHSFYKKFKAMS-JTQLQIEISA-N	-1	3	395.786	2.476	20	70		GEIDHM
Cc1ccc(S(=O)(=O)[N-]C[C@@H](O)COc2ccc(F)c(F)c2)c(F)c1	ZINC000161286919	531829705	/nfs/dbraw/zinc/82/97/05/531829705.db2.gz	ZNIUSCXEIHMRHD-LLVKDONJSA-N	-1	3	375.368	2.131	20	70		GEIDHM
CC(C)Sc1ccccc1NC(=O)Cn1cc(Br)c(=O)[n-]c1=O	ZINC000160929713	531819885	/nfs/dbraw/zinc/81/98/85/531819885.db2.gz	NNHDCJATFDMUKT-UHFFFAOYSA-N	-1	3	398.282	2.438	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)cc1)c1cc(F)ccc1Cl	ZINC000159992798	531801475	/nfs/dbraw/zinc/80/14/75/531801475.db2.gz	JXJBVYQXATUHJW-LBPRGKRZSA-N	-1	3	377.796	2.336	20	70		GEIDHM
Cc1ccc(S(=O)(=O)[N-]CCNc2nccc(C(F)(F)F)n2)c(F)c1	ZINC000159587148	531786697	/nfs/dbraw/zinc/78/66/97/531786697.db2.gz	ZAMMKSRVUIZUGG-UHFFFAOYSA-N	-1	3	378.351	2.333	20	70		GEIDHM
C[C@@H]1CC(=O)CC[C@@H]1C(=O)N1CCC([N-]S(=O)(=O)c2cccs2)CC1	ZINC000159712782	531791928	/nfs/dbraw/zinc/79/19/28/531791928.db2.gz	AHQLIXPKICTFHD-DOMZBBRYSA-N	-1	3	384.523	2.023	20	70		GEIDHM
COc1ccc(Br)cc1S(=O)(=O)[N-]Cc1ccccc1CO	ZINC000159753773	531792247	/nfs/dbraw/zinc/79/22/47/531792247.db2.gz	HMPAUXQWERHTNX-UHFFFAOYSA-N	-1	3	386.267	2.429	20	70		GEIDHM
CC(=O)Nc1cc(F)c(S(=O)(=O)[N-]Cc2ccccc2CO)cc1Cl	ZINC000159773066	531794114	/nfs/dbraw/zinc/79/41/14/531794114.db2.gz	RXRUOPDVEMNSJJ-UHFFFAOYSA-N	-1	3	386.832	2.408	20	70		GEIDHM
Cc1cc(F)c(S(=O)(=O)[N-]C[C@H](O)COc2ccc(F)cc2)cc1F	ZINC000159980060	531799768	/nfs/dbraw/zinc/79/97/68/531799768.db2.gz	DDVOLQMOQWQZSM-LBPRGKRZSA-N	-1	3	375.368	2.131	20	70		GEIDHM
O=C(C[N-]S(=O)(=O)c1ccc(Cl)s1)N[C@@H]1CCOC2(CCCC2)C1	ZINC000160000948	531802707	/nfs/dbraw/zinc/80/27/07/531802707.db2.gz	IUKDTDBVUWELPC-LLVKDONJSA-N	-1	3	392.930	2.288	20	70		GEIDHM
CS(=O)(=O)[N-]c1cc(C(=O)N2CCO[C@H](c3cccs3)C2)ccc1F	ZINC000161280711	531829660	/nfs/dbraw/zinc/82/96/60/531829660.db2.gz	YLPORPKWZUWTHM-AWEZNQCLSA-N	-1	3	384.454	2.472	20	70		GEIDHM
CCCn1c(=O)[n-]nc1S(=O)(=O)Cc1ccc(OC)c(Br)c1	ZINC000160925769	531820098	/nfs/dbraw/zinc/82/00/98/531820098.db2.gz	LINGZUUDXMFIGB-UHFFFAOYSA-N	-1	3	390.259	2.139	20	70		GEIDHM
Cc1ccc(S(=O)(=O)[N-]C[C@H](O)COc2ccc(F)c(F)c2)c(F)c1	ZINC000161286804	531830922	/nfs/dbraw/zinc/83/09/22/531830922.db2.gz	ZNIUSCXEIHMRHD-NSHDSACASA-N	-1	3	375.368	2.131	20	70		GEIDHM
CC(C)S(=O)(=O)[N-]c1ccc(S(=O)(=O)NCC2(C3CC3)CC2)cc1F	ZINC000160137249	531809077	/nfs/dbraw/zinc/80/90/77/531809077.db2.gz	PBONXBCVUHAHBS-UHFFFAOYSA-N	-1	3	390.502	2.444	20	70		GEIDHM
COc1ccc(S(=O)(=O)[N-]c2cc(-n3cnnn3)ccc2Cl)cc1F	ZINC000160858930	531818915	/nfs/dbraw/zinc/81/89/15/531818915.db2.gz	KOKISZBXGSHQNI-UHFFFAOYSA-N	-1	3	383.792	2.264	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COCC1CC1)c1ccc(Br)cc1Cl	ZINC000160671715	531814118	/nfs/dbraw/zinc/81/41/18/531814118.db2.gz	ZNVHATREBWYPOM-LLVKDONJSA-N	-1	3	398.706	2.168	20	70		GEIDHM
CC(C)C[C@@H](CO)NC(=O)CC[N-]S(=O)(=O)c1c(Cl)cccc1Cl	ZINC000160664887	531815006	/nfs/dbraw/zinc/81/50/06/531815006.db2.gz	LNUZSYSQBOVUOH-NSHDSACASA-N	-1	3	397.324	2.185	20	70		GEIDHM
Cc1ccc(F)c(S(=O)(=O)[N-]C[C@@H](O)COc2ccc(F)c(F)c2)c1	ZINC000161286396	531829882	/nfs/dbraw/zinc/82/98/82/531829882.db2.gz	JJBBKOPXUUBTMD-LLVKDONJSA-N	-1	3	375.368	2.131	20	70		GEIDHM
CS(=O)(=O)NCC[C@H]1CCCCN1Cc1cc([O-])ccc1Br	ZINC000159444379	531781129	/nfs/dbraw/zinc/78/11/29/531781129.db2.gz	KPGSLGCGVWSCFF-CYBMUJFWSA-N	-1	3	391.331	2.449	20	70		GEIDHM
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)[N-]Cc1ccc(Cl)cc1	ZINC000159945054	531800394	/nfs/dbraw/zinc/80/03/94/531800394.db2.gz	ASANUDIRSOUJNF-UHFFFAOYSA-N	-1	3	389.260	2.336	20	70		GEIDHM
CCc1ccc(S(=O)(=O)[N-]c2ccc(CS(N)(=O)=O)cc2)cc1CC	ZINC000160024796	531804043	/nfs/dbraw/zinc/80/40/43/531804043.db2.gz	TUWHHHFMNLEBGU-UHFFFAOYSA-N	-1	3	382.507	2.401	20	70		GEIDHM
CN1C[C@H]([N-]S(=O)(=O)c2cc(Br)ccc2Cl)CCC1=O	ZINC000160057863	531804310	/nfs/dbraw/zinc/80/43/10/531804310.db2.gz	ZRZYBEWFXIXUSU-SECBINFHSA-N	-1	3	381.679	2.002	20	70		GEIDHM
C[N-]S(=O)(=O)c1ccc(CNC(=O)Nc2ccn(CCC(C)C)n2)s1	ZINC000161175255	531826083	/nfs/dbraw/zinc/82/60/83/531826083.db2.gz	SXBIYTKMSWARRF-UHFFFAOYSA-N	-1	3	385.515	2.221	20	70		GEIDHM
O=S(=O)([N-]CCSCCCO)c1cc(Br)ccc1Cl	ZINC000161338714	531832177	/nfs/dbraw/zinc/83/21/77/531832177.db2.gz	HXBFBEQNAPWOFE-UHFFFAOYSA-N	-1	3	388.736	2.496	20	70		GEIDHM
Cc1noc(C)c1S(=O)(=O)[N-]C[C@@H](O)COc1cccc(Cl)c1Cl	ZINC000160013485	531802433	/nfs/dbraw/zinc/80/24/33/531802433.db2.gz	TZQFHZHANQQCFY-SNVBAGLBSA-N	-1	3	395.264	2.316	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(C(F)(F)F)cc1)c1cccs1	ZINC000160005823	531801762	/nfs/dbraw/zinc/80/17/62/531801762.db2.gz	BBEDUYBPPUGAEF-NSHDSACASA-N	-1	3	381.397	2.485	20	70		GEIDHM
Cc1ccc(F)c(S(=O)(=O)[N-]CCNc2nccc(C(F)(F)F)n2)c1	ZINC000159596608	531787181	/nfs/dbraw/zinc/78/71/81/531787181.db2.gz	ANEXKNZHADBJPY-UHFFFAOYSA-N	-1	3	378.351	2.333	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)cc1)c1cc(F)ccc1Cl	ZINC000159992654	531801956	/nfs/dbraw/zinc/80/19/56/531801956.db2.gz	JXJBVYQXATUHJW-GFCCVEGCSA-N	-1	3	377.796	2.336	20	70		GEIDHM
COc1ccsc1S(=O)(=O)[N-]c1cc(Br)c(=O)n(C)c1	ZINC000159835548	531795829	/nfs/dbraw/zinc/79/58/29/531795829.db2.gz	DQVSBARRVOHDML-UHFFFAOYSA-N	-1	3	379.257	2.019	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)c(F)c1)c1ccc(Cl)cc1F	ZINC000161291560	531829684	/nfs/dbraw/zinc/82/96/84/531829684.db2.gz	ARDYPMIFQZCFJM-SNVBAGLBSA-N	-1	3	395.786	2.476	20	70		GEIDHM
COc1ccc(Br)c(S(=O)(=O)[N-]Cc2ccccc2CO)c1	ZINC000159761621	531793903	/nfs/dbraw/zinc/79/39/03/531793903.db2.gz	HSNBSWGFPQZJTC-UHFFFAOYSA-N	-1	3	386.267	2.429	20	70		GEIDHM
Cc1noc(C)c1S(=O)(=O)[N-][C@@H](C)C(=O)N[C@@H]1CCCc2sccc21	ZINC000160023697	531803680	/nfs/dbraw/zinc/80/36/80/531803680.db2.gz	HSGOLHLPMOMBTN-GXFFZTMASA-N	-1	3	383.495	2.214	20	70		GEIDHM
CN(C)C[C@@H](O)COc1ccc([N-]S(=O)(=O)c2ccccc2Cl)cc1	ZINC000160111769	531806213	/nfs/dbraw/zinc/80/62/13/531806213.db2.gz	LRSJKAMXYLLLLN-CQSZACIVSA-N	-1	3	384.885	2.442	20	70		GEIDHM
CCC(CC)([N-]S(=O)(=O)c1ccc(Br)cc1Cl)C(N)=O	ZINC000161212722	531828183	/nfs/dbraw/zinc/82/81/83/531828183.db2.gz	LPYIXGLWLREIAV-UHFFFAOYSA-N	-1	3	383.695	2.425	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000161292075	531830836	/nfs/dbraw/zinc/83/08/36/531830836.db2.gz	ATQADRZPIKEYFW-SNVBAGLBSA-N	-1	3	395.786	2.476	20	70		GEIDHM
C[C@H](C[C@@H](O)c1ccccc1)NC(=O)CC[N-]S(=O)(=O)c1cccs1	ZINC000159459753	531782086	/nfs/dbraw/zinc/78/20/86/531782086.db2.gz	KLIDOEXOCRVVCZ-UKRRQHHQSA-N	-1	3	382.507	2.045	20	70		GEIDHM
COC(=O)c1ccc(S(=O)(=O)[N-]Cc2ccncc2)c(Br)c1	ZINC000159559704	531785180	/nfs/dbraw/zinc/78/51/80/531785180.db2.gz	LQSNWURMBCNPQO-UHFFFAOYSA-N	-1	3	385.239	2.109	20	70		GEIDHM
CCCCn1ncc(NC(=O)NCc2ccc(S(=O)(=O)[N-]C)s2)c1C	ZINC000159858572	531798483	/nfs/dbraw/zinc/79/84/83/531798483.db2.gz	NDWOMNPHRUABIC-UHFFFAOYSA-N	-1	3	385.515	2.283	20	70		GEIDHM
Cc1cc(S(=O)(=O)[N-]C[C@H](O)COc2ccc(F)cc2)c(F)cc1F	ZINC000159976235	531799886	/nfs/dbraw/zinc/79/98/86/531799886.db2.gz	DEVUYUPOUJFYPS-LBPRGKRZSA-N	-1	3	375.368	2.131	20	70		GEIDHM
CN(C)C[C@@H](O)COc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1	ZINC000160106174	531806105	/nfs/dbraw/zinc/80/61/05/531806105.db2.gz	MIVHENXGPZWODB-OAHLLOKOSA-N	-1	3	384.885	2.442	20	70		GEIDHM
CN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)[N-]CC2(O)CCCCCC2)c1	ZINC000160976341	531822762	/nfs/dbraw/zinc/82/27/62/531822762.db2.gz	PNNBRFLSTPVPHC-UHFFFAOYSA-N	-1	3	388.917	2.405	20	70		GEIDHM
CCc1noc(C)c1NC(=O)C(=O)NCc1ccc([O-])c(Br)c1	ZINC000161099739	531824499	/nfs/dbraw/zinc/82/44/99/531824499.db2.gz	JBCCXLQESGLMRW-UHFFFAOYSA-N	-1	3	382.214	2.268	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)c(F)c1)c1ccc(Cl)s1	ZINC000161274719	531829466	/nfs/dbraw/zinc/82/94/66/531829466.db2.gz	OTLFWKMPCYBKFD-MRVPVSSYSA-N	-1	3	383.825	2.398	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)c(F)c1)c1ccc(Cl)s1	ZINC000161274804	531829476	/nfs/dbraw/zinc/82/94/76/531829476.db2.gz	OTLFWKMPCYBKFD-QMMMGPOBSA-N	-1	3	383.825	2.398	20	70		GEIDHM
CS(=O)(=O)[N-]c1cc(C(=O)N2CCO[C@@H](c3cccs3)C2)ccc1F	ZINC000161280823	531830212	/nfs/dbraw/zinc/83/02/12/531830212.db2.gz	YLPORPKWZUWTHM-CQSZACIVSA-N	-1	3	384.454	2.472	20	70		GEIDHM
C[C@@H](C[C@H](O)c1ccccc1)NC(=O)CC[N-]S(=O)(=O)c1cccs1	ZINC000159459329	531782398	/nfs/dbraw/zinc/78/23/98/531782398.db2.gz	KLIDOEXOCRVVCZ-ZFWWWQNUSA-N	-1	3	382.507	2.045	20	70		GEIDHM
CC(=O)c1ccc(Cl)c(S(=O)(=O)[N-][C@@H]2CCN(c3ccccn3)C2)c1	ZINC000159361649	531779981	/nfs/dbraw/zinc/77/99/81/531779981.db2.gz	FPZIKLHZDQGGHK-CQSZACIVSA-N	-1	3	379.869	2.495	20	70		GEIDHM
Cc1cccc2[nH]c(CNC(=O)C[N-]S(=O)(=O)c3ccc(Cl)s3)nc21	ZINC000160592429	531812429	/nfs/dbraw/zinc/81/24/29/531812429.db2.gz	MFNCGFVUSLOHCM-UHFFFAOYSA-N	-1	3	398.897	2.181	20	70		GEIDHM
Cc1cccc2nc(CNC(=O)C[N-]S(=O)(=O)c3ccc(Cl)s3)[nH]c21	ZINC000160592429	531812433	/nfs/dbraw/zinc/81/24/33/531812433.db2.gz	MFNCGFVUSLOHCM-UHFFFAOYSA-N	-1	3	398.897	2.181	20	70		GEIDHM
CC(C)C1(CNC(=O)NCC[N-]S(=O)(=O)c2ccc(Cl)s2)CC1	ZINC000159557298	531785708	/nfs/dbraw/zinc/78/57/08/531785708.db2.gz	KYPFKGZPMGKQJZ-UHFFFAOYSA-N	-1	3	379.935	2.415	20	70		GEIDHM
NC(=O)c1cccc(CNC(=O)NCc2ccc([O-])c(Br)c2)c1	ZINC000159657078	531789199	/nfs/dbraw/zinc/78/91/99/531789199.db2.gz	XIHPVFFPNMWMME-UHFFFAOYSA-N	-1	3	378.226	2.253	20	70		GEIDHM
CC(=O)Nc1cc(F)c(S(=O)(=O)[N-]CC2(O)CCCCC2)cc1Cl	ZINC000159822952	531796667	/nfs/dbraw/zinc/79/66/67/531796667.db2.gz	CZULILKCCLWVSD-UHFFFAOYSA-N	-1	3	378.853	2.411	20	70		GEIDHM
Cc1ccn(-c2ccccc2NC(=O)C[N-]S(=O)(=O)c2cccs2)n1	ZINC000161122121	531826049	/nfs/dbraw/zinc/82/60/49/531826049.db2.gz	PQBSHJPAQQIKJW-UHFFFAOYSA-N	-1	3	376.463	2.159	20	70		GEIDHM
CS(=O)(=O)NCC[C@@H]1CCCCN1Cc1cc([O-])ccc1Br	ZINC000159444234	531781311	/nfs/dbraw/zinc/78/13/11/531781311.db2.gz	KPGSLGCGVWSCFF-ZDUSSCGKSA-N	-1	3	391.331	2.449	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1cccc(C(F)(F)F)c1)c1cccs1	ZINC000159955475	531800629	/nfs/dbraw/zinc/80/06/29/531800629.db2.gz	JNDSNSGPCWLLKM-NSHDSACASA-N	-1	3	381.397	2.485	20	70		GEIDHM
Cc1cc(S(=O)(=O)[N-]C[C@@H](O)COc2ccc(F)cc2)c(F)cc1F	ZINC000159976348	531800708	/nfs/dbraw/zinc/80/07/08/531800708.db2.gz	DEVUYUPOUJFYPS-GFCCVEGCSA-N	-1	3	375.368	2.131	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1cccs1	ZINC000160005965	531801882	/nfs/dbraw/zinc/80/18/82/531801882.db2.gz	BBEDUYBPPUGAEF-LLVKDONJSA-N	-1	3	381.397	2.485	20	70		GEIDHM
C[C@@H]([N-]S(=O)(=O)c1cccs1)C(=O)NCCc1cc2ccccc2[nH]1	ZINC000159630561	531787458	/nfs/dbraw/zinc/78/74/58/531787458.db2.gz	ZWZMLJCIKMJDRI-GFCCVEGCSA-N	-1	3	377.491	2.255	20	70		GEIDHM
O=C(Nc1cc(Cl)ccc1[O-])C1CCN(S(=O)(=O)CCCF)CC1	ZINC000159597029	531788036	/nfs/dbraw/zinc/78/80/36/531788036.db2.gz	WFOZZDIUUHQPBL-UHFFFAOYSA-N	-1	3	378.853	2.386	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)c(F)c1)c1cc(F)ccc1Cl	ZINC000161294183	531830305	/nfs/dbraw/zinc/83/03/05/531830305.db2.gz	HZDHSFYKKFKAMS-SNVBAGLBSA-N	-1	3	395.786	2.476	20	70		GEIDHM
O=C(c1sccc1S(=O)(=O)[N-]C1CCCCCC1)N1CCC(O)CC1	ZINC000159935843	531800753	/nfs/dbraw/zinc/80/07/53/531800753.db2.gz	WDIALQWEJPCRDN-UHFFFAOYSA-N	-1	3	386.539	2.346	20	70		GEIDHM
Cc1ccc([O-])c(CN2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)n1	ZINC000159475243	531783979	/nfs/dbraw/zinc/78/39/79/531783979.db2.gz	XICMTFIXYVNFFA-UHFFFAOYSA-N	-1	3	381.885	2.256	20	70		GEIDHM
Cc1cccc(OC[C@@H](O)C[N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)c1	ZINC000159919004	531800414	/nfs/dbraw/zinc/80/04/14/531800414.db2.gz	VZSFIWKBQBFRFG-NSHDSACASA-N	-1	3	375.368	2.131	20	70		GEIDHM
CCCn1c(=O)[n-]nc1S(=O)(=O)Cc1noc(-c2ccc(Cl)cc2)n1	ZINC000160918650	531821251	/nfs/dbraw/zinc/82/12/51/531821251.db2.gz	DMGCYTZMHVCTNH-UHFFFAOYSA-N	-1	3	383.817	2.071	20	70		GEIDHM
CN(C)C(=O)c1cc(S(=O)(=O)[N-]c2c(F)c(F)cc(F)c2F)cn1C	ZINC000160996066	531821581	/nfs/dbraw/zinc/82/15/81/531821581.db2.gz	OMIBATCAIGKYAK-UHFFFAOYSA-N	-1	3	379.335	2.084	20	70		GEIDHM
C[N-]S(=O)(=O)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)s1	ZINC000159672016	531789467	/nfs/dbraw/zinc/78/94/67/531789467.db2.gz	ABOIDZQSTPGOMN-WCQYABFASA-N	-1	3	386.445	2.354	20	70		GEIDHM
C[C@H](CO)C[N-]S(=O)(=O)c1csc(-c2ccc(Br)cc2)n1	ZINC000159734310	531792470	/nfs/dbraw/zinc/79/24/70/531792470.db2.gz	BXCVDBPYCQZTQD-VIFPVBQESA-N	-1	3	391.312	2.479	20	70		GEIDHM
O=S(=O)(Cc1cc(Cl)ccc1F)[N-]C[C@@H](O)COc1ccc(F)cc1	ZINC000159964251	531799187	/nfs/dbraw/zinc/79/91/87/531799187.db2.gz	MJGDBTMXABTWIN-CQSZACIVSA-N	-1	3	391.823	2.478	20	70		GEIDHM
Cc1noc(C)c1S(=O)(=O)[N-][C@@H](C)C(=O)N[C@H]1CCCc2sccc21	ZINC000160023826	531803434	/nfs/dbraw/zinc/80/34/34/531803434.db2.gz	HSGOLHLPMOMBTN-GWCFXTLKSA-N	-1	3	383.495	2.214	20	70		GEIDHM
O=C(CCCNC(=O)c1cccnc1)NCc1ccc([O-])c(Br)c1	ZINC000160977266	531822556	/nfs/dbraw/zinc/82/25/56/531822556.db2.gz	XVTZUHRWJIWKBY-UHFFFAOYSA-N	-1	3	392.253	2.376	20	70		GEIDHM
O=C(NCCOc1ccc(Br)cc1C(F)(F)F)c1c[n-]nn1	ZINC000161012081	531822715	/nfs/dbraw/zinc/82/27/15/531822715.db2.gz	VOPBLBCRHKCKIR-UHFFFAOYSA-N	-1	3	379.136	2.395	20	70		GEIDHM
O=C(NCCOc1ccc(Br)cc1C(F)(F)F)c1cnn[n-]1	ZINC000161012081	531822720	/nfs/dbraw/zinc/82/27/20/531822720.db2.gz	VOPBLBCRHKCKIR-UHFFFAOYSA-N	-1	3	379.136	2.395	20	70		GEIDHM
O=C(NCCOc1ccc(Br)cc1C(F)(F)F)c1cn[n-]n1	ZINC000161012081	531822726	/nfs/dbraw/zinc/82/27/26/531822726.db2.gz	VOPBLBCRHKCKIR-UHFFFAOYSA-N	-1	3	379.136	2.395	20	70		GEIDHM
CC(=O)c1ccc(Cl)c(S(=O)(=O)[N-][C@H]2CCN(c3ccccn3)C2)c1	ZINC000159361800	531779645	/nfs/dbraw/zinc/77/96/45/531779645.db2.gz	FPZIKLHZDQGGHK-AWEZNQCLSA-N	-1	3	379.869	2.495	20	70		GEIDHM
O=C(NCCCNC(=O)c1ccncc1Br)c1cccc([O-])c1	ZINC000159694825	531789990	/nfs/dbraw/zinc/78/99/90/531789990.db2.gz	FBVVBOHXHSSTPV-UHFFFAOYSA-N	-1	3	378.226	2.100	20	70		GEIDHM
CN(C)C[C@H](O)COc1ccc([N-]S(=O)(=O)c2ccccc2Cl)cc1	ZINC000160111651	531806168	/nfs/dbraw/zinc/80/61/68/531806168.db2.gz	LRSJKAMXYLLLLN-AWEZNQCLSA-N	-1	3	384.885	2.442	20	70		GEIDHM
Cc1nc(-c2ccc(S(=O)(=O)[N-]C[C@H](O)COCC3CC3)s2)cs1	ZINC000160667541	531815208	/nfs/dbraw/zinc/81/52/08/531815208.db2.gz	CGBKPERRMLRICU-LBPRGKRZSA-N	-1	3	388.536	2.246	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COCC1CC1)c1cc(C(F)(F)F)ccc1Cl	ZINC000160691332	531815402	/nfs/dbraw/zinc/81/54/02/531815402.db2.gz	XXGJTASJJSWJDR-NSHDSACASA-N	-1	3	387.807	2.425	20	70		GEIDHM
C[C@@H]1CC(=O)CC[C@H]1C(=O)N1CCC([N-]S(=O)(=O)c2cccs2)CC1	ZINC000159712997	531791842	/nfs/dbraw/zinc/79/18/42/531791842.db2.gz	AHQLIXPKICTFHD-IUODEOHRSA-N	-1	3	384.523	2.023	20	70		GEIDHM
C[C@@H](CO)C[N-]S(=O)(=O)c1ccc(Br)cc1C(F)(F)F	ZINC000159732819	531792371	/nfs/dbraw/zinc/79/23/71/531792371.db2.gz	PNDOCXNZSKWZRH-SSDOTTSWSA-N	-1	3	376.194	2.375	20	70		GEIDHM
Cn1nccc1C[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000159823562	531795654	/nfs/dbraw/zinc/79/56/54/531795654.db2.gz	QLLNITYWGMKIEX-UHFFFAOYSA-N	-1	3	382.642	2.454	20	70		GEIDHM
CCn1cnnc1C[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000159935259	531800038	/nfs/dbraw/zinc/80/00/38/531800038.db2.gz	SACBEDNRUGJWQU-UHFFFAOYSA-N	-1	3	397.657	2.332	20	70		GEIDHM
CN(C)C[C@@H](O)COc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000160115859	531806018	/nfs/dbraw/zinc/80/60/18/531806018.db2.gz	YWWXLBBALNMWCR-OAHLLOKOSA-N	-1	3	384.885	2.442	20	70		GEIDHM
Cc1nc2cc(NC(=O)NCC[N-]S(=O)(=O)c3cccs3)ccc2o1	ZINC000160516507	531811295	/nfs/dbraw/zinc/81/12/95/531811295.db2.gz	GFILBYVVSSHINC-UHFFFAOYSA-N	-1	3	380.451	2.298	20	70		GEIDHM
CC[C@@H](CS(=O)(=O)c1ccccc1)[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000160863443	531818979	/nfs/dbraw/zinc/81/89/79/531818979.db2.gz	LLCBENXPZZZILN-LBPRGKRZSA-N	-1	3	389.445	2.496	20	70		GEIDHM
C[C@]([N-]S(=O)(=O)c1ccc(Br)s1)(C(N)=O)c1ccccc1	ZINC000161229726	531828078	/nfs/dbraw/zinc/82/80/78/531828078.db2.gz	VSKISVAZKHTDOJ-CYBMUJFWSA-N	-1	3	389.296	2.190	20	70		GEIDHM
O=C(CC[N-]S(=O)(=O)c1cccs1)N[C@@H]1CCOC2(CCCCC2)C1	ZINC000161007273	531821711	/nfs/dbraw/zinc/82/17/11/531821711.db2.gz	KRBQORUFRLFPLR-CQSZACIVSA-N	-1	3	386.539	2.415	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)c(F)c1)c1ccc(Cl)cc1F	ZINC000161291683	531830689	/nfs/dbraw/zinc/83/06/89/531830689.db2.gz	ARDYPMIFQZCFJM-JTQLQIEISA-N	-1	3	395.786	2.476	20	70		GEIDHM
COc1ccc(Br)c(S(=O)(=O)[N-][C@H]2CC[C@@H](CO)CC2)c1	ZINC000161346713	531831490	/nfs/dbraw/zinc/83/14/90/531831490.db2.gz	VMGVZLRFMMFNBS-XYPYZODXSA-N	-1	3	378.288	2.287	20	70		GEIDHM
O=S(=O)([N-][C@H]1CCN(c2ccccn2)C1)c1ccc(Br)s1	ZINC000159370370	531779615	/nfs/dbraw/zinc/77/96/15/531779615.db2.gz	HDCWSIJKSWILIR-JTQLQIEISA-N	-1	3	388.312	2.463	20	70		GEIDHM
Cc1cc(F)c(S(=O)(=O)[N-]C[C@@H](O)COc2ccc(F)cc2)cc1F	ZINC000159980219	531800728	/nfs/dbraw/zinc/80/07/28/531800728.db2.gz	DDVOLQMOQWQZSM-GFCCVEGCSA-N	-1	3	375.368	2.131	20	70		GEIDHM
Cn1cc(C[N-]S(=O)(=O)c2c(Cl)cc(F)cc2Br)cn1	ZINC000160107082	531806116	/nfs/dbraw/zinc/80/61/16/531806116.db2.gz	NPPBRAZZFQVNNP-UHFFFAOYSA-N	-1	3	382.642	2.454	20	70		GEIDHM
CN(C)C[C@H](O)COc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1	ZINC000160106047	531806477	/nfs/dbraw/zinc/80/64/77/531806477.db2.gz	MIVHENXGPZWODB-HNNXBMFYSA-N	-1	3	384.885	2.442	20	70		GEIDHM
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)[N-]Cc1cccc(Cl)c1	ZINC000159995363	531801557	/nfs/dbraw/zinc/80/15/57/531801557.db2.gz	IDICMKWOVZBGJJ-UHFFFAOYSA-N	-1	3	389.260	2.336	20	70		GEIDHM
C[N-]S(=O)(=O)c1ccc(CNC(=O)Cc2c[nH]c3cc(F)ccc23)s1	ZINC000159507274	531784175	/nfs/dbraw/zinc/78/41/75/531784175.db2.gz	VBEWIORQRHYGGB-UHFFFAOYSA-N	-1	3	381.454	2.136	20	70		GEIDHM
C[C@H]1CC(=O)CC[C@H]1C(=O)N1CCC([N-]S(=O)(=O)c2cccs2)CC1	ZINC000159713133	531791977	/nfs/dbraw/zinc/79/19/77/531791977.db2.gz	AHQLIXPKICTFHD-SWLSCSKDSA-N	-1	3	384.523	2.023	20	70		GEIDHM
CN(C)C[C@H](O)COc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000160115729	531806877	/nfs/dbraw/zinc/80/68/77/531806877.db2.gz	YWWXLBBALNMWCR-HNNXBMFYSA-N	-1	3	384.885	2.442	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COc1ccc(F)cc1)c1cccc(Cl)c1F	ZINC000159994366	531802090	/nfs/dbraw/zinc/80/20/90/531802090.db2.gz	GAONQFDICKXNPR-LLVKDONJSA-N	-1	3	377.796	2.336	20	70		GEIDHM
Cc1cc(S(=O)(=O)[N-]c2ccc(OC[C@H](O)CN(C)C)cc2)c(C)s1	ZINC000160111341	531805437	/nfs/dbraw/zinc/80/54/37/531805437.db2.gz	KSGOMWXWLDHDBA-OAHLLOKOSA-N	-1	3	384.523	2.467	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COCC1CC1)c1ccc(Br)cc1Cl	ZINC000160671601	531814465	/nfs/dbraw/zinc/81/44/65/531814465.db2.gz	ZNVHATREBWYPOM-NSHDSACASA-N	-1	3	398.706	2.168	20	70		GEIDHM
C[C@@H](C[C@@H](O)c1ccccc1)NC(=O)CC[N-]S(=O)(=O)c1cccs1	ZINC000159459610	531781870	/nfs/dbraw/zinc/78/18/70/531781870.db2.gz	KLIDOEXOCRVVCZ-DZGCQCFKSA-N	-1	3	382.507	2.045	20	70		GEIDHM
O=C(CC[N-]S(=O)(=O)c1cccs1)NCCOc1ccccc1Cl	ZINC000159362215	531779857	/nfs/dbraw/zinc/77/98/57/531779857.db2.gz	OYCHDWBTDFCSAY-UHFFFAOYSA-N	-1	3	388.898	2.265	20	70		GEIDHM
O=S(=O)([N-]CCNc1nccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000159587878	531785274	/nfs/dbraw/zinc/78/52/74/531785274.db2.gz	RWDSORAMIODPCM-UHFFFAOYSA-N	-1	3	382.314	2.164	20	70		GEIDHM
C[N-]S(=O)(=O)c1ccc(CNC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)s1	ZINC000159672151	531789729	/nfs/dbraw/zinc/78/97/29/531789729.db2.gz	ABOIDZQSTPGOMN-AAEUAGOBSA-N	-1	3	386.445	2.354	20	70		GEIDHM
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)[N-]Cc1ccccc1Cl	ZINC000159995076	531801975	/nfs/dbraw/zinc/80/19/75/531801975.db2.gz	FLSDOYYKALGSAM-UHFFFAOYSA-N	-1	3	389.260	2.336	20	70		GEIDHM
C[C@H]1CC(=O)CC[C@@H]1C(=O)N1CCC([N-]S(=O)(=O)c2cccs2)CC1	ZINC000159712917	531792586	/nfs/dbraw/zinc/79/25/86/531792586.db2.gz	AHQLIXPKICTFHD-WFASDCNBSA-N	-1	3	384.523	2.023	20	70		GEIDHM
Cc1nc(-c2ccc(S(=O)(=O)[N-]CCCN3CCOCC3)s2)cs1	ZINC000160882375	531818526	/nfs/dbraw/zinc/81/85/26/531818526.db2.gz	CQGWXHYGVFVKFL-UHFFFAOYSA-N	-1	3	387.552	2.181	20	70		GEIDHM
CN1C[C@@H]([N-]S(=O)(=O)c2cc(Br)ccc2Cl)CCC1=O	ZINC000160058012	531804570	/nfs/dbraw/zinc/80/45/70/531804570.db2.gz	ZRZYBEWFXIXUSU-VIFPVBQESA-N	-1	3	381.679	2.002	20	70		GEIDHM
O=S(=O)([N-]C[C@@H](O)COCC1CC1)c1ccc(Cl)cc1C(F)(F)F	ZINC000160670122	531815101	/nfs/dbraw/zinc/81/51/01/531815101.db2.gz	KEKUBVJOYDKDCG-LLVKDONJSA-N	-1	3	387.807	2.425	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)c(F)c1)c1cccc(Cl)c1F	ZINC000161295752	531829614	/nfs/dbraw/zinc/82/96/14/531829614.db2.gz	NJYCCYQKMRMIIY-VIFPVBQESA-N	-1	3	395.786	2.476	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000161292201	531830550	/nfs/dbraw/zinc/83/05/50/531830550.db2.gz	ATQADRZPIKEYFW-JTQLQIEISA-N	-1	3	395.786	2.476	20	70		GEIDHM
O=C(c1sccc1S(=O)(=O)[N-]C1CCCCCC1)N1CCC[C@H](O)C1	ZINC000159931167	531800662	/nfs/dbraw/zinc/80/06/62/531800662.db2.gz	AFVURJJWSHYGDF-AWEZNQCLSA-N	-1	3	386.539	2.346	20	70		GEIDHM
C[C@H]([N-]S(=O)(=O)c1cccs1)C(=O)NCCc1cc2ccccc2[nH]1	ZINC000159630437	531787751	/nfs/dbraw/zinc/78/77/51/531787751.db2.gz	ZWZMLJCIKMJDRI-LBPRGKRZSA-N	-1	3	377.491	2.255	20	70		GEIDHM
C[C@@H](CO)C[N-]S(=O)(=O)c1csc(-c2ccc(Br)cc2)n1	ZINC000159734454	531792353	/nfs/dbraw/zinc/79/23/53/531792353.db2.gz	BXCVDBPYCQZTQD-SECBINFHSA-N	-1	3	391.312	2.479	20	70		GEIDHM
Cn1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2Br)cc1C(N)=O	ZINC000161115208	531823667	/nfs/dbraw/zinc/82/36/67/531823667.db2.gz	AVEHBYXEYKXCNG-UHFFFAOYSA-N	-1	3	392.662	2.341	20	70		GEIDHM
Cc1ccc(F)c(S(=O)(=O)[N-]C[C@H](O)COc2ccc(F)c(F)c2)c1	ZINC000161286270	531829306	/nfs/dbraw/zinc/82/93/06/531829306.db2.gz	JJBBKOPXUUBTMD-NSHDSACASA-N	-1	3	375.368	2.131	20	70		GEIDHM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]C2CCC(OC(C)C)CC2)s1	ZINC000159373865	531780587	/nfs/dbraw/zinc/78/05/87/531780587.db2.gz	LHYJWCRFCHFBHX-UHFFFAOYSA-N	-1	3	388.555	2.441	20	70		GEIDHM
C[C@@H]1C[C@H](C)CCN(S(=O)(=O)c2ccc([N-]S(C)(=O)=O)c(F)c2)C1	ZINC000159711498	531791788	/nfs/dbraw/zinc/79/17/88/531791788.db2.gz	XCIXHCNRUYYLMP-VXGBXAGGSA-N	-1	3	378.491	2.254	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COc1ccc(F)cc1)c1ccc(F)cc1Cl	ZINC000159990047	531802457	/nfs/dbraw/zinc/80/24/57/531802457.db2.gz	HDLJZXQIKVWCKA-LBPRGKRZSA-N	-1	3	377.796	2.336	20	70		GEIDHM
CCN1CCC([N-]S(=O)(=O)c2cc(F)c(Br)cc2F)CC1	ZINC000160016275	531802534	/nfs/dbraw/zinc/80/25/34/531802534.db2.gz	RKLBKOVXNDHPNH-UHFFFAOYSA-N	-1	3	383.258	2.490	20	70		GEIDHM
O=C(C[N-]S(=O)(=O)c1ccc(Cl)s1)N[C@H]1CCOC2(CCCC2)C1	ZINC000160001051	531802816	/nfs/dbraw/zinc/80/28/16/531802816.db2.gz	IUKDTDBVUWELPC-NSHDSACASA-N	-1	3	392.930	2.288	20	70		GEIDHM
O=C(NC1CC1)[C@@H]1CCCN1C(=O)NCc1ccc([O-])c(Br)c1	ZINC000160037823	531804021	/nfs/dbraw/zinc/80/40/21/531804021.db2.gz	BLOBIQVBLVAIAD-ZDUSSCGKSA-N	-1	3	382.258	2.107	20	70		GEIDHM
O=S(=O)([N-]C[C@H](O)COCC1CC1)c1ccc(Cl)cc1C(F)(F)F	ZINC000160669988	531815326	/nfs/dbraw/zinc/81/53/26/531815326.db2.gz	KEKUBVJOYDKDCG-NSHDSACASA-N	-1	3	387.807	2.425	20	70		GEIDHM
C[C@@]([N-]S(=O)(=O)c1ccc(Br)s1)(C(N)=O)c1ccccc1	ZINC000161229852	531828064	/nfs/dbraw/zinc/82/80/64/531828064.db2.gz	VSKISVAZKHTDOJ-ZDUSSCGKSA-N	-1	3	389.296	2.190	20	70		GEIDHM