smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC(=O)c1cccc(S(=O)(=O)[N-]c2cccc3c2C(=O)NC3)c1	ZINC000159877646	311347613	/nfs/dbraw/zinc/34/76/13/311347613.db2.gz	HFHXAVNDXPFINN-UHFFFAOYSA-N	-1	0	344.392	2.324	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1cc(Cl)ccn1	ZINC000160971471	311360627	/nfs/dbraw/zinc/36/06/27/311360627.db2.gz	BBVFMOMYZNJYIO-UHFFFAOYSA-N	-1	0	344.751	2.462	20	70		EEIDRM
CC1(C)C[C@]1(C(=O)[O-])C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1	ZINC001589220156	956763928	/nfs/dbraw/zinc/76/39/28/956763928.db2.gz	WPGKMNCXWDEXAM-CQSZACIVSA-N	-1	0	347.339	2.064	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CCC(Cn2ccnn2)CC1	ZINC000159523803	206250432	/nfs/dbraw/zinc/25/04/32/206250432.db2.gz	HZYNSQBUVONNMZ-UHFFFAOYSA-N	-1	0	338.770	2.329	20	70		EEIDRM
Cc1noc(C)c1C[C@@H](C)[N-]S(=O)(=O)c1c(F)cccc1F	ZINC000159884880	206268677	/nfs/dbraw/zinc/26/86/77/206268677.db2.gz	ZEZDLXXTKBYKCE-MRVPVSSYSA-N	-1	0	330.356	2.479	20	70		EEIDRM
O=S(=O)([N-]c1ccn(CC(F)(F)F)n1)c1ccc2c(c1)CCO2	ZINC000160253867	206286103	/nfs/dbraw/zinc/28/61/03/206286103.db2.gz	LVWPPTGVDYLRKQ-UHFFFAOYSA-N	-1	0	347.318	2.181	20	70		EEIDRM
Cc1cnccc1NS(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	ZINC000159716182	311345224	/nfs/dbraw/zinc/34/52/24/311345224.db2.gz	IYYJRQNBMWFKEY-UHFFFAOYSA-N	-1	0	331.397	2.421	20	70		EEIDRM
Cc1ccc(-c2nnc(NC(=O)Cc3cn4ccsc4n3)[n-]2)o1	ZINC000160183872	463322728	/nfs/dbraw/zinc/32/27/28/463322728.db2.gz	SPXVHSNVJDABLW-UHFFFAOYSA-N	-1	0	328.357	2.264	20	70		EEIDRM
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3n[nH]c(C)c3C)cc2C[C@H]1C	ZINC000160486662	311354669	/nfs/dbraw/zinc/35/46/69/311354669.db2.gz	YODJHPUHNZTPSU-SECBINFHSA-N	-1	0	348.428	2.125	20	70		EEIDRM
CCOc1ccccc1N1CCN(Cc2nc(CC)cc(=O)[nH]2)CC1	ZINC000160482332	311354763	/nfs/dbraw/zinc/35/47/63/311354763.db2.gz	OHPODTVXGJWAJV-UHFFFAOYSA-N	-1	0	342.443	2.466	20	70		EEIDRM
O=C([O-])CCCCNc1ccc([N+](=O)[O-])cc1CS(=O)(=O)F	ZINC001595047077	951442666	/nfs/dbraw/zinc/44/26/66/951442666.db2.gz	KRFSDHBIYXMRSR-UHFFFAOYSA-N	-1	0	334.325	2.061	20	70		EEIDRM
O=C([O-])Cc1ccccc1NC(=O)c1ccc(S(=O)(=O)F)cc1	ZINC001595136859	952059349	/nfs/dbraw/zinc/05/93/49/952059349.db2.gz	AIDWRVUWBOWOTP-UHFFFAOYSA-N	-1	0	337.328	2.224	20	70		EEIDRM
COc1ccccc1S(=O)(=O)[N-]c1ccn(CC(F)(F)F)n1	ZINC000160212665	311351253	/nfs/dbraw/zinc/35/12/53/311351253.db2.gz	ZSGGVXYEAULDLS-UHFFFAOYSA-N	-1	0	335.307	2.255	20	70		EEIDRM
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)cc1	ZINC000160656166	311356937	/nfs/dbraw/zinc/35/69/37/311356937.db2.gz	HLCRHONNMWNGNF-UHFFFAOYSA-N	-1	0	336.417	2.317	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]C[C@@H]1CCC[C@H](C)C1	ZINC000160885626	463379778	/nfs/dbraw/zinc/37/97/78/463379778.db2.gz	DTABZYIGGJJNNT-VHSXEESVSA-N	-1	0	332.447	2.034	20	70		EEIDRM
CCC(CC)(C(=O)[O-])C(=O)Nc1ccc(C)c(S(=O)(=O)F)c1	ZINC001589477976	954966294	/nfs/dbraw/zinc/96/62/94/954966294.db2.gz	UMPBEOSKMMECOD-UHFFFAOYSA-N	-1	0	331.365	2.483	20	70		EEIDRM
O=C([O-])CC1(C(=O)Nc2ccc(F)c(CS(=O)(=O)F)c2)CCC1	ZINC001574671702	962554623	/nfs/dbraw/zinc/55/46/23/962554623.db2.gz	UBDQCBONFDMLTB-UHFFFAOYSA-N	-1	0	347.339	2.209	20	70		EEIDRM
CC1(C)CCCC[C@@H]1CC(=O)Nc1nnc([N-]S(C)(=O)=O)s1	ZINC000160381011	463333442	/nfs/dbraw/zinc/33/34/42/463333442.db2.gz	KXINVEKDNLPXKN-SECBINFHSA-N	-1	0	346.478	2.455	20	70		EEIDRM
Cc1cccnc1[N-]S(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	ZINC000159653017	311344309	/nfs/dbraw/zinc/34/43/09/311344309.db2.gz	GFXPJWWFDSTGBP-UHFFFAOYSA-N	-1	0	331.397	2.421	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1ncc(C)s1	ZINC000160862346	311359552	/nfs/dbraw/zinc/35/95/52/311359552.db2.gz	FMIDLENMQLZDGL-UHFFFAOYSA-N	-1	0	330.362	2.178	20	70		EEIDRM
O=C([O-])c1ccc(/C=C/C(=O)Nc2ccc(S(=O)(=O)F)cc2)o1	ZINC001605667406	974065408	/nfs/dbraw/zinc/06/54/08/974065408.db2.gz	BTQORXQWNMLJIT-XBXARRHUSA-N	-1	0	339.300	2.288	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1ccnn1C(C)C	ZINC000160871198	206317050	/nfs/dbraw/zinc/31/70/50/206317050.db2.gz	FWGVRAYHHMYUKH-UHFFFAOYSA-N	-1	0	341.364	2.191	20	70		EEIDRM
O=S(=O)(NCc1ccccc1CO)c1cccc2c1N=S=N2	ZINC000159758456	311345484	/nfs/dbraw/zinc/34/54/84/311345484.db2.gz	REFRBYRXENOTEW-UHFFFAOYSA-N	-1	0	335.410	2.384	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2cn(CC(C)C)cn2)[nH]n1	ZINC000159955834	311348429	/nfs/dbraw/zinc/34/84/29/311348429.db2.gz	MWTIQFBONSFQLS-UHFFFAOYSA-N	-1	0	325.438	2.406	20	70		EEIDRM
Cc1cccc(N2N=C(C(=O)[N-]OCc3cccnc3)CCC2=O)c1	ZINC000160852346	463377523	/nfs/dbraw/zinc/37/75/23/463377523.db2.gz	WZTFMSGGOHLOHB-UHFFFAOYSA-N	-1	0	338.367	2.121	20	70		EEIDRM
CC[C@H](OC1CCCCC1)C(=O)[N-]S(=O)(=O)c1cccnc1	ZINC000161122899	463401710	/nfs/dbraw/zinc/40/17/10/463401710.db2.gz	AUNJNOXTDJGTMD-AWEZNQCLSA-N	-1	0	326.418	2.014	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1ccc(SC)cn1	ZINC000159615902	539516787	/nfs/dbraw/zinc/51/67/87/539516787.db2.gz	RQFPRKFRQWAZJY-UHFFFAOYSA-N	-1	0	340.474	2.463	20	70		EEIDRM
CS(=O)(=O)Cc1cc(F)ccc1[N-]S(=O)(=O)c1cccs1	ZINC000161054278	311361454	/nfs/dbraw/zinc/36/14/54/311361454.db2.gz	YABNVKZSIIMFIT-UHFFFAOYSA-N	-1	0	349.430	2.233	20	70		EEIDRM
CCS(=O)(=O)c1cccc(S(=O)(=O)[N-]c2ncc(C)s2)c1	ZINC000159497488	529170434	/nfs/dbraw/zinc/17/04/34/529170434.db2.gz	ISLWVIKIKOROKX-UHFFFAOYSA-N	-1	0	346.455	2.046	20	70		EEIDRM
O=C([O-])C1(CNc2ccc([N+](=O)[O-])cc2CS(=O)(=O)F)CCC1	ZINC001594880706	954429001	/nfs/dbraw/zinc/42/90/01/954429001.db2.gz	SSLQRRSGPAWQKL-UHFFFAOYSA-N	-1	0	346.336	2.061	20	70		EEIDRM
Cc1ccc(NC(=O)[C@@]2(C(=O)[O-])CC2(C)C)cc1S(=O)(=O)F	ZINC001574374292	961080127	/nfs/dbraw/zinc/08/01/27/961080127.db2.gz	QLSIUCQCCHQLQZ-CQSZACIVSA-N	-1	0	329.349	2.093	20	70		EEIDRM
Cc1ccc(F)c(OCC(=O)Nc2cccc(-c3nc(=O)o[n-]3)c2)c1	ZINC000161398202	539527809	/nfs/dbraw/zinc/52/78/09/539527809.db2.gz	VIXPOYLLIPUBSZ-UHFFFAOYSA-N	-1	0	343.314	2.495	20	70		EEIDRM
C[C@@H](OC1CCCCCC1)C(=O)[N-]S(=O)(=O)c1cccnc1	ZINC000161124264	463401871	/nfs/dbraw/zinc/40/18/71/463401871.db2.gz	QDWQIKPQLMBVCL-GFCCVEGCSA-N	-1	0	326.418	2.014	20	70		EEIDRM
C[C@@H]([N-]S(=O)(=O)c1nc2ccccc2s1)C(=O)OC(C)(C)C	ZINC000218266750	464108569	/nfs/dbraw/zinc/10/85/69/464108569.db2.gz	ODHNZJNEQIICNN-SECBINFHSA-N	-1	0	342.442	2.305	20	70		EEIDRM
O=C([O-])[C@@]1(C(=O)Nc2cccc(S(=O)(=O)F)c2)CC=CCC1	ZINC001594877771	954391910	/nfs/dbraw/zinc/39/19/10/954391910.db2.gz	LZRUMPLUNAOPQY-AWEZNQCLSA-N	-1	0	327.333	2.094	20	70		EEIDRM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)cc1C	ZINC000160654428	463359316	/nfs/dbraw/zinc/35/93/16/463359316.db2.gz	HCSGZBQMAGFWGH-UHFFFAOYSA-N	-1	0	337.401	2.429	20	70		EEIDRM
Cc1cc(S(=O)(=O)F)ccc1C(=O)NC[C@H](CC(C)C)C(=O)[O-]	ZINC001594328376	958194061	/nfs/dbraw/zinc/19/40/61/958194061.db2.gz	PMDXBDOOUIOIEJ-NSHDSACASA-N	-1	0	345.392	2.130	20	70		EEIDRM
CC(C)[C@H](CNc1ccc([N+](=O)[O-])cc1CS(=O)(=O)F)C(=O)[O-]	ZINC001588831332	961726433	/nfs/dbraw/zinc/72/64/33/961726433.db2.gz	VZKNZMFBAKOOFV-NSHDSACASA-N	-1	0	348.352	2.163	20	70		EEIDRM
O=C([O-])[C@@]1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CC=CCC1	ZINC001574632803	962302519	/nfs/dbraw/zinc/30/25/19/962302519.db2.gz	BSHDVMTYUGGWEF-AWEZNQCLSA-N	-1	0	327.333	2.094	20	70		EEIDRM
Cc1ccc(NC(=O)[C@@H](C(=O)[O-])C2CCCC2)cc1S(=O)(=O)F	ZINC001605288572	973095652	/nfs/dbraw/zinc/09/56/52/973095652.db2.gz	YKCHSMBPUXYQCP-ZDUSSCGKSA-N	-1	0	343.376	2.483	20	70		EEIDRM
CCC[C@@](C)(NC(=O)CCc1ccc(S(=O)(=O)F)cc1)C(=O)[O-]	ZINC001595547619	981421441	/nfs/dbraw/zinc/42/14/41/981421441.db2.gz	RYUGRFPJDOKELJ-OAHLLOKOSA-N	-1	0	345.392	2.037	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1ccc(Cl)cn1	ZINC000160908397	311359744	/nfs/dbraw/zinc/35/97/44/311359744.db2.gz	IWGHNOZBQFQYMF-UHFFFAOYSA-N	-1	0	344.751	2.462	20	70		EEIDRM
CC(C)n1cc(NC(=O)NCCCNC(=O)c2cccc(O)c2)cn1	ZINC000161508281	311367050	/nfs/dbraw/zinc/36/70/50/311367050.db2.gz	PODQECFLZMXKFL-UHFFFAOYSA-N	-1	0	345.403	2.111	20	70		EEIDRM
COc1ccsc1S(=O)(=O)[N-]c1ccn(CC(F)(F)F)n1	ZINC000160261701	225373179	/nfs/dbraw/zinc/37/31/79/225373179.db2.gz	UDZVYTBJSVLRPL-UHFFFAOYSA-N	-1	0	341.336	2.316	20	70		EEIDRM
CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3cc(C(C)C)[nH]n3)ccc21	ZINC000160657183	463359744	/nfs/dbraw/zinc/35/97/44/463359744.db2.gz	JQIZOQZMANIDRX-UHFFFAOYSA-N	-1	0	348.428	2.243	20	70		EEIDRM
Cc1cncc([N-]S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c1	ZINC000159787375	311346089	/nfs/dbraw/zinc/34/60/89/311346089.db2.gz	PVEWOSCTGVSMSB-UHFFFAOYSA-N	-1	0	331.397	2.421	20	70		EEIDRM
C[C@@H](NC(=O)c1nn(-c2ccc(F)cc2)cc1[O-])C(=O)OC(C)(C)C	ZINC000160109608	463318667	/nfs/dbraw/zinc/31/86/67/463318667.db2.gz	XGMVUSHNEPQRHI-SNVBAGLBSA-N	-1	0	349.362	2.177	20	70		EEIDRM
CC(C)(C)c1cnc(S([O-])=CC(=O)NCC(F)(F)F)s1	ZINC000160602598	463353673	/nfs/dbraw/zinc/35/36/73/463353673.db2.gz	APYRZBOLSINZJZ-HXUWFJFHSA-N	-1	0	328.381	2.227	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]C[C@H]1CCC[C@@H](C)C1	ZINC000160885222	463378922	/nfs/dbraw/zinc/37/89/22/463378922.db2.gz	DTABZYIGGJJNNT-ZJUUUORDSA-N	-1	0	332.447	2.034	20	70		EEIDRM
Cc1noc(C)c1S(=O)(=O)[N-]C(=O)[C@H](C)OC1CCCCCC1	ZINC000161088852	463399093	/nfs/dbraw/zinc/39/90/93/463399093.db2.gz	WXNMQDYJEMWCJB-LBPRGKRZSA-N	-1	0	344.433	2.224	20	70		EEIDRM
O=C([O-])[C@@H](C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1)C1CCCC1	ZINC001574616950	962228791	/nfs/dbraw/zinc/22/87/91/962228791.db2.gz	MBGLCKADXYZWHT-GFCCVEGCSA-N	-1	0	347.339	2.313	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1nnc(C(C)C)s1	ZINC000159652236	539518105	/nfs/dbraw/zinc/51/81/05/539518105.db2.gz	XVCYNPNFIIJMHN-UHFFFAOYSA-N	-1	0	343.478	2.321	20	70		EEIDRM
CC[C@@H](c1nnc([N-]S(=O)(=O)CCOC)s1)c1ccccc1	ZINC000160034296	311349367	/nfs/dbraw/zinc/34/93/67/311349367.db2.gz	ZDMVUBDVURXDIM-GFCCVEGCSA-N	-1	0	341.458	2.468	20	70		EEIDRM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)s1	ZINC000160647080	463358677	/nfs/dbraw/zinc/35/86/77/463358677.db2.gz	KTGCZMSFVCUXJW-UHFFFAOYSA-N	-1	0	329.403	2.182	20	70		EEIDRM
C[C@H]1CC[C@@](NC(=O)c2ccc(S(=O)(=O)F)cc2)(C(=O)[O-])CC1	ZINC001599907387	984941345	/nfs/dbraw/zinc/94/13/45/984941345.db2.gz	DCBXAHVYULZKJE-LGZQZNNBSA-N	-1	0	343.376	2.108	20	70		EEIDRM
C[C@H](OC1CCCCCC1)C(=O)[N-]S(=O)(=O)c1cccnc1	ZINC000161124144	463402171	/nfs/dbraw/zinc/40/21/71/463402171.db2.gz	QDWQIKPQLMBVCL-LBPRGKRZSA-N	-1	0	326.418	2.014	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1ccc(SC)nc1	ZINC000159601458	539516717	/nfs/dbraw/zinc/51/67/17/539516717.db2.gz	MYOMWHRBGHKENC-UHFFFAOYSA-N	-1	0	340.474	2.463	20	70		EEIDRM
Cc1nc(CC(=O)Nc2cccc(-c3nc(=O)o[n-]3)c2)c(C)s1	ZINC000161397361	539527690	/nfs/dbraw/zinc/52/76/90/539527690.db2.gz	QSXFVZGIQVEMHY-UHFFFAOYSA-N	-1	0	330.369	2.284	20	70		EEIDRM
COc1ccc(Cl)c(S(=O)(=O)NCc2ccccc2CO)c1	ZINC000159751567	311345501	/nfs/dbraw/zinc/34/55/01/311345501.db2.gz	RNYPVXZUFMMNAD-UHFFFAOYSA-N	-1	0	341.816	2.319	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1nc(C)cs1	ZINC000160853477	311359249	/nfs/dbraw/zinc/35/92/49/311359249.db2.gz	VJGYDRCPLIRLOB-UHFFFAOYSA-N	-1	0	330.362	2.178	20	70		EEIDRM
N#Cc1ccccc1S(=O)(=O)[N-]c1cccc(S(=O)(=O)F)c1	ZINC000490536429	270021106	/nfs/dbraw/zinc/02/11/06/270021106.db2.gz	LQFOVFNFFFCENV-UHFFFAOYSA-N	-1	0	340.357	2.017	20	70		EEIDRM
Cc1cccc(C(=O)N[C@H](C(=O)[N-]OCc2cccnc2)C(C)C)c1	ZINC000160849237	463376371	/nfs/dbraw/zinc/37/63/71/463376371.db2.gz	GIMDUEFHGRZUIW-KRWDZBQOSA-N	-1	0	341.411	2.392	20	70		EEIDRM
CC(C)n1nccc1[N-]S(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	ZINC000159513368	311342564	/nfs/dbraw/zinc/34/25/64/311342564.db2.gz	PGKWRQOTXCIURN-UHFFFAOYSA-N	-1	0	348.428	2.495	20	70		EEIDRM
Cc1cc(S(=O)(=O)F)ccc1C(=O)NC[C@@H](CC(C)C)C(=O)[O-]	ZINC001594328375	958194227	/nfs/dbraw/zinc/19/42/27/958194227.db2.gz	PMDXBDOOUIOIEJ-LLVKDONJSA-N	-1	0	345.392	2.130	20	70		EEIDRM
CC(C)(C)CC[C@H](NC(=O)c1cccc(S(=O)(=O)F)c1)C(=O)[O-]	ZINC001588648743	959750501	/nfs/dbraw/zinc/75/05/01/959750501.db2.gz	QKVUAVKAFCYYAW-LBPRGKRZSA-N	-1	0	345.392	2.354	20	70		EEIDRM
CC(C)c1nc(S(=O)(=O)[N-]c2ccn(CC(F)(F)F)n2)c[nH]1	ZINC000160222999	539520667	/nfs/dbraw/zinc/52/06/67/539520667.db2.gz	YRICECRDDPOBHZ-UHFFFAOYSA-N	-1	0	337.327	2.093	20	70		EEIDRM
CC(C)(C)c1cnc(S([O-])=CC(=O)NCC(F)(F)F)s1	ZINC000160602716	463354108	/nfs/dbraw/zinc/35/41/08/463354108.db2.gz	APYRZBOLSINZJZ-FQEVSTJZSA-N	-1	0	328.381	2.227	20	70		EEIDRM
O=C([O-])c1ccsc1NC(=O)c1ccc(S(=O)(=O)F)cc1	ZINC001594821698	953904614	/nfs/dbraw/zinc/90/46/14/953904614.db2.gz	CHALOVXLJFBDMN-UHFFFAOYSA-N	-1	0	329.330	2.357	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1ccc(OC)nc1C	ZINC000159672232	539517893	/nfs/dbraw/zinc/51/78/93/539517893.db2.gz	LKAKAXYQAFYLGR-UHFFFAOYSA-N	-1	0	338.433	2.058	20	70		EEIDRM
O=S(=O)([N-]c1ccn(CC(F)(F)F)n1)c1c[nH]c2ncccc12	ZINC000160218275	311351469	/nfs/dbraw/zinc/35/14/69/311351469.db2.gz	FVSYRJKNFDLEGL-UHFFFAOYSA-N	-1	0	345.306	2.123	20	70		EEIDRM
C[C@H]1Cc2cc(S(=O)(=O)[N-]c3nncs3)cc(Cl)c2O1	ZINC000160557196	463349291	/nfs/dbraw/zinc/34/92/91/463349291.db2.gz	NLTOVWYRGAWEEP-LURJTMIESA-N	-1	0	331.806	2.316	20	70		EEIDRM
CC(C)(C)c1cnc(S([O-])=CC(=O)NCc2ccco2)s1	ZINC000160488718	463342393	/nfs/dbraw/zinc/34/23/93/463342393.db2.gz	XMBZQMSHTZCBBL-NRFANRHFSA-N	-1	0	326.443	2.458	20	70		EEIDRM
CC(C)c1cc([N-]S(=O)(=O)c2cccc(C(=O)N(C)C)c2)n[nH]1	ZINC000160657892	463360617	/nfs/dbraw/zinc/36/06/17/463360617.db2.gz	HCVFENKIGYXNIA-UHFFFAOYSA-N	-1	0	336.417	2.036	20	70		EEIDRM
Cc1cc(S(=O)(=O)F)ccc1C(=O)NC1(C(=O)[O-])CCCCC1	ZINC001600294254	970794039	/nfs/dbraw/zinc/79/40/39/970794039.db2.gz	WURMMOHTPZHVIX-UHFFFAOYSA-N	-1	0	343.376	2.171	20	70		EEIDRM
CCC(CC)(CC(=O)[O-])NC(=O)c1ccc(S(=O)(=O)F)cc1	ZINC001595053128	979284447	/nfs/dbraw/zinc/28/44/47/979284447.db2.gz	AVJPNAFTSWBGOU-UHFFFAOYSA-N	-1	0	331.365	2.108	20	70		EEIDRM
CCc1cnc([N-]S(=O)(=O)c2c(CC)nn(C)c2CC)s1	ZINC000159627961	539516805	/nfs/dbraw/zinc/51/68/05/539516805.db2.gz	LZELDYVFVOEOFV-UHFFFAOYSA-N	-1	0	328.463	2.365	20	70		EEIDRM
N#Cc1cccc([N-]S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)c1	ZINC000490536338	268282762	/nfs/dbraw/zinc/28/27/62/268282762.db2.gz	ILELFQILTSJUSX-UHFFFAOYSA-N	-1	0	340.357	2.017	20	70		EEIDRM
CCC(CC)(CNC(=O)c1ccc(S(=O)(=O)F)cc1C)C(=O)[O-]	ZINC001603540176	973595146	/nfs/dbraw/zinc/59/51/46/973595146.db2.gz	VEHXBRHTFUZTKG-UHFFFAOYSA-N	-1	0	345.392	2.274	20	70		EEIDRM
O=C([O-])c1ccc(/C=C\C(=O)Nc2ccc(S(=O)(=O)F)cc2)o1	ZINC001605667408	974065372	/nfs/dbraw/zinc/06/53/72/974065372.db2.gz	BTQORXQWNMLJIT-YWEYNIOJSA-N	-1	0	339.300	2.288	20	70		EEIDRM
CNS(=O)(=O)c1cc(C(=O)Nc2ccc(C(F)(F)F)cc2)co1	ZINC000160574860	311356112	/nfs/dbraw/zinc/35/61/12/311356112.db2.gz	KEDSHDRDLHJFIP-UHFFFAOYSA-N	-1	0	348.302	2.459	20	70		EEIDRM
CC(C)(C)c1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2CCCOC2)s1	ZINC000160493045	463342633	/nfs/dbraw/zinc/34/26/33/463342633.db2.gz	VCHAXEOZZXBFRZ-SNVBAGLBSA-N	-1	0	331.459	2.277	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1cc(C(C)C)[nH]n1	ZINC000159662486	539517555	/nfs/dbraw/zinc/51/75/55/539517555.db2.gz	FKXAFJQOJPEOEQ-UHFFFAOYSA-N	-1	0	325.438	2.192	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CC(=O)N[C@@H]2CCCC[C@@H]21	ZINC000160580579	304493014	/nfs/dbraw/zinc/49/30/14/304493014.db2.gz	UNSLHNDIGKUWFZ-NEPJUHHUSA-N	-1	0	326.755	2.068	20	70		EEIDRM
N#Cc1ccc([N-]S(=O)(=O)c2ccc(S(=O)(=O)F)cc2)cc1	ZINC000490537173	270021026	/nfs/dbraw/zinc/02/10/26/270021026.db2.gz	OXXYECQAWLGMRB-UHFFFAOYSA-N	-1	0	340.357	2.017	20	70		EEIDRM
Cc1cc(C(=O)[O-])cc(C(=O)Nc2ncc(S(=O)(=O)F)s2)c1	ZINC001605141039	972816598	/nfs/dbraw/zinc/81/65/98/972816598.db2.gz	QLQWJONXGHFDPR-UHFFFAOYSA-N	-1	0	344.345	2.060	20	70		EEIDRM
Cc1cc(NC(=O)c2nn(-c3ccc(F)cc3C)cc2[O-])c[nH]c1=O	ZINC000159577510	311342903	/nfs/dbraw/zinc/34/29/03/311342903.db2.gz	XPCHWVGWCFMOOR-UHFFFAOYSA-N	-1	0	342.330	2.274	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]C[C@H]1CCC[C@H](C)C1	ZINC000160885346	463379670	/nfs/dbraw/zinc/37/96/70/463379670.db2.gz	DTABZYIGGJJNNT-UWVGGRQHSA-N	-1	0	332.447	2.034	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]C1(C)CCC(C)CC1	ZINC000161058846	463396637	/nfs/dbraw/zinc/39/66/37/463396637.db2.gz	KNFVDFYURKTCFM-UHFFFAOYSA-N	-1	0	332.447	2.177	20	70		EEIDRM
CC(C)(C)c1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2CCCCO2)s1	ZINC000160487651	255798010	/nfs/dbraw/zinc/79/80/10/255798010.db2.gz	KBOPUCNTVHQRRH-JTQLQIEISA-N	-1	0	331.459	2.420	20	70		EEIDRM
CC(C)(C)[C@@H](C(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1	ZINC001588633214	959627252	/nfs/dbraw/zinc/62/72/52/959627252.db2.gz	DRJUDNLZHZJZIA-SNVBAGLBSA-N	-1	0	335.328	2.169	20	70		EEIDRM
CNS(=O)(=O)c1cc(-c2nc(-c3ccc(F)c(F)c3)no2)co1	ZINC000161472407	311366676	/nfs/dbraw/zinc/36/66/76/311366676.db2.gz	YBRJGUDHGFSSOE-UHFFFAOYSA-N	-1	0	341.295	2.183	20	70		EEIDRM
CN(Cc1nc(=O)c2sccc2[n-]1)c1ncnc2c1CCCC2	ZINC000160563596	463350044	/nfs/dbraw/zinc/35/00/44/463350044.db2.gz	MHJHXZUGIBYWOG-UHFFFAOYSA-N	-1	0	327.413	2.290	20	70		EEIDRM
O=S(=O)(NCCSCCCO)c1cc(Cl)cc(Cl)c1	ZINC000161324491	463421085	/nfs/dbraw/zinc/42/10/85/463421085.db2.gz	YSICDCHZXBNTSJ-UHFFFAOYSA-N	-1	0	344.285	2.387	20	70		EEIDRM
C[C@@]1(NC(=O)c2cccc(S(=O)(=O)F)c2)CCCC[C@H]1C(=O)[O-]	ZINC001594056043	997793395	/nfs/dbraw/zinc/79/33/95/997793395.db2.gz	MZJXGYBHGOHJSP-SWLSCSKDSA-N	-1	0	343.376	2.108	20	70		EEIDRM
O=S(=O)([N-]c1nnc(C(F)F)s1)c1ccc2c(c1)CCO2	ZINC000160484395	206300767	/nfs/dbraw/zinc/30/07/67/206300767.db2.gz	NPBNUKBBMJKYDS-UHFFFAOYSA-N	-1	0	333.341	2.211	20	70		EEIDRM
CCC[C@H](CC)NS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O	ZINC000161469870	206349176	/nfs/dbraw/zinc/34/91/76/206349176.db2.gz	BGWTXSSVTAYBSB-NSHDSACASA-N	-1	0	348.852	2.061	20	70		EEIDRM
O=C([O-])[C@H](C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1)C1CCCC1	ZINC001574616952	962229121	/nfs/dbraw/zinc/22/91/21/962229121.db2.gz	MBGLCKADXYZWHT-LBPRGKRZSA-N	-1	0	347.339	2.313	20	70		EEIDRM
CCC(CC)(NS(=O)(=O)c1cc(Cl)cc(Cl)c1)C(N)=O	ZINC000161219850	463411861	/nfs/dbraw/zinc/41/18/61/463411861.db2.gz	JRSBZXMXJFEXOB-UHFFFAOYSA-N	-1	0	339.244	2.316	20	70		EEIDRM
C[C@@H](CC(=O)[O-])SC(F)(F)COS(=O)(=O)C(F)(F)F	ZINC001592420729	978030605	/nfs/dbraw/zinc/03/06/05/978030605.db2.gz	FZMXNEBFORSSJR-BYPYZUCNSA-N	-1	0	332.268	2.042	20	70		EEIDRM
CCC(CC)(CC(=O)[O-])NC(=O)Cc1ccc(S(=O)(=O)F)cc1	ZINC001595050865	979281509	/nfs/dbraw/zinc/28/15/09/979281509.db2.gz	FVCGDMFNWBMNFA-UHFFFAOYSA-N	-1	0	345.392	2.037	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2cc(C(=O)OC)c(C)o2)[nH]n1	ZINC000159964737	206272633	/nfs/dbraw/zinc/27/26/33/206272633.db2.gz	QWCMETDMPVHFQP-UHFFFAOYSA-N	-1	0	341.389	2.241	20	70		EEIDRM
O=C([O-])[C@@]1(C(=O)Nc2ccc(S(=O)(=O)F)c(F)c2)CC=CCC1	ZINC001605937691	972882648	/nfs/dbraw/zinc/88/26/48/972882648.db2.gz	JZELIGYXHDUYFR-AWEZNQCLSA-N	-1	0	345.323	2.234	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]CC[C@@H]1C[C@H]2CC[C@@H]1C2	ZINC000160850088	206316438	/nfs/dbraw/zinc/31/64/38/206316438.db2.gz	HUTWLHGVDBOXTD-HBNTYKKESA-N	-1	0	344.458	2.034	20	70		EEIDRM
COCCc1noc(CN(C)C(=O)c2cc(F)cc(Cl)c2[O-])n1	ZINC000160612346	206305675	/nfs/dbraw/zinc/30/56/75/206305675.db2.gz	SWTDRFCLHCTKKS-UHFFFAOYSA-N	-1	0	343.742	2.029	20	70		EEIDRM
COC(=O)c1ccc(OCc2ccccc2)c([N-]S(C)(=O)=O)c1	ZINC000217762712	485531256	/nfs/dbraw/zinc/53/12/56/485531256.db2.gz	DMOYDERCJRMAFM-UHFFFAOYSA-N	-1	0	335.381	2.424	20	70		EEIDRM
CC(C)(C)[C@H](C(=O)[O-])C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1	ZINC001573391719	958705411	/nfs/dbraw/zinc/70/54/11/958705411.db2.gz	XBCMBZIOJYEALJ-NSHDSACASA-N	-1	0	349.355	2.310	20	70		EEIDRM
C[C@]1(NC(=O)c2cccc(S(=O)(=O)F)c2)CCCC[C@H]1C(=O)[O-]	ZINC001594056044	997793695	/nfs/dbraw/zinc/79/36/95/997793695.db2.gz	MZJXGYBHGOHJSP-WFASDCNBSA-N	-1	0	343.376	2.108	20	70		EEIDRM
CCC[C@@H](CC)NS(=O)(=O)c1cc(Cl)ccc1OCC(N)=O	ZINC000161469768	206350334	/nfs/dbraw/zinc/35/03/34/206350334.db2.gz	BGWTXSSVTAYBSB-LLVKDONJSA-N	-1	0	348.852	2.061	20	70		EEIDRM
O=C([N-]OCc1cccnc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000160863345	463377343	/nfs/dbraw/zinc/37/73/43/463377343.db2.gz	WYGDQMCZLSJGSN-CQSZACIVSA-N	-1	0	345.424	2.386	20	70		EEIDRM
CCCCN1CCc2ccc([N-]S(=O)(=O)c3cnn(C)c3)cc21	ZINC000160203690	528486994	/nfs/dbraw/zinc/48/69/94/528486994.db2.gz	DYRMUGLGCRMVRT-UHFFFAOYSA-N	-1	0	334.445	2.384	20	70		EEIDRM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2n[nH]c(C)c2C)cc1Cl	ZINC000160477602	311354633	/nfs/dbraw/zinc/35/46/33/311354633.db2.gz	MWVLIIJLEOWYCS-UHFFFAOYSA-N	-1	0	342.808	2.439	20	70		EEIDRM
CCCOc1cc(F)ccc1[N-]S(=O)(=O)c1cn(C)c(C)n1	ZINC000161290073	463417188	/nfs/dbraw/zinc/41/71/88/463417188.db2.gz	VHXLHOMUVRKGOX-UHFFFAOYSA-N	-1	0	327.381	2.457	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2ccc(C(=O)OC)s2)n[nH]1	ZINC000159943276	529016669	/nfs/dbraw/zinc/01/66/69/529016669.db2.gz	ZRNOUNWIZGTZIF-UHFFFAOYSA-N	-1	0	343.430	2.401	20	70		EEIDRM
C[C@@H]1CC[C@H](C(=O)[O-])N1C(=O)c1ccc(S(=O)(=O)F)cc1Cl	ZINC001594218435	959351096	/nfs/dbraw/zinc/35/10/96/959351096.db2.gz	XFTARCZZQKCTTO-RDDDGLTNSA-N	-1	0	349.767	2.076	20	70		EEIDRM
CC(C)(C)CC[C@@H](NC(=O)c1cccc(S(=O)(=O)F)c1)C(=O)[O-]	ZINC001588648737	959750716	/nfs/dbraw/zinc/75/07/16/959750716.db2.gz	QKVUAVKAFCYYAW-GFCCVEGCSA-N	-1	0	345.392	2.354	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1cc(C(C)C)[nH]n1	ZINC000160651050	463358857	/nfs/dbraw/zinc/35/88/57/463358857.db2.gz	FXRGQNLLLAFQCQ-UHFFFAOYSA-N	-1	0	341.364	2.260	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]CC[C@H]1C[C@H]2CC[C@@H]1C2	ZINC000160850206	463375765	/nfs/dbraw/zinc/37/57/65/463375765.db2.gz	HUTWLHGVDBOXTD-AXFHLTTASA-N	-1	0	344.458	2.034	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2cccc(C(=O)OC)c2)n[nH]1	ZINC000159933735	529016910	/nfs/dbraw/zinc/01/69/10/529016910.db2.gz	NIFDGQZRIXNNAO-UHFFFAOYSA-N	-1	0	337.401	2.340	20	70		EEIDRM
CC1(C)C[C@@]1(C(=O)[O-])C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1	ZINC001589220155	956764260	/nfs/dbraw/zinc/76/42/60/956764260.db2.gz	WPGKMNCXWDEXAM-AWEZNQCLSA-N	-1	0	347.339	2.064	20	70		EEIDRM
Cc1ccc(NC(=O)C2(C(=O)[O-])CC=CC2)cc1S(=O)(=O)F	ZINC001605288110	973088907	/nfs/dbraw/zinc/08/89/07/973088907.db2.gz	BHFGVIZBLOFOKZ-UHFFFAOYSA-N	-1	0	327.333	2.013	20	70		EEIDRM
CC(=O)N1CCCc2cc(S(=O)(=O)[N-]c3n[nH]c(C)c3C)ccc21	ZINC000160478066	539522298	/nfs/dbraw/zinc/52/22/98/539522298.db2.gz	RJQDKLBITBBDAE-UHFFFAOYSA-N	-1	0	348.428	2.126	20	70		EEIDRM
CCCCCN(C(=O)c1c[nH]c2nc(=O)[n-]c(=O)c-2c1)[C@@H](C)CCC	ZINC000161299940	463418143	/nfs/dbraw/zinc/41/81/43/463418143.db2.gz	ZPJBOVQKUYAKGG-LBPRGKRZSA-N	-1	0	346.431	2.432	20	70		EEIDRM
CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ncc(C(N)=O)s2)s1	ZINC000160318074	526788734	/nfs/dbraw/zinc/78/87/34/526788734.db2.gz	QWERYXFMMYEBCK-UHFFFAOYSA-N	-1	0	345.471	2.402	20	70		EEIDRM
O=C([O-])C1(NC(=O)c2cccc(S(=O)(=O)F)c2)CCCCCC1	ZINC001605736656	972378756	/nfs/dbraw/zinc/37/87/56/972378756.db2.gz	YIDWOUZXEHZMJX-UHFFFAOYSA-N	-1	0	343.376	2.252	20	70		EEIDRM
CC(C)(CCNc1ccc([N+](=O)[O-])cc1CS(=O)(=O)F)C(=O)[O-]	ZINC001590693513	990408746	/nfs/dbraw/zinc/40/87/46/990408746.db2.gz	QTSVENNNFAHEDC-UHFFFAOYSA-N	-1	0	348.352	2.307	20	70		EEIDRM
CCc1ccc(S(=O)(=O)[N-]c2cnn(CCOC)c2)cc1CC	ZINC000160057076	529699026	/nfs/dbraw/zinc/69/90/26/529699026.db2.gz	QYCCSMRUGNNVOO-UHFFFAOYSA-N	-1	0	337.445	2.455	20	70		EEIDRM
CC(C)Oc1cncc(C(=O)Nc2cccc(-c3nc(=O)o[n-]3)c2)c1	ZINC000161395183	539526663	/nfs/dbraw/zinc/52/66/63/539526663.db2.gz	DSAMANIQJYXBEI-UHFFFAOYSA-N	-1	0	340.339	2.464	20	70		EEIDRM
O=S(=O)([N-][C@H]1c2ccccc2C[C@H]1O)c1c(F)cc(F)cc1F	ZINC000159865336	463307996	/nfs/dbraw/zinc/30/79/96/463307996.db2.gz	MHSXOXUOGMKRIR-KGLIPLIRSA-N	-1	0	343.326	2.041	20	70		EEIDRM
CC(C)n1cc(S(=O)(=O)[N-]c2ccn(CC(F)(F)F)n2)cn1	ZINC000160209733	528575359	/nfs/dbraw/zinc/57/53/59/528575359.db2.gz	FVDPVLRVSMAPKS-UHFFFAOYSA-N	-1	0	337.327	2.024	20	70		EEIDRM
C=C(C)C[C@H](NC(=O)c1cc(S(=O)(=O)F)ccc1Cl)C(=O)[O-]	ZINC001588546458	983615430	/nfs/dbraw/zinc/61/54/30/983615430.db2.gz	LRQKSZHCZWFCLC-NSHDSACASA-N	-1	0	349.767	2.147	20	70		EEIDRM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1O[C@H]1CCOC1	ZINC000161046482	225535547	/nfs/dbraw/zinc/53/55/47/225535547.db2.gz	ZUVZOYQAHCVHSA-LBPRGKRZSA-N	-1	0	338.385	2.260	20	70		EEIDRM
Cc1cc(S(=O)(=O)F)ccc1C(=O)N1CCCC[C@@H]1CC(=O)[O-]	ZINC001594328061	958191078	/nfs/dbraw/zinc/19/10/78/958191078.db2.gz	IAURSOUYFZPTDP-LLVKDONJSA-N	-1	0	343.376	2.123	20	70		EEIDRM
Cc1ccc(NC(=O)C2(CC(=O)[O-])CCC2)cc1S(=O)(=O)F	ZINC001605288183	973090568	/nfs/dbraw/zinc/09/05/68/973090568.db2.gz	GIBYSQMAZNLJPC-UHFFFAOYSA-N	-1	0	329.349	2.237	20	70		EEIDRM
CCC[C@](C)(NC(=O)CCc1ccc(S(=O)(=O)F)cc1)C(=O)[O-]	ZINC001595547617	981421656	/nfs/dbraw/zinc/42/16/56/981421656.db2.gz	RYUGRFPJDOKELJ-HNNXBMFYSA-N	-1	0	345.392	2.037	20	70		EEIDRM
Cc1nccc(NC(=O)NCCNC(=O)c2ccc(O)cc2)c1Cl	ZINC000159970728	539519771	/nfs/dbraw/zinc/51/97/71/539519771.db2.gz	NTTZHJBRYHYGDP-UHFFFAOYSA-N	-1	0	348.790	2.301	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CCO[C@H]([C@@H]2CCCO2)C1	ZINC000159408588	463284509	/nfs/dbraw/zinc/28/45/09/463284509.db2.gz	YSIJQJGBEQGARH-STQMWFEESA-N	-1	0	329.755	2.205	20	70		EEIDRM
O=C(c1cc(-c2ccccc2)cc(Cl)c1[O-])N1CCNC(=O)C1	ZINC000160211309	534654663	/nfs/dbraw/zinc/65/46/63/534654663.db2.gz	LTMNDWWRJAKXLH-UHFFFAOYSA-N	-1	0	330.771	2.285	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1cc(Cl)ccn1	ZINC000159641864	539517486	/nfs/dbraw/zinc/51/74/86/539517486.db2.gz	NLTBUKIOMXMABP-UHFFFAOYSA-N	-1	0	328.825	2.394	20	70		EEIDRM
CC(C)(C)c1ccc(S(=O)(=O)[N-]C(=O)[C@H]2CCCOC2)s1	ZINC000160493162	255797677	/nfs/dbraw/zinc/79/76/77/255797677.db2.gz	VCHAXEOZZXBFRZ-JTQLQIEISA-N	-1	0	331.459	2.277	20	70		EEIDRM
Cc1cc(F)ccc1-n1cc([O-])c(C(=O)N[C@H](CO)CC(C)C)n1	ZINC000160681146	311357492	/nfs/dbraw/zinc/35/74/92/311357492.db2.gz	GHLGLJIXPLXYSY-ZDUSSCGKSA-N	-1	0	335.379	2.162	20	70		EEIDRM
O=S(=O)(NCCSCCCO)c1cc(Cl)ccc1Cl	ZINC000161327878	463420924	/nfs/dbraw/zinc/42/09/24/463420924.db2.gz	QNNSXKHNMRLMAY-UHFFFAOYSA-N	-1	0	344.285	2.387	20	70		EEIDRM
O=C([N-]OCc1cccnc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000160863253	463377396	/nfs/dbraw/zinc/37/73/96/463377396.db2.gz	WYGDQMCZLSJGSN-AWEZNQCLSA-N	-1	0	345.424	2.386	20	70		EEIDRM
O=C([O-])[C@]1(C(=O)Nc2ccc(S(=O)(=O)F)c(F)c2)CC=CCC1	ZINC001605937692	972882709	/nfs/dbraw/zinc/88/27/09/972882709.db2.gz	JZELIGYXHDUYFR-CQSZACIVSA-N	-1	0	345.323	2.234	20	70		EEIDRM
CCn1cc(S(=O)(=O)[N-]c2cc(F)ccc2OC(F)F)cn1	ZINC000161122781	311362390	/nfs/dbraw/zinc/36/23/90/311362390.db2.gz	WQFUFWQSQLTMMV-UHFFFAOYSA-N	-1	0	335.307	2.444	20	70		EEIDRM
CC1(C)CCCC[C@H]1CC(=O)Nc1nnc([N-]S(C)(=O)=O)s1	ZINC000160381133	463332986	/nfs/dbraw/zinc/33/29/86/463332986.db2.gz	KXINVEKDNLPXKN-VIFPVBQESA-N	-1	0	346.478	2.455	20	70		EEIDRM
Cc1nc2cc(=O)[n-]n2c(C)c1CNC(=O)c1ccc(F)c(Cl)c1	ZINC000160689031	463362916	/nfs/dbraw/zinc/36/29/16/463362916.db2.gz	QSGGZPDYDSYHMB-UHFFFAOYSA-N	-1	0	348.765	2.362	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CCO[C@@H]([C@@H]2CCCO2)C1	ZINC000159408727	463284682	/nfs/dbraw/zinc/28/46/82/463284682.db2.gz	YSIJQJGBEQGARH-QWHCGFSZSA-N	-1	0	329.755	2.205	20	70		EEIDRM
COC(=O)c1cccc(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)c1C	ZINC000160643258	463358928	/nfs/dbraw/zinc/35/89/28/463358928.db2.gz	NANUJOZADGHWFE-UHFFFAOYSA-N	-1	0	337.401	2.429	20	70		EEIDRM
O=C(N[C@H](CO)c1ccccc1)c1nn(-c2ccc(F)cc2)cc1[O-]	ZINC000161053377	463395171	/nfs/dbraw/zinc/39/51/71/463395171.db2.gz	IFQCRGYXYDRACO-OAHLLOKOSA-N	-1	0	341.342	2.180	20	70		EEIDRM
O=C([O-])[C@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)C1CCCC1	ZINC001594838282	954047920	/nfs/dbraw/zinc/04/79/20/954047920.db2.gz	YSKKTFLARDTNHR-LBPRGKRZSA-N	-1	0	329.349	2.174	20	70		EEIDRM
Cc1cc(F)cc2c(O)c(C(=O)N(C)[C@@H](C)C(=O)OC(C)C)cnc12	ZINC000161409198	463429193	/nfs/dbraw/zinc/42/91/93/463429193.db2.gz	OLLJGPQAFFUEFK-NSHDSACASA-N	-1	0	348.374	2.388	20	70		EEIDRM
CCCCC[C@@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)[O-]	ZINC001595680625	982156577	/nfs/dbraw/zinc/15/65/77/982156577.db2.gz	CYCYPMVVPDIQDB-GFCCVEGCSA-N	-1	0	331.365	2.108	20	70		EEIDRM
Cc1[n-]n(-c2nc(C)cc(C)n2)c(=O)c1C(=O)Nc1ccccc1C	ZINC000160081956	311349649	/nfs/dbraw/zinc/34/96/49/311349649.db2.gz	QPPKESWBXKGOFC-OAHLLOKOSA-N	-1	0	337.383	2.379	20	70		EEIDRM
O=C([O-])[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2CS(=O)(=O)F)C1	ZINC001595178673	952244250	/nfs/dbraw/zinc/24/42/50/952244250.db2.gz	ZECVIENXRZQQTF-SCZZXKLOSA-N	-1	0	346.336	2.059	20	70		EEIDRM
Cc1ccc(NC(=O)[C@H](C(=O)[O-])C2CCCC2)cc1S(=O)(=O)F	ZINC001605288571	973095740	/nfs/dbraw/zinc/09/57/40/973095740.db2.gz	YKCHSMBPUXYQCP-CYBMUJFWSA-N	-1	0	343.376	2.483	20	70		EEIDRM
COC(=O)c1c(C)cccc1S(=O)(=O)[N-]c1cc(C(C)C)n[nH]1	ZINC000160651740	463358996	/nfs/dbraw/zinc/35/89/96/463358996.db2.gz	HZVCYSIJAANYCU-UHFFFAOYSA-N	-1	0	337.401	2.429	20	70		EEIDRM
Cc1cc(S(=O)(=O)F)ccc1C(=O)NCCCCCC(=O)[O-]	ZINC001574343202	960946274	/nfs/dbraw/zinc/94/62/74/960946274.db2.gz	IVEQVXAPSWPPMD-UHFFFAOYSA-N	-1	0	331.365	2.028	20	70		EEIDRM
CCc1cc([N-]S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)n(C)n1	ZINC000159729217	311345136	/nfs/dbraw/zinc/34/51/36/311345136.db2.gz	JPMFAPQYKHUIJB-UHFFFAOYSA-N	-1	0	348.428	2.013	20	70		EEIDRM
Cc1ccc(O)c(C(=O)N(C)CCN2C(=O)c3ccccc3C2=O)c1	ZINC000161383699	311365128	/nfs/dbraw/zinc/36/51/28/311365128.db2.gz	PQKMRQNEAUHVFS-UHFFFAOYSA-N	-1	0	338.363	2.069	20	70		EEIDRM
COc1ccc(-n2cc([O-])c(C(=O)N[C@H]3CCOC(C)(C)C3)n2)cc1	ZINC000160982825	463388559	/nfs/dbraw/zinc/38/85/59/463388559.db2.gz	TYNVOPZCHGWUQR-LBPRGKRZSA-N	-1	0	345.399	2.274	20	70		EEIDRM
CC(C)(C)[C@H](C(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1	ZINC001588633211	959626418	/nfs/dbraw/zinc/62/64/18/959626418.db2.gz	DRJUDNLZHZJZIA-JTQLQIEISA-N	-1	0	335.328	2.169	20	70		EEIDRM
CN(Cc1ccco1)C(=O)CO[N-]C(=O)C(C)(C)c1ccccc1	ZINC000160816727	206313661	/nfs/dbraw/zinc/31/36/61/206313661.db2.gz	IYHHWCNGYQTZMO-UHFFFAOYSA-N	-1	0	330.384	2.264	20	70		EEIDRM
COc1ncccc1CNC(=O)c1ccc(Br)c(O)c1	ZINC000159756632	311345558	/nfs/dbraw/zinc/34/55/58/311345558.db2.gz	CPRSHTMMSMHXDI-UHFFFAOYSA-N	-1	0	337.173	2.488	20	70		EEIDRM
O=S(=O)([N-]CCc1ccccc1O)c1c(F)cc(F)cc1F	ZINC000159665092	463298381	/nfs/dbraw/zinc/29/83/81/463298381.db2.gz	IWGYEESRAFWTOQ-UHFFFAOYSA-N	-1	0	331.315	2.331	20	70		EEIDRM
CCOC(=O)C[C@@H](C)NC(=O)c1nn(-c2ccc(F)cc2C)cc1[O-]	ZINC000160531099	463347076	/nfs/dbraw/zinc/34/70/76/463347076.db2.gz	RJVIBEGTVBAJLV-LLVKDONJSA-N	-1	0	349.362	2.097	20	70		EEIDRM
COC(=O)c1coc(S(=O)(=O)[N-]c2nccc3sccc32)c1	ZINC000160906247	463382126	/nfs/dbraw/zinc/38/21/26/463382126.db2.gz	DBYOWEAESGDYQI-UHFFFAOYSA-N	-1	0	338.366	2.477	20	70		EEIDRM
CC(=O)Nc1cc(F)c(S(=O)(=O)[N-]c2n[nH]c(C)c2C)c(F)c1	ZINC000160475949	539521968	/nfs/dbraw/zinc/52/19/68/539521968.db2.gz	ZEZJWJWSNNIUAS-UHFFFAOYSA-N	-1	0	344.343	2.064	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]Cc1ccc(C)cc1C	ZINC000160858731	206316737	/nfs/dbraw/zinc/31/67/37/206316737.db2.gz	XJCKSOJWSNOHLK-UHFFFAOYSA-N	-1	0	340.426	2.025	20	70		EEIDRM
CCOCCOc1ccc(S(=O)(=O)[N-]c2n[nH]c(C)c2C)cc1	ZINC000160500596	311354727	/nfs/dbraw/zinc/35/47/27/311354727.db2.gz	OVYNPCZIVFFXJB-UHFFFAOYSA-N	-1	0	339.417	2.243	20	70		EEIDRM
Cn1cnnc1CN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1	ZINC000160802738	311358867	/nfs/dbraw/zinc/35/88/67/311358867.db2.gz	VGNXQRVSDVKOJK-UHFFFAOYSA-N	-1	0	349.822	2.025	20	70		EEIDRM
CCCCn1ncc([N-]S(=O)(=O)c2ccc3c(c2)CC(=O)N3)c1C	ZINC000160206605	311351263	/nfs/dbraw/zinc/35/12/63/311351263.db2.gz	HAASMDSKDKHBMO-UHFFFAOYSA-N	-1	0	348.428	2.287	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CCO[C@H]([C@H]2CCCO2)C1	ZINC000159408881	463284502	/nfs/dbraw/zinc/28/45/02/463284502.db2.gz	YSIJQJGBEQGARH-OLZOCXBDSA-N	-1	0	329.755	2.205	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1nnc(C2CC2)s1	ZINC000159650829	539517800	/nfs/dbraw/zinc/51/78/00/539517800.db2.gz	LYHBTKPBTQVBDT-UHFFFAOYSA-N	-1	0	341.462	2.075	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2cccc3c2OCCO3)[nH]n1	ZINC000159952412	206271701	/nfs/dbraw/zinc/27/17/01/206271701.db2.gz	HPITVXFZNAGSPP-UHFFFAOYSA-N	-1	0	337.401	2.324	20	70		EEIDRM
COc1ccc(S(=O)(=O)[N-]c2ccn(CC(F)(F)F)n2)cc1	ZINC000160226802	206285394	/nfs/dbraw/zinc/28/53/94/206285394.db2.gz	GRXHXMWEPOJFFQ-UHFFFAOYSA-N	-1	0	335.307	2.255	20	70		EEIDRM
Cc1ccc(S(=O)(=O)[N-]C(=O)[C@H]2OCCc3ccccc32)c(F)c1	ZINC000161055752	463395227	/nfs/dbraw/zinc/39/52/27/463395227.db2.gz	DSTXASFVMQCTLJ-INIZCTEOSA-N	-1	0	349.383	2.253	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]CCCCC(C)(C)C	ZINC000161177369	206332145	/nfs/dbraw/zinc/33/21/45/206332145.db2.gz	OBXFQQWLZXAMKI-UHFFFAOYSA-N	-1	0	334.463	2.424	20	70		EEIDRM
CC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3cc(C(C)C)[nH]n3)cc21	ZINC000160652742	463358574	/nfs/dbraw/zinc/35/85/74/463358574.db2.gz	XZITUIHSAPIYJR-UHFFFAOYSA-N	-1	0	348.428	2.243	20	70		EEIDRM
CCC(=O)c1cccc(S(=O)(=O)[N-]c2cccc(C)c2C(N)=O)c1	ZINC000159918965	528481626	/nfs/dbraw/zinc/48/16/26/528481626.db2.gz	HEDYLQKSYZSQDU-UHFFFAOYSA-N	-1	0	346.408	2.487	20	70		EEIDRM
CC(C)(C)[C@@H](C(=O)[O-])C(=O)Nc1ccc(F)c(CS(=O)(=O)F)c1	ZINC001573391712	958705085	/nfs/dbraw/zinc/70/50/85/958705085.db2.gz	XBCMBZIOJYEALJ-LLVKDONJSA-N	-1	0	349.355	2.310	20	70		EEIDRM
C[C@@]1(NC(=O)c2ccc(S(=O)(=O)F)cc2)CCCC[C@@H]1C(=O)[O-]	ZINC001594055910	997792709	/nfs/dbraw/zinc/79/27/09/997792709.db2.gz	KWPVPDBCMGFILO-IUODEOHRSA-N	-1	0	343.376	2.108	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2ccc(C(=O)OCC)o2)[nH]n1	ZINC000159944429	311348432	/nfs/dbraw/zinc/34/84/32/311348432.db2.gz	RBBFTUNNYLOSKQ-UHFFFAOYSA-N	-1	0	341.389	2.323	20	70		EEIDRM
Cc1cc(F)ccc1-n1cc([O-])c(C(=O)N[C@@H](CO)CC(C)C)n1	ZINC000160681270	311357209	/nfs/dbraw/zinc/35/72/09/311357209.db2.gz	GHLGLJIXPLXYSY-CYBMUJFWSA-N	-1	0	335.379	2.162	20	70		EEIDRM
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)ccc1C	ZINC000160658699	311357008	/nfs/dbraw/zinc/35/70/08/311357008.db2.gz	UQCOTVIGCSXUHS-UHFFFAOYSA-N	-1	0	337.401	2.429	20	70		EEIDRM
CC[C@@H](OC1CCCCC1)C(=O)[N-]S(=O)(=O)c1cccnc1	ZINC000161123015	463402545	/nfs/dbraw/zinc/40/25/45/463402545.db2.gz	AUNJNOXTDJGTMD-CQSZACIVSA-N	-1	0	326.418	2.014	20	70		EEIDRM
O=C([O-])c1ccc(NC(=O)c2ccc(S(=O)(=O)F)cc2)c(F)c1	ZINC001595237195	949419944	/nfs/dbraw/zinc/41/99/44/949419944.db2.gz	UZNWFPJPCLWMGD-UHFFFAOYSA-N	-1	0	341.291	2.434	20	70		EEIDRM
CC(C)[C@@H](CNc1ccc([N+](=O)[O-])cc1CS(=O)(=O)F)C(=O)[O-]	ZINC001588831331	961726461	/nfs/dbraw/zinc/72/64/61/961726461.db2.gz	VZKNZMFBAKOOFV-LLVKDONJSA-N	-1	0	348.352	2.163	20	70		EEIDRM
C[C@]1(NC(=O)c2ccc(S(=O)(=O)F)cc2)CCCC[C@H]1C(=O)[O-]	ZINC001594055915	997792521	/nfs/dbraw/zinc/79/25/21/997792521.db2.gz	KWPVPDBCMGFILO-WFASDCNBSA-N	-1	0	343.376	2.108	20	70		EEIDRM
COCCNS(=O)(=O)c1c(Cl)cc(F)cc1Br	ZINC000159755050	311345782	/nfs/dbraw/zinc/34/57/82/311345782.db2.gz	JFSAFKDXLDJWBD-UHFFFAOYSA-N	-1	0	346.605	2.166	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2cnc3c(c2)c(C)nn3C)n[nH]1	ZINC000159939863	311348410	/nfs/dbraw/zinc/34/84/10/311348410.db2.gz	WDYGHALEUDYBLZ-UHFFFAOYSA-N	-1	0	348.432	2.143	20	70		EEIDRM
NC(=O)c1ccc(CNC(=O)c2ccc(Br)c(O)c2)cc1	ZINC000160252489	311351875	/nfs/dbraw/zinc/35/18/75/311351875.db2.gz	WEDFOTVFNXEHDF-UHFFFAOYSA-N	-1	0	349.184	2.184	20	70		EEIDRM
O=C([O-])[C@]1(C(=O)Nc2ccc(S(=O)(=O)F)cc2)CC=CCC1	ZINC001574632806	962302713	/nfs/dbraw/zinc/30/27/13/962302713.db2.gz	BSHDVMTYUGGWEF-CQSZACIVSA-N	-1	0	327.333	2.094	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1ccc(Cl)cn1	ZINC000159606059	539516687	/nfs/dbraw/zinc/51/66/87/539516687.db2.gz	DWECRVVZBWENOF-UHFFFAOYSA-N	-1	0	328.825	2.394	20	70		EEIDRM
CCC(CC)(C(=O)[O-])C(=O)Nc1ccc(S(=O)(=O)F)c(F)c1	ZINC001589480476	954969792	/nfs/dbraw/zinc/96/97/92/954969792.db2.gz	ZPKFDZKGXIWBHC-UHFFFAOYSA-N	-1	0	335.328	2.313	20	70		EEIDRM
O=C([O-])[C@@H]1CCCCN1C(=O)c1ccc(S(=O)(=O)F)cc1Cl	ZINC001574748165	957712576	/nfs/dbraw/zinc/71/25/76/957712576.db2.gz	GQNACWRITBWHMA-NSHDSACASA-N	-1	0	349.767	2.078	20	70		EEIDRM
O=C([O-])CN(C(=O)c1ccc(S(=O)(=O)F)cc1Cl)C1CCC1	ZINC001574710825	962712034	/nfs/dbraw/zinc/71/20/34/962712034.db2.gz	CLRNLMFBAXGWOL-UHFFFAOYSA-N	-1	0	349.767	2.078	20	70		EEIDRM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1cccc(Cl)c1F	ZINC000159552371	225237377	/nfs/dbraw/zinc/23/73/77/225237377.db2.gz	PNKVPMRKTARFJG-UHFFFAOYSA-N	-1	0	339.754	2.379	20	70		EEIDRM
Cc1ccc(-c2nc(NC(=O)CNC(=O)CC3CCCC3)n[nH]2)o1	ZINC000160246820	463324151	/nfs/dbraw/zinc/32/41/51/463324151.db2.gz	JKRYHZIGXRTFFR-UHFFFAOYSA-N	-1	0	331.376	2.008	20	70		EEIDRM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1O[C@@H]1CCOC1	ZINC000161046355	463394050	/nfs/dbraw/zinc/39/40/50/463394050.db2.gz	ZUVZOYQAHCVHSA-GFCCVEGCSA-N	-1	0	338.385	2.260	20	70		EEIDRM
Cc1cccc(C(=O)N[C@@H](C(=O)[N-]OCc2cccnc2)C(C)C)c1	ZINC000160849352	463376021	/nfs/dbraw/zinc/37/60/21/463376021.db2.gz	GIMDUEFHGRZUIW-QGZVFWFLSA-N	-1	0	341.411	2.392	20	70		EEIDRM
O=C([O-])CN(C(=O)c1cc(S(=O)(=O)F)ccc1Cl)C1CCC1	ZINC001574711364	962716642	/nfs/dbraw/zinc/71/66/42/962716642.db2.gz	YQGRDWCCMTXQHF-UHFFFAOYSA-N	-1	0	349.767	2.078	20	70		EEIDRM
C[C@H](CC(=O)[O-])SC(F)(F)COS(=O)(=O)C(F)(F)F	ZINC001592420730	978030933	/nfs/dbraw/zinc/03/09/33/978030933.db2.gz	FZMXNEBFORSSJR-SCSAIBSYSA-N	-1	0	332.268	2.042	20	70		EEIDRM
CCOC(=O)C[C@H](C)NC(=O)c1nn(-c2ccc(F)cc2C)cc1[O-]	ZINC000160531242	463346872	/nfs/dbraw/zinc/34/68/72/463346872.db2.gz	RJVIBEGTVBAJLV-NSHDSACASA-N	-1	0	349.362	2.097	20	70		EEIDRM
CC(C)(C)c1cnc(S([O-])=CC(=O)NCc2ccco2)s1	ZINC000160488637	463342816	/nfs/dbraw/zinc/34/28/16/463342816.db2.gz	XMBZQMSHTZCBBL-OAQYLSRUSA-N	-1	0	326.443	2.458	20	70		EEIDRM
CC(C)(C)c1ccc(S(=O)(=O)[N-]C(=O)[C@H]2CCCCO2)s1	ZINC000160487775	463343002	/nfs/dbraw/zinc/34/30/02/463343002.db2.gz	KBOPUCNTVHQRRH-SNVBAGLBSA-N	-1	0	331.459	2.420	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2c(CC)nn(C)c2CC)n[nH]1	ZINC000159673268	539518169	/nfs/dbraw/zinc/51/81/69/539518169.db2.gz	PSOHQXDTKFLFIQ-UHFFFAOYSA-N	-1	0	339.465	2.411	20	70		EEIDRM
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2cc(C(C)C)n[nH]2)o1	ZINC000160648384	311356881	/nfs/dbraw/zinc/35/68/81/311356881.db2.gz	KQCSCPMBBYEHKV-UHFFFAOYSA-N	-1	0	327.362	2.104	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]CCCC1CCCC1	ZINC000160829718	463374768	/nfs/dbraw/zinc/37/47/68/463374768.db2.gz	YMLNXPXAXVAFIM-UHFFFAOYSA-N	-1	0	332.447	2.178	20	70		EEIDRM
CCOc1cccc([N-]S(=O)(=O)c2c(CC)nn(C)c2CC)n1	ZINC000159638975	539517033	/nfs/dbraw/zinc/51/70/33/539517033.db2.gz	RBDQIELBIKIFAO-UHFFFAOYSA-N	-1	0	338.433	2.139	20	70		EEIDRM
COc1ccc(-n2cc([O-])c(C(=O)NCCc3ccco3)n2)cc1	ZINC000160013841	463313793	/nfs/dbraw/zinc/31/37/93/463313793.db2.gz	ORBPMINATRKLPL-UHFFFAOYSA-N	-1	0	327.340	2.152	20	70		EEIDRM
CC(C)Sc1n[nH]c([N-]S(=O)(=O)c2c(F)cccc2F)n1	ZINC000160932625	463384158	/nfs/dbraw/zinc/38/41/58/463384158.db2.gz	OBOLBBOYDDSGQO-UHFFFAOYSA-N	-1	0	334.373	2.384	20	70		EEIDRM
C[C@@]1(NC(=O)c2ccc(S(=O)(=O)F)cc2)CCCC[C@H]1C(=O)[O-]	ZINC001594055912	997792447	/nfs/dbraw/zinc/79/24/47/997792447.db2.gz	KWPVPDBCMGFILO-SWLSCSKDSA-N	-1	0	343.376	2.108	20	70		EEIDRM
C[C@@]1(NC(=O)c2cccc(S(=O)(=O)F)c2)CCCC[C@@H]1C(=O)[O-]	ZINC001594056042	997793762	/nfs/dbraw/zinc/79/37/62/997793762.db2.gz	MZJXGYBHGOHJSP-IUODEOHRSA-N	-1	0	343.376	2.108	20	70		EEIDRM
CCC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)cccc2C(N)=O)c1	ZINC000159878193	311347614	/nfs/dbraw/zinc/34/76/14/311347614.db2.gz	HXZYBHYTURXXOD-UHFFFAOYSA-N	-1	0	346.408	2.487	20	70		EEIDRM
O=C([O-])[C@@H](C(=O)Nc1ccc(S(=O)(=O)F)cc1)C1CCCC1	ZINC001594838281	954048295	/nfs/dbraw/zinc/04/82/95/954048295.db2.gz	YSKKTFLARDTNHR-GFCCVEGCSA-N	-1	0	329.349	2.174	20	70		EEIDRM
Cc1ccc(NC(=O)[C@]2(C(=O)[O-])CC2(C)C)cc1S(=O)(=O)F	ZINC001574374290	961080709	/nfs/dbraw/zinc/08/07/09/961080709.db2.gz	QLSIUCQCCHQLQZ-AWEZNQCLSA-N	-1	0	329.349	2.093	20	70		EEIDRM
CC(C)Sc1n[nH]c([N-]S(=O)(=O)c2ccc(Cl)nc2)n1	ZINC000160951874	463384982	/nfs/dbraw/zinc/38/49/82/463384982.db2.gz	GRPQITMYXXCRGO-UHFFFAOYSA-N	-1	0	333.826	2.154	20	70		EEIDRM
O=C([O-])[C@]1(C(=O)Nc2cccc(S(=O)(=O)F)c2)CC=CCC1	ZINC001594877772	954392820	/nfs/dbraw/zinc/39/28/20/954392820.db2.gz	LZRUMPLUNAOPQY-CQSZACIVSA-N	-1	0	327.333	2.094	20	70		EEIDRM
CCCCn1ncc([N-]S(=O)(=O)c2ccc(C(=O)OC)o2)c1C	ZINC000160192542	311350956	/nfs/dbraw/zinc/35/09/56/311350956.db2.gz	VSOJKUSYNATFIG-UHFFFAOYSA-N	-1	0	341.389	2.172	20	70		EEIDRM
Cc1[n-]n(-c2nc(C)cc(C)n2)c(=O)c1C(=O)Nc1ccccc1C	ZINC000160081862	311349819	/nfs/dbraw/zinc/34/98/19/311349819.db2.gz	QPPKESWBXKGOFC-HNNXBMFYSA-N	-1	0	337.383	2.379	20	70		EEIDRM
CC(C)[C@H](NC(=O)c1cccs1)C(=O)[N-]OCc1cccnc1	ZINC000160820762	463373674	/nfs/dbraw/zinc/37/36/74/463373674.db2.gz	AIIMRRKHTQZNLL-AWEZNQCLSA-N	-1	0	333.413	2.146	20	70		EEIDRM
O=S(=O)([N-]C[C@H](O)C1CCCCC1)c1c(F)cc(F)cc1F	ZINC000159567118	463293058	/nfs/dbraw/zinc/29/30/58/463293058.db2.gz	MOUBDDZIJKOIKE-ZDUSSCGKSA-N	-1	0	337.363	2.323	20	70		EEIDRM
O=C([O-])Cc1cccc(NC(=O)c2ccc(S(=O)(=O)F)cc2)c1	ZINC001595132746	952046125	/nfs/dbraw/zinc/04/61/25/952046125.db2.gz	HSKWLNKUJIDUQM-UHFFFAOYSA-N	-1	0	337.328	2.224	20	70		EEIDRM
CC(C)(C(=O)NCc1n[nH]c(=O)[n-]1)c1ccc(-c2ccccc2)cc1	ZINC000160119247	311350062	/nfs/dbraw/zinc/35/00/62/311350062.db2.gz	ZIIWXAQPUMHFSE-UHFFFAOYSA-N	-1	0	336.395	2.359	20	70		EEIDRM
CC(C)CN(C(=O)c1cccc(S(=O)(=O)F)c1)C(C)(C)C(=O)[O-]	ZINC001591284863	992220676	/nfs/dbraw/zinc/22/06/76/992220676.db2.gz	GFLKJKNSZYJPKM-UHFFFAOYSA-N	-1	0	345.392	2.306	20	70		EEIDRM
CCc1c([N-]S(=O)(=O)c2cnn(CC)c2)cnn1CC(C)C	ZINC000160369493	539521041	/nfs/dbraw/zinc/52/10/41/539521041.db2.gz	WRGMXWPYNILSFX-UHFFFAOYSA-N	-1	0	325.438	2.119	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CC(=O)N[C@H]2CCCC[C@@H]21	ZINC000160580406	304493354	/nfs/dbraw/zinc/49/33/54/304493354.db2.gz	UNSLHNDIGKUWFZ-RYUDHWBXSA-N	-1	0	326.755	2.068	20	70		EEIDRM
CC1(C)CCC(CC(=O)Nc2nnc([N-]S(C)(=O)=O)s2)CC1	ZINC000160382403	280924434	/nfs/dbraw/zinc/92/44/34/280924434.db2.gz	AXQLUVJICUZLLB-UHFFFAOYSA-N	-1	0	346.478	2.455	20	70		EEIDRM
Cc1ccc(C(=O)N[C@H](C(=O)[N-]OCc2cccnc2)C(C)C)cc1	ZINC000160746495	463366946	/nfs/dbraw/zinc/36/69/46/463366946.db2.gz	FHALWFXXGGVLAU-KRWDZBQOSA-N	-1	0	341.411	2.392	20	70		EEIDRM
O=C(N[C@@H](CO)c1ccccc1)c1nn(-c2ccc(F)cc2)cc1[O-]	ZINC000161053507	463395563	/nfs/dbraw/zinc/39/55/63/463395563.db2.gz	IFQCRGYXYDRACO-HNNXBMFYSA-N	-1	0	341.342	2.180	20	70		EEIDRM
CCC(CC)(NS(=O)(=O)c1c(Cl)cccc1Cl)C(N)=O	ZINC000161219702	463411937	/nfs/dbraw/zinc/41/19/37/463411937.db2.gz	KEOYEZWYCQEJMD-UHFFFAOYSA-N	-1	0	339.244	2.316	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1ccnn1C(C)C	ZINC000159583734	539517160	/nfs/dbraw/zinc/51/71/60/539517160.db2.gz	QNFZXGZWHYFTLU-UHFFFAOYSA-N	-1	0	325.438	2.123	20	70		EEIDRM
CCc1c([N-]S(=O)(=O)c2c(C)n[nH]c2C)cnn1CC(C)C	ZINC000160363566	539521531	/nfs/dbraw/zinc/52/15/31/539521531.db2.gz	QGBOUPFQFDZGTL-UHFFFAOYSA-N	-1	0	325.438	2.242	20	70		EEIDRM
Cc1ccncc1[N-]S(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	ZINC000159817112	311346581	/nfs/dbraw/zinc/34/65/81/311346581.db2.gz	YWHOKGJQBFIPQP-UHFFFAOYSA-N	-1	0	331.397	2.421	20	70		EEIDRM
CCCCCN(C(=O)c1c[nH]c2nc(=O)[n-]c(=O)c-2c1)[C@H](C)CCC	ZINC000161300030	463417951	/nfs/dbraw/zinc/41/79/51/463417951.db2.gz	ZPJBOVQKUYAKGG-GFCCVEGCSA-N	-1	0	346.431	2.432	20	70		EEIDRM
O=C([O-])/C=C\c1cc(C(=O)Nc2ccc(S(=O)(=O)F)cc2)co1	ZINC001574666792	962519495	/nfs/dbraw/zinc/51/94/95/962519495.db2.gz	HAGPXIIBLAWVFQ-UTCJRWHESA-N	-1	0	339.300	2.288	20	70		EEIDRM
CCc1ccc(S(=O)(=O)[N-]c2ccn(CCOC)n2)cc1CC	ZINC000160097798	529699334	/nfs/dbraw/zinc/69/93/34/529699334.db2.gz	UJEKUEMOHXAHKU-UHFFFAOYSA-N	-1	0	337.445	2.455	20	70		EEIDRM
CCCCc1cc([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)n[nH]1	ZINC000159949866	311348496	/nfs/dbraw/zinc/34/84/96/311348496.db2.gz	JOQDGSHQVGFROA-UHFFFAOYSA-N	-1	0	337.401	2.324	20	70		EEIDRM
O=C([O-])c1ccc(COC(=O)c2cccc(S(=O)(=O)F)c2)cc1	ZINC001606495362	973980504	/nfs/dbraw/zinc/98/05/04/973980504.db2.gz	SRAOCPGYRYIHFX-UHFFFAOYSA-N	-1	0	338.312	2.400	20	70		EEIDRM
COc1ccsc1S(=O)(=O)[N-]c1cccnc1-n1cccn1	ZINC000159609188	463295089	/nfs/dbraw/zinc/29/50/89/463295089.db2.gz	PMLGUXSYDGMRGX-UHFFFAOYSA-N	-1	0	336.398	2.138	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1ccc2n[nH]cc2c1	ZINC000160920672	311360120	/nfs/dbraw/zinc/36/01/20/311360120.db2.gz	SXQMEOXXFDLAQU-UHFFFAOYSA-N	-1	0	349.343	2.289	20	70		EEIDRM
O=C([O-])c1ccsc1NC(=O)c1cccc(S(=O)(=O)F)c1	ZINC001594821897	953906226	/nfs/dbraw/zinc/90/62/26/953906226.db2.gz	ICVSRHLABVAEBA-UHFFFAOYSA-N	-1	0	329.330	2.357	20	70		EEIDRM
CN(CCNC(=O)c1nn(-c2ccccc2)cc1[O-])c1ccccc1	ZINC000217034542	160216529	/nfs/dbraw/zinc/21/65/29/160216529.db2.gz	QUMNDVHFRAAHRQ-UHFFFAOYSA-N	-1	0	336.395	2.444	20	70		EEIDRM
O=C([O-])/C=C/c1cc(C(=O)Nc2cccc(S(=O)(=O)F)c2)co1	ZINC001594971102	950852268	/nfs/dbraw/zinc/85/22/68/950852268.db2.gz	NBGITVYZHUNVOX-SNAWJCMRSA-N	-1	0	339.300	2.288	20	70		EEIDRM
O=C([O-])c1ccc(/C=C/C(=O)Nc2cccc(S(=O)(=O)F)c2)o1	ZINC001594673797	956640387	/nfs/dbraw/zinc/64/03/87/956640387.db2.gz	KNSYYEFHQLIBNY-FNORWQNLSA-N	-1	0	339.300	2.288	20	70		EEIDRM
Cc1noc(C)c1S(=O)(=O)[N-]C(=O)[C@@H](C)OC1CCCCCC1	ZINC000161088717	206327727	/nfs/dbraw/zinc/32/77/27/206327727.db2.gz	WXNMQDYJEMWCJB-GFCCVEGCSA-N	-1	0	344.433	2.224	20	70		EEIDRM
O=C([O-])/C=C\c1cc(C(=O)Nc2cccc(S(=O)(=O)F)c2)co1	ZINC001594971100	950853561	/nfs/dbraw/zinc/85/35/61/950853561.db2.gz	NBGITVYZHUNVOX-PLNGDYQASA-N	-1	0	339.300	2.288	20	70		EEIDRM
CC(C)[C@@H](NC(=O)c1cccs1)C(=O)[N-]OCc1cccnc1	ZINC000160820870	206314730	/nfs/dbraw/zinc/31/47/30/206314730.db2.gz	AIIMRRKHTQZNLL-CQSZACIVSA-N	-1	0	333.413	2.146	20	70		EEIDRM
Cc1nc(S(=O)(=O)[N-]c2cc(F)ccc2OC(F)F)cn1C	ZINC000161093642	206328489	/nfs/dbraw/zinc/32/84/89/206328489.db2.gz	MYXMGKWBPPKJID-UHFFFAOYSA-N	-1	0	335.307	2.270	20	70		EEIDRM
CC[C@H](c1nnc([N-]S(=O)(=O)CCOC)s1)c1ccccc1	ZINC000160034166	311349283	/nfs/dbraw/zinc/34/92/83/311349283.db2.gz	ZDMVUBDVURXDIM-LBPRGKRZSA-N	-1	0	341.458	2.468	20	70		EEIDRM
Cc1ccc(C(=O)N(C)CCN2C(=O)c3ccccc3C2=O)c(O)c1	ZINC000161409801	463429330	/nfs/dbraw/zinc/42/93/30/463429330.db2.gz	GCMJBLYIIKMANG-UHFFFAOYSA-N	-1	0	338.363	2.069	20	70		EEIDRM
O=C([O-])[C@@H]1CCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1CS(=O)(=O)F	ZINC001595172283	952226453	/nfs/dbraw/zinc/22/64/53/952226453.db2.gz	VRPNKHUWXFHLCV-PWSUYJOCSA-N	-1	0	346.336	2.059	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CC(=O)N[C@H]2CCCC[C@H]21	ZINC000160580704	304493471	/nfs/dbraw/zinc/49/34/71/304493471.db2.gz	UNSLHNDIGKUWFZ-NWDGAFQWSA-N	-1	0	326.755	2.068	20	70		EEIDRM
Cc1cc(S(=O)(=O)F)ccc1C(=O)NC1CCC(C(=O)[O-])CC1	ZINC001574343603	960954693	/nfs/dbraw/zinc/95/46/93/960954693.db2.gz	ZXGQBLYJHPRVMT-UHFFFAOYSA-N	-1	0	343.376	2.026	20	70		EEIDRM
CC(C)(C)c1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)s1	ZINC000160463577	273985715	/nfs/dbraw/zinc/98/57/15/273985715.db2.gz	FGTIJEFPKRPGAV-MXWKQRLJSA-N	-1	0	343.470	2.418	20	70		EEIDRM
Cc1[nH]nc([N-]S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c1C	ZINC000160493235	311354741	/nfs/dbraw/zinc/35/47/41/311354741.db2.gz	MRRIDWKCLOMHJS-UHFFFAOYSA-N	-1	0	334.401	2.057	20	70		EEIDRM
CC(=O)N1CCC(CCC(=O)Nc2n[nH]c(-c3ccc(C)o3)n2)CC1	ZINC000160171466	463321530	/nfs/dbraw/zinc/32/15/30/463321530.db2.gz	FDTFNASSZPJLON-UHFFFAOYSA-N	-1	0	345.403	2.350	20	70		EEIDRM
CCS(=O)(=O)c1cccc(S(=O)(=O)[N-]c2nc(C)cs2)c1	ZINC000159479894	529170498	/nfs/dbraw/zinc/17/04/98/529170498.db2.gz	BOWGMWJQJTWUMG-UHFFFAOYSA-N	-1	0	346.455	2.046	20	70		EEIDRM
C[C@H]1CC[C@@](NC(=O)c2cccc(S(=O)(=O)F)c2)(C(=O)[O-])CC1	ZINC001599908075	984948960	/nfs/dbraw/zinc/94/89/60/984948960.db2.gz	XRETYLPTBSBVAR-LGZQZNNBSA-N	-1	0	343.376	2.108	20	70		EEIDRM
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3n[nH]c(C)c3C)cc2C[C@@H]1C	ZINC000160486508	311354810	/nfs/dbraw/zinc/35/48/10/311354810.db2.gz	YODJHPUHNZTPSU-VIFPVBQESA-N	-1	0	348.428	2.125	20	70		EEIDRM
CC(=O)Nc1cc(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)ccc1F	ZINC000160650291	463358804	/nfs/dbraw/zinc/35/88/04/463358804.db2.gz	GGBZCHCDONHWGY-UHFFFAOYSA-N	-1	0	340.380	2.431	20	70		EEIDRM
COC(=O)CN(C(=O)c1nn(-c2ccccc2)cc1[O-])C1CCCC1	ZINC000160842836	291061926	/nfs/dbraw/zinc/06/19/26/291061926.db2.gz	QPLRJNQFBNYZNX-UHFFFAOYSA-N	-1	0	343.383	2.136	20	70		EEIDRM
CN(C)c1ccc(Br)c(S(=O)(=O)[N-]c2cn[nH]c2)c1	ZINC000159714844	311345289	/nfs/dbraw/zinc/34/52/89/311345289.db2.gz	DMKFHTIYYDLIRH-UHFFFAOYSA-N	-1	0	345.222	2.039	20	70		EEIDRM
NC(=O)c1cccc(S(=O)(=O)[N-]c2nccc3sccc32)c1	ZINC000160932862	463384063	/nfs/dbraw/zinc/38/40/63/463384063.db2.gz	XVHCDTPFBHGBLX-UHFFFAOYSA-N	-1	0	333.394	2.196	20	70		EEIDRM
C=C(C)C[C@@H](NC(=O)c1ccc(S(=O)(=O)F)cc1Cl)C(=O)[O-]	ZINC001588547102	983618314	/nfs/dbraw/zinc/61/83/14/983618314.db2.gz	SYVHZVPCJZFLOL-LLVKDONJSA-N	-1	0	349.767	2.147	20	70		EEIDRM
CCCc1nnc([N-]S(=O)(=O)c2c(CC)nn(C)c2CC)s1	ZINC000159651950	539517952	/nfs/dbraw/zinc/51/79/52/539517952.db2.gz	NRKWPYMIAOWNLY-UHFFFAOYSA-N	-1	0	343.478	2.150	20	70		EEIDRM
CC(C)Sc1nc([N-]S(=O)(=O)Cc2ccc(F)cc2)n[nH]1	ZINC000160930698	463383583	/nfs/dbraw/zinc/38/35/83/463383583.db2.gz	WROKCNAPFNMIFZ-UHFFFAOYSA-N	-1	0	330.410	2.386	20	70		EEIDRM
C[C@]1(NC(=O)c2cccc(S(=O)(=O)F)c2)CCCC[C@@H]1C(=O)[O-]	ZINC001594056041	997793366	/nfs/dbraw/zinc/79/33/66/997793366.db2.gz	MZJXGYBHGOHJSP-DOMZBBRYSA-N	-1	0	343.376	2.108	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CCO[C@@H]([C@H]2CCCO2)C1	ZINC000159409015	463284826	/nfs/dbraw/zinc/28/48/26/463284826.db2.gz	YSIJQJGBEQGARH-CHWSQXEVSA-N	-1	0	329.755	2.205	20	70		EEIDRM
Cc1cc(S(=O)(=O)[N-]C(=O)c2noc3c2CCCCC3)c(C)o1	ZINC000159641276	463296653	/nfs/dbraw/zinc/29/66/53/463296653.db2.gz	KMMXKSWECNIGFN-UHFFFAOYSA-N	-1	0	338.385	2.272	20	70		EEIDRM
CCc1cc(=O)[nH]c(CN2CCC[N@H+](Cc3ccccc3)CC2)n1	ZINC000160629719	463356180	/nfs/dbraw/zinc/35/61/80/463356180.db2.gz	OCZSHCIYZINUCG-UHFFFAOYSA-N	-1	0	326.444	2.453	20	70		EEIDRM
CC(=O)c1ccc(S(=O)(=O)[N-]c2ccn(CC(F)(F)F)n2)cc1	ZINC000160226961	311351257	/nfs/dbraw/zinc/35/12/57/311351257.db2.gz	UBMKIXPJZWGQME-UHFFFAOYSA-N	-1	0	347.318	2.449	20	70		EEIDRM
COc1ccc([N-]S(=O)(=O)c2cnn(-c3ccccc3)c2)c(C)n1	ZINC000160675530	311357375	/nfs/dbraw/zinc/35/73/75/311357375.db2.gz	ALLFTLQOVHIDMN-UHFFFAOYSA-N	-1	0	344.396	2.385	20	70		EEIDRM
Cc1cc(Oc2ccc([N-]S(=O)(=O)c3cnn(C)c3)cc2)n[nH]1	ZINC000160684068	311357451	/nfs/dbraw/zinc/35/74/51/311357451.db2.gz	RBICUFGRRAABSL-UHFFFAOYSA-N	-1	0	333.373	2.045	20	70		EEIDRM
O=C([O-])c1ccc(/C=C\C(=O)Nc2cccc(S(=O)(=O)F)c2)o1	ZINC001594673796	956640203	/nfs/dbraw/zinc/64/02/03/956640203.db2.gz	KNSYYEFHQLIBNY-ALCCZGGFSA-N	-1	0	339.300	2.288	20	70		EEIDRM
COCCS(=O)(=O)[N-]c1nnc(C(C)(C)c2ccccc2)s1	ZINC000160098262	225337612	/nfs/dbraw/zinc/33/76/12/225337612.db2.gz	XUPNUGKVZHDRCT-UHFFFAOYSA-N	-1	0	341.458	2.252	20	70		EEIDRM
Cc1ccc(C(=O)N[C@@H](C(=O)[N-]OCc2cccnc2)C(C)C)cc1	ZINC000160746553	534269304	/nfs/dbraw/zinc/26/93/04/534269304.db2.gz	FHALWFXXGGVLAU-QGZVFWFLSA-N	-1	0	341.411	2.392	20	70		EEIDRM
CC(C)(C)C(=O)NCC(=O)[N-]OCc1ccc(C(F)(F)F)cc1	ZINC000160712848	463364607	/nfs/dbraw/zinc/36/46/07/463364607.db2.gz	WHFIEJDZFVODBB-UHFFFAOYSA-N	-1	0	332.322	2.416	20	70		EEIDRM
CCCCC[C@H](NC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)[O-]	ZINC001595680626	982156663	/nfs/dbraw/zinc/15/66/63/982156663.db2.gz	CYCYPMVVPDIQDB-LBPRGKRZSA-N	-1	0	331.365	2.108	20	70		EEIDRM
CC(=O)c1cccc(S(=O)(=O)[N-]c2ccn(CC(F)(F)F)n2)c1	ZINC000160242735	311351897	/nfs/dbraw/zinc/35/18/97/311351897.db2.gz	ZIKZTJVRZPBZAS-UHFFFAOYSA-N	-1	0	347.318	2.449	20	70		EEIDRM
O=C(c1cc(F)cc(Cl)c1[O-])N1CC(=O)N[C@@H]2CCCC[C@H]21	ZINC000160580823	463352551	/nfs/dbraw/zinc/35/25/51/463352551.db2.gz	UNSLHNDIGKUWFZ-VXGBXAGGSA-N	-1	0	326.755	2.068	20	70		EEIDRM
C=C(C)C[C@@H](NC(=O)c1cc(S(=O)(=O)F)ccc1Cl)C(=O)[O-]	ZINC001588546457	983615605	/nfs/dbraw/zinc/61/56/05/983615605.db2.gz	LRQKSZHCZWFCLC-LLVKDONJSA-N	-1	0	349.767	2.147	20	70		EEIDRM
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(C(C)C)n[nH]2)oc1C	ZINC000160640849	311357029	/nfs/dbraw/zinc/35/70/29/311357029.db2.gz	AQUDPEMOCLSEMG-UHFFFAOYSA-N	-1	0	327.362	2.022	20	70		EEIDRM
O=C([O-])/C=C/c1cc(C(=O)Nc2ccc(S(=O)(=O)F)cc2)co1	ZINC001574666793	962519835	/nfs/dbraw/zinc/51/98/35/962519835.db2.gz	HAGPXIIBLAWVFQ-ZZXKWVIFSA-N	-1	0	339.300	2.288	20	70		EEIDRM
CCc1cnc([N-]S(=O)(=O)c2cccc(F)c2C(=O)OC)s1	ZINC000160961043	311360517	/nfs/dbraw/zinc/36/05/17/311360517.db2.gz	IYXCBNGNFXZXOZ-UHFFFAOYSA-N	-1	0	344.389	2.432	20	70		EEIDRM
CCCC[C@@H](CC)C[N-]S(=O)(=O)c1scnc1C(=O)OC	ZINC000160830555	463375050	/nfs/dbraw/zinc/37/50/50/463375050.db2.gz	ZICBFJIAJXXPFQ-SNVBAGLBSA-N	-1	0	334.463	2.424	20	70		EEIDRM
COc1ccc(-n2cc([O-])c(C(=O)N[C@@H]3CCOC(C)(C)C3)n2)cc1	ZINC000160982694	463388297	/nfs/dbraw/zinc/38/82/97/463388297.db2.gz	TYNVOPZCHGWUQR-GFCCVEGCSA-N	-1	0	345.399	2.274	20	70		EEIDRM
CC(C)(C)c1ccc(S(=O)(=O)[N-]C(=O)C2CCOCC2)s1	ZINC000160510618	463345574	/nfs/dbraw/zinc/34/55/74/463345574.db2.gz	XBDIDVQZFFOCBG-UHFFFAOYSA-N	-1	0	331.459	2.277	20	70		EEIDRM
COC(=O)c1ncsc1S(=O)(=O)[N-]C[C@@H]1CCC[C@@H](C)C1	ZINC000160885480	463379321	/nfs/dbraw/zinc/37/93/21/463379321.db2.gz	DTABZYIGGJJNNT-NXEZZACHSA-N	-1	0	332.447	2.034	20	70		EEIDRM
Cc1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2OCCc3ccccc32)c(F)c1	ZINC000161055870	463395661	/nfs/dbraw/zinc/39/56/61/463395661.db2.gz	DSTXASFVMQCTLJ-MRXNPFEDSA-N	-1	0	349.383	2.253	20	70		EEIDRM
COc1ccsc1S(=O)(=O)[N-]c1ccc2c(c1)N(C)CCO2	ZINC000159761850	225274297	/nfs/dbraw/zinc/27/42/97/225274297.db2.gz	NVFBXHAESCGUAD-UHFFFAOYSA-N	-1	0	340.426	2.386	20	70		EEIDRM
Cc1cc(F)cc2c(O)c(C(=O)N(C)[C@H](C)C(=O)OC(C)C)cnc12	ZINC000161409330	463428667	/nfs/dbraw/zinc/42/86/67/463428667.db2.gz	OLLJGPQAFFUEFK-LLVKDONJSA-N	-1	0	348.374	2.388	20	70		EEIDRM
O=C([O-])[C@H](C(=O)Nc1cccc(S(=O)(=O)F)c1)C1CCCC1	ZINC001605900626	972726069	/nfs/dbraw/zinc/72/60/69/972726069.db2.gz	DSAZVSIFZMLHTN-LBPRGKRZSA-N	-1	0	329.349	2.174	20	70		EEIDRM
O=C([O-])[C@@H](C(=O)Nc1cccc(S(=O)(=O)F)c1)C1CCCC1	ZINC001605900625	972726715	/nfs/dbraw/zinc/72/67/15/972726715.db2.gz	DSAZVSIFZMLHTN-GFCCVEGCSA-N	-1	0	329.349	2.174	20	70		EEIDRM
COC(=O)c1c(F)cccc1S(=O)(=O)[N-]c1cccc2[nH]cnc21	ZINC000160960780	311360428	/nfs/dbraw/zinc/36/04/28/311360428.db2.gz	NGFPYOUVWOPQJL-UHFFFAOYSA-N	-1	0	349.343	2.289	20	70		EEIDRM
CC(C)Cn1cnc(S(=O)(=O)[N-]C(=O)C2(C)CCCCC2)c1	ZINC000159655539	463297777	/nfs/dbraw/zinc/29/77/77/463297777.db2.gz	PSZBDVNQDWBPCI-UHFFFAOYSA-N	-1	0	327.450	2.314	20	70		EEIDRM
Cc1cc(Cl)ccc1C(=O)Nc1nnc([N-]S(C)(=O)=O)s1	ZINC000160248649	463323451	/nfs/dbraw/zinc/32/34/51/463323451.db2.gz	RLRVRJSSEILZMM-UHFFFAOYSA-N	-1	0	346.821	2.124	20	70		EEIDRM
C[C@@H]1CC[C@H](C(=O)[O-])N1C(=O)c1cc(S(=O)(=O)F)ccc1Cl	ZINC001594218049	959347234	/nfs/dbraw/zinc/34/72/34/959347234.db2.gz	LNSAPHBVWRBCTB-RDDDGLTNSA-N	-1	0	349.767	2.076	20	70		EEIDRM
O=C([O-])c1ccccc1CC(=O)Nc1cccc(S(=O)(=O)F)c1	ZINC001605719875	974153170	/nfs/dbraw/zinc/15/31/70/974153170.db2.gz	OMNUGSGNRSQPRX-UHFFFAOYSA-N	-1	0	337.328	2.224	20	70		EEIDRM
C[C@]1(NC(=O)c2ccc(S(=O)(=O)F)cc2)CCCC[C@@H]1C(=O)[O-]	ZINC001594055871	997790741	/nfs/dbraw/zinc/79/07/41/997790741.db2.gz	KWPVPDBCMGFILO-DOMZBBRYSA-N	-1	0	343.376	2.108	20	70		EEIDRM
CCCC[C@H](CC)C[N-]S(=O)(=O)c1scnc1C(=O)OC	ZINC000160830682	463375025	/nfs/dbraw/zinc/37/50/25/463375025.db2.gz	ZICBFJIAJXXPFQ-JTQLQIEISA-N	-1	0	334.463	2.424	20	70		EEIDRM
O=C([O-])c1cccc(C(=O)Nc2ccc(S(=O)(=O)F)c(F)c2)c1	ZINC001595241994	949471742	/nfs/dbraw/zinc/47/17/42/949471742.db2.gz	WDRZQNQZNCEYOX-UHFFFAOYSA-N	-1	0	341.291	2.434	20	70		EEIDRM
C=C(C)C[C@H](NC(=O)c1ccc(S(=O)(=O)F)cc1Cl)C(=O)[O-]	ZINC001588547104	983618270	/nfs/dbraw/zinc/61/82/70/983618270.db2.gz	SYVHZVPCJZFLOL-NSHDSACASA-N	-1	0	349.767	2.147	20	70		EEIDRM
C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3nncs3)cc(Cl)c2O1	ZINC000160557078	463349757	/nfs/dbraw/zinc/34/97/57/463349757.db2.gz	NLTOVWYRGAWEEP-ZCFIWIBFSA-N	-1	0	331.806	2.316	20	70		EEIDRM
CC(C)(C(=O)Nc1nnc([N-]S(C)(=O)=O)s1)C1CCCC1	ZINC000160764864	463367835	/nfs/dbraw/zinc/36/78/35/463367835.db2.gz	KAAKKIVOOBRTDZ-UHFFFAOYSA-N	-1	0	332.451	2.065	20	70		EEIDRM
Cc1noc(C)c1C[C@H](C)[N-]S(=O)(=O)c1c(F)cccc1F	ZINC000159885021	225295904	/nfs/dbraw/zinc/29/59/04/225295904.db2.gz	ZEZDLXXTKBYKCE-QMMMGPOBSA-N	-1	0	330.356	2.479	20	70		EEIDRM
CC(C)c1ccc(CC2CCN(C(=O)c3nc(=O)[nH][n-]3)CC2)cc1	ZINC000159368493	311340452	/nfs/dbraw/zinc/34/04/52/311340452.db2.gz	BVRNIBRRWSHEEG-UHFFFAOYSA-N	-1	0	328.416	2.316	20	70		EEIDRM
O=C(/C=C/c1ccc2c(c1)CCO2)[N-]S(=O)(=O)c1ccsc1	ZINC000159805574	311346698	/nfs/dbraw/zinc/34/66/98/311346698.db2.gz	LGAAKWWKEXPODX-DUXPYHPUSA-N	-1	0	335.406	2.201	20	70		EEIDRM
COC(=O)c1ccc(F)c(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)c1	ZINC000160642957	463359134	/nfs/dbraw/zinc/35/91/34/463359134.db2.gz	UAAVUXJMEQQNJF-UHFFFAOYSA-N	-1	0	341.364	2.260	20	70		EEIDRM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1nc(C)ccc1OC	ZINC000159639839	539516880	/nfs/dbraw/zinc/51/68/80/539516880.db2.gz	FINVSEFVJPQGQF-UHFFFAOYSA-N	-1	0	338.433	2.058	20	70		EEIDRM
O=S(=O)([N-]C[C@@H](O)C1CCCCC1)c1c(F)cc(F)cc1F	ZINC000159567249	463292193	/nfs/dbraw/zinc/29/21/93/463292193.db2.gz	MOUBDDZIJKOIKE-CYBMUJFWSA-N	-1	0	337.363	2.323	20	70		EEIDRM
O=C([O-])[C@@H]1CC[C@H](C(=O)Nc2ccc(F)c(CS(=O)(=O)F)c2)C1	ZINC001594804443	953771558	/nfs/dbraw/zinc/77/15/58/953771558.db2.gz	XAPFVNCLTKHLIV-DTWKUNHWSA-N	-1	0	347.339	2.064	20	70		EEIDRM
Cc1cc(S(=O)(=O)F)ccc1C(=O)N1CCCC[C@H]1CC(=O)[O-]	ZINC001594328062	958191029	/nfs/dbraw/zinc/19/10/29/958191029.db2.gz	IAURSOUYFZPTDP-NSHDSACASA-N	-1	0	343.376	2.123	20	70		EEIDRM