smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1oc(-c2ccccc2)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000004851355	956870701	/nfs/dbraw/zinc/87/07/01/956870701.db2.gz	BSTWUJDKFASTAI-SFHVURJKSA-N	-1	0	349.386	3.681	50	0		EHAARM
Cc1c(COc2ccccc2)cccc1NC(=O)C(C)(C)C(=O)[O-]	ZINC000575408717	1131546998	/nfs/dbraw/zinc/54/69/98/1131546998.db2.gz	XYVNVTYETZFDSE-UHFFFAOYSA-N	-1	0	327.380	3.623	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3cc(OC)c(OC)cc3n2)cc1	ZINC000012941661	201877251	/nfs/dbraw/zinc/87/72/51/201877251.db2.gz	SEHUYBJYVKZFNC-UHFFFAOYSA-N	-1	0	339.347	3.626	50	0		EHAARM
CCc1ccc2oc(-c3ccc(OC)cc3)c/c(=N\CC(=O)[O-])c2c1	ZINC000019793151	202020904	/nfs/dbraw/zinc/02/09/04/202020904.db2.gz	YDNXBWSBODYUCM-HEHNFIMWSA-N	-1	0	337.375	3.656	50	0		EHAARM
Cc1nc2sc(-c3ccccc3)cc2c(N(C)CCC(=O)[O-])n1	ZINC000020317968	202038242	/nfs/dbraw/zinc/03/82/42/202038242.db2.gz	KTPIBVOFFUIORJ-UHFFFAOYSA-N	-1	0	327.409	3.578	50	0		EHAARM
O=C([O-])c1cccc(COc2ccc(Br)cc2F)c1	ZINC000020304834	202038344	/nfs/dbraw/zinc/03/83/44/202038344.db2.gz	QJLJWPCVXYXJJR-UHFFFAOYSA-N	-1	0	325.133	3.865	50	0		EHAARM
Cc1nc(-c2csc(S(=O)(=O)[N-]c3cc(C)ccc3C)c2)no1	ZINC000021701754	202068672	/nfs/dbraw/zinc/06/86/72/202068672.db2.gz	NXEWCZQWZBAKBC-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CC(=O)Nc3c2ncn3-c2ccccc2)cc1	ZINC000031820673	202210593	/nfs/dbraw/zinc/21/05/93/202210593.db2.gz	WREQTDXRORIXQC-HNNXBMFYSA-N	-1	0	333.347	3.694	50	0		EHAARM
O=C([O-])CCCN1C(=S)S/C(=C\c2ccsc2)C1=S	ZINC000032929461	202242852	/nfs/dbraw/zinc/24/28/52/202242852.db2.gz	FSVIELRHYCULOB-TWGQIWQCSA-N	-1	0	329.493	3.615	50	0		EHAARM
O=C([O-])CCCN1C(=S)S/C(=C/c2ccsc2)C1=S	ZINC000097097024	201378970	/nfs/dbraw/zinc/37/89/70/201378970.db2.gz	FSVIELRHYCULOB-RMKNXTFCSA-N	-1	0	329.493	3.615	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1CC(=O)c1cccc(Br)c1	ZINC000043879381	202517089	/nfs/dbraw/zinc/51/70/89/202517089.db2.gz	HXMGBTCEMUDHJI-GXFFZTMASA-N	-1	0	325.202	3.913	50	0		EHAARM
Cc1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000000226870	201451856	/nfs/dbraw/zinc/45/18/56/201451856.db2.gz	QAMKCWLSDIAWSU-ZYHUDNBSSA-N	-1	0	325.290	3.550	50	0		EHAARM
Cc1nc(-c2ccccc2C(=O)N(C(C)C)C(C)C)c(Cl)c(=O)[n-]1	ZINC000215860764	241150933	/nfs/dbraw/zinc/15/09/33/241150933.db2.gz	OUMPSHXTYBPEOG-UHFFFAOYSA-N	-1	0	347.846	3.658	50	0		EHAARM
O=C([O-])c1cccc(CN2C(=O)S/C(=C/c3ccccc3)C2=O)c1	ZINC000002330473	201529247	/nfs/dbraw/zinc/52/92/47/201529247.db2.gz	HGTILGNTGVXCHG-XNTDXEJSSA-N	-1	0	339.372	3.621	50	0		EHAARM
O=C([O-])c1cnc2ccccc2c1Nc1ccc(N2CCOCC2)cc1	ZINC000019795547	212069039	/nfs/dbraw/zinc/06/90/39/212069039.db2.gz	BKDHMJUEHFVZRO-UHFFFAOYSA-N	-1	0	349.390	3.513	50	0		EHAARM
CC1(C)CC(=O)C(C(=O)Nc2ccc(Cl)c(Cl)c2)=C([O-])C1	ZINC000102306689	204035765	/nfs/dbraw/zinc/03/57/65/204035765.db2.gz	KNDHSIGCCHSYHC-UHFFFAOYSA-N	-1	0	328.195	3.506	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc(Cl)ccc2Cl)C1	ZINC000043583568	204285223	/nfs/dbraw/zinc/28/52/23/204285223.db2.gz	MOVMZWCTSGTBNQ-JTQLQIEISA-N	-1	0	330.211	3.710	50	0		EHAARM
CCc1nc2cc(NC(=O)CC3(C(=O)[O-])CCCCC3)ccc2o1	ZINC000048382545	204351277	/nfs/dbraw/zinc/35/12/77/204351277.db2.gz	UASXSNCODKVONQ-UHFFFAOYSA-N	-1	0	330.384	3.754	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)Nc2ccccc2Br)c1	ZINC000000008930	206211577	/nfs/dbraw/zinc/21/15/77/206211577.db2.gz	YXMAFWVJYDIDQY-UHFFFAOYSA-N	-1	0	335.157	3.791	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000005383798	206503998	/nfs/dbraw/zinc/50/39/98/206503998.db2.gz	UWWCJMRSYZRTMP-KGLIPLIRSA-N	-1	0	333.428	3.822	50	0		EHAARM
O=C([O-])CC1(NC(=O)Cc2cccc3ccccc32)CCCCC1	ZINC000006244091	206514086	/nfs/dbraw/zinc/51/40/86/206514086.db2.gz	HQYGGYCZXROVFI-UHFFFAOYSA-N	-1	0	325.408	3.676	50	0		EHAARM
CC(=O)Nc1ccc(NC(=O)[C@](C)(CC(=O)[O-])C2CCCCC2)cc1	ZINC000169975457	206568115	/nfs/dbraw/zinc/56/81/15/206568115.db2.gz	AFHZWOPWIWMWOR-LJQANCHMSA-N	-1	0	346.427	3.645	50	0		EHAARM
O=C([O-])[C@@H]1CCCc2sc(NC(=O)c3ccc(Cl)cc3)nc21	ZINC000011920131	207027478	/nfs/dbraw/zinc/02/74/78/207027478.db2.gz	IADHSTDPSDJTFV-SNVBAGLBSA-N	-1	0	336.800	3.553	50	0		EHAARM
Cc1ccc2c(c1)CCCN2C(=O)[C@@H]1CC(C)=C(C)C[C@@H]1C(=O)[O-]	ZINC000017067054	135711500	/nfs/dbraw/zinc/71/15/00/135711500.db2.gz	XEDQTOBUZGSKLA-SJORKVTESA-N	-1	0	327.424	3.721	50	0		EHAARM
O=C([O-])c1cc2n(n1)[C@H](C(F)(F)F)C[C@H](c1ccc(Cl)cc1)N2	ZINC000000226877	563263051	/nfs/dbraw/zinc/26/30/51/563263051.db2.gz	QJWIAWGYDPQGOS-KOLCDFICSA-N	-1	0	345.708	3.895	50	0		EHAARM
O=C([O-])[C@H]1CS[C@@H](c2ccc(OCc3ccccc3Cl)cc2)N1	ZINC000002472418	563433195	/nfs/dbraw/zinc/43/31/95/563433195.db2.gz	CYMVBODYZNMIRO-CVEARBPZSA-N	-1	0	349.839	3.707	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1cccc2ccccc21	ZINC000002572728	563442515	/nfs/dbraw/zinc/44/25/15/563442515.db2.gz	JXDXPRAUFACOHG-OAHLLOKOSA-N	-1	0	329.396	3.750	50	0		EHAARM
Cc1cc(NC(=O)[N-]S(=O)(=O)c2ccccc2)ccc1C(C)C	ZINC000004104995	563494371	/nfs/dbraw/zinc/49/43/71/563494371.db2.gz	WBOFGXSLHAYRCN-UHFFFAOYSA-N	-1	0	332.425	3.629	50	0		EHAARM
CSc1nc(-c2ccccc2)[n-]c1S(=O)(=O)c1ccccc1	ZINC000006184532	563560546	/nfs/dbraw/zinc/56/05/46/563560546.db2.gz	OQFAORHWMJGDJZ-UHFFFAOYSA-N	-1	0	330.434	3.631	50	0		EHAARM
N#CNc1nc(C=Cc2ccccc2Cl)nc(-c2ccccc2[O-])n1	ZINC000009053200	563641501	/nfs/dbraw/zinc/64/15/01/563641501.db2.gz	ITUORZHZJJGBES-MDZDMXLPSA-N	-1	0	349.781	3.961	50	0		EHAARM
CCc1cccc(CC)c1[N-]S(=O)(=O)c1cc(F)ccc1OC	ZINC000010302076	563646763	/nfs/dbraw/zinc/64/67/63/563646763.db2.gz	JMKQJHIADAAHMJ-UHFFFAOYSA-N	-1	0	337.416	3.760	50	0		EHAARM
S=c1[n-]nc2cc(-c3ccccc3)c3cc4c(cc3n21)OCCO4	ZINC000012505983	563661974	/nfs/dbraw/zinc/66/19/74/563661974.db2.gz	MZYWTEVBDPCCOW-UHFFFAOYSA-N	-1	0	335.388	3.609	50	0		EHAARM
Cc1ccc(C)c(NC(=O)[C@H](C)Sc2ncccc2C(=O)[O-])c1	ZINC000013310045	563694610	/nfs/dbraw/zinc/69/46/10/563694610.db2.gz	HCZYQVLCBKLHTR-LBPRGKRZSA-N	-1	0	330.409	3.516	50	0		EHAARM
CCCCCCCCCCCCC[C@@H](O)CC(=O)NCC(=O)[O-]	ZINC000137430904	563765912	/nfs/dbraw/zinc/76/59/12/563765912.db2.gz	MZUHHHSFDVDBCZ-MRXNPFEDSA-N	-1	0	329.481	3.639	50	0	biogenic,in-vitro	EHAARM
O=S(=O)(N[C@@H](c1ccccc1)C1CC1)c1ccc(Cl)cc1F	ZINC000010677577	563858742	/nfs/dbraw/zinc/85/87/42/563858742.db2.gz	RQHYTPRUIFYBEU-INIZCTEOSA-N	-1	0	339.819	3.909	50	0		EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CCCCC2)C12CCCC2	ZINC000045895553	563929392	/nfs/dbraw/zinc/92/93/92/563929392.db2.gz	BGXXEKUQVJLQMB-KRWDZBQOSA-N	-1	0	327.424	3.956	50	0		EHAARM
O=C([O-])c1ccc(-c2c(-c3ccccc3)ncn2Cc2ncc[nH]2)cc1	ZINC000067678877	563962512	/nfs/dbraw/zinc/96/25/12/563962512.db2.gz	GXVONGNEQBYSHB-UHFFFAOYSA-N	-1	0	344.374	3.687	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)c3ccc4cc[nH]c4c3)C2)cc1	ZINC000095360733	563976775	/nfs/dbraw/zinc/97/67/75/563976775.db2.gz	BRWNHGROPGKPET-SFHVURJKSA-N	-1	0	348.402	3.886	50	0		EHAARM
CC(C)n1cccc1C(=O)N1CCC[C@H](c2ccc(C(=O)[O-])cc2)C1	ZINC000095368839	563976790	/nfs/dbraw/zinc/97/67/90/563976790.db2.gz	ACUFQKHQOIJSLT-KRWDZBQOSA-N	-1	0	340.423	3.787	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@@H](C(=O)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000000106223	563986476	/nfs/dbraw/zinc/98/64/76/563986476.db2.gz	XBNFYFUGSSJTKU-STQMWFEESA-N	-1	0	343.301	3.581	50	0		EHAARM
CCOC(=O)NC1([N-]c2ccccc2Cl)Oc2ccccc2O1	ZINC000000217614	563988724	/nfs/dbraw/zinc/98/87/24/563988724.db2.gz	UYEIZUXOHRDAQO-UHFFFAOYSA-N	-1	0	334.759	3.581	50	0		EHAARM
O=S(=O)([N-]c1ccncc1)c1ccc(Cl)c(Cl)c1Cl	ZINC000000367689	563991741	/nfs/dbraw/zinc/99/17/41/563991741.db2.gz	KAHNJYPVAZXPDO-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
Cc1ccsc1[C@@H]1C[C@H]1C(=O)N[C@H](CC(=O)[O-])c1cccs1	ZINC000252486171	563997740	/nfs/dbraw/zinc/99/77/40/563997740.db2.gz	GFMAPRHJICAGKC-IJLUTSLNSA-N	-1	0	335.450	3.554	50	0		EHAARM
C[C@H](Oc1ccc2cc(-c3ccc(Cl)cc3)c(=O)oc2c1)C(=O)[O-]	ZINC000005234673	564001362	/nfs/dbraw/zinc/00/13/62/564001362.db2.gz	HPODAEPKTVPRNM-JTQLQIEISA-N	-1	0	344.750	3.965	50	0		EHAARM
Cc1noc(-c2csc(S(=O)(=O)[N-]c3ccccc3)c2)c1C	ZINC000044900866	564027597	/nfs/dbraw/zinc/02/75/97/564027597.db2.gz	YBJRXLHBXATGCK-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CC[C@H]1c2[nH]c3ccccc3c2C[C@H](C(=O)[O-])N1C(=O)c1ccccc1	ZINC000003173966	564034297	/nfs/dbraw/zinc/03/42/97/564034297.db2.gz	VANZQNXBIFPECN-ZWKOTPCHSA-N	-1	0	348.402	3.771	50	0		EHAARM
Cc1cc([N-]S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)no1	ZINC000225443143	564046800	/nfs/dbraw/zinc/04/68/00/564046800.db2.gz	ISMRGYROPUFQDH-UHFFFAOYSA-N	-1	0	341.603	3.744	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2c(C)ccnc2C)cc1C(F)(F)F	ZINC000239654480	564051651	/nfs/dbraw/zinc/05/16/51/564051651.db2.gz	BNYBCZDMQAQYBZ-UHFFFAOYSA-N	-1	0	344.358	3.826	50	0		EHAARM
CC(C)c1ccc(-c2nc(C(=O)[N-]n3cn[nH]c3=S)cs2)cc1	ZINC000012825314	564075056	/nfs/dbraw/zinc/07/50/56/564075056.db2.gz	KZHBOVMZYMNSPG-UHFFFAOYSA-N	-1	0	345.453	3.571	50	0		EHAARM
O=C([O-])C[C@@H](CC(=O)N(Cc1ccsc1)C1CC1)c1cccs1	ZINC000090607335	564086271	/nfs/dbraw/zinc/08/62/71/564086271.db2.gz	JNVIZEVLVAFJLG-CYBMUJFWSA-N	-1	0	349.477	3.949	50	0		EHAARM
O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc([O-])c(Cl)c1	ZINC000143557399	564093381	/nfs/dbraw/zinc/09/33/81/564093381.db2.gz	QIRXZCKVNGEQES-YJBOKZPZSA-N	-1	0	345.826	3.943	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(-c3cc(C)no3)o2)cc1	ZINC000064958420	564098517	/nfs/dbraw/zinc/09/85/17/564098517.db2.gz	UHZQNRRBZZSLSZ-UHFFFAOYSA-N	-1	0	332.381	3.606	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3)o2)c1C	ZINC000064958606	564098524	/nfs/dbraw/zinc/09/85/24/564098524.db2.gz	GAFJXTIHDHHEFM-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
CC[C@@](NC(=O)[C@@H](C)Sc1ccccc1)(C(=O)[O-])c1ccccc1	ZINC000170592054	564108828	/nfs/dbraw/zinc/10/88/28/564108828.db2.gz	VWQPJNOOJVNPKT-KUHUBIRLSA-N	-1	0	343.448	3.674	50	0		EHAARM
O=S(=O)([N-]c1cccc2ncccc12)c1cnc2ccccc2c1	ZINC000170617517	564110154	/nfs/dbraw/zinc/11/01/54/564110154.db2.gz	MBHJCFYCLSACEA-UHFFFAOYSA-N	-1	0	335.388	3.584	50	0		EHAARM
CC(C)(C)OC(=O)N1CCc2c(cc(Cl)c(C(=O)[O-])c2Cl)C1	ZINC000137764711	564129546	/nfs/dbraw/zinc/12/95/46/564129546.db2.gz	JXBQRXIJBFUZMR-UHFFFAOYSA-N	-1	0	346.210	3.985	50	0		EHAARM
O=C(N[C@H]1CCSc2ccccc21)c1cc(F)c(F)c([O-])c1F	ZINC000095468981	564141221	/nfs/dbraw/zinc/14/12/21/564141221.db2.gz	UGZBQKQNTWCIPP-NSHDSACASA-N	-1	0	339.338	3.776	50	0		EHAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1ncc(-c2ccc(F)cc2)o1	ZINC000299743277	564150549	/nfs/dbraw/zinc/15/05/49/564150549.db2.gz	MWHSQLHZWGXSFM-BPUTZDHNSA-N	-1	0	344.386	3.698	50	0		EHAARM
Cc1cccc2c(C)nc([N-]c3ncc4c(n3)CC(C)(C)CC4=O)nc12	ZINC000009477325	564173850	/nfs/dbraw/zinc/17/38/50/564173850.db2.gz	CVYRZPTYIBDMAR-UHFFFAOYSA-N	-1	0	347.422	3.935	50	0		EHAARM
CC(C)(C)[C@@H]1OCC[C@H]1CNC(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000073770167	564176411	/nfs/dbraw/zinc/17/64/11/564176411.db2.gz	AZIOGUDSZUDKHS-SMDDNHRTSA-N	-1	0	334.441	3.671	50	0		EHAARM
Cc1ccc(-n2nc([O-])c(=O)c3c2C(=Cc2ccccc2)CC3)cc1	ZINC000058161715	1037558455	/nfs/dbraw/zinc/55/84/55/1037558455.db2.gz	LQQLNJLIPAKLFY-DTQAZKPQSA-N	-1	0	330.387	3.733	50	0		EHAARM
Cc1[n-]n(-c2ccccc2)c(=O)c1N=Nc1ccc(C)c(Cl)c1	ZINC000254392483	1042581475	/nfs/dbraw/zinc/58/14/75/1042581475.db2.gz	MZIBDORFLAJUJZ-UHFFFAOYSA-N	-1	0	326.787	3.839	50	0		EHAARM
Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@H](C)C(=O)[O-]	ZINC000563128858	1130650597	/nfs/dbraw/zinc/65/05/97/1130650597.db2.gz	WUAWOZFEUXJSKO-KBPBESRZSA-N	-1	0	327.380	3.794	50	0		EHAARM
C[C@@H](Nc1nc(N)nc2ccc(C(=O)[O-])cc21)c1ccc(Cl)cc1	ZINC000065410669	1132281027	/nfs/dbraw/zinc/28/10/27/1132281027.db2.gz	MXCSHFJIDLQSEG-SECBINFHSA-N	-1	0	342.786	3.737	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000004523508	210214004	/nfs/dbraw/zinc/21/40/04/210214004.db2.gz	XMJBBSPXYYWVOW-NXEZZACHSA-N	-1	0	347.720	3.964	50	0		EHAARM
COc1cc(/C=C/c2cc(C(=O)[O-])c3ccccc3n2)cc2c1OCO2	ZINC000008320948	201744207	/nfs/dbraw/zinc/74/42/07/201744207.db2.gz	IFLJRNFRTDBXLG-VOTSOKGWSA-N	-1	0	349.342	3.841	50	0		EHAARM
O=C([O-])[C@@H](CC(=O)Nc1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC000013253258	201889117	/nfs/dbraw/zinc/88/91/17/201889117.db2.gz	TWDJFDFNBCGLGO-AWEZNQCLSA-N	-1	0	337.297	3.902	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CCn2ccc3ccc(F)cc32)cc1	ZINC000013725211	201911973	/nfs/dbraw/zinc/91/19/73/201911973.db2.gz	XDTJBCKAIMSQQG-UHFFFAOYSA-N	-1	0	326.327	3.507	50	0		EHAARM
CC(C)COc1ccc(-c2nonc2NC(=O)c2ccco2)cc1	ZINC000027664129	202158854	/nfs/dbraw/zinc/15/88/54/202158854.db2.gz	TXCJGVKOZGZXMQ-UHFFFAOYSA-N	-1	0	327.340	3.617	50	0		EHAARM
CC(C)Cc1csc2nc(=O)n3nc(Cc4ccccc4)[n-]c3c12	ZINC000032072561	202220517	/nfs/dbraw/zinc/22/05/17/202220517.db2.gz	MTQUKNUSPZFJGL-UHFFFAOYSA-N	-1	0	338.436	3.834	50	0		EHAARM
Cc1oc2cc(OCC(=O)[O-])ccc2c(=O)c1-c1ccc(Cl)cc1	ZINC000011766712	201363277	/nfs/dbraw/zinc/36/32/77/201363277.db2.gz	TYUUEVWTPHMLCK-UHFFFAOYSA-N	-1	0	344.750	3.885	50	0	biogenic	EHAARM
COC(=O)c1ccc(/C=C(\CC(=O)[O-])c2nc3ccccc3s2)o1	ZINC000096188178	201374613	/nfs/dbraw/zinc/37/46/13/201374613.db2.gz	QRZWFLLTSWNYTK-CSKARUKUSA-N	-1	0	343.360	3.691	50	0		EHAARM
COc1cc(S(=O)(=O)[N-]c2cccc3cccnc32)c(C)cc1C	ZINC000214077598	241096383	/nfs/dbraw/zinc/09/63/83/241096383.db2.gz	JZYCNQSUIIGTAG-UHFFFAOYSA-N	-1	0	342.420	3.661	50	0		EHAARM
CC1=C(c2ccccc2)N(C(=O)Cc2ccccc2)[N-]C(=S)S1	ZINC000000389435	201467237	/nfs/dbraw/zinc/46/72/37/201467237.db2.gz	ZWYPJDQZHBXMHJ-UHFFFAOYSA-N	-1	0	340.473	3.983	50	0		EHAARM
O=C([O-])c1ccccc1SCC(=O)Nc1ccnc2ccccc21	ZINC000001069406	201498032	/nfs/dbraw/zinc/49/80/32/201498032.db2.gz	OPXPCAFVHUYDJM-UHFFFAOYSA-N	-1	0	338.388	3.664	50	0		EHAARM
O=C([O-])C[C@@H](CC(=O)Nc1cccc2cccnc21)c1cccs1	ZINC000226751105	242112346	/nfs/dbraw/zinc/11/23/46/242112346.db2.gz	HMUBLMNDZRCQMJ-CYBMUJFWSA-N	-1	0	340.404	3.883	50	0		EHAARM
Cc1c(C(=O)[O-])sc2ncnc(NCc3cccc(Cl)c3)c12	ZINC000021715885	212242934	/nfs/dbraw/zinc/24/29/34/212242934.db2.gz	JUYNZYNIBYIQDW-UHFFFAOYSA-N	-1	0	333.800	3.963	50	0		EHAARM
CN(C(=O)OCC1c2ccccc2-c2ccccc21)C(C)(C)C(=O)[O-]	ZINC000002384238	201530663	/nfs/dbraw/zinc/53/06/63/201530663.db2.gz	HFPNKXXPYGPHJQ-UHFFFAOYSA-N	-1	0	339.391	3.731	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1ccc2ccccc2c1	ZINC000002572731	201536755	/nfs/dbraw/zinc/53/67/55/201536755.db2.gz	RKULNBHGHIPRGC-INIZCTEOSA-N	-1	0	329.396	3.750	50	0		EHAARM
CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccc(O)cc1C(=O)[O-]	ZINC000002991982	201554243	/nfs/dbraw/zinc/55/42/43/201554243.db2.gz	OLNFVVYKRSFQEV-GFCCVEGCSA-N	-1	0	343.379	3.621	50	0		EHAARM
CC(C)(C)C(=O)Nc1ccccc1C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000003092363	201557371	/nfs/dbraw/zinc/55/73/71/201557371.db2.gz	KGFRLSDQERUZHH-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
CC[C@H](C(=O)[O-])n1cnc2scc(-c3ccc(C)c(C)c3)c2c1=O	ZINC000003642063	201579472	/nfs/dbraw/zinc/57/94/72/201579472.db2.gz	VRHVVZPZKNQPIZ-CQSZACIVSA-N	-1	0	342.420	3.778	50	0		EHAARM
O=C([O-])CCc1ccc(-c2cccs2)n1NC(=O)c1cccs1	ZINC000003612534	201579079	/nfs/dbraw/zinc/57/90/79/201579079.db2.gz	ZPUMYOYSNYTADN-UHFFFAOYSA-N	-1	0	346.433	3.679	50	0		EHAARM
COc1cccc(C[C@H](CC(=O)[O-])C(=O)Nc2cc(C)ccc2C)c1	ZINC000004428054	201600769	/nfs/dbraw/zinc/60/07/69/201600769.db2.gz	CYAKMJNBMBWOTC-MRXNPFEDSA-N	-1	0	341.407	3.584	50	0		EHAARM
O=C([O-])c1cccc(Nc2c(-c3ccc(F)cc3)nc3cnccn32)c1	ZINC000065322799	202835243	/nfs/dbraw/zinc/83/52/43/202835243.db2.gz	KIUYLGXPAHBZFW-UHFFFAOYSA-N	-1	0	348.337	3.977	50	0		EHAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c1	ZINC000075351846	203312527	/nfs/dbraw/zinc/31/25/27/203312527.db2.gz	UFFCNCRDCGZREO-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c1	ZINC000075351840	203312801	/nfs/dbraw/zinc/31/28/01/203312801.db2.gz	KUPZBNVBNHNUSF-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3cc(F)ccc3C)c(C)o2)n[nH]1	ZINC000075519171	203316651	/nfs/dbraw/zinc/31/66/51/203316651.db2.gz	RSCYZPUENHLBPS-UHFFFAOYSA-N	-1	0	349.387	3.535	50	0		EHAARM
Cc1c(C(=O)NC2(C(=O)[O-])CCCCC2)sc2nc(C)cc(C)c12	ZINC000089600742	203583514	/nfs/dbraw/zinc/58/35/14/203583514.db2.gz	CUKHOLSCSYTDKM-UHFFFAOYSA-N	-1	0	346.452	3.739	50	0		EHAARM
C[C@H](Oc1ccc2oc(-c3ccc(Cl)cc3)cc(=O)c2c1)C(=O)[O-]	ZINC000001978016	205602798	/nfs/dbraw/zinc/60/27/98/205602798.db2.gz	IUVREUUECMFWBG-JTQLQIEISA-N	-1	0	344.750	3.965	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)Nc2ccc(OC(F)(F)F)cc2)c1	ZINC000000151370	206208162	/nfs/dbraw/zinc/20/81/62/206208162.db2.gz	GWABUIDFZMRJTA-UHFFFAOYSA-N	-1	0	340.257	3.927	50	0		EHAARM
O=S(=O)([N-]c1ccc(N2CCCCC2)cc1)c1ccccc1F	ZINC000000155396	206208690	/nfs/dbraw/zinc/20/86/90/206208690.db2.gz	JIPIFKSKAOFQMK-UHFFFAOYSA-N	-1	0	334.416	3.617	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CCCOc2ccccc2)cc1Cl	ZINC000095369501	218303467	/nfs/dbraw/zinc/30/34/67/218303467.db2.gz	PAJOHEIRCQWABX-UHFFFAOYSA-N	-1	0	333.771	3.836	50	0		EHAARM
CC(C)N(C(=O)c1ccccc1-c1cc(C(=O)[O-])ccn1)C(C)C	ZINC000215371447	534956793	/nfs/dbraw/zinc/95/67/93/534956793.db2.gz	BCFOZSOWQCNBSV-UHFFFAOYSA-N	-1	0	326.396	3.706	50	0		EHAARM
CCCCCCCCCCCCC[C@H](O)CC(=O)NCC(=O)[O-]	ZINC000137430827	563766409	/nfs/dbraw/zinc/76/64/09/563766409.db2.gz	MZUHHHSFDVDBCZ-INIZCTEOSA-N	-1	0	329.481	3.639	50	0	biogenic,in-vitro	EHAARM
CC1(C)[C@H](C(=O)Nc2ccccc2C(=O)[O-])[C@H]1C=C(Cl)Cl	ZINC000000041901	563212890	/nfs/dbraw/zinc/21/28/90/563212890.db2.gz	BRFXGVVYPHCOTN-SKDRFNHKSA-N	-1	0	328.195	3.915	50	0		EHAARM
Cc1ccc2sc(-c3ccc(NC(=O)/C=C/C(=O)[O-])cc3)nc2c1	ZINC000000134056	563239847	/nfs/dbraw/zinc/23/98/47/563239847.db2.gz	PEXIQNCFSAYDOH-CMDGGOBGSA-N	-1	0	338.388	3.851	50	0		EHAARM
Cc1ccccc1[N-]S(=O)(=O)c1ccc(Br)s1	ZINC000000373828	563298045	/nfs/dbraw/zinc/29/80/45/563298045.db2.gz	HKFXCMZOUFCGGX-UHFFFAOYSA-N	-1	0	332.244	3.620	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@@]1(Cc1cccc(Cl)c1)C(=O)[O-]	ZINC000000391970	563304179	/nfs/dbraw/zinc/30/41/79/563304179.db2.gz	KLTFJXPAPHYWKB-QGZVFWFLSA-N	-1	0	339.819	3.737	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1cc(Cl)ccc1C	ZINC000000583223	563351467	/nfs/dbraw/zinc/35/14/67/563351467.db2.gz	ZYOYNWXMTRRPIP-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CCc1cccc(CC)c1NS(=O)(=O)c1ccc(OC)c(C)c1	ZINC000000617437	563359182	/nfs/dbraw/zinc/35/91/82/563359182.db2.gz	CAFBOXVCEVMEHP-UHFFFAOYSA-N	-1	0	333.453	3.929	50	0		EHAARM
O=S(=O)(C=C([O-])c1ccc(Cl)cc1)c1ccc(Cl)cc1	ZINC000001384760	563385100	/nfs/dbraw/zinc/38/51/00/563385100.db2.gz	ITYDKMOKHRLFIV-UHFFFAOYSA-N	-1	0	329.204	3.650	50	0		EHAARM
O=C([O-])/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccccc1Cl	ZINC000002982037	563465704	/nfs/dbraw/zinc/46/57/04/563465704.db2.gz	SNMVKXZTHTWCMG-NTEUORMPSA-N	-1	0	336.174	3.849	50	0		EHAARM
CCOc1cc(/C=C/C(=O)[O-])ccc1OCCOc1ccc(F)cc1	ZINC000003250332	563478074	/nfs/dbraw/zinc/47/80/74/563478074.db2.gz	FAHGSYHYYHTIGB-ONNFQVAWSA-N	-1	0	346.354	3.780	50	0		EHAARM
CCc1ccc(-c2nc(C[NH+]3CCC(C(=O)[O-])CC3)c(C)o2)cc1	ZINC000003913602	563491237	/nfs/dbraw/zinc/49/12/37/563491237.db2.gz	UJXZFYVVLYBLLR-UHFFFAOYSA-N	-1	0	328.412	3.509	50	0		EHAARM
O=S(=O)([N-]c1ccc(F)c(F)c1)c1ccccc1Br	ZINC000007405431	563601568	/nfs/dbraw/zinc/60/15/68/563601568.db2.gz	XSIJZTKUGIFURT-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2ccccc2Br)c1	ZINC000007052218	563594354	/nfs/dbraw/zinc/59/43/54/563594354.db2.gz	VQROSENWMWEHJS-UHFFFAOYSA-N	-1	0	340.242	3.867	50	0		EHAARM
Cc1sc(NC(=O)CCCC(=O)[O-])nc1-c1ccc(C)c(C)c1	ZINC000002730572	563609008	/nfs/dbraw/zinc/60/90/08/563609008.db2.gz	LSOKBEAOINSGLO-UHFFFAOYSA-N	-1	0	332.425	3.929	50	0		EHAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(C)c(Cl)c1	ZINC000010301932	563646357	/nfs/dbraw/zinc/64/63/57/563646357.db2.gz	ZGCQSNDZNIHSOV-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CSc2ccc3ccccc3n2)cc1	ZINC000011667546	563650425	/nfs/dbraw/zinc/65/04/25/563650425.db2.gz	HJAAZBMVKNPCOU-UHFFFAOYSA-N	-1	0	338.388	3.664	50	0		EHAARM
CCCCOc1ccc(I)cc1/C=C/C(=O)[O-]	ZINC000012394658	563659701	/nfs/dbraw/zinc/65/97/01/563659701.db2.gz	SWYHPGWSGHBQEV-QPJJXVBHSA-N	-1	0	346.164	3.568	50	0		EHAARM
O=c1c2c3c(sc2[n-]c(=S)n1Cc1cccnc1)CCCCC3	ZINC000017071732	563834968	/nfs/dbraw/zinc/83/49/68/563834968.db2.gz	DEUGOGMUMIMKCK-UHFFFAOYSA-N	-1	0	343.477	3.833	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1CC(=O)c1ccc(Br)cc1	ZINC000043879314	563925961	/nfs/dbraw/zinc/92/59/61/563925961.db2.gz	OKDDEYGDICYAOL-DGCLKSJQSA-N	-1	0	325.202	3.913	50	0		EHAARM
Cc1cc(C)c(-c2c(-c3ccccc3)ncn2Cc2nn[nH]n2)c(C)c1	ZINC000067822122	563962802	/nfs/dbraw/zinc/96/28/02/563962802.db2.gz	APCKFKIFLUHSRS-UHFFFAOYSA-N	-1	0	344.422	3.704	50	0		EHAARM
C[C@@H](Oc1ccc(CC(=O)[O-])cc1)c1nc(-c2cccs2)no1	ZINC000097103274	563967576	/nfs/dbraw/zinc/96/75/76/563967576.db2.gz	DEYVNMJTRCTERF-SNVBAGLBSA-N	-1	0	330.365	3.565	50	0		EHAARM
O=C([O-])c1ccc(OC(=O)COc2ccc(Cl)cc2Cl)cc1	ZINC000004754866	563973356	/nfs/dbraw/zinc/97/33/56/563973356.db2.gz	ISFHSVQHOMRYQZ-UHFFFAOYSA-N	-1	0	341.146	3.676	50	0		EHAARM
CC[C@H](c1nc(C)c(C)s1)n1cc(-c2ccccc2C(=O)[O-])nn1	ZINC000095364405	563976806	/nfs/dbraw/zinc/97/68/06/563976806.db2.gz	NMUSUBANXDTNSB-OAHLLOKOSA-N	-1	0	342.424	3.716	50	0		EHAARM
Cc1nn(C)c2nc([N-]c3nsc4nc(C)cc(C)c34)sc12	ZINC000096162777	563979908	/nfs/dbraw/zinc/97/99/08/563979908.db2.gz	LEHRCPJDRJTLOE-UHFFFAOYSA-N	-1	0	330.442	3.703	50	0		EHAARM
CCOc1ccc([C@@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])cc1	ZINC000072233799	563986096	/nfs/dbraw/zinc/98/60/96/563986096.db2.gz	USZJCPNSXWNJIA-JKSUJKDBSA-N	-1	0	349.427	3.653	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@@H](Cc2ccc(Cl)cc2)[C@H]1C(=O)[O-]	ZINC000221038571	563989639	/nfs/dbraw/zinc/98/96/39/563989639.db2.gz	WGOZBWNNXCXPKD-JSGCOSHPSA-N	-1	0	339.819	3.593	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2	ZINC000005126870	563994456	/nfs/dbraw/zinc/99/44/56/563994456.db2.gz	BQQOPTKYYWXQSN-UHFFFAOYSA-N	-1	0	331.437	3.683	50	0		EHAARM
Cc1ccc([C@@H]2CCCN2C(=O)CCc2ccccc2C(=O)[O-])o1	ZINC000262233397	563994954	/nfs/dbraw/zinc/99/49/54/563994954.db2.gz	XAGTYMIBGJOMTC-INIZCTEOSA-N	-1	0	327.380	3.583	50	0		EHAARM
O=C(CCCn1c(=O)c2sccc2[n-]c1=S)Nc1ccccc1	ZINC000000425443	563998957	/nfs/dbraw/zinc/99/89/57/563998957.db2.gz	ZRLJFZDGJXHJAV-UHFFFAOYSA-N	-1	0	345.449	3.539	50	0		EHAARM
COc1ccc(C)c2sc([N-]S(=O)(=O)c3ccc(C)cc3)nc21	ZINC000008864619	564007225	/nfs/dbraw/zinc/00/72/25/564007225.db2.gz	RQZCNDLUFJDUSJ-UHFFFAOYSA-N	-1	0	348.449	3.723	50	0		EHAARM
COC(=O)Nc1cccc(NC(=O)CC2(C(=O)[O-])CCCCCC2)c1	ZINC000048382380	564031682	/nfs/dbraw/zinc/03/16/82/564031682.db2.gz	GVIZUXSQQCAQSA-UHFFFAOYSA-N	-1	0	348.399	3.619	50	0		EHAARM
Cc1ccc(NC(=O)c2ccccc2C(=O)[O-])c(Br)c1	ZINC000026843286	564040807	/nfs/dbraw/zinc/04/08/07/564040807.db2.gz	LQVFCWDWBGOMQA-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2ccc(C)c(C)c2)c1=O	ZINC000012414629	564051097	/nfs/dbraw/zinc/05/10/97/564051097.db2.gz	DONIRSXUXSEXSU-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
CC(C)n1ccc(C(=O)Nc2ccc3sc(C(=O)[O-])cc3c2)n1	ZINC000241587782	564052027	/nfs/dbraw/zinc/05/20/27/564052027.db2.gz	OXDSHGNKUDWIRM-UHFFFAOYSA-N	-1	0	329.381	3.629	50	0		EHAARM
C[C@H](O)[C@@H]1CC[C@@H]2[C@@H]3CCC(=O)[C@](C)(CCC(=O)[O-])[C@H]3CC[C@]12C	ZINC000248378470	564053169	/nfs/dbraw/zinc/05/31/69/564053169.db2.gz	JPPQYWISPXWYPP-YYHHWPJFSA-N	-1	0	336.472	3.660	50	0		EHAARM
CCCn1ccc2cc([N-]S(=O)(=O)c3ccccc3OC)ccc21	ZINC000063476107	564057601	/nfs/dbraw/zinc/05/76/01/564057601.db2.gz	BZQZVBBEQSIKRW-UHFFFAOYSA-N	-1	0	344.436	3.861	50	0		EHAARM
O=c1cc([O-])c2sc3nc4c(c(-c5cccnc5)c3c2[nH]1)CCCC4	ZINC000005387506	564060937	/nfs/dbraw/zinc/06/09/37/564060937.db2.gz	FBOOGXXWMUIHOM-UHFFFAOYSA-N	-1	0	349.415	3.784	50	0		EHAARM
COc1ccccc1C[C@@H]1CCCN1C(=O)c1c([O-])cc(F)cc1F	ZINC000083980041	564065495	/nfs/dbraw/zinc/06/54/95/564065495.db2.gz	FLBUBPHCFKEWOL-AWEZNQCLSA-N	-1	0	347.361	3.526	50	0		EHAARM
C[C@H](c1ccccc1)N(C)C(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000063809032	564077218	/nfs/dbraw/zinc/07/72/18/564077218.db2.gz	XONCIOVKHGSURB-LLVKDONJSA-N	-1	0	339.420	3.831	50	0		EHAARM
COc1ccc(-c2cc(O)c(C)c(=O)n2-c2ccc(OC)cc2)cc1	ZINC000006666885	564095664	/nfs/dbraw/zinc/09/56/64/564095664.db2.gz	XFLFFOLABNRVRE-UHFFFAOYSA-N	-1	0	337.375	3.536	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cc(-c3ccsc3)no2)cc1F	ZINC000065153434	564102066	/nfs/dbraw/zinc/10/20/66/564102066.db2.gz	UVSDBSVVBBZPAR-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
CCc1ccccc1NC(=O)c1c([O-])c2sccc2n(CC)c1=O	ZINC000065215449	564102867	/nfs/dbraw/zinc/10/28/67/564102867.db2.gz	AYADHGVTXMGTES-UHFFFAOYSA-N	-1	0	342.420	3.603	50	0		EHAARM
CCc1cccc([N-]S(=O)(=O)c2cn(C(C)C)c3ncccc23)c1	ZINC000065242187	564103358	/nfs/dbraw/zinc/10/33/58/564103358.db2.gz	KOAJDTYRLNLRNI-UHFFFAOYSA-N	-1	0	343.452	3.980	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000007056405	564103959	/nfs/dbraw/zinc/10/39/59/564103959.db2.gz	FWJNGHYEGSIWMO-UHFFFAOYSA-N	-1	0	345.342	3.823	50	0		EHAARM
CC(=O)c1oc2ccccc2c1[N-]S(=O)(=O)Cc1cccc(F)c1	ZINC000170609126	564109681	/nfs/dbraw/zinc/10/96/81/564109681.db2.gz	IMBBLZNIWKFWJD-UHFFFAOYSA-N	-1	0	347.367	3.716	50	0		EHAARM
Cc1ccsc1/C=C1\C(=O)N(c2cccc(C(=O)[O-])c2)N=C1C	ZINC000008556768	564116310	/nfs/dbraw/zinc/11/63/10/564116310.db2.gz	KIYPIXAPZMJUQM-ZROIWOOFSA-N	-1	0	326.377	3.561	50	0		EHAARM
Cc1c2cccc(C)c2oc1C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000237751928	564117789	/nfs/dbraw/zinc/11/77/89/564117789.db2.gz	FFIAXWGHWJXUHE-AWEZNQCLSA-N	-1	0	329.396	3.767	50	0		EHAARM
CCCCNC(=O)CCCCCn1c(=O)c2ccccc2[n-]c1=S	ZINC000002970451	564125253	/nfs/dbraw/zinc/12/52/53/564125253.db2.gz	WBFFIWZCXWQWQO-UHFFFAOYSA-N	-1	0	347.484	3.536	50	0		EHAARM
Cc1oc(-c2ccsc2)nc1CC(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000225457199	564134943	/nfs/dbraw/zinc/13/49/43/564134943.db2.gz	ZAVRQRHPBOAGFF-UHFFFAOYSA-N	-1	0	342.376	3.591	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)CCCc1cccs1)c1ccc(F)cc1	ZINC000095393698	564139379	/nfs/dbraw/zinc/13/93/79/564139379.db2.gz	SDIHBGUBIDUHQG-OAHLLOKOSA-N	-1	0	335.400	3.542	50	0		EHAARM
Cc1nc(S(=O)(=O)[N-]c2ccccc2)c(-c2ccccc2)s1	ZINC000096346197	564146832	/nfs/dbraw/zinc/14/68/32/564146832.db2.gz	JLDPPOPOKIXIIM-UHFFFAOYSA-N	-1	0	330.434	3.919	50	0		EHAARM
O=C([O-])[C@@H]1CS[C@H](c2cccc(OCc3ccc(Cl)cc3)c2)N1	ZINC000003642581	564159276	/nfs/dbraw/zinc/15/92/76/564159276.db2.gz	MTJOHDVAHGAFOD-JKSUJKDBSA-N	-1	0	349.839	3.707	50	0		EHAARM
CSc1ccc([C@H](CC(=O)[O-])N2Cc3ccccc3C2=O)cc1	ZINC000003855998	564159531	/nfs/dbraw/zinc/15/95/31/564159531.db2.gz	BXHNIKZOCMFRHW-INIZCTEOSA-N	-1	0	327.405	3.580	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000069158236	564168479	/nfs/dbraw/zinc/16/84/79/564168479.db2.gz	GEAOKMRNZRGOMW-CHWSQXEVSA-N	-1	0	342.420	3.779	50	0		EHAARM
CCO[C@H]1C[C@@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000073984572	564176464	/nfs/dbraw/zinc/17/64/64/564176464.db2.gz	WEPOGIXLFWMSAL-KGLIPLIRSA-N	-1	0	332.425	3.568	50	0		EHAARM
C[C@@H](C(=O)[O-])c1cccc(NC(=O)[C@H]2CCc3cc(F)ccc32)c1	ZINC000574651745	974786816	/nfs/dbraw/zinc/78/68/16/974786816.db2.gz	IQSQEEVGWQKKOO-DIFFPNOSSA-N	-1	0	327.355	3.682	50	0		EHAARM
Cc1cc(C(=O)Nc2ccc(O[C@@H](C)C(=O)[O-])c(F)c2)sc1C	ZINC000630259230	975202795	/nfs/dbraw/zinc/20/27/95/975202795.db2.gz	LOYAIKHCOQCKJG-VIFPVBQESA-N	-1	0	337.372	3.608	50	0		EHAARM
O=C([O-])/C=C/c1cnc(/C=C/c2cccc3c2OCCCO3)s1	ZINC000079943404	1028237426	/nfs/dbraw/zinc/23/74/26/1028237426.db2.gz	WFDGZAIZRXMUBN-KQQUZDAGSA-N	-1	0	329.377	3.573	50	0		EHAARM
N#Cc1csc(/C=C/C(=O)c2ccc(SCC(=O)[O-])c(F)c2)c1	ZINC000170651764	1033405137	/nfs/dbraw/zinc/40/51/37/1033405137.db2.gz	ONOUHFWRJNDOEW-NSCUHMNNSA-N	-1	0	347.392	3.832	50	0		EHAARM
COc1ccc(OC)c(C(C)=NNc2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000254443594	1039821609	/nfs/dbraw/zinc/82/16/09/1039821609.db2.gz	ARCIWCRAFXXFNJ-UHFFFAOYSA-N	-1	0	348.786	3.892	50	0		EHAARM
CC[C@](C)(CC(=O)[O-])CC(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000006847341	1040147480	/nfs/dbraw/zinc/14/74/80/1040147480.db2.gz	RTMSNKDNGNSQJC-INIZCTEOSA-N	-1	0	343.807	3.577	50	0		EHAARM
O=C([O-])c1ccc2nc(/C=C/c3ccnn3C3CCOCC3)ccc2c1	ZINC000888100525	1043269700	/nfs/dbraw/zinc/26/97/00/1043269700.db2.gz	BILCSASOVKTDFJ-SNAWJCMRSA-N	-1	0	349.390	3.651	50	0		EHAARM
CN1Cc2c(nc3ccccc3c2C(=O)[O-])/C(=C/c2cccs2)C1	ZINC000006228415	1139040041	/nfs/dbraw/zinc/04/00/41/1139040041.db2.gz	XBFZKVYBAXNXDS-FMIVXFBMSA-N	-1	0	336.416	3.981	50	0		EHAARM
O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cc(Cl)ccc1[O-]	ZINC000022285515	202082369	/nfs/dbraw/zinc/08/23/69/202082369.db2.gz	VJCXZLZADGVJJT-UHFFFAOYSA-N	-1	0	330.771	3.646	50	0		EHAARM
COc1ccccc1-n1nc(-c2ccc(Cl)cc2)cc1C(=O)[O-]	ZINC000025762366	202135865	/nfs/dbraw/zinc/13/58/65/202135865.db2.gz	DHAHWDPHMYBRDT-UHFFFAOYSA-N	-1	0	328.755	3.900	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1cc(C)cc(C)c1	ZINC000032971325	202245266	/nfs/dbraw/zinc/24/52/66/202245266.db2.gz	QZMHCPNPXIEVAS-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
Cc1cc(F)ccc1[C@@H]1[C@H](C(=O)[O-])CCC(=O)N1Cc1ccsc1	ZINC000069919891	202294820	/nfs/dbraw/zinc/29/48/20/202294820.db2.gz	QGKAVKUDQRSEQY-NVXWUHKLSA-N	-1	0	347.411	3.760	50	0		EHAARM
Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(C(F)(F)F)ccc2O)c1	ZINC000076059512	202388059	/nfs/dbraw/zinc/38/80/59/202388059.db2.gz	PFETVYGLIKAQDM-UHFFFAOYSA-N	-1	0	345.342	3.829	50	0		EHAARM
O=C([O-])c1cnn(-c2nc(-c3ccccc3)cs2)c1C(F)(F)F	ZINC000000170221	201443038	/nfs/dbraw/zinc/44/30/38/201443038.db2.gz	FKEJESOARPPCIP-UHFFFAOYSA-N	-1	0	339.298	3.713	50	0		EHAARM
Cc1cc(C)n(Cc2ccc(-c3ccc(CCC(=O)[O-])cc3)nc2)n1	ZINC000215442551	241126719	/nfs/dbraw/zinc/12/67/19/241126719.db2.gz	JDUQRVXUTLMUKT-UHFFFAOYSA-N	-1	0	335.407	3.627	50	0		EHAARM
Cc1csc(-c2ccc(NC(=O)c3ccc(C(=O)[O-])o3)cc2)n1	ZINC000225484561	241892067	/nfs/dbraw/zinc/89/20/67/241892067.db2.gz	YPUJTQHPPVDGMW-UHFFFAOYSA-N	-1	0	328.349	3.662	50	0		EHAARM
CCC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002530815	201534902	/nfs/dbraw/zinc/53/49/02/201534902.db2.gz	JBIJSEUVWWLFGV-GOSISDBHSA-N	-1	0	339.391	3.778	50	0		EHAARM
C[C@H](Sc1nc(-c2ccc(F)cc2)cc(C(F)(F)F)n1)C(=O)[O-]	ZINC000002798537	201545748	/nfs/dbraw/zinc/54/57/48/201545748.db2.gz	FJSPJFPEEQZYCN-ZETCQYMHSA-N	-1	0	346.305	3.867	50	0		EHAARM
[O-]/N=c1\cc(-c2ccc3c(c2)OCCO3)oc2ccc(Cl)cc21	ZINC000004790939	201619322	/nfs/dbraw/zinc/61/93/22/201619322.db2.gz	XDPIRDJCRJBJRK-CPNJWEJPSA-N	-1	0	329.739	3.814	50	0		EHAARM
O=C([O-])CCCC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccs1	ZINC000005067866	201638345	/nfs/dbraw/zinc/63/83/45/201638345.db2.gz	QIGMLTFTAYIIFG-GFCCVEGCSA-N	-1	0	348.449	3.742	50	0		EHAARM
C[C@H](c1cccnc1)N(C)C(=O)c1ccc(Cl)c(Cl)c1[O-]	ZINC000069703656	203039452	/nfs/dbraw/zinc/03/94/52/203039452.db2.gz	AHBZTYJHYSGSJG-SECBINFHSA-N	-1	0	325.195	3.927	50	0		EHAARM
O=C([O-])[C@]1(Cc2ccc(F)cc2)CCCN(c2ccc(Cl)cn2)C1	ZINC000071764688	203110981	/nfs/dbraw/zinc/11/09/81/203110981.db2.gz	ZPMAHVKFJIDBTR-SFHVURJKSA-N	-1	0	348.805	3.788	50	0		EHAARM
Cc1cc(=O)c(C(=O)[O-])c(Cc2ccccc2)n1CCc1ccccc1	ZINC000072446977	203225295	/nfs/dbraw/zinc/22/52/95/203225295.db2.gz	BXWGSKFOUHBBHJ-UHFFFAOYSA-N	-1	0	347.414	3.688	50	0		EHAARM
CCC(CC)(CC(=O)Nc1ccc(N2CCCC2)c(F)c1)C(=O)[O-]	ZINC000048382486	204350616	/nfs/dbraw/zinc/35/06/16/204350616.db2.gz	VPNWGOCOLVJWLJ-UHFFFAOYSA-N	-1	0	336.407	3.646	50	0		EHAARM
CC(=C\c1ccccc1)/C=C1\SC(=O)N(CCCC(=O)[O-])C1=O	ZINC000005295848	205766795	/nfs/dbraw/zinc/76/67/95/205766795.db2.gz	GYNBIQYSIWHSCB-MQZPGMTCSA-N	-1	0	331.393	3.534	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)CSCc2ccc(Cl)cc2)c1	ZINC000000450530	206241854	/nfs/dbraw/zinc/24/18/54/206241854.db2.gz	XVYSIDQXEWKIKP-UHFFFAOYSA-N	-1	0	335.812	3.910	50	0		EHAARM
O=C([O-])c1cc(-c2ccccc2O)nc2[nH]c(-c3ccccc3)nc21	ZINC000011694709	211237292	/nfs/dbraw/zinc/23/72/92/211237292.db2.gz	GOONSRHDQFVFOR-UHFFFAOYSA-N	-1	0	331.331	3.696	50	0		EHAARM
CC[C@@H](C)[C@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)c1ccccc1	ZINC000095361108	218294048	/nfs/dbraw/zinc/29/40/48/218294048.db2.gz	IORYCVSFYDWOFH-PXAZEXFGSA-N	-1	0	329.396	3.732	50	0		EHAARM
O=C([O-])C1(NC(=O)/C=C\c2ccc(Cl)cc2Cl)CCCC1	ZINC000096305456	218741541	/nfs/dbraw/zinc/74/15/41/218741541.db2.gz	LLYYNEASXMZKRA-XQRVVYSFSA-N	-1	0	328.195	3.520	50	0		EHAARM
O=c1c2ccccc2[n-]c(=S)n1N=c1[nH]c2ccccc2s1	ZINC000010274424	258003434	/nfs/dbraw/zinc/00/34/34/258003434.db2.gz	NCYOSVZOBWRTKU-UHFFFAOYSA-N	-1	0	326.406	3.544	50	0		EHAARM
Cc1nn(C(C)C)c(C)c1[N-]S(=O)(=O)c1cccc(Cl)c1	ZINC000055649170	563647272	/nfs/dbraw/zinc/64/72/72/563647272.db2.gz	AXINNWYVJMIWTL-UHFFFAOYSA-N	-1	0	327.837	3.535	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)NCc2csc3ccccc23)[C@@H](C(=O)[O-])C1	ZINC000000069838	563214846	/nfs/dbraw/zinc/21/48/46/563214846.db2.gz	VWDPEQJAESBSCA-HOTGVXAUSA-N	-1	0	343.448	3.965	50	0		EHAARM
O=C([O-])c1ccc(Nc2ncnc3ccc(Br)cc32)cc1	ZINC000000099101	563225351	/nfs/dbraw/zinc/22/53/51/563225351.db2.gz	FLTISWNJFNYFTR-UHFFFAOYSA-N	-1	0	344.168	3.834	50	0		EHAARM
O=C(/C=C/c1cccs1)Nc1ccc(N2CCCC2)c(C(=O)[O-])c1	ZINC000000139268	563241513	/nfs/dbraw/zinc/24/15/13/563241513.db2.gz	GSRKALOFKGAFPZ-SOFGYWHQSA-N	-1	0	342.420	3.698	50	0		EHAARM
CC[C@H](C)c1ccc(OCC(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000001164987	563376967	/nfs/dbraw/zinc/37/69/67/563376967.db2.gz	OJEGCQLBJSIRGZ-ZDUSSCGKSA-N	-1	0	327.380	3.916	50	0		EHAARM
CCCCOc1ccc(/C=C/C(=O)[O-])cc1I	ZINC000002049208	563419478	/nfs/dbraw/zinc/41/94/78/563419478.db2.gz	GRRQLQVOPZONQP-FNORWQNLSA-N	-1	0	346.164	3.568	50	0		EHAARM
CCOc1cc(C(=O)[O-])cc(Br)c1OCCC(C)C	ZINC000003296799	563479117	/nfs/dbraw/zinc/47/91/17/563479117.db2.gz	RQWBEMFVGUCFQS-UHFFFAOYSA-N	-1	0	331.206	3.971	50	0		EHAARM
CC(C)(C)OC(=O)N1C[C@H](Cc2ccccc2Cl)C[C@H]1C(=O)[O-]	ZINC000004241328	563498324	/nfs/dbraw/zinc/49/83/24/563498324.db2.gz	MOXTXGGTGJQIBX-RISCZKNCSA-N	-1	0	339.819	3.593	50	0		EHAARM
COC(=O)[C@@H]1[C@H](c2ccccc2)C=C[C@H](c2ccccc2)[C@@H]1C(=O)[O-]	ZINC000004462277	563502900	/nfs/dbraw/zinc/50/29/00/563502900.db2.gz	ZXGPHADSLBDYNB-YDZRNGNQSA-N	-1	0	336.387	3.614	50	0		EHAARM
Cc1ccc2nc(NC(=O)[C@@H]3CC(C)=CC[C@@H]3C(=O)[O-])sc2c1	ZINC000004976937	563516644	/nfs/dbraw/zinc/51/66/44/563516644.db2.gz	IVCSMRNUYHKNBU-NWDGAFQWSA-N	-1	0	330.409	3.600	50	0		EHAARM
O=C([O-])c1cc(Br)ccc1OCc1ccc(F)cc1	ZINC000007603896	563607180	/nfs/dbraw/zinc/60/71/80/563607180.db2.gz	NYIGHZWKHZIQCM-UHFFFAOYSA-N	-1	0	325.133	3.865	50	0		EHAARM
O=C([O-])c1cc(NC(=O)c2ccc(Cl)cc2Cl)ccc1O	ZINC000002756639	563612425	/nfs/dbraw/zinc/61/24/25/563612425.db2.gz	HJXSODMZEPBYLT-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
C[C@@H](Oc1cccnc1)C(=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000097379061	563613082	/nfs/dbraw/zinc/61/30/82/563613082.db2.gz	WPOREYBTPYCSCD-MRVPVSSYSA-N	-1	0	327.167	3.500	50	0		EHAARM
CCCOc1cc(S(=O)(=O)[N-]c2ccccc2O)ccc1Cl	ZINC000008714699	563636364	/nfs/dbraw/zinc/63/63/64/563636364.db2.gz	UYRZEZKCPYSQOM-UHFFFAOYSA-N	-1	0	341.816	3.635	50	0		EHAARM
COc1ccccc1-n1c(=S)[n-]nc1-c1cc(-c2ccco2)[nH]n1	ZINC000009110028	563641904	/nfs/dbraw/zinc/64/19/04/563641904.db2.gz	NXTMOTYZHUYKLO-UHFFFAOYSA-N	-1	0	339.380	3.589	50	0		EHAARM
O=C([O-])[C@@H](Oc1ccc(F)cc1Br)c1ccccc1	ZINC000011825491	563651370	/nfs/dbraw/zinc/65/13/70/563651370.db2.gz	SDIOMWCKQMZSMJ-ZDUSSCGKSA-N	-1	0	325.133	3.793	50	0		EHAARM
CC(C)(C)C1CCC([NH2+]CCc2ccccc2)(P(=O)([O-])[O-])CC1	ZINC000012998749	563684195	/nfs/dbraw/zinc/68/41/95/563684195.db2.gz	DCKSKOIWKKYMAJ-UHFFFAOYSA-N	-1	0	339.416	3.929	50	0		EHAARM
O=C([O-])c1ccc(F)cc1NC(=O)c1cccc(Br)c1	ZINC000013303211	563694221	/nfs/dbraw/zinc/69/42/21/563694221.db2.gz	LAHBDMGRJXRMBR-UHFFFAOYSA-N	-1	0	338.132	3.539	50	0		EHAARM
CC(C)Oc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(F)cc2)cc1	ZINC000004581137	563802160	/nfs/dbraw/zinc/80/21/60/563802160.db2.gz	SOFQXERJWDXQTP-QGZVFWFLSA-N	-1	0	345.370	3.559	50	0		EHAARM
C[C@@H](C(=O)N1CCC[C@@H](CCC(=O)[O-])C1)c1cc2ccccc2o1	ZINC000097039524	563966917	/nfs/dbraw/zinc/96/69/17/563966917.db2.gz	XHEYQPURYRSSIK-KGLIPLIRSA-N	-1	0	329.396	3.640	50	0		EHAARM
Cc1cc(C(=O)N2CCC[C@H](c3ccc(C(=O)[O-])cc3)C2)c(C)o1	ZINC000095354479	563976675	/nfs/dbraw/zinc/97/66/75/563976675.db2.gz	XXXDQPYUFCZHJH-INIZCTEOSA-N	-1	0	327.380	3.614	50	0		EHAARM
Cc1ccc(C(=O)C=C([O-])c2ccc(Br)cc2)c(O)c1	ZINC000100640325	563982685	/nfs/dbraw/zinc/98/26/85/563982685.db2.gz	PQJACAMSQQHBIW-UHFFFAOYSA-N	-1	0	333.181	3.919	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@@H](CCCc2ccccc2)[C@H]1C(=O)[O-]	ZINC000209933189	563984290	/nfs/dbraw/zinc/98/42/90/563984290.db2.gz	JJVIAYZDVHANGB-CVEARBPZSA-N	-1	0	333.428	3.720	50	0		EHAARM
Cc1ccccc1C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)[O-]	ZINC000221032867	563989606	/nfs/dbraw/zinc/98/96/06/563989606.db2.gz	VEISDHRYJDNLDB-HOTGVXAUSA-N	-1	0	333.428	3.638	50	0		EHAARM
CCOc1ccc([C@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])cc1	ZINC000221039749	563989628	/nfs/dbraw/zinc/98/96/28/563989628.db2.gz	USZJCPNSXWNJIA-HZPDHXFCSA-N	-1	0	349.427	3.653	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)CCCc2ccc(Cl)cc2)C1	ZINC000238000672	563994395	/nfs/dbraw/zinc/99/43/95/563994395.db2.gz	FMRHZPNSVKHMPY-OAHLLOKOSA-N	-1	0	337.847	3.766	50	0		EHAARM
O=C(c1cnc2ccccc2c1O)N(Cc1ccco1)Cc1ccco1	ZINC000125546345	563995575	/nfs/dbraw/zinc/99/55/75/563995575.db2.gz	HRNSUHHEKDHSGX-UHFFFAOYSA-N	-1	0	348.358	3.557	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@H](C(=O)[O-])[C@@H](C)CC)n1	ZINC000005184798	564000120	/nfs/dbraw/zinc/00/01/20/564000120.db2.gz	QULZSYPFJAEODG-HZMBPMFUSA-N	-1	0	327.384	3.850	50	0		EHAARM
Cc1ccc(CNC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)c(C)c1	ZINC000047085449	564025689	/nfs/dbraw/zinc/02/56/89/564025689.db2.gz	JPHFTSPYZZEGPR-UHFFFAOYSA-N	-1	0	339.420	3.545	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1-2	ZINC000001724498	564056585	/nfs/dbraw/zinc/05/65/85/564056585.db2.gz	AFLSVPDXCXLNDA-UHFFFAOYSA-N	-1	0	343.338	3.849	50	0		EHAARM
COc1ccc(CCC(=O)Nc2sc3c(c2C(=O)[O-])CCC3)cc1	ZINC000005917042	564056965	/nfs/dbraw/zinc/05/69/65/564056965.db2.gz	MLYVLKHUPINQKB-UHFFFAOYSA-N	-1	0	345.420	3.515	50	0		EHAARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(C)cc2)cc1	ZINC000003623791	564060066	/nfs/dbraw/zinc/06/00/66/564060066.db2.gz	YYCDUTQPZQNVCW-SFHVURJKSA-N	-1	0	341.407	3.730	50	0		EHAARM
COc1ccc(/C=C\C(=O)Nc2sc(C)c(C)c2C(=O)[O-])cc1	ZINC000006167300	564077112	/nfs/dbraw/zinc/07/71/12/564077112.db2.gz	FURBUDYMZDPVNI-TWGQIWQCSA-N	-1	0	331.393	3.724	50	0		EHAARM
O=C([O-])[C@@H]1CCCN(c2nc(-c3ccsc3)nc3ccccc32)C1	ZINC000012979927	564084959	/nfs/dbraw/zinc/08/49/59/564084959.db2.gz	VAZWJLOEBSYNSE-GFCCVEGCSA-N	-1	0	339.420	3.659	50	0		EHAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC000089351065	564089753	/nfs/dbraw/zinc/08/97/53/564089753.db2.gz	MZPRIWZQWQHZIF-KGLIPLIRSA-N	-1	0	343.345	3.712	50	0		EHAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC000089351072	564089799	/nfs/dbraw/zinc/08/97/99/564089799.db2.gz	MZPRIWZQWQHZIF-ZIAGYGMSSA-N	-1	0	343.345	3.712	50	0		EHAARM
COc1ccc(-n2c(CNc3ccc(C)cc3)n[n-]c2=S)cc1	ZINC000006533819	564091645	/nfs/dbraw/zinc/09/16/45/564091645.db2.gz	SKHSYSVBDUMDIC-UHFFFAOYSA-N	-1	0	326.425	3.859	50	0		EHAARM
CCc1cc(C(=O)[O-])c(NC(=O)/C=C\c2ccc(OC)cc2)s1	ZINC000016696291	564093019	/nfs/dbraw/zinc/09/30/19/564093019.db2.gz	OURUQWHDCYXNFZ-TWGQIWQCSA-N	-1	0	331.393	3.669	50	0		EHAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)cs2)c1	ZINC000065112317	564101307	/nfs/dbraw/zinc/10/13/07/564101307.db2.gz	FVWTVMDTVFWMGR-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
Cc1ccccc1[N-]S(=O)(=O)c1ccc(-c2nnc(C(C)C)o2)o1	ZINC000065246281	564103362	/nfs/dbraw/zinc/10/33/62/564103362.db2.gz	XUYMFHYKLFCFDY-UHFFFAOYSA-N	-1	0	347.396	3.562	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2ccc(C)c(F)c2)c2cccnc21	ZINC000065242246	564103373	/nfs/dbraw/zinc/10/33/73/564103373.db2.gz	RNSRLWIXZSFJAF-UHFFFAOYSA-N	-1	0	347.415	3.695	50	0		EHAARM
O=C([O-])Cc1c(-c2cccs2)oc2c1c(=O)oc1ccccc21	ZINC000524731332	564103741	/nfs/dbraw/zinc/10/37/41/564103741.db2.gz	TYBRJEJMVHJCOX-UHFFFAOYSA-N	-1	0	326.329	3.895	50	0	biogenic	EHAARM
COc1ccc(-c2nc3oc(-c4ccc(C)cc4)nc3c(=O)[nH]2)cc1	ZINC000170623647	564110431	/nfs/dbraw/zinc/11/04/31/564110431.db2.gz	FMWZUAYUSSOOBU-UHFFFAOYSA-N	-1	0	333.347	3.562	50	0		EHAARM
CCn1c2ccccc2nc1-c1cc(C(=O)c2ccccc2[O-])c[nH]1	ZINC000007719349	564122230	/nfs/dbraw/zinc/12/22/30/564122230.db2.gz	NTEZDTWDUFKLQF-UHFFFAOYSA-N	-1	0	331.375	3.988	50	0		EHAARM
COc1cc(C)c(S(=O)(=O)[N-]c2ncccc2C)cc1C(C)C	ZINC000009061848	564168741	/nfs/dbraw/zinc/16/87/41/564168741.db2.gz	SJWOGESDYRZULS-UHFFFAOYSA-N	-1	0	334.441	3.631	50	0		EHAARM
O=C([O-])c1ccccc1-c1nnc(-c2ccc(Br)cc2)o1	ZINC000163324092	564177312	/nfs/dbraw/zinc/17/73/12/564177312.db2.gz	QABMCYSYQOFCJW-UHFFFAOYSA-N	-1	0	345.152	3.864	50	0		EHAARM
O=c1[n-]c(Nc2cccc(C(F)(F)F)c2)nnc1-c1ccccc1	ZINC000016675972	1031262865	/nfs/dbraw/zinc/26/28/65/1031262865.db2.gz	PSZZEGOMLOFJIJ-UHFFFAOYSA-N	-1	0	332.285	3.594	50	0		EHAARM
CCOc1ccc(C=NNc2ccc(Cl)c(C(=O)[O-])c2)cc1OC	ZINC000254734121	1041140151	/nfs/dbraw/zinc/14/01/51/1041140151.db2.gz	RVHIYSZALSXZOW-UHFFFAOYSA-N	-1	0	348.786	3.892	50	0		EHAARM
O=S(=O)([N-]c1ccc2[nH]c(C3CCC3)nc2c1)c1ccccc1F	ZINC000176581825	1120995168	/nfs/dbraw/zinc/99/51/68/1120995168.db2.gz	RNCGESUAFOAOBJ-UHFFFAOYSA-N	-1	0	345.399	3.770	50	0		EHAARM
C[C@H](CC(=O)[O-])CC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000565550198	1130767059	/nfs/dbraw/zinc/76/70/59/1130767059.db2.gz	VBXGCRVYJJQGGI-HNAYVOBHSA-N	-1	0	337.419	3.814	50	0		EHAARM
COc1cccc(NC(=O)[C@@H](C)Sc2ccccc2C(=O)[O-])c1	ZINC000012797273	201867577	/nfs/dbraw/zinc/86/75/77/201867577.db2.gz	FHBUSYQJUKIZQV-LLVKDONJSA-N	-1	0	331.393	3.513	50	0		EHAARM
O=C(Nc1cccc(Cn2cccn2)c1)c1ccc([O-])c(Cl)c1	ZINC000029913565	202191985	/nfs/dbraw/zinc/19/19/85/202191985.db2.gz	AQHSKJPGVNPCBZ-UHFFFAOYSA-N	-1	0	327.771	3.543	50	0		EHAARM
O=C(NC[C@@H]1OCCc2sccc21)c1ccc2[n-]c(=S)oc2c1	ZINC000074093958	202372222	/nfs/dbraw/zinc/37/22/22/202372222.db2.gz	CVVJHLVEUWDCFR-ZDUSSCGKSA-N	-1	0	346.433	3.596	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@H](C)C4)c(C)c1	ZINC000299738137	201354334	/nfs/dbraw/zinc/35/43/34/201354334.db2.gz	BADOKBLEVNPBGC-CYBMUJFWSA-N	-1	0	348.402	3.693	50	0		EHAARM
CC(C)(C)c1csc([N-]S(=O)(=O)c2ccc(Cl)cc2)n1	ZINC000000140498	201440041	/nfs/dbraw/zinc/44/00/41/201440041.db2.gz	ZVJLBQPEBJKODY-UHFFFAOYSA-N	-1	0	330.862	3.895	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000020509588	212141033	/nfs/dbraw/zinc/14/10/33/212141033.db2.gz	PSHSPWLMOCXLJN-QZTJIDSGSA-N	-1	0	335.403	3.559	50	0		EHAARM
CCc1ccc([C@@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)o1	ZINC000071910693	203147574	/nfs/dbraw/zinc/14/75/74/203147574.db2.gz	WWWKQCZHWKOUEQ-ZDUSSCGKSA-N	-1	0	329.425	3.889	50	0		EHAARM
O=C([O-])c1ccccc1[C@H]1CCN(C(=O)c2ccc(F)cc2Cl)C1	ZINC000072174287	203182510	/nfs/dbraw/zinc/18/25/10/203182510.db2.gz	ISJCMXZGZZPRHB-NSHDSACASA-N	-1	0	347.773	3.807	50	0		EHAARM
O=C([O-])c1ccnc(-c2ccnc(NCc3ccc(Cl)s3)n2)c1	ZINC000072480618	203233521	/nfs/dbraw/zinc/23/35/21/203233521.db2.gz	MWKFKLKOOXIIKS-UHFFFAOYSA-N	-1	0	346.799	3.564	50	0		EHAARM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3ccc(F)cc3C)c(C)o2)n[nH]1	ZINC000075519144	203316404	/nfs/dbraw/zinc/31/64/04/203316404.db2.gz	WKYMGYBKHCIYOB-UHFFFAOYSA-N	-1	0	349.387	3.535	50	0		EHAARM
O=c1c2ccccc2[n-]c(=S)n1[C@H]1CCOC2(CCCCC2)C1	ZINC000128444903	205148171	/nfs/dbraw/zinc/14/81/71/205148171.db2.gz	KXXIUXWDAYSIAK-ZDUSSCGKSA-N	-1	0	330.453	3.740	50	0		EHAARM
O=C([O-])c1cccc(Nc2ncnc3ccc(Br)cc32)c1	ZINC000000065028	205399456	/nfs/dbraw/zinc/39/94/56/205399456.db2.gz	LSPRHJULHMEMDR-UHFFFAOYSA-N	-1	0	344.168	3.834	50	0		EHAARM
O=S(=O)([N-]c1n[nH]c2ccccc21)c1ccc(Cl)c(Cl)c1	ZINC000000140400	206208370	/nfs/dbraw/zinc/20/83/70/206208370.db2.gz	YLUUEMYTRCVSBA-UHFFFAOYSA-N	-1	0	342.207	3.671	50	0		EHAARM
O=C([O-])c1ccc(CNC(=O)Nc2ccccc2C(F)(F)F)cc1	ZINC000000609656	206245741	/nfs/dbraw/zinc/24/57/41/206245741.db2.gz	DLOYPXQQBVOFNB-UHFFFAOYSA-N	-1	0	338.285	3.725	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1cccc(C(F)(F)F)c1	ZINC000000528603	206238954	/nfs/dbraw/zinc/23/89/54/206238954.db2.gz	CFEDFRXSHUOJHH-UHFFFAOYSA-N	-1	0	345.342	3.823	50	0		EHAARM
O=c1[n-]c(SCc2cccc(Cl)c2)nnc1-c1ccccc1	ZINC000011990965	207054026	/nfs/dbraw/zinc/05/40/26/207054026.db2.gz	ZCIVRKKYVUKORL-UHFFFAOYSA-N	-1	0	329.812	3.778	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000012773578	207246478	/nfs/dbraw/zinc/24/64/78/207246478.db2.gz	LVVQTXAAIVLYMP-ZJUUUORDSA-N	-1	0	347.720	3.964	50	0		EHAARM
O=C([O-])c1ccc([C@H]2c3ccccc3C(=O)N2Cc2ccccc2)o1	ZINC000334163152	258016151	/nfs/dbraw/zinc/01/61/51/258016151.db2.gz	MRABAWUKIDMVPO-GOSISDBHSA-N	-1	0	333.343	3.723	50	0		EHAARM
O=C([O-])c1ccc(N2CCCN(Cc3ccc(Cl)cc3)C2=O)cc1	ZINC000034798150	132388615	/nfs/dbraw/zinc/38/86/15/132388615.db2.gz	NSUVZEWGRTUEEB-UHFFFAOYSA-N	-1	0	344.798	3.871	50	0		EHAARM
COc1ccc(NC(=O)C[C@H](CC(=O)[O-])c2ccccc2)c(C)c1	ZINC000226750180	536781607	/nfs/dbraw/zinc/78/16/07/536781607.db2.gz	INIHMCCVSZARTM-OAHLLOKOSA-N	-1	0	327.380	3.591	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[O-]	ZINC000002386871	563431282	/nfs/dbraw/zinc/43/12/82/563431282.db2.gz	KSDWBXFRQWMWHO-NSHDSACASA-N	-1	0	334.199	3.514	50	0		EHAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c1	ZINC000000081736	563219043	/nfs/dbraw/zinc/21/90/43/563219043.db2.gz	PVSKOXDEOQFXNI-UHFFFAOYSA-N	-1	0	349.452	3.738	50	0		EHAARM
O=C([O-])c1nnn(-c2cccc(C(F)(F)F)c2)c1-c1ccccc1	ZINC000000138595	563241254	/nfs/dbraw/zinc/24/12/54/563241254.db2.gz	HWYGQIJCKVFIJU-UHFFFAOYSA-N	-1	0	333.269	3.651	50	0		EHAARM
CC(=O)N(Cc1ccc(Br)cc1)c1ccccc1C(=O)[O-]	ZINC000000349790	563289132	/nfs/dbraw/zinc/28/91/32/563289132.db2.gz	QWMAUKFNMAIXIZ-UHFFFAOYSA-N	-1	0	348.196	3.700	50	0		EHAARM
O=C([O-])c1ccccc1-c1ccccc1C(=O)NCc1ccccc1	ZINC000001228874	563380312	/nfs/dbraw/zinc/38/03/12/563380312.db2.gz	XSRJRJVZVPKPKL-UHFFFAOYSA-N	-1	0	331.371	3.982	50	0		EHAARM
O=C([O-])[C@@H]1CS[C@@H](c2ccc(OCc3ccccc3Cl)cc2)N1	ZINC000002472424	563433421	/nfs/dbraw/zinc/43/34/21/563433421.db2.gz	CYMVBODYZNMIRO-HOTGVXAUSA-N	-1	0	349.839	3.707	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)[O-]	ZINC000002517124	563437769	/nfs/dbraw/zinc/43/77/69/563437769.db2.gz	UGZIQCCPEDCGGN-LLVKDONJSA-N	-1	0	334.199	3.514	50	0		EHAARM
CCCCCOc1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])cc1	ZINC000003017290	563469835	/nfs/dbraw/zinc/46/98/35/563469835.db2.gz	FRQAZRBRWXLBLT-IAGOWNOFSA-N	-1	0	331.412	3.861	50	0		EHAARM
CCCCCOc1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])cc1	ZINC000003017296	563469850	/nfs/dbraw/zinc/46/98/50/563469850.db2.gz	FRQAZRBRWXLBLT-SJORKVTESA-N	-1	0	331.412	3.861	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@]1(Cc1ccc(Cl)cc1)C(=O)[O-]	ZINC000004240994	563498474	/nfs/dbraw/zinc/49/84/74/563498474.db2.gz	ITYZUJACZSDOIE-KRWDZBQOSA-N	-1	0	339.819	3.737	50	0		EHAARM
O=C([O-])c1cc(Cl)c(Cl)cc1C(=O)NCCc1ccccc1	ZINC000004819020	563512022	/nfs/dbraw/zinc/51/20/22/563512022.db2.gz	WXNGWXHANLKUKC-UHFFFAOYSA-N	-1	0	338.190	3.664	50	0		EHAARM
COc1ccc(Cl)cc1NC(=S)Nc1ccc(C(=O)[O-])cc1	ZINC000005041694	563519872	/nfs/dbraw/zinc/51/98/72/563519872.db2.gz	DQPFLIFDTYCMFK-UHFFFAOYSA-N	-1	0	336.800	3.856	50	0		EHAARM
Cc1cc2c(cc1-c1c(C)oc3c(C)c([O-])ccc3c1=O)OCCO2	ZINC000006556632	563571856	/nfs/dbraw/zinc/57/18/56/563571856.db2.gz	WEPODFBTOANJNL-UHFFFAOYSA-N	-1	0	338.359	3.862	50	0	biogenic	EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000002747130	563611636	/nfs/dbraw/zinc/61/16/36/563611636.db2.gz	LLRZMGIWYNSYSC-CHWSQXEVSA-N	-1	0	346.383	3.555	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccccc2Br)cc1C	ZINC000016101076	563803630	/nfs/dbraw/zinc/80/36/30/563803630.db2.gz	UXKXEUHBGFBPSW-UHFFFAOYSA-N	-1	0	340.242	3.867	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2OC)cc1	ZINC000016192455	563805564	/nfs/dbraw/zinc/80/55/64/563805564.db2.gz	GEXGKQXXMQAVHL-UHFFFAOYSA-N	-1	0	325.817	3.712	50	0		EHAARM
CCCCOc1ccc(S(=O)(=O)[N-]c2ncccc2C)cc1C	ZINC000016650727	563819448	/nfs/dbraw/zinc/81/94/48/563819448.db2.gz	JHMMFDALUODKJS-UHFFFAOYSA-N	-1	0	334.441	3.678	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000000245527	563917128	/nfs/dbraw/zinc/91/71/28/563917128.db2.gz	IUPYUTYGBUGAJI-UHFFFAOYSA-N	-1	0	342.351	3.900	50	0		EHAARM
O=C([O-])[C@@H]1CCC[C@H](CC(=O)c2cccc(Br)c2)C1	ZINC000043879450	563925980	/nfs/dbraw/zinc/92/59/80/563925980.db2.gz	JOFLRYUOGPNRLS-CMPLNLGQSA-N	-1	0	325.202	3.913	50	0		EHAARM
CCc1nc(C)c([C@@H](C)N(C)Cc2nc(=O)c3sccc3[n-]2)s1	ZINC000096424496	563952009	/nfs/dbraw/zinc/95/20/09/563952009.db2.gz	DDBIRWSXNZDJGJ-SNVBAGLBSA-N	-1	0	348.497	3.505	50	0		EHAARM
O=C([O-])c1cc2cc(NC(=O)CCc3cscn3)ccc2s1	ZINC000097018467	563966776	/nfs/dbraw/zinc/96/67/76/563966776.db2.gz	WBKJQOQUOXPBAL-UHFFFAOYSA-N	-1	0	332.406	3.627	50	0		EHAARM
CN(Cc1ccccc1C(F)(F)F)C(=O)c1cccc(C(=O)[O-])c1	ZINC000097578900	563981718	/nfs/dbraw/zinc/98/17/18/563981718.db2.gz	VNZWGWPEJXQRSA-UHFFFAOYSA-N	-1	0	337.297	3.676	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@@H](CCCc2ccccc2)[C@@H]1C(=O)[O-]	ZINC000209933157	563984295	/nfs/dbraw/zinc/98/42/95/563984295.db2.gz	JJVIAYZDVHANGB-HZPDHXFCSA-N	-1	0	333.428	3.720	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2c(Cl)cccc2Cl)C1	ZINC000049842033	563991150	/nfs/dbraw/zinc/99/11/50/563991150.db2.gz	QAZRERKRWGBZLN-JTQLQIEISA-N	-1	0	330.211	3.710	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2ccccc2OC(F)F)c(C)s1	ZINC000024070382	563991697	/nfs/dbraw/zinc/99/16/97/563991697.db2.gz	JEBPXXGDUYPXPS-UHFFFAOYSA-N	-1	0	333.381	3.767	50	0		EHAARM
CCn1c(=O)c(C(=O)Nc2ccc(Cl)cc2)c([O-])c2ccccc21	ZINC000100536978	563993540	/nfs/dbraw/zinc/99/35/40/563993540.db2.gz	PLNXJQBOWZOBGQ-UHFFFAOYSA-N	-1	0	342.782	3.633	50	0		EHAARM
CC(=O)Nc1ccc(NC(=O)c2cc(Cl)cc(Cl)c2[O-])cc1	ZINC000003151773	564015254	/nfs/dbraw/zinc/01/52/54/564015254.db2.gz	JAOLWVKMXKPINW-UHFFFAOYSA-N	-1	0	339.178	3.910	50	0		EHAARM
COc1ccc(Cn2c(=O)c3oc4ccccc4c3[n-]c2=S)cc1	ZINC000100892746	564023842	/nfs/dbraw/zinc/02/38/42/564023842.db2.gz	WGINJFBCUUKZAH-UHFFFAOYSA-N	-1	0	338.388	3.862	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2OC(F)(F)F)cc1	ZINC000005729474	564024234	/nfs/dbraw/zinc/02/42/34/564024234.db2.gz	RFSGZNGCIYHKBK-UHFFFAOYSA-N	-1	0	331.315	3.694	50	0		EHAARM
O=c1oc2cc([O-])ccc2cc1-c1nnc(NC2CCCCC2)s1	ZINC000006918052	564033846	/nfs/dbraw/zinc/03/38/46/564033846.db2.gz	MIVGSTJINDWPJG-UHFFFAOYSA-N	-1	0	343.408	3.762	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cn1)c1ccccc1C(F)(F)F	ZINC000008195494	564034836	/nfs/dbraw/zinc/03/48/36/564034836.db2.gz	JPLIBODYUYUXFH-UHFFFAOYSA-N	-1	0	336.722	3.555	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)Nc1ccc(C(=O)c2ccccc2)cc1	ZINC000000288319	564043065	/nfs/dbraw/zinc/04/30/65/564043065.db2.gz	AMGXOMRBTBWBTA-UHFFFAOYSA-N	-1	0	345.354	3.868	50	0		EHAARM
O=C([O-])c1ccc(/C=C2/SC(=O)N(c3ccc(F)cc3)C2=O)cc1	ZINC000001214129	564057247	/nfs/dbraw/zinc/05/72/47/564057247.db2.gz	DTKMBEAPTVFZKT-NTEUORMPSA-N	-1	0	343.335	3.765	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)N(Cc1ccccc1)Cc1ccccc1	ZINC000005773223	564070617	/nfs/dbraw/zinc/07/06/17/564070617.db2.gz	UNSMZYSBHPOFFL-WOJBJXKFSA-N	-1	0	349.430	3.882	50	0		EHAARM
COc1ccccc1NC(=O)[C@H](C)Sc1ccccc1C(=O)[O-]	ZINC000012811994	564072831	/nfs/dbraw/zinc/07/28/31/564072831.db2.gz	OZIWZPINOGYNTH-NSHDSACASA-N	-1	0	331.393	3.513	50	0		EHAARM
O=C([O-])c1cccnc1N1CCC(c2nc3ccccc3s2)CC1	ZINC000012925285	564078484	/nfs/dbraw/zinc/07/84/84/564078484.db2.gz	XEOOAMVRCPQBMS-UHFFFAOYSA-N	-1	0	339.420	3.774	50	0		EHAARM
CCN(CC)c1ccc(C(=O)[O-])cc1NC(=O)c1ccccc1C	ZINC000064820488	564096579	/nfs/dbraw/zinc/09/65/79/564096579.db2.gz	OOXCDLLJRZHPLV-UHFFFAOYSA-N	-1	0	326.396	3.792	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cccc(Cl)c3)o2)on1	ZINC000064958398	564098507	/nfs/dbraw/zinc/09/85/07/564098507.db2.gz	NDOJEUZMUJLNIL-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cn(C(C)C)c3ncccc23)cc1F	ZINC000065242202	564103395	/nfs/dbraw/zinc/10/33/95/564103395.db2.gz	PYBNHMXNGRMDNV-UHFFFAOYSA-N	-1	0	347.415	3.866	50	0		EHAARM
Cc1ccccc1[N-]S(=O)(=O)c1cn(CC(C)C)c2ncccc12	ZINC000065242285	564103415	/nfs/dbraw/zinc/10/34/15/564103415.db2.gz	HRFZEQDXZWILIV-UHFFFAOYSA-N	-1	0	343.452	3.802	50	0		EHAARM
CCc1ccc(/C=C2\Sc3ccccc3N(CC(=O)[O-])C2=O)cc1	ZINC000020665437	564141770	/nfs/dbraw/zinc/14/17/70/564141770.db2.gz	RNPMRKSCWDWMCO-BOPFTXTBSA-N	-1	0	339.416	3.813	50	0		EHAARM
CC(C)(C)c1ccc([C@@H]2c3sc(=O)[nH]c3SC=C2C(=O)[O-])cc1	ZINC000096318912	564146759	/nfs/dbraw/zinc/14/67/59/564146759.db2.gz	QAWWCASCVQAUQW-LBPRGKRZSA-N	-1	0	347.461	3.940	50	0		EHAARM
C[C@@H]1CCCN(c2ccc(NC(=O)c3cccs3)cc2C(=O)[O-])C1	ZINC000058064942	564157414	/nfs/dbraw/zinc/15/74/14/564157414.db2.gz	DXBGEWAWFHDSKF-GFCCVEGCSA-N	-1	0	344.436	3.935	50	0		EHAARM
Cc1c(C)c2ccc(OCc3ccc(C(=O)[O-])cc3)c(C)c2oc1=O	ZINC000004029451	564160132	/nfs/dbraw/zinc/16/01/32/564160132.db2.gz	VRBFEHQWMDKTDC-UHFFFAOYSA-N	-1	0	338.359	3.995	50	0	biogenic	EHAARM
O=C([O-])c1cn(-c2cccc(C(F)(F)F)c2)nc1-c1cccnc1	ZINC000004051549	564160250	/nfs/dbraw/zinc/16/02/50/564160250.db2.gz	QMJYZBMQXDKDRB-UHFFFAOYSA-N	-1	0	333.269	3.651	50	0		EHAARM
CCOC(=O)c1sc([N-]c2nc3ccc(OC)cc3s2)nc1C	ZINC000004137735	564160855	/nfs/dbraw/zinc/16/08/55/564160855.db2.gz	DQOWLSBEWJWRCW-UHFFFAOYSA-N	-1	0	349.437	3.990	50	0		EHAARM
CCCc1ccc(C(=O)/C(C#N)=C\c2ccc(OCC(=O)[O-])cc2)cc1	ZINC000096669592	958339316	/nfs/dbraw/zinc/33/93/16/958339316.db2.gz	AHXWFJCRLCGXNI-PDGQHHTCSA-N	-1	0	349.386	3.892	50	0		EHAARM
O=C([O-])[C@@H]1CCN(C(=O)C[C@@H]2CCc3ccccc32)c2ccccc21	ZINC000669435064	976001237	/nfs/dbraw/zinc/00/12/37/976001237.db2.gz	SDMIKRKJWMDCKR-MAUKXSAKSA-N	-1	0	335.403	3.712	50	0		EHAARM
C[C@H](Sc1ccccc1C(=O)[O-])C(=O)Nc1ccc(N(C)C)cc1	ZINC000025054558	202126243	/nfs/dbraw/zinc/12/62/43/202126243.db2.gz	MXTYCHDTSJTHHM-LBPRGKRZSA-N	-1	0	344.436	3.570	50	0		EHAARM
O=C(Nc1cccc(Cn2ccnc2)c1)c1cc(Cl)ccc1[O-]	ZINC000031803561	202210095	/nfs/dbraw/zinc/21/00/95/202210095.db2.gz	XQUZFJMEHNZMTB-UHFFFAOYSA-N	-1	0	327.771	3.543	50	0		EHAARM
CC(C)CCC[C@@H](C)NC(=O)CSCc1cccc(C(=O)[O-])c1	ZINC000032885594	202240098	/nfs/dbraw/zinc/24/00/98/202240098.db2.gz	QVHSUDYRBYOTQI-CQSZACIVSA-N	-1	0	337.485	3.949	50	0		EHAARM
O=C([O-])c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1	ZINC000036378489	202323370	/nfs/dbraw/zinc/32/33/70/202323370.db2.gz	OGGVOECRHLFWNP-UHFFFAOYSA-N	-1	0	345.420	3.505	50	0		EHAARM
O=S(=O)([N-]c1nccs1)c1cccc(COc2ccccc2)c1	ZINC000072264768	202359323	/nfs/dbraw/zinc/35/93/23/202359323.db2.gz	BJSDSCOLEGELBC-UHFFFAOYSA-N	-1	0	346.433	3.523	50	0		EHAARM
O=C(NC[C@H]1OCCc2sccc21)c1ccc2[n-]c(=S)oc2c1	ZINC000074093955	202372105	/nfs/dbraw/zinc/37/21/05/202372105.db2.gz	CVVJHLVEUWDCFR-CYBMUJFWSA-N	-1	0	346.433	3.596	50	0		EHAARM
Cc1nc2sc([C@H](c3ccccc3F)N3CCCCC3)c([O-])n2n1	ZINC000022626001	212313653	/nfs/dbraw/zinc/31/36/53/212313653.db2.gz	SJECKRWLPFLEJE-AWEZNQCLSA-N	-1	0	346.431	3.519	50	0		EHAARM
COc1cccc2c1N1C(=O)c3c(cccc3C(=O)[O-])[C@H]1CC2(C)C	ZINC000000235511	201451488	/nfs/dbraw/zinc/45/14/88/201451488.db2.gz	XZPACUICPVWESN-CQSZACIVSA-N	-1	0	337.375	3.776	50	0	biogenic	EHAARM
Cc1ccc(C(=O)C=C([O-])c2cccc(Br)c2)c(O)c1	ZINC000216629458	241202355	/nfs/dbraw/zinc/20/23/55/241202355.db2.gz	AHJJBBIGWFLSIY-UHFFFAOYSA-N	-1	0	333.181	3.919	50	0		EHAARM
O=C([O-])c1ccc(CSc2nnc(Cc3ccccc3)o2)cc1	ZINC000001059400	201497920	/nfs/dbraw/zinc/49/79/20/201497920.db2.gz	GZKSOFCRKSPIPX-UHFFFAOYSA-N	-1	0	326.377	3.651	50	0		EHAARM
Cc1[n-]n2c(nc(C)c(Cc3ccccc3)c2=O)c1-c1ccccc1	ZINC000006556428	201685529	/nfs/dbraw/zinc/68/55/29/201685529.db2.gz	OAONDAJJGYOCDX-UHFFFAOYSA-N	-1	0	329.403	3.897	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])n3ncc(-c4ccccc4)c3n2)cc1	ZINC000020605752	212154043	/nfs/dbraw/zinc/15/40/43/212154043.db2.gz	JWAFPBTUPSOLDQ-UHFFFAOYSA-N	-1	0	345.358	3.770	50	0		EHAARM
Cc1ccc(-c2nc(C)c(C(=O)NC3(C(=O)[O-])CCCCC3)s2)o1	ZINC000071843930	203127174	/nfs/dbraw/zinc/12/71/74/203127174.db2.gz	IRCPOQAOHGDLGX-UHFFFAOYSA-N	-1	0	348.424	3.537	50	0		EHAARM
C[C@@H](CC(=O)N1CC[C@](C)(C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237340213	204547060	/nfs/dbraw/zinc/54/70/60/204547060.db2.gz	ZZZMIGYLJPDDQB-ZBEGNZNMSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000484062	206237491	/nfs/dbraw/zinc/23/74/91/206237491.db2.gz	QWHZBNHBBJIOFC-UWVGGRQHSA-N	-1	0	338.816	3.779	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2ccc(Br)cc2)CCCC1	ZINC000000554790	206238722	/nfs/dbraw/zinc/23/87/22/206238722.db2.gz	YKWHGZGFWPNZDS-UHFFFAOYSA-N	-1	0	340.217	3.813	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)Oc1cccc(Cl)c1	ZINC000004813752	206495693	/nfs/dbraw/zinc/49/56/93/206495693.db2.gz	JRVWZUMLZDHWDG-NSHDSACASA-N	-1	0	333.771	3.753	50	0		EHAARM
CCCCc1ccc(NC(=O)N[C@H](Cc2ccccc2)C(=O)[O-])cc1	ZINC000005349110	206501081	/nfs/dbraw/zinc/50/10/81/206501081.db2.gz	KUHOAQVGJQNXEB-GOSISDBHSA-N	-1	0	340.423	3.847	50	0		EHAARM
CSc1ccc(Cl)c(C(=O)NCc2ccc(C(=O)[O-])cc2)c1	ZINC000009863953	211129134	/nfs/dbraw/zinc/12/91/34/211129134.db2.gz	DPZMBKXRDHQPPW-UHFFFAOYSA-N	-1	0	335.812	3.690	50	0		EHAARM
COc1ccccc1[C@H]1[C@@H](C(=O)[O-])CCC(=O)N1c1ccc(C)cc1	ZINC000004200326	135662877	/nfs/dbraw/zinc/66/28/77/135662877.db2.gz	MSAZOYMMVYAYHB-LPHOPBHVSA-N	-1	0	339.391	3.573	50	0		EHAARM
CC1(C)C[C@]1(C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1)c1ccc(F)cc1	ZINC000248338847	520573424	/nfs/dbraw/zinc/57/34/24/520573424.db2.gz	SABJWVUWHRAAIN-ARGWCVDVSA-N	-1	0	347.430	3.501	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)NCc2c(F)cccc2Cl)[C@@H](C(=O)[O-])C1	ZINC000000119097	563233673	/nfs/dbraw/zinc/23/36/73/563233673.db2.gz	GMZWWZZYRIUHQM-RYUDHWBXSA-N	-1	0	339.794	3.543	50	0		EHAARM
O=C([O-])[C@H]1Cc2c3ccccc3[nH]c2[C@@H](c2ccccc2Cl)N1	ZINC000000188025	563255464	/nfs/dbraw/zinc/25/54/64/563255464.db2.gz	JNLXAXOXLWSEML-HZPDHXFCSA-N	-1	0	326.783	3.510	50	0		EHAARM
O=S(=O)(Cc1ccccc1)[N-]c1nnc(C2CCCCC2)s1	ZINC000000298938	563275324	/nfs/dbraw/zinc/27/53/24/563275324.db2.gz	GZZSQPNNLDDSLM-UHFFFAOYSA-N	-1	0	337.470	3.528	50	0		EHAARM
O=C([O-])c1nn2c(nc(-c3ccccc3)cc2C(F)(F)F)c1Cl	ZINC000000300081	563275688	/nfs/dbraw/zinc/27/56/88/563275688.db2.gz	TXCVDMINOJYADZ-UHFFFAOYSA-N	-1	0	341.676	3.767	50	0		EHAARM
O=S(=O)([N-]c1ccc2c(c1)OCO2)c1cc(Cl)ccc1Cl	ZINC000000449885	563319107	/nfs/dbraw/zinc/31/91/07/563319107.db2.gz	BOYNMJWCRQMLSW-UHFFFAOYSA-N	-1	0	346.191	3.523	50	0		EHAARM
O=C([O-])/C(=C\c1ccccc1)NC(=O)c1ccc(Cl)cc1Cl	ZINC000003865417	563489766	/nfs/dbraw/zinc/48/97/66/563489766.db2.gz	DCFFTEXFFCCNBF-RIYZIHGNSA-N	-1	0	336.174	3.849	50	0		EHAARM
O=S(=O)([N-]c1ccc(OC(F)(F)F)cc1Cl)C(F)(F)F	ZINC000004390076	563502242	/nfs/dbraw/zinc/50/22/42/563502242.db2.gz	SGNMBPSXSHRFPT-UHFFFAOYSA-N	-1	0	343.632	3.500	50	0		EHAARM
COc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccc(C)cc1	ZINC000004660783	563507011	/nfs/dbraw/zinc/50/70/11/563507011.db2.gz	UDVUFKIGWCUBEV-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
Cc1nc(-c2ccc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])cc2)cs1	ZINC000006668241	563577509	/nfs/dbraw/zinc/57/75/09/563577509.db2.gz	PYYXNAANQQHGKL-HUUCEWRRSA-N	-1	0	342.420	3.724	50	0		EHAARM
CCc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1	ZINC000008132609	563622124	/nfs/dbraw/zinc/62/21/24/563622124.db2.gz	RKYBBFSJMPCYMN-UHFFFAOYSA-N	-1	0	325.817	3.712	50	0		EHAARM
CN1C(=O)/C(=C/c2ccccc2F)Sc2ccc(C(=O)[O-])cc21	ZINC000004472162	563727931	/nfs/dbraw/zinc/72/79/31/563727931.db2.gz	SSNLGNPTVMCPTA-DHDCSXOGSA-N	-1	0	329.352	3.634	50	0		EHAARM
C[C@H]1CCc2nc(NC(=O)CC3(CC(=O)[O-])CCCC3)sc2C1	ZINC000017070750	563833241	/nfs/dbraw/zinc/83/32/41/563833241.db2.gz	LJMMYNNLJHYRCE-NSHDSACASA-N	-1	0	336.457	3.632	50	0		EHAARM
O=C([O-])CCc1ccc(NC(=O)Cc2c[nH]c3ccc(F)cc23)cc1	ZINC000097018938	563966783	/nfs/dbraw/zinc/96/67/83/563966783.db2.gz	IZTZUQXSFULNMT-UHFFFAOYSA-N	-1	0	340.354	3.505	50	0		EHAARM
COc1ccc(OC)c([C@@H](C(=O)[O-])N(C)Cc2ccccc2Cl)c1	ZINC000095386474	563976924	/nfs/dbraw/zinc/97/69/24/563976924.db2.gz	VPCNIPFOHYIGOH-KRWDZBQOSA-N	-1	0	349.814	3.615	50	0		EHAARM
CCN(C(=O)Cc1c2ccccc2[nH]c1C(=O)[O-])c1cccc(C)c1	ZINC000000201590	563988367	/nfs/dbraw/zinc/98/83/67/563988367.db2.gz	MIDCVVMCFCMLOM-UHFFFAOYSA-N	-1	0	336.391	3.770	50	0		EHAARM
O=C([O-])C1CCN(c2nc3ccc(-c4ccccc4)nc3s2)CC1	ZINC000169676726	564017175	/nfs/dbraw/zinc/01/71/75/564017175.db2.gz	MIOHOXNQIXPVJT-UHFFFAOYSA-N	-1	0	339.420	3.659	50	0		EHAARM
Cc1ccc(-c2cccc(NC(=O)[C@@H]3[C@H]4C=C[C@H](C4)[C@H]3C(=O)[O-])c2)o1	ZINC000000510426	564020056	/nfs/dbraw/zinc/02/00/56/564020056.db2.gz	VAMWDEDFRKPIHI-MJSCVDMRSA-N	-1	0	337.375	3.716	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CC2)[C@H]1c1ccccc1Cl	ZINC000045923082	564028891	/nfs/dbraw/zinc/02/88/91/564028891.db2.gz	KQJTWDKMBAIVCP-IRXDYDNUSA-N	-1	0	341.794	3.868	50	0		EHAARM
C[C@@H]1CCCN(c2ccc(NC(=O)c3ccccc3)cc2C(=O)[O-])C1	ZINC000046053445	564029352	/nfs/dbraw/zinc/02/93/52/564029352.db2.gz	QHUFSVMYDAZKQG-CQSZACIVSA-N	-1	0	338.407	3.873	50	0		EHAARM
O=S(=O)([N-]c1ccc(Oc2ccccc2)nc1)c1ccccc1	ZINC000048326501	564031167	/nfs/dbraw/zinc/03/11/67/564031167.db2.gz	YBIYYQJWNHYEFC-UHFFFAOYSA-N	-1	0	326.377	3.675	50	0		EHAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccccc2C(C)C)c1	ZINC000006919559	564033824	/nfs/dbraw/zinc/03/38/24/564033824.db2.gz	FVRNZXKOQWOEOI-UHFFFAOYSA-N	-1	0	335.425	3.628	50	0		EHAARM
O=c1nc(-c2ccncn2)[n-]c2cc(-c3ccccc3Cl)sc21	ZINC000225566578	564047858	/nfs/dbraw/zinc/04/78/58/564047858.db2.gz	FGZRRZCSZYXAIE-UHFFFAOYSA-N	-1	0	340.795	3.762	50	0		EHAARM
C[C@]12CC[C@@H]3[C@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@H]1CC[C@@]2(O)CC(=O)[O-]	ZINC000257346214	564055879	/nfs/dbraw/zinc/05/58/79/564055879.db2.gz	VAPBKEAUXQVFHX-OQINTAEXSA-N	-1	0	348.483	3.516	50	0		EHAARM
C[C@]12CC[C@@H]3[C@H](CC=C4C[C@@H](OCC(=O)[O-])CC[C@@]43C)[C@H]1CCC2=O	ZINC000257356404	564055926	/nfs/dbraw/zinc/05/59/26/564055926.db2.gz	HVGDJTBADGQHHZ-GLDUVZCJSA-N	-1	0	346.467	3.988	50	0		EHAARM
Cc1cc(C(=O)[O-])ccc1-c1ccc(/C=C2/SC(=O)N(C)C2=O)o1	ZINC000001176740	564056238	/nfs/dbraw/zinc/05/62/38/564056238.db2.gz	RXGXTXPZYDROQY-RIYZIHGNSA-N	-1	0	343.360	3.619	50	0		EHAARM
Cc1nn(-c2ccccc2)c2ncc(C(=O)c3cc(F)ccc3[O-])cc12	ZINC000005824990	564056523	/nfs/dbraw/zinc/05/65/23/564056523.db2.gz	SIOCZFQDFPVIAQ-UHFFFAOYSA-N	-1	0	347.349	3.805	50	0		EHAARM
COc1ccc2[nH]c3c([n-]c(=S)n(Cc4ccccc4)c3=O)c2c1	ZINC000001240410	564062568	/nfs/dbraw/zinc/06/25/68/564062568.db2.gz	RQEZBULMSQMWHX-UHFFFAOYSA-N	-1	0	337.404	3.597	50	0		EHAARM
COCCn1ccc2cc(NC(=O)c3c([O-])cc(F)cc3F)ccc21	ZINC000083914491	564064567	/nfs/dbraw/zinc/06/45/67/564064567.db2.gz	HEWDOTIRODTWRZ-UHFFFAOYSA-N	-1	0	346.333	3.524	50	0		EHAARM
COc1ccc(OC)c(-c2noc([N-]c3ccccc3OC)n2)c1	ZINC000015680417	564070719	/nfs/dbraw/zinc/07/07/19/564070719.db2.gz	LQAAYAHQHZBEHQ-UHFFFAOYSA-N	-1	0	327.340	3.506	50	0		EHAARM
O=C([O-])c1cc(N2CCCCC2)ccc1NC(=O)c1ccccc1F	ZINC000064588813	564092549	/nfs/dbraw/zinc/09/25/49/564092549.db2.gz	YLEUPGBSLGWEFV-UHFFFAOYSA-N	-1	0	342.370	3.767	50	0		EHAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)Nc1cccc(Cl)c1C	ZINC000064983795	564099080	/nfs/dbraw/zinc/09/90/80/564099080.db2.gz	IDZXXRKTYMWTAW-UHFFFAOYSA-N	-1	0	334.803	3.658	50	0		EHAARM
Cc1ccc(Cl)cc1NC(=O)c1c([O-])c2sccc2[nH]c1=O	ZINC000065215171	564102837	/nfs/dbraw/zinc/10/28/37/564102837.db2.gz	PSLLSLQBYGDTJZ-UHFFFAOYSA-N	-1	0	334.784	3.509	50	0		EHAARM
CCOc1cc(C(=O)[O-])c(NC(=O)c2ccccc2Cl)cc1OC	ZINC000007002337	564103013	/nfs/dbraw/zinc/10/30/13/564103013.db2.gz	SUPUKHNBQXSFNF-UHFFFAOYSA-N	-1	0	349.770	3.698	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc(-c2ccccc2)cc1	ZINC000007054034	564103908	/nfs/dbraw/zinc/10/39/08/564103908.db2.gz	JLNTWMGSQVQVHO-UHFFFAOYSA-N	-1	0	328.393	3.759	50	0		EHAARM
Cc1cc(C)c(C)c(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2C)c1C	ZINC000014097285	564112179	/nfs/dbraw/zinc/11/21/79/564112179.db2.gz	LDJFLFUXNLLYHN-UHFFFAOYSA-N	-1	0	347.436	3.728	50	0		EHAARM
Cc1c(C(=O)Nc2ccc(C(=O)[O-])cc2)cnn1-c1cc(C)ccc1C	ZINC000237690499	564117768	/nfs/dbraw/zinc/11/77/68/564117768.db2.gz	YCFHHWRZMNLCPL-UHFFFAOYSA-N	-1	0	349.390	3.748	50	0		EHAARM
CC(=NNc1ccccc1C(=O)[O-])c1cc(Br)ccc1O	ZINC000252504418	564119904	/nfs/dbraw/zinc/11/99/04/564119904.db2.gz	BAMVBRRQXOFYCA-UHFFFAOYSA-N	-1	0	349.184	3.689	50	0		EHAARM
CCN1C(=O)S/C(=C\c2ccc(-c3ccc(C(=O)[O-])cc3)o2)C1=O	ZINC000002208009	564121173	/nfs/dbraw/zinc/12/11/73/564121173.db2.gz	MNSVFMQYUAJBRB-ZROIWOOFSA-N	-1	0	343.360	3.701	50	0		EHAARM
O=C([O-])c1ccc(/C=C/C(=O)c2ccc(O)c(CCCl)c2)cc1	ZINC000013003929	564133615	/nfs/dbraw/zinc/13/36/15/564133615.db2.gz	FWULDBDMMZWRRU-XVNBXDOJSA-N	-1	0	330.767	3.768	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2ccccc2Br)CCCC1	ZINC000004185932	564161076	/nfs/dbraw/zinc/16/10/76/564161076.db2.gz	DIWJBHBULAFMQR-UHFFFAOYSA-N	-1	0	340.217	3.813	50	0		EHAARM
C[C@@H](Nc1nc(=O)c(Cc2ccc(Cl)cc2)n[n-]1)c1ccccc1	ZINC000008914646	564167893	/nfs/dbraw/zinc/16/78/93/564167893.db2.gz	KDTMQYLYJJDRTE-GFCCVEGCSA-N	-1	0	340.814	3.582	50	0		EHAARM
O=C([O-])c1cc(-c2cccc(C(=O)C3CCOCC3)c2)ccc1F	ZINC000584422361	1032500437	/nfs/dbraw/zinc/50/04/37/1032500437.db2.gz	UMRNQSBPRRTEMH-UHFFFAOYSA-N	-1	0	328.339	3.800	50	0		EHAARM
Cc1cc(=O)[nH]c(NN=Cc2ccc(OCc3ccccc3)cc2)n1	ZINC000017379125	1027460095	/nfs/dbraw/zinc/46/00/95/1027460095.db2.gz	NRVYORBMWHVAIV-UHFFFAOYSA-N	-1	0	334.379	3.516	50	0		EHAARM
CC(C)(C)c1ccc(S(=O)(=O)Nc2ccsc2C(=O)[O-])cc1	ZINC000043202971	1138039253	/nfs/dbraw/zinc/03/92/53/1138039253.db2.gz	ZQGHKUXYQHDKBP-UHFFFAOYSA-N	-1	0	339.438	3.545	50	0		EHAARM
Cc1ccc(-c2noc3nc(-c4cccnc4)cc(C(=O)[O-])c32)cc1	ZINC000008342516	201745837	/nfs/dbraw/zinc/74/58/37/201745837.db2.gz	RVJIMWTZQDSMOA-UHFFFAOYSA-N	-1	0	331.331	3.958	50	0		EHAARM
CCCCCCSC1=NC(=O)C(Cc2ccc(OC)cc2)C([O-])=N1	ZINC000009190203	201769835	/nfs/dbraw/zinc/76/98/35/201769835.db2.gz	NAODCQXLUZNOGS-UHFFFAOYSA-N	-1	0	348.468	3.747	50	0		EHAARM
O=C([O-])[C@@H](Oc1ccc(Br)cc1F)c1ccccc1	ZINC000020307015	202038284	/nfs/dbraw/zinc/03/82/84/202038284.db2.gz	CTROPUKPDSAFQE-ZDUSSCGKSA-N	-1	0	325.133	3.793	50	0		EHAARM
Cc1ccc2nc3c(c(C(=O)[O-])c2c1)CCC/C3=C/c1cnn(C)c1	ZINC000021957570	202076138	/nfs/dbraw/zinc/07/61/38/202076138.db2.gz	NFGTVZWXFGDOGB-ZROIWOOFSA-N	-1	0	333.391	3.852	50	0		EHAARM
Cc1[nH]nc(-c2ccc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)o2)c1C	ZINC000033262033	202254172	/nfs/dbraw/zinc/25/41/72/202254172.db2.gz	WEDKCFQBKUSSQA-UHFFFAOYSA-N	-1	0	345.424	3.704	50	0		EHAARM
CCCc1cc2c(cc1[O-])occ(-c1ccc3c(c1)OCCO3)c2=O	ZINC000005686283	201361771	/nfs/dbraw/zinc/36/17/71/201361771.db2.gz	CKOAZRUDFDRXFQ-UHFFFAOYSA-N	-1	0	338.359	3.889	50	0	biogenic	EHAARM
O=C([O-])c1cnc(/C=C\c2cnn(-c3ccc(Cl)cc3)c2)s1	ZINC000096402115	201376506	/nfs/dbraw/zinc/37/65/06/201376506.db2.gz	XSVGXDJSAFMTEV-BHQIHCQQSA-N	-1	0	331.784	3.851	50	0		EHAARM
O=C([O-])CCN1C(=S)S/C(=C/c2cccc(Cl)c2)C1=S	ZINC000097097021	201379050	/nfs/dbraw/zinc/37/90/50/201379050.db2.gz	XIXJTVGSLQDSEU-JXMROGBWSA-N	-1	0	343.882	3.817	50	0		EHAARM
O=C([O-])C1CCN(C(=O)OC2c3ccccc3-c3ccccc32)CC1	ZINC000000336655	201461708	/nfs/dbraw/zinc/46/17/08/201461708.db2.gz	BZAYANARTAKJTL-UHFFFAOYSA-N	-1	0	337.375	3.690	50	0		EHAARM
O=C([O-])C[C@H](CC(=O)Nc1cccc2cccnc21)c1cccs1	ZINC000226751109	242113327	/nfs/dbraw/zinc/11/33/27/242113327.db2.gz	HMUBLMNDZRCQMJ-ZDUSSCGKSA-N	-1	0	340.404	3.883	50	0		EHAARM
CCC(=O)Nc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)[O-])cc1	ZINC000004824759	201620672	/nfs/dbraw/zinc/62/06/72/201620672.db2.gz	PWWDTHYIUJCJBQ-UHFFFAOYSA-N	-1	0	346.770	3.639	50	0		EHAARM
Cc1ccc([C@@H]2CC(c3cccs3)=NN2C(=O)CCC(=O)[O-])cc1	ZINC000004858071	201623508	/nfs/dbraw/zinc/62/35/08/201623508.db2.gz	SLKYRQVJTUUSMY-HNNXBMFYSA-N	-1	0	342.420	3.599	50	0		EHAARM
CCCc1ccc(-c2ccc(C(=O)N3C[C@H]4[C@H](C(=O)[O-])[C@H]4C3)cc2)cc1	ZINC000244605515	243043996	/nfs/dbraw/zinc/04/39/96/243043996.db2.gz	DZWJMFZBQMZRQL-PMOLBWCYSA-N	-1	0	349.430	3.709	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccc(Cl)cc3)o2)on1	ZINC000064958399	202820772	/nfs/dbraw/zinc/82/07/72/202820772.db2.gz	QEIWUFHRKGNWHO-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
O=C([O-])c1ncc(OCc2ccccc2)cc1OCc1ccccc1	ZINC000071257221	203089009	/nfs/dbraw/zinc/08/90/09/203089009.db2.gz	OEJYKWLDGWAOIF-UHFFFAOYSA-N	-1	0	335.359	3.938	50	0		EHAARM
CCc1cc2c(nc(C)nc2NCc2ccc(C(=O)[O-])cc2)s1	ZINC000020315867	212118792	/nfs/dbraw/zinc/11/87/92/212118792.db2.gz	GOCXPOOPLRPFRR-UHFFFAOYSA-N	-1	0	327.409	3.872	50	0		EHAARM
C[C@H](Oc1ccc(CC(=O)[O-])cc1)c1nc(-c2cccs2)no1	ZINC000097103273	203919710	/nfs/dbraw/zinc/91/97/10/203919710.db2.gz	DEYVNMJTRCTERF-JTQLQIEISA-N	-1	0	330.365	3.565	50	0		EHAARM
O=C(C[C@H]1CC[C@@H](C(=O)[O-])CC1)c1ccc(Br)cc1	ZINC000100449377	203993703	/nfs/dbraw/zinc/99/37/03/203993703.db2.gz	UQBNQQLWXYCNJS-UMSPYCQHSA-N	-1	0	325.202	3.913	50	0		EHAARM
COc1ccc(C([O-])=CC(=O)c2cc(Cl)ccc2O)cc1OC	ZINC000101268280	204004212	/nfs/dbraw/zinc/00/42/12/204004212.db2.gz	JXTSHFQTPCUYHZ-UHFFFAOYSA-N	-1	0	334.755	3.519	50	0		EHAARM
O=C([O-])c1ccc(-n2nc(-c3ccccc3)c3ccccc3c2=O)cc1	ZINC000000045067	206211092	/nfs/dbraw/zinc/21/10/92/206211092.db2.gz	FYIMSUNLFNPGTL-UHFFFAOYSA-N	-1	0	342.354	3.751	50	0		EHAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000000347123	206234481	/nfs/dbraw/zinc/23/44/81/206234481.db2.gz	ZNWNSKHKNZWEMR-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CCn1c(C)nc2c1cc(Br)c([O-])c2Br	ZINC000000441203	206241917	/nfs/dbraw/zinc/24/19/17/206241917.db2.gz	HJEAYFSKUJOYJZ-UHFFFAOYSA-N	-1	0	334.011	3.595	50	0		EHAARM
O=C([O-])CC1(CC(=O)N2CCC(Cc3ccccc3)CC2)CCCC1	ZINC000001498937	206289364	/nfs/dbraw/zinc/28/93/64/206289364.db2.gz	NKCPAUDSIYWNCL-UHFFFAOYSA-N	-1	0	343.467	3.893	50	0		EHAARM
COc1ccc(Cl)cc1C(=O)Nc1cc(Cl)ccc1C(=O)[O-]	ZINC000004808929	206495517	/nfs/dbraw/zinc/49/55/17/206495517.db2.gz	JYNLPMUURYWPQM-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
O=C([O-])c1nn2c(c1Cl)N[C@@H](c1ccccc1)C[C@H]2C(F)(F)F	ZINC000000226824	563263033	/nfs/dbraw/zinc/26/30/33/563263033.db2.gz	RQMWBEVLHVOEIT-BDAKNGLRSA-N	-1	0	345.708	3.895	50	0		EHAARM
O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1c(F)cccc1F	ZINC000000465015	563328077	/nfs/dbraw/zinc/32/80/77/563328077.db2.gz	LKTBJNREZOEKGX-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])n2)cc1	ZINC000000996318	563367383	/nfs/dbraw/zinc/36/73/83/563367383.db2.gz	XSFUUEIBDYMQJY-KGLIPLIRSA-N	-1	0	342.420	3.724	50	0		EHAARM
Cc1ccc(OCCSc2nc3ccccc3n2CC(=O)[O-])cc1	ZINC000002056537	563420189	/nfs/dbraw/zinc/42/01/89/563420189.db2.gz	IAPUDLWFEXAJCG-UHFFFAOYSA-N	-1	0	342.420	3.600	50	0		EHAARM
O=S(=O)([O-])c1ccc2oc3ccc(Br)cc3c2c1	ZINC000003200728	563476452	/nfs/dbraw/zinc/47/64/52/563476452.db2.gz	IQOLCHKEYNGSGI-UHFFFAOYSA-N	-1	0	327.155	3.595	50	0		EHAARM
Cc1cc(C)nc(-n2[n-]c(CSc3ccc(Cl)cc3)cc2=O)n1	ZINC000004487052	563503600	/nfs/dbraw/zinc/50/36/00/563503600.db2.gz	FQMPDGPPPMKEGJ-UHFFFAOYSA-N	-1	0	346.843	3.632	50	0		EHAARM
CCCOc1ccc(S(=O)(=O)[N-]c2ccccn2)c2ccccc12	ZINC000004660775	563507001	/nfs/dbraw/zinc/50/70/01/563507001.db2.gz	DOPGDEXLJDYLPB-UHFFFAOYSA-N	-1	0	342.420	3.824	50	0		EHAARM
O=S(=O)([N-]c1ccc(Br)cc1)c1ccc(F)cc1F	ZINC000007052556	563594292	/nfs/dbraw/zinc/59/42/92/563594292.db2.gz	DRZYSUGVTZVSCM-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccccc1Br	ZINC000007405636	563601553	/nfs/dbraw/zinc/60/15/53/563601553.db2.gz	JJEODSQCVDMTQF-UHFFFAOYSA-N	-1	0	344.205	3.697	50	0		EHAARM
COc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccccc1C	ZINC000008132585	563622103	/nfs/dbraw/zinc/62/21/03/563622103.db2.gz	AWBXKFVOWMSQRD-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CC(C)Cc1nc2sc3c([n-]c(=S)[nH]c3=O)c2c2c1CCC2	ZINC000013110348	563688113	/nfs/dbraw/zinc/68/81/13/563688113.db2.gz	OHJZBRLNKKHBKV-UHFFFAOYSA-N	-1	0	331.466	3.509	50	0		EHAARM
Cc1c(NC(=O)[C@H](C)SCc2ccccc2)cccc1C(=O)[O-]	ZINC000013843376	563726040	/nfs/dbraw/zinc/72/60/40/563726040.db2.gz	RFVIDKGCYVUZMI-ZDUSSCGKSA-N	-1	0	329.421	3.954	50	0		EHAARM
O=S(=O)([N-]c1cnc(-c2ccccc2)nc1)c1ccc(Cl)cc1	ZINC000015222159	563780488	/nfs/dbraw/zinc/78/04/88/563780488.db2.gz	WTOSYKWKCONRLD-UHFFFAOYSA-N	-1	0	345.811	3.598	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2nc3ccc(F)cc3s2)CCCC1	ZINC000017070708	563833217	/nfs/dbraw/zinc/83/32/17/563833217.db2.gz	LVLXQZLETYHXOL-UHFFFAOYSA-N	-1	0	336.388	3.799	50	0		EHAARM
O=C([O-])c1c(Cl)nc(Br)n1-c1ccc(Cl)cc1	ZINC000069949611	563888910	/nfs/dbraw/zinc/88/89/10/563888910.db2.gz	FHEAMNHBAJQUGF-UHFFFAOYSA-N	-1	0	335.972	3.640	50	0		EHAARM
COc1ccc(/C=C(/CC(=O)[O-])c2nc3ccccc3o2)cc1OC	ZINC000058229987	563940469	/nfs/dbraw/zinc/94/04/69/563940469.db2.gz	HPDDOUNPHBRJEY-LCYFTJDESA-N	-1	0	339.347	3.860	50	0		EHAARM
COc1cc(/C=C/c2ncc(C(=O)[O-])s2)cc(Cl)c1OC	ZINC000058343806	563943065	/nfs/dbraw/zinc/94/30/65/563943065.db2.gz	STXMCXMZAGDHQM-ONEGZZNKSA-N	-1	0	325.773	3.682	50	0		EHAARM
Cc1ccc(S(=O)(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)c(C)c1	ZINC000067172782	563962240	/nfs/dbraw/zinc/96/22/40/563962240.db2.gz	XCWAMJSCBZDOEP-UHFFFAOYSA-N	-1	0	349.358	3.668	50	0		EHAARM
Cc1cc(C)n(-c2cc(C)ccc2-c2ccc([C@H](O)C(=O)[O-])cc2)n1	ZINC000067691163	563962492	/nfs/dbraw/zinc/96/24/92/563962492.db2.gz	YZWIMVUACGGMND-IBGZPJMESA-N	-1	0	336.391	3.583	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)CSc1ccccc1)c1ccc(Cl)cc1	ZINC000004653312	563963417	/nfs/dbraw/zinc/96/34/17/563963417.db2.gz	BQQIBIFZONRWLM-HNNXBMFYSA-N	-1	0	349.839	3.764	50	0		EHAARM
C[C@H](C(=O)[O-])[C@H](NC(=O)c1cccc(F)c1Cl)c1ccccc1	ZINC000097018248	563971009	/nfs/dbraw/zinc/97/10/09/563971009.db2.gz	VKTHABRYKXGGHC-BONVTDFDSA-N	-1	0	335.762	3.671	50	0		EHAARM
O=C([O-])CSc1nnc(-c2ccccc2Cl)n1-c1ccccc1	ZINC000000079688	563974582	/nfs/dbraw/zinc/97/45/82/563974582.db2.gz	IQLKTILSOWLTFX-UHFFFAOYSA-N	-1	0	345.811	3.764	50	0		EHAARM
O=C([O-])c1cccc([C@@H]2CCCN(C(=O)c3cccn3C3CC3)C2)c1	ZINC000095383406	563976903	/nfs/dbraw/zinc/97/69/03/563976903.db2.gz	OZBLCQNCHJHEJV-MRXNPFEDSA-N	-1	0	338.407	3.541	50	0		EHAARM
O=C([O-])c1ccc(/C=C2\SC(=O)N(Cc3ccccc3)C2=O)cc1	ZINC000096938346	563981142	/nfs/dbraw/zinc/98/11/42/563981142.db2.gz	WSRUQMCLQKYEFS-GDNBJRDFSA-N	-1	0	339.372	3.621	50	0		EHAARM
CC(C)COc1ccc(C(=O)N[C@@H](CC(=O)[O-])c2ccccc2)cc1	ZINC000000206844	563988539	/nfs/dbraw/zinc/98/85/39/563988539.db2.gz	ITLLSEZJXZVABX-SFHVURJKSA-N	-1	0	341.407	3.667	50	0		EHAARM
CC(C)(C)c1ccc([C@H](CC(=O)[O-])NC(=O)Cc2ccccc2)cc1	ZINC000000117676	563989009	/nfs/dbraw/zinc/98/90/09/563989009.db2.gz	GLXOJZFFKJUVNN-SFHVURJKSA-N	-1	0	339.435	3.859	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc(C)sc1C	ZINC000024069994	563991717	/nfs/dbraw/zinc/99/17/17/563991717.db2.gz	RANDBWWCJMOPIG-UHFFFAOYSA-N	-1	0	331.846	3.828	50	0		EHAARM
Cn1c2ccc(Cl)cc2nc1C(=O)/C=C/c1ccc(C(=O)[O-])cc1	ZINC000075094289	563995958	/nfs/dbraw/zinc/99/59/58/563995958.db2.gz	CIQBQTZYWLZSKQ-RUDMXATFSA-N	-1	0	340.766	3.821	50	0		EHAARM
O=C([O-])[C@H]1CC[C@H](C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)CC1	ZINC000253429172	563999231	/nfs/dbraw/zinc/99/92/31/563999231.db2.gz	CCVYJVPFPYGVPC-BILUERTLSA-N	-1	0	327.424	3.582	50	0		EHAARM
CCn1c2ccccc2c([O-])c(-c2nc(-c3ccccc3C)no2)c1=O	ZINC000101725575	564019548	/nfs/dbraw/zinc/01/95/48/564019548.db2.gz	LQBHVBBAYJUGTB-UHFFFAOYSA-N	-1	0	347.374	3.752	50	0		EHAARM
C[C@H]([C@@H]1CCCO1)n1c(=O)c2c([n-]c1=S)sc1c2CCCC1	ZINC000017070773	564024832	/nfs/dbraw/zinc/02/48/32/564024832.db2.gz	YSISXRAGZZJPCJ-KOLCDFICSA-N	-1	0	336.482	3.739	50	0		EHAARM
COC(=O)Nc1ccc(NC(=O)CC2(C(=O)[O-])CCCCCC2)cc1	ZINC000048383555	564031736	/nfs/dbraw/zinc/03/17/36/564031736.db2.gz	QTVGBSFHGHCWLK-UHFFFAOYSA-N	-1	0	348.399	3.619	50	0		EHAARM
O=C([O-])c1ccc(Cl)cc1NC(=O)COc1ccccc1Cl	ZINC000002937126	564045163	/nfs/dbraw/zinc/04/51/63/564045163.db2.gz	CVQCJPCMPGKEDH-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)CCc1ccccc1)c1ccc(Cl)cc1	ZINC000003628932	564060050	/nfs/dbraw/zinc/06/00/50/564060050.db2.gz	CQMBWBPNWXHUKA-INIZCTEOSA-N	-1	0	331.799	3.605	50	0		EHAARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(F)cc2)cc1	ZINC000003623659	564060051	/nfs/dbraw/zinc/06/00/51/564060051.db2.gz	PSOTXTFICVPDQM-QGZVFWFLSA-N	-1	0	345.370	3.560	50	0		EHAARM
Cc1cc(C(F)(F)F)nc(S[C@@H](C(=O)[O-])c2ccccc2)n1	ZINC000006189383	564080650	/nfs/dbraw/zinc/08/06/50/564080650.db2.gz	NLCGGGYQUYNZFR-LLVKDONJSA-N	-1	0	328.315	3.722	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2	ZINC000006328864	564085014	/nfs/dbraw/zinc/08/50/14/564085014.db2.gz	XNOKTJPNHLIILI-UHFFFAOYSA-N	-1	0	329.421	3.569	50	0		EHAARM
C[S@@](=O)Cc1ccccc1NC(=O)Nc1ccc(O)c(Cl)c1	ZINC000192266882	564090071	/nfs/dbraw/zinc/09/00/71/564090071.db2.gz	PCHYHWOTMSUDOY-JOCHJYFZSA-N	-1	0	338.816	3.568	50	0		EHAARM
CCCN(C(=O)Cc1c(C(=O)[O-])c(C)cn1CC)c1ccc(F)cc1	ZINC000064980686	564098898	/nfs/dbraw/zinc/09/88/98/564098898.db2.gz	AWGNBGOOSVFECS-UHFFFAOYSA-N	-1	0	346.402	3.639	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)c1C	ZINC000065031070	564099755	/nfs/dbraw/zinc/09/97/55/564099755.db2.gz	RXXVBPGVZWAMRP-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)cc1	ZINC000065031075	564099760	/nfs/dbraw/zinc/09/97/60/564099760.db2.gz	KENBASCBWZGCGY-UHFFFAOYSA-N	-1	0	334.422	3.766	50	0		EHAARM
CCc1cccc(NC(=O)c2c([O-])c3sccc3n(CC)c2=O)c1	ZINC000065215446	564102875	/nfs/dbraw/zinc/10/28/75/564102875.db2.gz	FHRPTZMRKAAEJJ-UHFFFAOYSA-N	-1	0	342.420	3.603	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1Cc1ccccc1	ZINC000007057557	564104002	/nfs/dbraw/zinc/10/40/02/564104002.db2.gz	RFMURFPICZQABJ-UHFFFAOYSA-N	-1	0	342.420	3.683	50	0		EHAARM
O=S(=O)([N-]c1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000007405414	564107953	/nfs/dbraw/zinc/10/79/53/564107953.db2.gz	KCXXFLUJPZHNTM-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
CC[C@](NC(=O)[C@H](C)Sc1ccccc1)(C(=O)[O-])c1ccccc1	ZINC000170592055	564108826	/nfs/dbraw/zinc/10/88/26/564108826.db2.gz	VWQPJNOOJVNPKT-IFXJQAMLSA-N	-1	0	343.448	3.674	50	0		EHAARM
Cc1cc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)sc1C	ZINC000237847009	564120047	/nfs/dbraw/zinc/12/00/47/564120047.db2.gz	QWVZRBNMCMLGAK-UHFFFAOYSA-N	-1	0	343.448	3.624	50	0		EHAARM
C[C@H]1C[C@@H]1c1ccc(CN(C(=O)C2CCC(C(=O)[O-])CC2)C2CC2)o1	ZINC000194390482	564120505	/nfs/dbraw/zinc/12/05/05/564120505.db2.gz	VXHKUKXJZFXOAH-VWLISTAJSA-N	-1	0	345.439	3.785	50	0		EHAARM
CC(C)C[C@H](C(=O)[O-])[C@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002272713	564125584	/nfs/dbraw/zinc/12/55/84/564125584.db2.gz	DFNZDMUCEFEEPF-ZBFHGGJFSA-N	-1	0	343.427	3.584	50	0		EHAARM
CC(C)CCCCCCOc1ccc([C@H](CC(N)=O)C(=O)[O-])cc1	ZINC000002295555	564131718	/nfs/dbraw/zinc/13/17/18/564131718.db2.gz	AJVJZPMMDYNMMZ-KRWDZBQOSA-N	-1	0	335.444	3.716	50	0		EHAARM
O=C(/C=C/c1ccc([O-])c([N+](=O)[O-])c1)c1ccc(O)c(CCCl)c1	ZINC000012909587	564133582	/nfs/dbraw/zinc/13/35/82/564133582.db2.gz	JAANIYVNYAHOPW-DAFODLJHSA-N	-1	0	347.754	3.683	50	0		EHAARM
CCCc1ccc(S(=O)(=O)[N-]c2ncnc3oc(C)c(C)c32)cc1	ZINC000095944100	564142137	/nfs/dbraw/zinc/14/21/37/564142137.db2.gz	VIVCJRZGNDCGIA-UHFFFAOYSA-N	-1	0	345.424	3.593	50	0		EHAARM
C[C@H](CC(=O)N1CCC[C@@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000096479550	564148558	/nfs/dbraw/zinc/14/85/58/564148558.db2.gz	DKGQWQJBIAJJCW-DGCLKSJQSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])C1CCN(c2ncnc3sc(-c4ccccc4)cc32)CC1	ZINC000003358754	564157651	/nfs/dbraw/zinc/15/76/51/564157651.db2.gz	BWGYKBDJRBXSPQ-UHFFFAOYSA-N	-1	0	339.420	3.659	50	0		EHAARM
CCO[C@@H]1C[C@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000073984564	564176437	/nfs/dbraw/zinc/17/64/37/564176437.db2.gz	WEPOGIXLFWMSAL-UONOGXRCSA-N	-1	0	332.425	3.568	50	0		EHAARM
CCCOc1cccc(C(=O)N2CC[C@@H](C(=O)[O-])c3ccccc32)c1	ZINC000327542366	951115406	/nfs/dbraw/zinc/11/54/06/951115406.db2.gz	VPQFUICDXKQZHA-QGZVFWFLSA-N	-1	0	339.391	3.694	50	0		EHAARM
Cc1oc(-c2ccccc2)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)[O-]	ZINC000004851357	1042533986	/nfs/dbraw/zinc/53/39/86/1042533986.db2.gz	BSTWUJDKFASTAI-GOSISDBHSA-N	-1	0	349.386	3.681	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC(CCc2ccc(C(=O)[O-])cc2)CC1	ZINC000200940400	1120198385	/nfs/dbraw/zinc/19/83/85/1120198385.db2.gz	XRPRIDFMIYNINS-UHFFFAOYSA-N	-1	0	333.428	3.965	50	0		EHAARM
O=C([O-])[C@@H](CC(=O)N1CCC[C@@]2(CC=CCC2)C1)c1ccccc1	ZINC000634885238	1137481267	/nfs/dbraw/zinc/48/12/67/1137481267.db2.gz	CNYXSCSNAOMZGA-PXNSSMCTSA-N	-1	0	327.424	3.594	50	0		EHAARM
O=C([O-])[C@@H](CC(=O)N1CCC[C@]2(CC=CCC2)C1)c1ccccc1	ZINC000634885237	1137481300	/nfs/dbraw/zinc/48/13/00/1137481300.db2.gz	CNYXSCSNAOMZGA-FXAWDEMLSA-N	-1	0	327.424	3.594	50	0		EHAARM
O=c1nc(Cc2nc(-c3ccccc3)cs2)[n-]c2ccsc21	ZINC000053848006	214202457	/nfs/dbraw/zinc/20/24/57/214202457.db2.gz	ILNFMNLMTMYWHL-UHFFFAOYSA-N	-1	0	325.418	3.699	50	0		EHAARM
CCOc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000038103852	202105812	/nfs/dbraw/zinc/10/58/12/202105812.db2.gz	RXBHQVZYBIGZBP-UHFFFAOYSA-N	-1	0	329.780	3.679	50	0		EHAARM
CCCCCOc1ccc(S(=O)(=O)[N-]c2ccccn2)cc1C	ZINC000027823151	202160315	/nfs/dbraw/zinc/16/03/15/202160315.db2.gz	KSROIPRMEVUSOK-UHFFFAOYSA-N	-1	0	334.441	3.760	50	0		EHAARM
O=C(NCc1coc(-c2cccs2)n1)c1ccc([O-])c(Cl)c1	ZINC000029771102	202191796	/nfs/dbraw/zinc/19/17/96/202191796.db2.gz	UTSCFHHTLIEIAG-UHFFFAOYSA-N	-1	0	334.784	3.692	50	0		EHAARM
O=C(Nc1ccc(Cl)cc1)c1c[n-]c2cc(F)cc(F)c2c1=O	ZINC000032606775	202228826	/nfs/dbraw/zinc/22/88/26/202228826.db2.gz	TXRODHMNKZBUPM-UHFFFAOYSA-N	-1	0	334.709	3.712	50	0		EHAARM
CC(C)(C)c1nc2cc(NC(=O)CC3(C(=O)[O-])CCCC3)ccc2[nH]1	ZINC000013469907	201366027	/nfs/dbraw/zinc/36/60/27/201366027.db2.gz	FQYWNAKCPJQDGM-UHFFFAOYSA-N	-1	0	343.427	3.834	50	0		EHAARM
Cc1cccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@@H](C)C4)c1C	ZINC000299738140	201354630	/nfs/dbraw/zinc/35/46/30/201354630.db2.gz	BCRGUORXTRLXDA-LBPRGKRZSA-N	-1	0	348.402	3.693	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)[O-]	ZINC000002556724	201535088	/nfs/dbraw/zinc/53/50/88/201535088.db2.gz	NBVVKAUSAGHTSU-KRWDZBQOSA-N	-1	0	341.407	3.874	50	0		EHAARM
CCOc1cc(NC(=O)c2ccccc2Cl)c(C(=O)[O-])cc1OC	ZINC000006588613	201686639	/nfs/dbraw/zinc/68/66/39/201686639.db2.gz	UUEZPPOYBOBYDY-UHFFFAOYSA-N	-1	0	349.770	3.698	50	0		EHAARM
CCN(CC)c1ccc(C(=O)[O-])cc1NC(=O)c1ccc(F)cc1	ZINC000064820401	202818631	/nfs/dbraw/zinc/81/86/31/202818631.db2.gz	HAGDGCOQNZBRBN-UHFFFAOYSA-N	-1	0	330.359	3.622	50	0		EHAARM
COc1ccccc1Oc1ccc(Cl)cc1[N-]S(C)(=O)=O	ZINC000071375853	203094308	/nfs/dbraw/zinc/09/43/08/203094308.db2.gz	MPEZDBXMYCBOQY-UHFFFAOYSA-N	-1	0	327.789	3.512	50	0		EHAARM
COCOc1cc([O-])c2c(=O)cc(-c3ccc(Cl)cc3)oc2c1	ZINC000071788853	203113455	/nfs/dbraw/zinc/11/34/55/203113455.db2.gz	GBZOBWKRCVGUSK-UHFFFAOYSA-N	-1	0	332.739	3.802	50	0		EHAARM
O=C([O-])c1ccc(-c2cc(NCc3ccccn3)nc3[nH]ccc32)o1	ZINC000072144600	203170321	/nfs/dbraw/zinc/17/03/21/203170321.db2.gz	JUSQQRQOXZQGOW-UHFFFAOYSA-N	-1	0	334.335	3.528	50	0		EHAARM
C[C@]12CC(=O)[C@@H]3[C@H](CC[C@H]4C[C@H](O)CC[C@@]34C)[C@H]1CC=C2CC(=O)[O-]	ZINC000257358880	244583123	/nfs/dbraw/zinc/58/31/23/244583123.db2.gz	WXRCQADVBJRAON-ZGSOQKCWSA-N	-1	0	346.467	3.580	50	0		EHAARM
O=C([O-])c1cccc([C@H]2CCCN(C(=O)c3cccn3C3CC3)C2)c1	ZINC000095383407	203724593	/nfs/dbraw/zinc/72/45/93/203724593.db2.gz	OZBLCQNCHJHEJV-INIZCTEOSA-N	-1	0	338.407	3.541	50	0		EHAARM
O=C(N[C@@H]1CCSc2ccccc21)c1cc(F)c(F)c([O-])c1F	ZINC000095468980	203748166	/nfs/dbraw/zinc/74/81/66/203748166.db2.gz	UGZBQKQNTWCIPP-LLVKDONJSA-N	-1	0	339.338	3.776	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC000225901580	205102961	/nfs/dbraw/zinc/10/29/61/205102961.db2.gz	WSNYDIRTGGFGKJ-MRVPVSSYSA-N	-1	0	336.240	3.772	50	0		EHAARM
CCOC(=O)c1sc([N-]c2nc3cc(OC)ccc3s2)nc1C	ZINC000004359823	205702263	/nfs/dbraw/zinc/70/22/63/205702263.db2.gz	KEDXRBANVYXFST-UHFFFAOYSA-N	-1	0	349.437	3.990	50	0		EHAARM
O=C([O-])[C@H](NC(=O)c1ccc(Cl)cc1)C12CC3CC(CC(C3)C1)C2	ZINC000004376095	205703368	/nfs/dbraw/zinc/70/33/68/205703368.db2.gz	ZGVVRGAJVBTNPC-RTLPCREESA-N	-1	0	347.842	3.739	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)N(Cc1ccccc1)Cc1ccccc1	ZINC000005773227	206506356	/nfs/dbraw/zinc/50/63/56/206506356.db2.gz	UNSMZYSBHPOFFL-VQTJNVASSA-N	-1	0	349.430	3.882	50	0		EHAARM
CCc1c([O-])c(C(C)=O)c(=O)n(-c2ccccc2)c1-c1ccccc1	ZINC000000087808	563221148	/nfs/dbraw/zinc/22/11/48/563221148.db2.gz	BJGVMWXAKAXKGB-UHFFFAOYSA-N	-1	0	333.387	3.975	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)NCc2c(F)cccc2Cl)[C@H](C(=O)[O-])C1	ZINC000000119089	563233397	/nfs/dbraw/zinc/23/33/97/563233397.db2.gz	GMZWWZZYRIUHQM-NWDGAFQWSA-N	-1	0	339.794	3.543	50	0		EHAARM
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1cccc2cccnc21	ZINC000000437068	563313248	/nfs/dbraw/zinc/31/32/48/563313248.db2.gz	MPIZFXSOIUMWBG-UHFFFAOYSA-N	-1	0	332.812	3.997	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1cccc(C(F)(F)F)c1	ZINC000002385887	563430935	/nfs/dbraw/zinc/43/09/35/563430935.db2.gz	ATUJVGXTABSYTK-GFCCVEGCSA-N	-1	0	347.333	3.616	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1ccccc1C(F)(F)F	ZINC000002385884	563430953	/nfs/dbraw/zinc/43/09/53/563430953.db2.gz	YQJFIZXCXGBMPB-LLVKDONJSA-N	-1	0	347.333	3.616	50	0		EHAARM
Cc1cccnc1[N-]S(=O)(=O)c1cc(Cl)c(Cl)cc1C	ZINC000004411689	563502497	/nfs/dbraw/zinc/50/24/97/563502497.db2.gz	AHWJEKIYRGQYAA-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000004612054	563505817	/nfs/dbraw/zinc/50/58/17/563505817.db2.gz	STMFJDTXVZATRV-OLZOCXBDSA-N	-1	0	348.399	3.779	50	0		EHAARM
Cc1ccccc1-c1cc2oc(=O)cc([O-])c2c(=O)n1-c1ccccc1	ZINC000006666796	563577093	/nfs/dbraw/zinc/57/70/93/563577093.db2.gz	YIQYDNFMXTVJNR-UHFFFAOYSA-N	-1	0	345.354	3.625	50	0		EHAARM
COc1ccc(Cl)cc1/C=C/C(=O)Nc1cccc(C(=O)[O-])c1	ZINC000008187024	563622762	/nfs/dbraw/zinc/62/27/62/563622762.db2.gz	BCEUYTMUSKKTCD-VMPITWQZSA-N	-1	0	331.755	3.699	50	0		EHAARM
O=C([O-])c1ccc(Br)c(OC(F)F)c1Br	ZINC000008698298	563635644	/nfs/dbraw/zinc/63/56/44/563635644.db2.gz	MYABBCIHLRGMEC-UHFFFAOYSA-N	-1	0	345.921	3.511	50	0		EHAARM
O=C([O-])c1cc(-c2ccccc2)nc2c1cnn2-c1ccc(F)cc1	ZINC000012395946	563659661	/nfs/dbraw/zinc/65/96/61/563659661.db2.gz	HMXZKXBILOZHMK-UHFFFAOYSA-N	-1	0	333.322	3.925	50	0		EHAARM
CCOC(=O)c1c(SC)[n-]c2c(cccc2C(F)(F)F)c1=O	ZINC000013466479	563698869	/nfs/dbraw/zinc/69/88/69/563698869.db2.gz	HYKHMSOQDYMNMM-UHFFFAOYSA-N	-1	0	331.315	3.858	50	0		EHAARM
O=c1c2ccccc2[nH]c(=S)n1-c1cc(Cl)c([O-])c(Cl)c1	ZINC000017071069	563833919	/nfs/dbraw/zinc/83/39/19/563833919.db2.gz	DZALQCHBLYXNFI-UHFFFAOYSA-N	-1	0	339.203	3.687	50	0		EHAARM
CC[C@](C)(NC(=O)CCc1ccc(C(=O)[O-])cc1)c1nc(C)cs1	ZINC000097017787	563966788	/nfs/dbraw/zinc/96/67/88/563966788.db2.gz	MYACYYUJVAKAIU-SFHVURJKSA-N	-1	0	346.452	3.524	50	0		EHAARM
Cc1cc(C)cc(C[C@@H](C(=O)Nc2ccccc2)[C@H](C)C(=O)[O-])c1	ZINC000000037849	563968376	/nfs/dbraw/zinc/96/83/76/563968376.db2.gz	DDUJKVMTEJMQQH-MAUKXSAKSA-N	-1	0	325.408	3.822	50	0		EHAARM
COc1ccc([C@@H]2S[C@@H](C)C(=O)N2c2cccc(C(=O)[O-])c2)cc1	ZINC000000191268	563988161	/nfs/dbraw/zinc/98/81/61/563988161.db2.gz	CDAPDEHTTWYUPC-GTNSWQLSSA-N	-1	0	343.404	3.561	50	0		EHAARM
CCOc1ccc2nc(NC(=O)c3ccccc3C(=O)[O-])sc2c1	ZINC000004603998	564013878	/nfs/dbraw/zinc/01/38/78/564013878.db2.gz	LGQRAZRQFCLNDX-UHFFFAOYSA-N	-1	0	342.376	3.646	50	0		EHAARM
Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1cccc(C(=O)[O-])c1	ZINC000004808946	564013901	/nfs/dbraw/zinc/01/39/01/564013901.db2.gz	RKLWOIGJWSKHRT-LLVKDONJSA-N	-1	0	333.771	3.753	50	0		EHAARM
Cc1ccc(-c2noc(-c3c([O-])c4ccccc4n(C)c3=O)n2)c(C)c1	ZINC000101725738	564019538	/nfs/dbraw/zinc/01/95/38/564019538.db2.gz	IWEGAJULAMCWML-UHFFFAOYSA-N	-1	0	347.374	3.578	50	0		EHAARM
O=C1CC(c2ccccc2)CC([O-])=C1[S@](=O)c1ccc(Cl)cc1	ZINC000108809361	564028482	/nfs/dbraw/zinc/02/84/82/564028482.db2.gz	RJKDYYATTWYCNA-JDNDNIJDSA-N	-1	0	346.835	3.532	50	0		EHAARM
CCn1ncc(-c2ccccc2C(=O)N(C(C)C)C(C)C)c1C(=O)[O-]	ZINC000534661257	564061628	/nfs/dbraw/zinc/06/16/28/564061628.db2.gz	UPNGJWOCXFGCIU-UHFFFAOYSA-N	-1	0	343.427	3.527	50	0		EHAARM
O=c1[nH]c2ccccc2c([O-])c1-c1nc(-c2ccccc2Cl)no1	ZINC000075536626	564087928	/nfs/dbraw/zinc/08/79/28/564087928.db2.gz	ISSHVXRBMHQIBE-UHFFFAOYSA-N	-1	0	339.738	3.604	50	0		EHAARM
O=C(Nc1ccc(O)c(Cl)c1)Nc1cc2c(cc1F)NC(=O)CC2	ZINC000192278022	564090081	/nfs/dbraw/zinc/09/00/81/564090081.db2.gz	LMSYCSNWMHXSNA-UHFFFAOYSA-N	-1	0	349.749	3.713	50	0		EHAARM
Cc1c(NC(=O)c2cc(F)cc(Cl)c2[O-])n[nH]c1-c1ccncc1	ZINC000089547765	564092802	/nfs/dbraw/zinc/09/28/02/564092802.db2.gz	ZCHMBPOOIZUIKD-UHFFFAOYSA-N	-1	0	346.749	3.531	50	0		EHAARM
Cc1c2cc(F)ccc2oc1C(=O)Nc1cccc(OCC(=O)[O-])c1	ZINC000089568199	564092900	/nfs/dbraw/zinc/09/29/00/564092900.db2.gz	UARISSNHTOFHOF-UHFFFAOYSA-N	-1	0	343.310	3.596	50	0		EHAARM
Cc1nnc(-c2csc(S(=O)(=O)[N-]c3c(C)cccc3C)c2)o1	ZINC000065098528	564101085	/nfs/dbraw/zinc/10/10/85/564101085.db2.gz	MLYBKKOWHFGQQC-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)cc1Cl	ZINC000065215325	564102855	/nfs/dbraw/zinc/10/28/55/564102855.db2.gz	VGHNYIZOOPQNDS-UHFFFAOYSA-N	-1	0	348.811	3.520	50	0		EHAARM
Cc1cc(S(=O)(=O)Nc2ccc(C)cc2Cl)sc1C(=O)[O-]	ZINC000037238981	564109059	/nfs/dbraw/zinc/10/90/59/564109059.db2.gz	JDYWXQLKEKUBTN-UHFFFAOYSA-N	-1	0	345.829	3.517	50	0		EHAARM
Cc1cccc(S(=O)(=O)[N-]c2ccc(C(C)(C)C)nn2)c1Cl	ZINC000170609224	564109701	/nfs/dbraw/zinc/10/97/01/564109701.db2.gz	FHOXMNQRYUDUDK-UHFFFAOYSA-N	-1	0	339.848	3.537	50	0		EHAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)CCCc1c[nH]c2ccccc12	ZINC000237980973	564117787	/nfs/dbraw/zinc/11/77/87/564117787.db2.gz	FYRBYTHTGLBJNP-MRXNPFEDSA-N	-1	0	342.439	3.737	50	0		EHAARM
COc1ccc(S(=O)(=O)[N-]c2c(C)cc(Cl)cc2C)c(F)c1	ZINC000252502669	564119870	/nfs/dbraw/zinc/11/98/70/564119870.db2.gz	USVAWMZQCVPQRO-UHFFFAOYSA-N	-1	0	343.807	3.905	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)cc1C(=O)[O-]	ZINC000299748164	564150679	/nfs/dbraw/zinc/15/06/79/564150679.db2.gz	GHGMAQACQYORRR-CVEARBPZSA-N	-1	0	347.798	3.702	50	0		EHAARM
Cc1noc(C)c1CCC(=O)Nc1cc2ccccc2cc1C(=O)[O-]	ZINC000008429427	564165278	/nfs/dbraw/zinc/16/52/78/564165278.db2.gz	YDFYMGMYYFBHIC-UHFFFAOYSA-N	-1	0	338.363	3.714	50	0		EHAARM
COc1ccc(Cc2nnc(Nc3ccc(C)cc3C)[n-]c2=O)cc1	ZINC000008578469	564165773	/nfs/dbraw/zinc/16/57/73/564165773.db2.gz	XJHODURGMVYOOO-UHFFFAOYSA-N	-1	0	336.395	3.537	50	0		EHAARM
Cc1noc(C)c1COc1ccc(C(=O)Nc2ccccc2O)cc1	ZINC000009390129	564173306	/nfs/dbraw/zinc/17/33/06/564173306.db2.gz	IOJOVPCNRYADGP-UHFFFAOYSA-N	-1	0	338.363	3.828	50	0		EHAARM
COc1ccc(-c2cc(F)ccc2OC[C@H]2CCOC2)cc1C(=O)[O-]	ZINC000516088715	564177458	/nfs/dbraw/zinc/17/74/58/564177458.db2.gz	JMRLODVRUSURNM-LBPRGKRZSA-N	-1	0	346.354	3.615	50	0		EHAARM
Cc1cc2[nH]c(C(=O)N3C[C@@H](C(=O)[O-])c4ccccc43)cc2c(C)c1	ZINC000192937176	600278842	/nfs/dbraw/zinc/27/88/42/600278842.db2.gz	BINYAGHSTCGEMK-OAHLLOKOSA-N	-1	0	334.375	3.613	50	0		EHAARM
O=C([O-])c1ccc(CN=Nc2ncc(C(F)(F)F)cc2Cl)cc1	ZINC000013146673	1034906716	/nfs/dbraw/zinc/90/67/16/1034906716.db2.gz	XPYISUSPQPYMSS-UHFFFAOYSA-N	-1	0	343.692	3.898	50	0		EHAARM
CC[C@@H](C)n1ncc2c1nc(/C=C/c1cncs1)cc2C(=O)[O-]	ZINC000566305719	1130804518	/nfs/dbraw/zinc/80/45/18/1130804518.db2.gz	ZJFVIMWTSNLBCX-ORAHPGNNSA-N	-1	0	328.397	3.727	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cnn([C@@H](C)C3CC3)c2)cc1Cl	ZINC000187740810	1131949784	/nfs/dbraw/zinc/94/97/84/1131949784.db2.gz	LYZBHUWCWVYDSG-NSHDSACASA-N	-1	0	339.848	3.617	50	0		EHAARM
COc1ccc(-n2nc(C)c3c2nc(C(C)C)cc3C(=O)[O-])cc1	ZINC000012398005	201843236	/nfs/dbraw/zinc/84/32/36/201843236.db2.gz	JKUHTSVJYPZQAY-UHFFFAOYSA-N	-1	0	325.368	3.559	50	0		EHAARM
CSc1ccc(NC(=O)CSc2ccccc2C(=O)[O-])cc1	ZINC000012937269	201875741	/nfs/dbraw/zinc/87/57/41/201875741.db2.gz	NQLXSECARUQNAD-UHFFFAOYSA-N	-1	0	333.434	3.838	50	0		EHAARM
COc1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000003370438	210019750	/nfs/dbraw/zinc/01/97/50/210019750.db2.gz	LDTWIKIFIKTXCR-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
CCOC(=O)c1ccc([N-]c2nc(-c3ccc(OC)cc3)no2)cc1	ZINC000021158371	202062782	/nfs/dbraw/zinc/06/27/82/202062782.db2.gz	RWHFQGSMZIBCQL-UHFFFAOYSA-N	-1	0	339.351	3.666	50	0		EHAARM
CN(Cc1ccccc1F)Cc1cc(=O)oc2cc([O-])c(Cl)cc12	ZINC000023718829	202108602	/nfs/dbraw/zinc/10/86/02/202108602.db2.gz	APEBDJMZLASLIL-UHFFFAOYSA-N	-1	0	347.773	3.923	50	0		EHAARM
Cc1cccc(C)c1NC(=O)c1c([O-])c2cccc3c2n(c1=O)[C@@H](C)C3	ZINC000299738215	201355315	/nfs/dbraw/zinc/35/53/15/201355315.db2.gz	KBTMJHKAXHWMEZ-ZDUSSCGKSA-N	-1	0	348.402	3.693	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@@]1(Cc1ccccc1Cl)C(=O)[O-]	ZINC000000391968	201467441	/nfs/dbraw/zinc/46/74/41/201467441.db2.gz	WNUHKLSUIDCUPW-QGZVFWFLSA-N	-1	0	339.819	3.737	50	0		EHAARM
CC(C)(C)c1ccc(OCC(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000001207533	201500413	/nfs/dbraw/zinc/50/04/13/201500413.db2.gz	HBWHFUOANGBPBY-UHFFFAOYSA-N	-1	0	327.380	3.700	50	0		EHAARM
O=C([O-])C[C@H](CC(=O)Nc1cccc2cccnc21)c1ccccc1	ZINC000226750213	242113723	/nfs/dbraw/zinc/11/37/23/242113723.db2.gz	YFIVOALIQGQPAN-INIZCTEOSA-N	-1	0	334.375	3.822	50	0		EHAARM
O=C([O-])COc1c(=O)c2ccccc2oc1-c1ccc(Cl)cc1	ZINC000001978318	201523176	/nfs/dbraw/zinc/52/31/76/201523176.db2.gz	QTLOJBFQUFWAGM-UHFFFAOYSA-N	-1	0	330.723	3.577	50	0		EHAARM
COP(=O)(OC)[C@@H](Nc1ccccc1C(=O)[O-])c1ccccc1	ZINC000002311968	201529821	/nfs/dbraw/zinc/52/98/21/201529821.db2.gz	ZJMNFDOLPMKZGS-OAHLLOKOSA-N	-1	0	335.296	3.981	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000020509591	212141687	/nfs/dbraw/zinc/14/16/87/212141687.db2.gz	PSHSPWLMOCXLJN-MSOLQXFVSA-N	-1	0	335.403	3.559	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](Cc1cc(Cl)cc(Cl)c1)C(=O)[O-]	ZINC000069554625	203016855	/nfs/dbraw/zinc/01/68/55/203016855.db2.gz	VKAOZRGFKAVEKA-NSHDSACASA-N	-1	0	334.199	3.514	50	0		EHAARM
COCC[C@@]1(C(=O)[O-])CCCN(c2ccnc3cc(Cl)ccc32)C1	ZINC000071753980	203107985	/nfs/dbraw/zinc/10/79/85/203107985.db2.gz	LCEAPHUZYWJYSR-SFHVURJKSA-N	-1	0	348.830	3.596	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)/C=C/c2ccc(Cl)s2)C1	ZINC000043584277	204285790	/nfs/dbraw/zinc/28/57/90/204285790.db2.gz	YDTCJJHASGYGEY-ZRQQLDRUSA-N	-1	0	327.833	3.518	50	0		EHAARM
O=C([N-]C(=O)C(Cl)(Cl)Cl)Oc1cccc2ccccc21	ZINC000000082164	205399194	/nfs/dbraw/zinc/39/91/94/205399194.db2.gz	XOQVMLWEVJIYNT-UHFFFAOYSA-N	-1	0	332.570	3.825	50	0		EHAARM
CC(=O)c1sc([N-]c2nc3cc4c(cc3s2)OCO4)nc1C	ZINC000004137822	205691354	/nfs/dbraw/zinc/69/13/54/205691354.db2.gz	CGMOMSVSXUYEAG-UHFFFAOYSA-N	-1	0	333.394	3.736	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000000268425	206224015	/nfs/dbraw/zinc/22/40/15/206224015.db2.gz	GLTIFAPRQURZFG-UONOGXRCSA-N	-1	0	331.412	3.598	50	0		EHAARM
CC(C)CC(=O)Nc1cccc(C(=O)Nc2cccc(C(=O)[O-])c2)c1	ZINC000010109728	211149214	/nfs/dbraw/zinc/14/92/14/211149214.db2.gz	QBHMQAWPLXWLHU-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
Cc1ccc(N2C(=O)c3cccc4c(C(=O)[O-])ccc(c43)C2=O)cc1	ZINC000000097009	135644279	/nfs/dbraw/zinc/64/42/79/135644279.db2.gz	GTVCVDZZVCAZHQ-UHFFFAOYSA-N	-1	0	331.327	3.647	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c(O)c1	ZINC000004618403	564013858	/nfs/dbraw/zinc/01/38/58/564013858.db2.gz	PIPQYWFQACGJEB-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
O=C(Nc1ccccc1O)c1cccc(C(=O)Nc2ccccc2O)c1	ZINC000000059365	563213720	/nfs/dbraw/zinc/21/37/20/563213720.db2.gz	JRJRREGDBAVNHN-UHFFFAOYSA-N	-1	0	348.358	3.602	50	0		EHAARM
Cc1nc(-c2ccc(NC(=O)CC(C)(C)CC(=O)[O-])cc2)cs1	ZINC000000146845	563244530	/nfs/dbraw/zinc/24/45/30/563244530.db2.gz	DROZXTGSEBNGAM-UHFFFAOYSA-N	-1	0	332.425	3.948	50	0		EHAARM
O=S(=O)([N-]c1cccc2c1ccc1cccn12)c1cccs1	ZINC000001386580	563385342	/nfs/dbraw/zinc/38/53/42/563385342.db2.gz	BPTPNBWSOKFDTN-UHFFFAOYSA-N	-1	0	328.418	3.955	50	0	aggregator	EHAARM
O=S(=O)([N-]c1ccc(Cl)cc1F)c1ccc(Cl)s1	ZINC000002637428	563444740	/nfs/dbraw/zinc/44/47/40/563444740.db2.gz	SVYYOEKVIFEJNC-UHFFFAOYSA-N	-1	0	326.201	3.995	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000004652572	563506543	/nfs/dbraw/zinc/50/65/43/563506543.db2.gz	LTDGNQBCXLPCMP-WDEREUQCSA-N	-1	0	330.211	3.501	50	0		EHAARM
Cc1ccc(C)c(-n2c(=S)[n-]nc2-c2ccc3c(c2)OCO3)c1	ZINC000006533785	563571683	/nfs/dbraw/zinc/57/16/83/563571683.db2.gz	UUUBHSDLUIDMLH-UHFFFAOYSA-N	-1	0	325.393	3.942	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(Br)s2)cc1	ZINC000002464725	563575194	/nfs/dbraw/zinc/57/51/94/563575194.db2.gz	FZVIFRSAQWWXAJ-UHFFFAOYSA-N	-1	0	332.244	3.620	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccccc2Br)c1C	ZINC000007053066	563594277	/nfs/dbraw/zinc/59/42/77/563594277.db2.gz	LUAGXHKMNXFILL-UHFFFAOYSA-N	-1	0	340.242	3.867	50	0		EHAARM
CCCCOc1ccc(S(=O)(=O)[N-]c2ccccc2O)cc1C	ZINC000011565948	563649903	/nfs/dbraw/zinc/64/99/03/563649903.db2.gz	OYUOTPGMUYFWDG-UHFFFAOYSA-N	-1	0	335.425	3.680	50	0		EHAARM
CN1C(=O)c2ccccc2N[C@H]1c1ccc(-c2ccc(C(=O)[O-])cc2)o1	ZINC000013462184	563698400	/nfs/dbraw/zinc/69/84/00/563698400.db2.gz	NUJHJTSSOLHMBL-GOSISDBHSA-N	-1	0	348.358	3.841	50	0		EHAARM
O=S(=O)([N-]c1nnc(C2CCCCC2)s1)c1ccc(F)cc1	ZINC000000378605	563917414	/nfs/dbraw/zinc/91/74/14/563917414.db2.gz	NRMLKQSKIUWFMJ-UHFFFAOYSA-N	-1	0	341.433	3.526	50	0		EHAARM
CCCCOc1ccc(C)cc1S(=O)(=O)[N-]c1ccccc1O	ZINC000041091986	563924208	/nfs/dbraw/zinc/92/42/08/563924208.db2.gz	RYBBBMNUSUBYCI-UHFFFAOYSA-N	-1	0	335.425	3.680	50	0		EHAARM
COc1cccc([C@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)c1	ZINC000058180101	563939154	/nfs/dbraw/zinc/93/91/54/563939154.db2.gz	MPVCPNSRRNYYRZ-OAHLLOKOSA-N	-1	0	341.436	3.743	50	0		EHAARM
O=C([O-])CN1C(=O)/C(=C\c2cccc(Cl)c2)Sc2ccccc21	ZINC000004670243	563963619	/nfs/dbraw/zinc/96/36/19/563963619.db2.gz	NEXYOYVCPVCQGP-OQLLNIDSSA-N	-1	0	345.807	3.904	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)c1ccco1)c1ccc(OC2CCCC2)cc1	ZINC000004689303	563964400	/nfs/dbraw/zinc/96/44/00/563964400.db2.gz	LNQQHZDUSZDTOV-MRXNPFEDSA-N	-1	0	343.379	3.547	50	0		EHAARM
COc1ccc(-c2csc(Nc3ccc(O)c(C(=O)[O-])c3)n2)cc1	ZINC000004711779	563966024	/nfs/dbraw/zinc/96/60/24/563966024.db2.gz	GFCLNSHPMXBANX-UHFFFAOYSA-N	-1	0	342.376	3.966	50	0		EHAARM
CCCn1c(=O)c(C(=O)Nc2ccc(F)cc2)c([O-])c2ccccc21	ZINC000100504393	563982648	/nfs/dbraw/zinc/98/26/48/563982648.db2.gz	VGRIIMYAFZDESW-UHFFFAOYSA-N	-1	0	340.354	3.509	50	0		EHAARM
CC(C)[C@H](NC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-])c1ccc(Cl)cc1	ZINC000248234861	563983844	/nfs/dbraw/zinc/98/38/44/563983844.db2.gz	MEHLKVRXOKTCJQ-OAGGEKHMSA-N	-1	0	335.831	3.820	50	0		EHAARM
Cc1cc(Cl)ccc1NC(=O)c1ccc(O[C@@H](C)C(=O)[O-])cc1	ZINC000000148414	563987306	/nfs/dbraw/zinc/98/73/06/563987306.db2.gz	HEFAXWHJDHPLEJ-NSHDSACASA-N	-1	0	333.771	3.753	50	0		EHAARM
CC(C)CC(=O)Nc1cccc(C(=O)Nc2ccccc2C(=O)[O-])c1	ZINC000000378298	563991904	/nfs/dbraw/zinc/99/19/04/563991904.db2.gz	OPSFKYZQRQRBJJ-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0	biogenic	EHAARM
Cc1ccc(-c2nnc(SCCC(=O)[O-])n2-c2ccccc2)cc1	ZINC000000420857	563998278	/nfs/dbraw/zinc/99/82/78/563998278.db2.gz	QRHQGKWEEUVEKZ-UHFFFAOYSA-N	-1	0	339.420	3.810	50	0		EHAARM
COc1ccc(C[C@@H](CC(=O)[O-])C(=O)Nc2ccc(Cl)cc2)cc1	ZINC000005170678	563999888	/nfs/dbraw/zinc/99/98/88/563999888.db2.gz	RXTJZLAISJKFDV-ZDUSSCGKSA-N	-1	0	347.798	3.621	50	0		EHAARM
CCCOC(=O)[C@@H]1C2c3ccccc3C(c3ccccc32)[C@H]1C(=O)[O-]	ZINC000002496189	564003815	/nfs/dbraw/zinc/00/38/15/564003815.db2.gz	AXMPLSTZNMYFSE-CSODTCANSA-N	-1	0	336.387	3.548	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cn1)c1cc(Cl)ccc1Cl	ZINC000005557823	564005453	/nfs/dbraw/zinc/00/54/53/564005453.db2.gz	HWMBAEMYPWOGRN-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
COc1ccccc1NC(=O)[C@H](CC(=O)[O-])Cc1ccc(Cl)cc1	ZINC000000524382	564021223	/nfs/dbraw/zinc/02/12/23/564021223.db2.gz	PJDWYOCFRPNMMK-ZDUSSCGKSA-N	-1	0	347.798	3.621	50	0		EHAARM
CC(C)CCO[C@H]1CCN(C(=O)c2ccc3[n-]c(=S)oc3c2)C1	ZINC000083010559	564060284	/nfs/dbraw/zinc/06/02/84/564060284.db2.gz	INWWAGXDKHJRQZ-ZDUSSCGKSA-N	-1	0	334.441	3.768	50	0		EHAARM
CC(C)N(C(=O)c1ccccc1-c1cncc(C(=O)[O-])c1)C(C)C	ZINC000534590021	564061194	/nfs/dbraw/zinc/06/11/94/564061194.db2.gz	GISITHZTQJOFAB-UHFFFAOYSA-N	-1	0	326.396	3.706	50	0		EHAARM
O=C([O-])c1ccc(-n2nncc2-c2cccc(C(F)(F)F)c2)cc1	ZINC000012998170	564086075	/nfs/dbraw/zinc/08/60/75/564086075.db2.gz	MRNYPGVXYIDOBV-UHFFFAOYSA-N	-1	0	333.269	3.651	50	0		EHAARM
CCOc1cc(C)c(C)cc1S(=O)(=O)[N-]c1ccc(Cl)cn1	ZINC000004970544	564093165	/nfs/dbraw/zinc/09/31/65/564093165.db2.gz	MDLDBIHONPLLMY-UHFFFAOYSA-N	-1	0	340.832	3.551	50	0		EHAARM
Cc1nn(-c2cccc(C)c2)c2ncc(C(=O)c3ccccc3[O-])cc12	ZINC000006934958	564101608	/nfs/dbraw/zinc/10/16/08/564101608.db2.gz	IFPGPSSEWNEIJM-UHFFFAOYSA-N	-1	0	343.386	3.974	50	0		EHAARM
Cc1nnc(-c2cc([N-]S(=O)(=O)c3cccc(C)c3)c(C)s2)o1	ZINC000065149427	564101736	/nfs/dbraw/zinc/10/17/36/564101736.db2.gz	SDQJRDFJZQVZDD-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CCc1ccc(S(=O)(=O)[N-]c2cc(-c3ccsc3)no2)cc1	ZINC000065153424	564102077	/nfs/dbraw/zinc/10/20/77/564102077.db2.gz	RYYQCVWNSWBBNX-UHFFFAOYSA-N	-1	0	334.422	3.766	50	0		EHAARM
CCc1nnc(NC(=O)c2sc(-c3ccsc3)nc2C)s1	ZINC000007462790	564108693	/nfs/dbraw/zinc/10/86/93/564108693.db2.gz	MOPQQSAEXHSRKD-UHFFFAOYSA-N	-1	0	336.467	3.846	50	0		EHAARM
C[C@@H]1C[C@H](Nc2ccccc2)c2ccccc2N1C(=O)CCC(=O)[O-]	ZINC000004561467	564111681	/nfs/dbraw/zinc/11/16/81/564111681.db2.gz	STNRBABUYVLMIL-PBHICJAKSA-N	-1	0	338.407	3.830	50	0		EHAARM
CCCN(C[C@H]1CCCCO1)C(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000170642137	564118949	/nfs/dbraw/zinc/11/89/49/564118949.db2.gz	ZAEDREWFHFHELX-CYBMUJFWSA-N	-1	0	334.441	3.538	50	0		EHAARM
O=S(=O)([N-]c1cccc2cccnc21)c1ccc(Cl)cc1F	ZINC000007709469	564122121	/nfs/dbraw/zinc/12/21/21/564122121.db2.gz	DCXGHZPMRLETJZ-UHFFFAOYSA-N	-1	0	336.775	3.828	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1C(=O)[O-]	ZINC000299748167	564150697	/nfs/dbraw/zinc/15/06/97/564150697.db2.gz	GHGMAQACQYORRR-JKSUJKDBSA-N	-1	0	347.798	3.702	50	0		EHAARM
COc1cccc(Nc2c(F)c(OC)c(F)c(F)c2C(=O)[O-])c1	ZINC000003651463	564159273	/nfs/dbraw/zinc/15/92/73/564159273.db2.gz	WRNJIDDRYNCLGD-UHFFFAOYSA-N	-1	0	327.258	3.563	50	0		EHAARM
CSc1ccc([C@@H](CC(=O)[O-])N2Cc3ccccc3C2=O)cc1	ZINC000003855997	564159520	/nfs/dbraw/zinc/15/95/20/564159520.db2.gz	BXHNIKZOCMFRHW-MRXNPFEDSA-N	-1	0	327.405	3.580	50	0		EHAARM
Cc1cccc(-n2ncc3c2nc(SCc2ccccn2)[nH]c3=O)c1	ZINC000009018906	564168589	/nfs/dbraw/zinc/16/85/89/564168589.db2.gz	LOZNDZOLPRMAIG-UHFFFAOYSA-N	-1	0	349.419	3.517	50	0		EHAARM
COC(=O)c1c(SCc2cccc(F)c2)[n-]c2ccccc2c1=O	ZINC000009300290	564172380	/nfs/dbraw/zinc/17/23/80/564172380.db2.gz	MHIIUBLJZVOSGM-UHFFFAOYSA-N	-1	0	343.379	3.746	50	0		EHAARM
CC(C)(C)[C@@H]1OCC[C@@H]1CNC(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000073770170	564176424	/nfs/dbraw/zinc/17/64/24/564176424.db2.gz	AZIOGUDSZUDKHS-BXUZGUMPSA-N	-1	0	334.441	3.671	50	0		EHAARM
COc1ccc(C(C)=NNc2ccc(Cl)c(C(=O)[O-])c2)c(O)c1	ZINC000254481721	1039907808	/nfs/dbraw/zinc/90/78/08/1039907808.db2.gz	JCTVZBQUHJNOBL-UHFFFAOYSA-N	-1	0	334.759	3.589	50	0		EHAARM
Cc1cnc(/C=C/c2cc(C(=O)[O-])c3cnn(C(C)C)c3n2)s1	ZINC000576826855	1131688955	/nfs/dbraw/zinc/68/89/55/1131688955.db2.gz	NSLZIBSPHBPBDL-SNAWJCMRSA-N	-1	0	328.397	3.646	50	0		EHAARM
COc1ccccc1-c1ccc([C@@H](C)NC(=O)C(C)(C)C(=O)[O-])cc1	ZINC000579957080	1132116519	/nfs/dbraw/zinc/11/65/19/1132116519.db2.gz	XPWMFLMPPVECNF-CYBMUJFWSA-N	-1	0	341.407	3.650	50	0		EHAARM
Nc1nc(-c2ccc(OCc3cccc(C(=O)[O-])c3)cc2)cs1	ZINC000020329828	202037594	/nfs/dbraw/zinc/03/75/94/202037594.db2.gz	QFENYSJWMQYSAV-UHFFFAOYSA-N	-1	0	326.377	3.670	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(C)cc1C	ZINC000032601927	202229335	/nfs/dbraw/zinc/22/93/35/202229335.db2.gz	NXGCTGWCSGJYCF-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2O)cc1C	ZINC000035592595	202307598	/nfs/dbraw/zinc/30/75/98/202307598.db2.gz	YCDSZXPRNMQZOD-UHFFFAOYSA-N	-1	0	341.816	3.554	50	0		EHAARM
CCc1cc2c(cc1[O-])oc(C)c(-c1nc3ccccc3n1C)c2=O	ZINC000005686750	201362102	/nfs/dbraw/zinc/36/21/02/201362102.db2.gz	KKFCQJBFHARTOH-UHFFFAOYSA-N	-1	0	334.375	3.923	50	0	biogenic	EHAARM
COc1ccccc1S(=O)(=O)[N-]c1cccc(OC2CCCC2)c1	ZINC000044668057	202526372	/nfs/dbraw/zinc/52/63/72/202526372.db2.gz	XCSFRZACVAKLAO-UHFFFAOYSA-N	-1	0	347.436	3.817	50	0		EHAARM
CCc1ccc(NC(=O)c2c([O-])c3sccc3n(CC)c2=O)cc1	ZINC000049409526	202621704	/nfs/dbraw/zinc/62/17/04/202621704.db2.gz	UMELYRMHYODWSE-UHFFFAOYSA-N	-1	0	342.420	3.603	50	0		EHAARM
CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc1cccc(C(=O)[O-])c1	ZINC000000041896	201425626	/nfs/dbraw/zinc/42/56/26/201425626.db2.gz	LVQFPCUAPXISCX-CMPLNLGQSA-N	-1	0	328.195	3.915	50	0		EHAARM
O=C([O-])c1ccccc1-n1nc(-c2ccccc2)c2ccccc2c1=O	ZINC000000045066	201426843	/nfs/dbraw/zinc/42/68/43/201426843.db2.gz	PDQDBJOAIGWDFX-UHFFFAOYSA-N	-1	0	342.354	3.751	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2cccc3cccnc32)ccc1Cl	ZINC000214077289	241096563	/nfs/dbraw/zinc/09/65/63/241096563.db2.gz	ONKHCBCVHIPBLO-UHFFFAOYSA-N	-1	0	332.812	3.997	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(Br)s2)c1	ZINC000000470240	201477479	/nfs/dbraw/zinc/47/74/79/201477479.db2.gz	WYHSRPSWMFYLGN-UHFFFAOYSA-N	-1	0	332.244	3.620	50	0		EHAARM
O=C([O-])C[C@H]1CCCCN1C(=O)c1ccccc1Oc1ccccc1	ZINC000221268727	241461537	/nfs/dbraw/zinc/46/15/37/241461537.db2.gz	MIYKUJJJNVOEAI-OAHLLOKOSA-N	-1	0	339.391	3.948	50	0		EHAARM
Cc1ncc(-c2ccc(S(=O)(=O)[N-]c3ccccc3C)s2)o1	ZINC000065003835	202823157	/nfs/dbraw/zinc/82/31/57/202823157.db2.gz	GHWKNDIIQCGQPJ-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
Cc1ccc(C2(C(=O)N3CC[C@H](c4ccccc4C(=O)[O-])C3)CC2)cc1	ZINC000072129110	203166233	/nfs/dbraw/zinc/16/62/33/203166233.db2.gz	NZJJOIDUZWPSOO-INIZCTEOSA-N	-1	0	349.430	3.741	50	0		EHAARM
Cc1ccc(Cl)cc1C(=O)N1CC[C@@H](c2ccccc2C(=O)[O-])C1	ZINC000072150970	203172892	/nfs/dbraw/zinc/17/28/92/203172892.db2.gz	YSMCDUBCWZWXMN-CYBMUJFWSA-N	-1	0	343.810	3.976	50	0		EHAARM
Cc1cc(Cl)cc2c1ncc(C(=O)[O-])c2Nc1cccc(O)c1	ZINC000019795505	212068666	/nfs/dbraw/zinc/06/86/66/212068666.db2.gz	BHESBEYKHOKMEZ-UHFFFAOYSA-N	-1	0	328.755	3.766	50	0		EHAARM
O=c1cc(C(F)(F)F)nc2c(-c3ccccc3)c(C(F)(F)F)[n-]n21	ZINC000100232446	203991390	/nfs/dbraw/zinc/99/13/90/203991390.db2.gz	NTHFNFTWFOCLDZ-UHFFFAOYSA-N	-1	0	347.218	3.727	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2c(C)cccc2C)c1=O	ZINC000100602452	203995720	/nfs/dbraw/zinc/99/57/20/203995720.db2.gz	IXSWAGDXYSVPSM-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2ccc(Cl)cc2Cl)C1	ZINC000043583355	204285273	/nfs/dbraw/zinc/28/52/73/204285273.db2.gz	WGIGCMSFORXDJA-SNVBAGLBSA-N	-1	0	330.211	3.710	50	0		EHAARM
O=C(N[C@H]1CCOC2(CCCCC2)C1)c1ccc2[n-]c(=S)oc2c1	ZINC000124184332	204953161	/nfs/dbraw/zinc/95/31/61/204953161.db2.gz	JNZRYOMTSLRNNU-ZDUSSCGKSA-N	-1	0	346.452	3.728	50	0		EHAARM
Cc1cc(Br)ccc1NC(=O)[C@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000000242516	206207802	/nfs/dbraw/zinc/20/78/02/206207802.db2.gz	SIXQASFELNQYLR-RYUDHWBXSA-N	-1	0	340.217	3.587	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000003128431	564155305	/nfs/dbraw/zinc/15/53/05/564155305.db2.gz	KNXCINQNSMHIBJ-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
O=C([O-])c1cc(Cl)cn(Cc2ccc(Cl)c(Cl)c2)c1=O	ZINC000000169894	563250846	/nfs/dbraw/zinc/25/08/46/563250846.db2.gz	DMJSKFSNMJSLJU-UHFFFAOYSA-N	-1	0	332.570	3.555	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2cc3ccccc3cn2)CCCCC1	ZINC000000129665	563238061	/nfs/dbraw/zinc/23/80/61/563238061.db2.gz	LNYUQSODHLBDFH-UHFFFAOYSA-N	-1	0	326.396	3.989	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc2ccccc2c1	ZINC000000299079	563275373	/nfs/dbraw/zinc/27/53/73/563275373.db2.gz	NKQQPUQBLFDBSO-UHFFFAOYSA-N	-1	0	327.405	3.958	50	0		EHAARM
Cc1ccc(C[C@@H](C(=O)[O-])[C@H](C)C(=O)Nc2ccc(F)cc2)cc1	ZINC000000350635	563289491	/nfs/dbraw/zinc/28/94/91/563289491.db2.gz	VZVZQCSDNMAZDA-SUMWQHHRSA-N	-1	0	329.371	3.652	50	0		EHAARM
COc1ccc(NC(=O)C[C@@H](Cc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000000351308	563289492	/nfs/dbraw/zinc/28/94/92/563289492.db2.gz	PKHGRYMSMWUGKW-CYBMUJFWSA-N	-1	0	347.798	3.621	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@@H]3CCCC[C@H]3C(=O)[O-])n2)cc1	ZINC000000483890	563337799	/nfs/dbraw/zinc/33/77/99/563337799.db2.gz	MSWQGSUCTSKSLI-ZIAGYGMSSA-N	-1	0	344.436	3.948	50	0		EHAARM
CC(C)(C)OC(=O)N1[C@H](C(=O)[O-])CS[C@H]1c1ccc(Cl)cc1	ZINC000001406902	563388192	/nfs/dbraw/zinc/38/81/92/563388192.db2.gz	MCVPXTHCXZFQMW-RYUDHWBXSA-N	-1	0	343.832	3.776	50	0		EHAARM
Nc1ccc(Oc2ccc(Cl)cc2S(=O)(=O)[O-])c(Cl)c1	ZINC000002165087	563424735	/nfs/dbraw/zinc/42/47/35/563424735.db2.gz	RSMQUWVTBSMHJV-UHFFFAOYSA-N	-1	0	334.180	3.615	50	0		EHAARM
O=C([O-])c1cccc(CN2C(=O)S/C(=C\c3ccccc3)C2=O)c1	ZINC000002330474	563429386	/nfs/dbraw/zinc/42/93/86/563429386.db2.gz	HGTILGNTGVXCHG-GDNBJRDFSA-N	-1	0	339.372	3.621	50	0		EHAARM
O=C([O-])CCCCCC(=O)c1cccc(I)c1	ZINC000002579886	563442867	/nfs/dbraw/zinc/44/28/67/563442867.db2.gz	QNSRZYMQZSPGKJ-UHFFFAOYSA-N	-1	0	346.164	3.509	50	0		EHAARM
CCCCc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1	ZINC000003215160	563476920	/nfs/dbraw/zinc/47/69/20/563476920.db2.gz	MFFZLTRBQGTWRR-UHFFFAOYSA-N	-1	0	347.436	3.837	50	0		EHAARM
CC(C)=CCOc1ccc2c(C)c(CCC(=O)[O-])c(=O)oc2c1C	ZINC000004044864	563492856	/nfs/dbraw/zinc/49/28/56/563492856.db2.gz	JUBVHMXVQKLSAG-UHFFFAOYSA-N	-1	0	330.380	3.772	50	0	biogenic	EHAARM
CCN1C(=O)S/C(=C/c2ccc(-c3ccc(C(=O)[O-])cc3)o2)C1=O	ZINC000004917569	563515603	/nfs/dbraw/zinc/51/56/03/563515603.db2.gz	MNSVFMQYUAJBRB-NTEUORMPSA-N	-1	0	343.360	3.701	50	0		EHAARM
Cc1nc(-c2c(=O)c3ccc([O-])cc3oc2C(F)(F)F)cs1	ZINC000005730853	563547653	/nfs/dbraw/zinc/54/76/53/563547653.db2.gz	FDGPZXWQGFWDKO-UHFFFAOYSA-N	-1	0	327.283	3.949	50	0		EHAARM
Cc1nn(-c2ccc(C(=O)[O-])cc2)c2nc(C)cc(C(F)(F)F)c12	ZINC000009592570	563644373	/nfs/dbraw/zinc/64/43/73/563644373.db2.gz	WLCNERHJDJOLBM-UHFFFAOYSA-N	-1	0	335.285	3.754	50	0		EHAARM
CC(C)OCc1ccc(C(=O)N[C@@H](CC(=O)[O-])c2cccs2)cc1	ZINC000013389674	563697336	/nfs/dbraw/zinc/69/73/36/563697336.db2.gz	ISTXTHGERCCWCY-HNNXBMFYSA-N	-1	0	347.436	3.619	50	0		EHAARM
O=c1c2cc(-c3ccccc3)sc2[n-]c(=S)n1C[C@@H]1CCCO1	ZINC000017071904	563835237	/nfs/dbraw/zinc/83/52/37/563835237.db2.gz	QFOXULJUQLOQQJ-LBPRGKRZSA-N	-1	0	344.461	3.967	50	0		EHAARM
O=C([O-])[C@H]1CC=C[C@H]1NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000041702052	563924581	/nfs/dbraw/zinc/92/45/81/563924581.db2.gz	UNMKIEMIGPKQSA-PKOBYXMFSA-N	-1	0	349.386	3.554	50	0		EHAARM
CCC[C@H](NC(=O)c1ccccc1NCC(=O)[O-])c1cccs1	ZINC000065501993	563961671	/nfs/dbraw/zinc/96/16/71/563961671.db2.gz	SLGMJYHRRQXIJA-AWEZNQCLSA-N	-1	0	332.425	3.516	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)COc2ccc(Cl)cc2Cl)c1	ZINC000000028124	563963354	/nfs/dbraw/zinc/96/33/54/563963354.db2.gz	ULHWGJDNWCGWHC-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
C[C@@H](C(=O)[O-])[C@H](NC(=O)c1cccc(F)c1Cl)c1ccccc1	ZINC000097018249	563966796	/nfs/dbraw/zinc/96/67/96/563966796.db2.gz	VKTHABRYKXGGHC-BMIGLBTASA-N	-1	0	335.762	3.671	50	0		EHAARM
CC[C@]1(C(=O)[O-])CCCN(C(=O)c2cccc(-c3ccc(C)o3)c2)C1	ZINC000091326991	563975335	/nfs/dbraw/zinc/97/53/35/563975335.db2.gz	NVMVJWNJXJQVKT-FQEVSTJZSA-N	-1	0	341.407	3.972	50	0		EHAARM
CCn1nc(/C=C/c2ncc(C(=O)[O-])c(C(C)C)n2)c2ccccc21	ZINC000274493299	564000999	/nfs/dbraw/zinc/00/09/99/564000999.db2.gz	JBNIQRADNUTCKP-MDZDMXLPSA-N	-1	0	336.395	3.838	50	0		EHAARM
Cc1ccc(C)c(OCC(=O)Nc2cc(Cl)ccc2C(=O)[O-])c1	ZINC000004724558	564013884	/nfs/dbraw/zinc/01/38/84/564013884.db2.gz	NTNFYIFLWCEOQD-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000007053772	564015376	/nfs/dbraw/zinc/01/53/76/564015376.db2.gz	FQDDFIUXSSIXOR-GFCCVEGCSA-N	-1	0	333.409	3.699	50	0		EHAARM
Cc1ccc([C@@H]2[C@@H](C(=O)[O-])CCC(=O)N2[C@H](C)c2cc(C)oc2C)o1	ZINC000106839536	564026673	/nfs/dbraw/zinc/02/66/73/564026673.db2.gz	ZWQLKOMDUDWMDL-IAISJRAMSA-N	-1	0	345.395	3.923	50	0		EHAARM
O=C(Nc1nc(SCc2ccc(F)cc2)ns1)c1ccco1	ZINC000000111462	564065367	/nfs/dbraw/zinc/06/53/67/564065367.db2.gz	MLUZBBAFALEMND-UHFFFAOYSA-N	-1	0	335.385	3.815	50	0		EHAARM
CC(=O)c1c(C)[nH]c(C(=O)CSc2ccccc2C(=O)[O-])c1C	ZINC000012759091	564067288	/nfs/dbraw/zinc/06/72/88/564067288.db2.gz	OUFFEAIXFCNPIL-UHFFFAOYSA-N	-1	0	331.393	3.507	50	0		EHAARM
CC(C)n1ncc2cc(NC(=O)c3ccc([O-])c(Cl)c3)cnc21	ZINC000012764159	564067874	/nfs/dbraw/zinc/06/78/74/564067874.db2.gz	DSKHCJXTWMLKJG-UHFFFAOYSA-N	-1	0	330.775	3.624	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000063897914	564083056	/nfs/dbraw/zinc/08/30/56/564083056.db2.gz	GEAOKMRNZRGOMW-QWHCGFSZSA-N	-1	0	342.420	3.779	50	0		EHAARM
O=S(=O)([N-]c1ccccn1)c1ccc2[nH]c3c(c2c1)CCCCC3	ZINC000006887639	564100719	/nfs/dbraw/zinc/10/07/19/564100719.db2.gz	MDRUDINEVXYTAC-UHFFFAOYSA-N	-1	0	341.436	3.633	50	0		EHAARM
Cc1nnc(-c2csc(S(=O)(=O)[N-]c3cccc(C)c3C)c2)o1	ZINC000065098527	564101080	/nfs/dbraw/zinc/10/10/80/564101080.db2.gz	ZVTWBSZAIJGROR-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cccc(F)c2C)c2cccnc21	ZINC000065242270	564103379	/nfs/dbraw/zinc/10/33/79/564103379.db2.gz	DDTZUVZZAYCECP-UHFFFAOYSA-N	-1	0	347.415	3.695	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cccc(C)c2C)c2cccnc21	ZINC000065242241	564103381	/nfs/dbraw/zinc/10/33/81/564103381.db2.gz	LIJWFRUZABGOOI-UHFFFAOYSA-N	-1	0	343.452	3.864	50	0		EHAARM
COc1cc2nc(C)sc2cc1NC(=O)CC1(C(=O)[O-])CCCC1	ZINC000169975741	564104141	/nfs/dbraw/zinc/10/41/41/564104141.db2.gz	SANNRMPQVOAMMW-UHFFFAOYSA-N	-1	0	348.424	3.587	50	0		EHAARM
COc1ccc(-c2c([O-])c3cc(Cl)c(OC)cc3oc2=O)cc1	ZINC000071404797	564129443	/nfs/dbraw/zinc/12/94/43/564129443.db2.gz	CIFQSENOUNSDIB-UHFFFAOYSA-N	-1	0	332.739	3.836	50	0		EHAARM
Cc1cc(Br)c(C(=O)[O-])cc1NC(=O)[C@H]1CC=CCC1	ZINC000312352931	564134420	/nfs/dbraw/zinc/13/44/20/564134420.db2.gz	XZXUNCKDHOYJNF-JTQLQIEISA-N	-1	0	338.201	3.751	50	0		EHAARM
O=C([O-])C1CCN(C(=O)c2ccc(Oc3cccc(F)c3)cc2)CC1	ZINC000299753342	564150690	/nfs/dbraw/zinc/15/06/90/564150690.db2.gz	XWZYTMPUGDKYNM-UHFFFAOYSA-N	-1	0	343.354	3.555	50	0		EHAARM
COc1ccccc1-n1[n-]c(C)c(Cc2ccc(Cl)cc2)c1=O	ZINC000009939739	564174889	/nfs/dbraw/zinc/17/48/89/564174889.db2.gz	OAFOWPQGXADPMA-UHFFFAOYSA-N	-1	0	328.799	3.727	50	0		EHAARM
O=C([O-])[C@H]1CCN(C(=O)Nc2ccc(OCC3CCCCC3)cc2)C1	ZINC000263494443	962678468	/nfs/dbraw/zinc/67/84/68/962678468.db2.gz	QEQNOJXNHKCGFR-HNNXBMFYSA-N	-1	0	346.427	3.584	50	0		EHAARM
O=C([O-])C/C(=C/c1cc(F)c(O)c(F)c1)c1nc2ccccc2o1	ZINC000095964091	1034379331	/nfs/dbraw/zinc/37/93/31/1034379331.db2.gz	DUIMVLJMUYFLRX-YHYXMXQVSA-N	-1	0	331.274	3.827	50	0		EHAARM
CC(C)c1nc(/C=C/c2cnn(Cc3ccccc3)c2)ncc1C(=O)[O-]	ZINC000172488475	1035511573	/nfs/dbraw/zinc/51/15/73/1035511573.db2.gz	HJSFUBVNSAEZIA-CMDGGOBGSA-N	-1	0	348.406	3.713	50	0		EHAARM
CCOc1cc(C=NNc2ccc(C(=O)[O-])cc2)cc(Cl)c1O	ZINC000254624290	1040993639	/nfs/dbraw/zinc/99/36/39/1040993639.db2.gz	PUWKWIITVSXGFO-UHFFFAOYSA-N	-1	0	334.759	3.589	50	0		EHAARM
Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@H](C)C(=O)[O-]	ZINC000563128865	1130650088	/nfs/dbraw/zinc/65/00/88/1130650088.db2.gz	WUAWOZFEUXJSKO-UONOGXRCSA-N	-1	0	327.380	3.794	50	0		EHAARM
CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(C3CC3)nn2)s1	ZINC000683721357	1133105244	/nfs/dbraw/zinc/10/52/44/1133105244.db2.gz	TVHLABMNNGQLPC-UHFFFAOYSA-N	-1	0	337.470	3.514	50	0		EHAARM
O=c1nc(Nc2ccc(Cl)cc2)[n-]nc1Cc1ccc(Cl)cc1	ZINC000009067015	201767020	/nfs/dbraw/zinc/76/70/20/201767020.db2.gz	CMEBQRWVVAYXOS-UHFFFAOYSA-N	-1	0	347.205	3.806	50	0		EHAARM
COc1cc(/C=C/C(=O)[O-])c(Br)cc1OC1CCCC1	ZINC000012394634	201843449	/nfs/dbraw/zinc/84/34/49/201843449.db2.gz	CVEWDRDNLMVCPU-VOTSOKGWSA-N	-1	0	341.201	3.877	50	0		EHAARM
CC(C)(C)c1nc2cc(NC(=O)CC(C)(C)CC(=O)[O-])ccc2o1	ZINC000046834802	213811153	/nfs/dbraw/zinc/81/11/53/213811153.db2.gz	WHOVKCWOCKFZNJ-UHFFFAOYSA-N	-1	0	332.400	3.955	50	0		EHAARM
O=C([O-])c1cc(-c2ccc(O)cc2)nc2n[nH]c(-c3ccc(F)cc3)c21	ZINC000015677221	201960517	/nfs/dbraw/zinc/96/05/17/201960517.db2.gz	RNTCEWMFPJVOAN-UHFFFAOYSA-N	-1	0	349.321	3.835	50	0		EHAARM
O=C([O-])[C@H](Oc1ccc(Br)cc1F)c1ccccc1	ZINC000020307016	202038024	/nfs/dbraw/zinc/03/80/24/202038024.db2.gz	CTROPUKPDSAFQE-CYBMUJFWSA-N	-1	0	325.133	3.793	50	0		EHAARM
CCc1ccc([C@@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)s1	ZINC000020617184	202051539	/nfs/dbraw/zinc/05/15/39/202051539.db2.gz	XZYUWMYRDNFJAQ-GXSJLCMTSA-N	-1	0	345.346	3.866	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)OCc1ccccc1)c1ccccc1Cl	ZINC000038580539	202139662	/nfs/dbraw/zinc/13/96/62/202139662.db2.gz	HJNVDNSNHGNSSS-OAHLLOKOSA-N	-1	0	333.771	3.782	50	0		EHAARM
CCOCc1cccc(S(=O)(=O)[N-]c2nc3ccccc3s2)c1	ZINC000071195469	202341247	/nfs/dbraw/zinc/34/12/47/202341247.db2.gz	VDXBMWAKPQWFNE-UHFFFAOYSA-N	-1	0	348.449	3.634	50	0		EHAARM
CC1(C)[C@@H](C(=O)Nc2nc3ccccc3s2)CC[C@]1(C)C(=O)[O-]	ZINC000000191660	201446070	/nfs/dbraw/zinc/44/60/70/201446070.db2.gz	MUKSDTCHANCPAN-BMLIUANNSA-N	-1	0	332.425	3.762	50	0		EHAARM
Cc1ccc([C@@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1	ZINC000000226866	201451362	/nfs/dbraw/zinc/45/13/62/201451362.db2.gz	BRZQPRHKSQMCSZ-NWDGAFQWSA-N	-1	0	325.290	3.550	50	0		EHAARM
Cc1ccc(-c2cccc(NC(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C(=O)[O-])c2)o1	ZINC000000510425	201482116	/nfs/dbraw/zinc/48/21/16/201482116.db2.gz	VAMWDEDFRKPIHI-IHETXDGRSA-N	-1	0	337.375	3.716	50	0		EHAARM
O=C([O-])c1cc(Cl)c(Cl)cc1C(=O)Nc1ccc(O)cc1	ZINC000004109274	201590372	/nfs/dbraw/zinc/59/03/72/201590372.db2.gz	QKYLHQIDBYATGW-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)CSc1ccccc1)c1ccc(Cl)cc1	ZINC000004653313	201609186	/nfs/dbraw/zinc/60/91/86/201609186.db2.gz	BQQIBIFZONRWLM-OAHLLOKOSA-N	-1	0	349.839	3.764	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cc(C)ccc3C)o2)on1	ZINC000064958453	202820606	/nfs/dbraw/zinc/82/06/06/202820606.db2.gz	ONRLOLUMXYWOAX-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
Cc1nnc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3C)s2)o1	ZINC000064919948	202819501	/nfs/dbraw/zinc/81/95/01/202819501.db2.gz	WKOKNGMSDMZOIE-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1cc(C(=O)N2CC[C@H](c3ccccc3C(=O)[O-])C2)ccc1Cl	ZINC000072172571	203182809	/nfs/dbraw/zinc/18/28/09/203182809.db2.gz	OBLFCSULSDYDDG-AWEZNQCLSA-N	-1	0	343.810	3.976	50	0		EHAARM
CCC(=O)Nc1ccc(-n2ccnc2-c2ccccc2C(=O)[O-])c(C)c1	ZINC000077378806	203384765	/nfs/dbraw/zinc/38/47/65/203384765.db2.gz	FQRJNHNHSYOAMZ-UHFFFAOYSA-N	-1	0	349.390	3.894	50	0		EHAARM
CCC[C@@H](C(=O)NCc1ccc(OC)c(C(=O)[O-])c1)c1ccccc1	ZINC000095349934	203713971	/nfs/dbraw/zinc/71/39/71/203713971.db2.gz	JYLNUGFMYHVZSU-MRXNPFEDSA-N	-1	0	341.407	3.594	50	0		EHAARM
O=C(C[C@H]1CC[C@@H](C(=O)[O-])CC1)c1ccccc1Br	ZINC000100449320	203993807	/nfs/dbraw/zinc/99/38/07/203993807.db2.gz	ALNIXWJGPRLYLB-XYPYZODXSA-N	-1	0	325.202	3.913	50	0		EHAARM
O=C(CSc1nc2ccccc2s1)Nc1ccc(C(=O)[O-])cc1	ZINC000000181627	206208611	/nfs/dbraw/zinc/20/86/11/206208611.db2.gz	ARVQDURBWHSEPA-UHFFFAOYSA-N	-1	0	344.417	3.725	50	0		EHAARM
O=C([O-])c1ccc(-c2nnc(-c3cccc(Br)c3)o2)cc1	ZINC000000266569	206222465	/nfs/dbraw/zinc/22/24/65/206222465.db2.gz	XMVKOJLZERNSMF-UHFFFAOYSA-N	-1	0	345.152	3.864	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)c1ccccc1C(F)(F)F)c1ccccc1	ZINC000013223935	207365742	/nfs/dbraw/zinc/36/57/42/207365742.db2.gz	VBSPIKRUBQZDGD-AWEZNQCLSA-N	-1	0	337.297	3.651	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2ccc3ccccc3n2)CCCCC1	ZINC000000129724	563238056	/nfs/dbraw/zinc/23/80/56/563238056.db2.gz	CTVMNVAOPDCGDN-UHFFFAOYSA-N	-1	0	326.396	3.989	50	0		EHAARM
O=C([O-])[C@H]1Cc2c3ccccc3[nH]c2[C@H](c2ccccc2Cl)N1	ZINC000000188037	563255449	/nfs/dbraw/zinc/25/54/49/563255449.db2.gz	JNLXAXOXLWSEML-CVEARBPZSA-N	-1	0	326.783	3.510	50	0		EHAARM
COc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1ccc(Cl)cn1	ZINC000000384700	563301303	/nfs/dbraw/zinc/30/13/03/563301303.db2.gz	XNYRYSBNCKGQLI-UHFFFAOYSA-N	-1	0	340.832	3.668	50	0		EHAARM
CCc1cc(=O)oc2c(C)c(O[C@@H](C(=O)[O-])c3ccccc3)ccc12	ZINC000000487404	563338375	/nfs/dbraw/zinc/33/83/75/563338375.db2.gz	IPGYKOREVNTCHE-LJQANCHMSA-N	-1	0	338.359	3.869	50	0	biogenic	EHAARM
CCc1cc2c(nc(C)nc2N[C@@H](Cc2ccccc2)C(=O)[O-])s1	ZINC000000572982	563350314	/nfs/dbraw/zinc/35/03/14/563350314.db2.gz	VXRLJDNQIOOMIC-HNNXBMFYSA-N	-1	0	341.436	3.670	50	0		EHAARM
O=C(N=C([O-])Nc1c(Cl)cc(Cl)cc1Cl)C(F)(F)F	ZINC000001019331	563369003	/nfs/dbraw/zinc/36/90/03/563369003.db2.gz	FYFVNJZRIZYQDP-UHFFFAOYSA-N	-1	0	335.496	3.857	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)[O-]	ZINC000002556725	563440939	/nfs/dbraw/zinc/44/09/39/563440939.db2.gz	NBVVKAUSAGHTSU-QGZVFWFLSA-N	-1	0	341.407	3.874	50	0		EHAARM
C[C@@H](Nc1nc(-c2ccccc2)nc2c3ccccc3oc21)C(=O)[O-]	ZINC000004302007	563499424	/nfs/dbraw/zinc/49/94/24/563499424.db2.gz	VPVMZMQLIYHSQH-LLVKDONJSA-N	-1	0	333.347	3.928	50	0		EHAARM
O=S(=O)(Nc1ccccc1Cl)c1ccc2[n-]c(=S)oc2c1	ZINC000005556417	563539551	/nfs/dbraw/zinc/53/95/51/563539551.db2.gz	CLCSMCQRGWEMEU-UHFFFAOYSA-N	-1	0	340.813	3.571	50	0		EHAARM
COc1ccc(-n2c(Cc3ccccc3)n[n-]c2=S)c(OC)c1	ZINC000005687657	563545938	/nfs/dbraw/zinc/54/59/38/563545938.db2.gz	QPNDCJTXQUFFHD-UHFFFAOYSA-N	-1	0	327.409	3.538	50	0		EHAARM
CC(C)(C)C(=O)Nc1cccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])c1	ZINC000012381327	563659416	/nfs/dbraw/zinc/65/94/16/563659416.db2.gz	UJJJUWGCLMWZPE-HUUCEWRRSA-N	-1	0	346.427	3.501	50	0		EHAARM
COc1ccccc1Nc1nnc(Cc2ccc(Cl)cc2)c(=O)[n-]1	ZINC000016777312	563822892	/nfs/dbraw/zinc/82/28/92/563822892.db2.gz	ZYEZBPPSBHNNIL-UHFFFAOYSA-N	-1	0	342.786	3.574	50	0		EHAARM
C[C@H]1CCc2c(sc3[n-]c(=S)n(Cc4cccnc4)c(=O)c23)C1	ZINC000017071734	563835002	/nfs/dbraw/zinc/83/50/02/563835002.db2.gz	GRFGWRMOMMCUSZ-JTQLQIEISA-N	-1	0	343.477	3.689	50	0		EHAARM
O=C(c1ccc([O-])c(Cl)c1)N1CCC(Nc2ccccc2F)CC1	ZINC000096440924	563953314	/nfs/dbraw/zinc/95/33/14/563953314.db2.gz	MELVULPDLIBIKE-UHFFFAOYSA-N	-1	0	348.805	3.901	50	0		EHAARM
Cc1c(C(=O)[O-])sc2ncnc(N[C@@H](C)c3ncccc3C)c12	ZINC000067514097	563962358	/nfs/dbraw/zinc/96/23/58/563962358.db2.gz	KGCGLFNTDNFGBS-JTQLQIEISA-N	-1	0	328.397	3.574	50	0		EHAARM
O=C([O-])Cc1ccccc1-n1ccc(-c2cc(Cl)ccc2O)n1	ZINC000067879565	563962957	/nfs/dbraw/zinc/96/29/57/563962957.db2.gz	UQDCYSHGKHKOIL-UHFFFAOYSA-N	-1	0	328.755	3.525	50	0		EHAARM
O=S(=O)([N-]c1nc2c(ccc(Cl)c2F)s1)c1ccccc1	ZINC000097034312	563966940	/nfs/dbraw/zinc/96/69/40/563966940.db2.gz	KWUXCQCTSPYGFX-UHFFFAOYSA-N	-1	0	342.804	3.890	50	0		EHAARM
CN(C)c1cc(C(F)(F)F)cc(-c2ccc(/C=C/C(=O)[O-])cc2)n1	ZINC000091695394	563975689	/nfs/dbraw/zinc/97/56/89/563975689.db2.gz	QJKHXHWFHCMNMW-VMPITWQZSA-N	-1	0	336.313	3.931	50	0		EHAARM
Cc1ncsc1CCN(C)[C@H](C(=O)[O-])c1c(F)cccc1Cl	ZINC000095369875	563976803	/nfs/dbraw/zinc/97/68/03/563976803.db2.gz	DTFDVLSHEFPGMY-AWEZNQCLSA-N	-1	0	342.823	3.544	50	0		EHAARM
COC(=O)C=C([O-])c1sc(-c2ccc(C(F)(F)F)cc2)nc1C	ZINC000095921824	563977798	/nfs/dbraw/zinc/97/77/98/563977798.db2.gz	VEHIWGVGSILJBL-UHFFFAOYSA-N	-1	0	343.326	3.883	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@@H](C(=O)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000000106216	563986467	/nfs/dbraw/zinc/98/64/67/563986467.db2.gz	XBNFYFUGSSJTKU-OLZOCXBDSA-N	-1	0	343.301	3.581	50	0		EHAARM
CCOc1cccc([C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])c1	ZINC000221039483	563989630	/nfs/dbraw/zinc/98/96/30/563989630.db2.gz	DKAUKPNHISACCN-HOTGVXAUSA-N	-1	0	349.427	3.653	50	0		EHAARM
Cc1ccc(-c2ccc(NC(=O)[C@@H]3[C@H]4C=C[C@H](C4)[C@H]3C(=O)[O-])cc2)o1	ZINC000004852784	563992094	/nfs/dbraw/zinc/99/20/94/563992094.db2.gz	FKSLNBYCLBTOCK-MJSCVDMRSA-N	-1	0	337.375	3.716	50	0		EHAARM
CCCSc1nnc([N-]C(=O)c2cc(-c3ccccc3)on2)s1	ZINC000011917158	563995499	/nfs/dbraw/zinc/99/54/99/563995499.db2.gz	WBFUTSYMJJGGQD-UHFFFAOYSA-N	-1	0	346.437	3.948	50	0		EHAARM
CCOc1cc2[n-]c(=S)n(C3CCCC3)c(=O)c2cc1OCC	ZINC000000425114	563998570	/nfs/dbraw/zinc/99/85/70/563998570.db2.gz	ZEQOCNZJZQBKSR-UHFFFAOYSA-N	-1	0	334.441	3.972	50	0		EHAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOc2ccccc2C1	ZINC000081276368	564025998	/nfs/dbraw/zinc/02/59/98/564025998.db2.gz	IIZRQYAHVGLFJR-UHFFFAOYSA-N	-1	0	326.377	3.525	50	0		EHAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2cc(C)ccc2C)c1=O	ZINC000049409501	564032737	/nfs/dbraw/zinc/03/27/37/564032737.db2.gz	POAVJIUVDPYKDS-UHFFFAOYSA-N	-1	0	342.420	3.658	50	0		EHAARM
CCCCSCc1cc(C(=O)NC2(C(=O)[O-])CCCC2)oc1C	ZINC000244899310	564052358	/nfs/dbraw/zinc/05/23/58/564052358.db2.gz	ZHPABKRDZKXVJT-UHFFFAOYSA-N	-1	0	339.457	3.749	50	0		EHAARM
O=S(=O)([O-])c1ccc(NN=Cc2csc3ccccc23)cc1	ZINC000252617596	564090689	/nfs/dbraw/zinc/09/06/89/564090689.db2.gz	KWSIKVDPDVTOEW-UHFFFAOYSA-N	-1	0	332.406	3.594	50	0		EHAARM
CCCOc1ccccc1[C@H](C)NC(=O)c1ccccc1C(=O)[O-]	ZINC000426493026	564093892	/nfs/dbraw/zinc/09/38/92/564093892.db2.gz	SRRZPPIPLGZGLS-ZDUSSCGKSA-N	-1	0	327.380	3.665	50	0		EHAARM
O=C([O-])c1cc(N2C(=S)N=NC2c2ccc(F)cc2)ccc1Cl	ZINC000006659225	564095533	/nfs/dbraw/zinc/09/55/33/564095533.db2.gz	NZLCZMGTDPEMAW-UHFFFAOYSA-N	-1	0	349.774	3.714	50	0		EHAARM
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(-c2ccno2)o1	ZINC000064958629	564098542	/nfs/dbraw/zinc/09/85/42/564098542.db2.gz	BDMNHXRVVSQITO-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
Cc1ccccc1[N-]S(=O)(=O)c1cn(C(C)C)c2ncccc12	ZINC000065242190	564103350	/nfs/dbraw/zinc/10/33/50/564103350.db2.gz	XZGABPHOZSPOFT-UHFFFAOYSA-N	-1	0	329.425	3.726	50	0		EHAARM
C[C@](CC(=O)[O-])(C(=O)Nc1ccc2c[nH]nc2c1)C1CCCCC1	ZINC000169975479	564104132	/nfs/dbraw/zinc/10/41/32/564104132.db2.gz	JMIZWBYTMAHJEU-GOSISDBHSA-N	-1	0	329.400	3.563	50	0		EHAARM
Cc1cnc2c(cccc2S(=O)(=O)[N-]c2c(C)ccc(O)c2C)c1	ZINC000170601691	564109378	/nfs/dbraw/zinc/10/93/78/564109378.db2.gz	UAEQTQOIAFCJIJ-UHFFFAOYSA-N	-1	0	342.420	3.666	50	0		EHAARM
CCn1nc(C)c(C(C)=NNc2ccc(Cl)c(C(=O)[O-])c2)c1C	ZINC000252474321	564118929	/nfs/dbraw/zinc/11/89/29/564118929.db2.gz	AXCWIVCCOMAXNU-UHFFFAOYSA-N	-1	0	334.807	3.708	50	0		EHAARM
Cc1nc(CC(=O)Nc2ccc3sc(C(=O)[O-])cc3c2)cs1	ZINC000225442682	564134824	/nfs/dbraw/zinc/13/48/24/564134824.db2.gz	YCXGYHQDHPIRGR-UHFFFAOYSA-N	-1	0	332.406	3.546	50	0		EHAARM
Cn1c2ccccc2nc1[N-]S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000027924053	564137559	/nfs/dbraw/zinc/13/75/59/564137559.db2.gz	NBSRRSJHDFWFRX-UHFFFAOYSA-N	-1	0	343.452	3.672	50	0		EHAARM
Cc1ccc(-c2cc(C(=O)N3CC[C@H]3C(=O)[O-])c3ccccc3n2)cc1	ZINC000095359508	564139270	/nfs/dbraw/zinc/13/92/70/564139270.db2.gz	AEYKHSDIPYULRZ-IBGZPJMESA-N	-1	0	346.386	3.509	50	0		EHAARM
O=S(=O)([N-]c1cccc2cnccc21)c1cccc2cccnc21	ZINC000028248502	564150837	/nfs/dbraw/zinc/15/08/37/564150837.db2.gz	LTDKNGYKXNJLRC-UHFFFAOYSA-N	-1	0	335.388	3.584	50	0		EHAARM
O=C([O-])c1cn(-c2ccccc2)c2c1NC(=O)C[C@H]2c1ccncc1	ZINC000040288283	564168682	/nfs/dbraw/zinc/16/86/82/564168682.db2.gz	UGKHZHAHEXGQIP-AWEZNQCLSA-N	-1	0	333.347	3.694	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)ns2)C1	ZINC000263103489	950266169	/nfs/dbraw/zinc/26/61/69/950266169.db2.gz	JBLPOXIWBSPNCD-CYBMUJFWSA-N	-1	0	344.436	3.527	50	0		EHAARM
Cc1c(NC(=O)CSc2nc3ccccc3o2)cccc1C(=O)[O-]	ZINC000095482001	958335412	/nfs/dbraw/zinc/33/54/12/958335412.db2.gz	WKSRHASFWCWLTB-UHFFFAOYSA-N	-1	0	342.376	3.565	50	0		EHAARM
CC[C@](CNC(=O)c1ccc(Cl)s1)(C(=O)[O-])c1ccccc1	ZINC000263139849	1029669172	/nfs/dbraw/zinc/66/91/72/1029669172.db2.gz	ZRFRFPFNFMIMQF-MRXNPFEDSA-N	-1	0	337.828	3.564	50	0		EHAARM
CCCOc1ccccc1NC(=O)CSc1ccccc1C(=O)[O-]	ZINC000012785715	201868001	/nfs/dbraw/zinc/86/80/01/201868001.db2.gz	JIKZKGAFYJYTKU-UHFFFAOYSA-N	-1	0	345.420	3.904	50	0		EHAARM
COc1ccc(-n2[n-]c(C)c(Cc3cccc(Cl)c3)c2=O)cc1	ZINC000017879316	201991659	/nfs/dbraw/zinc/99/16/59/201991659.db2.gz	DVYPATQFURMVLB-UHFFFAOYSA-N	-1	0	328.799	3.727	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3c(n[nH]c3-c3ccccc3)n2)cc1	ZINC000020134665	202032551	/nfs/dbraw/zinc/03/25/51/202032551.db2.gz	ICNGHDVRJGYUOO-UHFFFAOYSA-N	-1	0	345.358	3.999	50	0		EHAARM
Cc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1C	ZINC000020616883	202051689	/nfs/dbraw/zinc/05/16/89/202051689.db2.gz	OGLOQIHCRMSYSJ-STQMWFEESA-N	-1	0	339.317	3.858	50	0		EHAARM
O=C(c1cnc2cc(-c3ccc(Cl)cc3)nn2c1)c1ccccc1[O-]	ZINC000021729143	202069887	/nfs/dbraw/zinc/06/98/87/202069887.db2.gz	BDVJYDQSFMDNFI-UHFFFAOYSA-N	-1	0	349.777	3.986	50	0		EHAARM
COc1ccc(/C=C/c2nc(C)nc(-c3ccccc3[O-])n2)cc1OC	ZINC000030781704	202199378	/nfs/dbraw/zinc/19/93/78/202199378.db2.gz	NMTKQGAIIZBLJI-PKNBQFBNSA-N	-1	0	349.390	3.740	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1cccc(C)c1C	ZINC000032971272	202245209	/nfs/dbraw/zinc/24/52/09/202245209.db2.gz	DODWOQPSJKIKMK-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
Cc1csc(-c2nnc([N-]C(=O)c3cc(-c4ccco4)on3)o2)c1	ZINC000070635594	202337031	/nfs/dbraw/zinc/33/70/31/202337031.db2.gz	UIHGJTYIVZHQGR-UHFFFAOYSA-N	-1	0	342.336	3.607	50	0		EHAARM
COc1ccc(/C=C\c2ncc(C(=O)[O-])s2)cc1OC(F)F	ZINC000096402164	201376484	/nfs/dbraw/zinc/37/64/84/201376484.db2.gz	SHJXTLQQTXDKAP-HYXAFXHYSA-N	-1	0	327.308	3.622	50	0		EHAARM
CCOc1cc(C)ccc1S(=O)(=O)[N-]c1cccc2cccnc21	ZINC000214077942	241096575	/nfs/dbraw/zinc/09/65/75/241096575.db2.gz	QGIKJAYNOHHHSY-UHFFFAOYSA-N	-1	0	342.420	3.743	50	0		EHAARM
O=C([O-])C[C@@H](CC(=O)Nc1cccc2cccnc21)c1ccccc1	ZINC000226750206	242113359	/nfs/dbraw/zinc/11/33/59/242113359.db2.gz	YFIVOALIQGQPAN-MRXNPFEDSA-N	-1	0	334.375	3.822	50	0		EHAARM
COc1ccc(C(=O)Nc2sc3c(c2C(=O)[O-])CCCC3)cc1	ZINC000003148790	201558100	/nfs/dbraw/zinc/55/81/00/201558100.db2.gz	FOXADHJEWCJTGJ-UHFFFAOYSA-N	-1	0	331.393	3.586	50	0		EHAARM
CCc1ccc(NC(=O)Cc2c3ccccc3n(C)c2C(=O)[O-])cc1	ZINC000003660312	201580325	/nfs/dbraw/zinc/58/03/25/201580325.db2.gz	MFKXPFFWWTZZSJ-UHFFFAOYSA-N	-1	0	336.391	3.620	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@@H](CC(C)C)C(=O)[O-])n1	ZINC000005164615	201641791	/nfs/dbraw/zinc/64/17/91/201641791.db2.gz	JMENKYVSPWBBQI-LBPRGKRZSA-N	-1	0	327.384	3.850	50	0		EHAARM
O=c1[nH]c(CNc2cccc(Cl)c2)nn1Cc1ccc(Cl)cc1	ZINC000071279842	203089322	/nfs/dbraw/zinc/08/93/22/203089322.db2.gz	RKSISAQOMXYYBR-UHFFFAOYSA-N	-1	0	349.221	3.539	50	0		EHAARM
CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)[N-]c1ccncc1	ZINC000072414387	203218459	/nfs/dbraw/zinc/21/84/59/203218459.db2.gz	IXHXCKYAETYQSM-UHFFFAOYSA-N	-1	0	334.441	3.713	50	0		EHAARM
Cc1ccoc1C(=O)NCc1c(C(=O)[O-])sc2cccc(F)c21	ZINC000097018860	203907008	/nfs/dbraw/zinc/90/70/08/203907008.db2.gz	SLUAPLDLPMOQNT-UHFFFAOYSA-N	-1	0	333.340	3.570	50	0		EHAARM
O=C([O-])[C@H]1CCCc2sc(NC(=O)c3ccc(Cl)cc3)nc21	ZINC000011920132	207027910	/nfs/dbraw/zinc/02/79/10/207027910.db2.gz	IADHSTDPSDJTFV-JTQLQIEISA-N	-1	0	336.800	3.553	50	0		EHAARM
O=C([O-])c1ccc(Cl)c(NC(=O)CCCOc2ccccc2)c1	ZINC000013167812	207358989	/nfs/dbraw/zinc/35/89/89/207358989.db2.gz	MDPSKRKLEJUINC-UHFFFAOYSA-N	-1	0	333.771	3.836	50	0		EHAARM
Cc1oc(C)c(C(=O)Nc2ccc(C(=O)[O-])cc2)c1Br	ZINC000096479716	218856264	/nfs/dbraw/zinc/85/62/64/218856264.db2.gz	JSVAVEITWOHOPY-UHFFFAOYSA-N	-1	0	338.157	3.609	50	0		EHAARM
C[C@@H](CC(=O)N1CCC(C(=O)[O-])CC1)c1ccccc1C(F)(F)F	ZINC000096479444	218856477	/nfs/dbraw/zinc/85/64/77/218856477.db2.gz	ZMKSVEFJTRHNPP-NSHDSACASA-N	-1	0	343.345	3.522	50	0		EHAARM
O=c1c2ccccc2[n-]c(=S)n1CCCSCc1ccco1	ZINC000002869067	257950952	/nfs/dbraw/zinc/95/09/52/257950952.db2.gz	ZHQIREMVOOBXOB-UHFFFAOYSA-N	-1	0	332.450	3.976	50	0		EHAARM
O=C(c1cnn(-c2ccccc2)c1)c1ccc(Br)cc1[O-]	ZINC000328578968	258017610	/nfs/dbraw/zinc/01/76/10/258017610.db2.gz	CFZQYZPIOFGCPU-UHFFFAOYSA-N	-1	0	343.180	3.571	50	0		EHAARM
O=C([O-])c1cc(-c2cccc(-c3ccccc3)c2)cc(-n2cnnn2)c1	ZINC000299796685	258100827	/nfs/dbraw/zinc/10/08/27/258100827.db2.gz	ODAXJILZBLPDRI-UHFFFAOYSA-N	-1	0	342.358	3.695	50	0		EHAARM
O=[P@@]([O-])(O)[C@@H](Nc1ccc(OC(F)F)cc1)c1cccs1	ZINC000012537060	258055188	/nfs/dbraw/zinc/05/51/88/258055188.db2.gz	IOZILNFNIQOTRP-LLVKDONJSA-N	-1	0	335.268	3.638	50	0		EHAARM
O=C([O-])COc1ccc(C(=O)c2cccs2)c(Cl)c1Cl	ZINC000000002166	563211333	/nfs/dbraw/zinc/21/13/33/563211333.db2.gz	AGHANLSBXUWXTB-UHFFFAOYSA-N	-1	0	331.176	3.749	50	0	world	EHAARM
O=C([O-])c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccc(Cl)cc1)N2	ZINC000000226880	563263007	/nfs/dbraw/zinc/26/30/07/563263007.db2.gz	QJWIAWGYDPQGOS-MWLCHTKSSA-N	-1	0	345.708	3.895	50	0		EHAARM
Cc1ccc([C@@H]2C[C@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000000226871	563263076	/nfs/dbraw/zinc/26/30/76/563263076.db2.gz	QAMKCWLSDIAWSU-CMPLNLGQSA-N	-1	0	325.290	3.550	50	0		EHAARM
O=S(=O)([N-]c1cccnc1)c1cc(Cl)c(Cl)cc1Cl	ZINC000000324708	563284393	/nfs/dbraw/zinc/28/43/93/563284393.db2.gz	FNQVREYRGZFBBW-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
COCCCn1c(=O)c2cc(-c3ccccc3)sc2[n-]c1=S	ZINC000005925464	563554351	/nfs/dbraw/zinc/55/43/51/563554351.db2.gz	KCMDJLNVESVWTJ-UHFFFAOYSA-N	-1	0	332.450	3.824	50	0		EHAARM
COc1cc(C)c(C(C)C)cc1S(=O)(=O)[N-]c1cccc(C)n1	ZINC000008715810	563637339	/nfs/dbraw/zinc/63/73/39/563637339.db2.gz	AWYKQAKPERRMNX-UHFFFAOYSA-N	-1	0	334.441	3.631	50	0		EHAARM
Cc1nn(C(C)C)c(C)c1[N-]S(=O)(=O)c1ccccc1Cl	ZINC000055649133	563647164	/nfs/dbraw/zinc/64/71/64/563647164.db2.gz	LKBBQUAWBCVVTE-UHFFFAOYSA-N	-1	0	327.837	3.535	50	0		EHAARM
O=S(=O)(Nc1cccc(Cl)c1)c1ccc2oc(=S)[n-]c2c1	ZINC000013142207	563690918	/nfs/dbraw/zinc/69/09/18/563690918.db2.gz	NMPQXUOXRPCYIJ-UHFFFAOYSA-N	-1	0	340.813	3.571	50	0		EHAARM
COc1ccc2nc([N-]c3nc(C)cc(C(F)(F)F)n3)nc(C)c2c1	ZINC000017838273	563845749	/nfs/dbraw/zinc/84/57/49/563845749.db2.gz	MPDDQTRIAVAKDG-UHFFFAOYSA-N	-1	0	349.316	3.808	50	0		EHAARM
CC(C)(C)N(Cc1ccc(Cl)cc1Cl)C(=O)CCC(=O)[O-]	ZINC000002317126	563917914	/nfs/dbraw/zinc/91/79/14/563917914.db2.gz	CIQFJJQENMYKLF-UHFFFAOYSA-N	-1	0	332.227	3.985	50	0		EHAARM
CCc1nc2sc(C)cc2c(N[C@@H](Cc2ccccc2)C(=O)[O-])n1	ZINC000041090722	563924169	/nfs/dbraw/zinc/92/41/69/563924169.db2.gz	YCEUCEHRLIUUQN-AWEZNQCLSA-N	-1	0	341.436	3.670	50	0		EHAARM
O=C([O-])c1c(CO[C@H]2CCCCO2)onc1-c1ccc(Cl)cc1	ZINC000045796234	563929389	/nfs/dbraw/zinc/92/93/89/563929389.db2.gz	DMKLSZDLNZOCLK-ZDUSSCGKSA-N	-1	0	337.759	3.736	50	0		EHAARM
O=C(C[C@H]1CC[C@@H](C(=O)[O-])CC1)c1cccc(Br)c1	ZINC000100449357	563982626	/nfs/dbraw/zinc/98/26/26/563982626.db2.gz	COTXSNAGEWJUML-XYPYZODXSA-N	-1	0	325.202	3.913	50	0		EHAARM
Cc1cccc(-c2ncc(-c3nc4cc(C(=O)[O-])ccc4[nH]3)cn2)c1	ZINC000067804037	563962796	/nfs/dbraw/zinc/96/27/96/563962796.db2.gz	ZKSGOLWSQIURBF-UHFFFAOYSA-N	-1	0	330.347	3.694	50	0		EHAARM
COc1cc(C=NNc2cccc(C(=O)[O-])c2)cc(Cl)c1OC	ZINC000004647044	563963288	/nfs/dbraw/zinc/96/32/88/563963288.db2.gz	PCHAGBJIFYZZCR-UHFFFAOYSA-N	-1	0	334.759	3.501	50	0		EHAARM
CCOc1ccc2[nH]c(S[C@H](C(=O)[O-])c3ccccc3)nc2c1	ZINC000000157510	563987440	/nfs/dbraw/zinc/98/74/40/563987440.db2.gz	NQKFMKPCVWNYPX-HNNXBMFYSA-N	-1	0	328.393	3.880	50	0		EHAARM
COc1ccc([C@H]2S[C@@H](C)C(=O)N2c2cccc(C(=O)[O-])c2)cc1	ZINC000000191260	563988129	/nfs/dbraw/zinc/98/81/29/563988129.db2.gz	CDAPDEHTTWYUPC-APPDUMDISA-N	-1	0	343.404	3.561	50	0		EHAARM
C[C@@H](CC(=O)N1CC[C@](C)(C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237340099	563991910	/nfs/dbraw/zinc/99/19/10/563991910.db2.gz	LKJAXSMXGVKMGF-ZBEGNZNMSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1ccc(Cl)s1	ZINC000000811978	564034884	/nfs/dbraw/zinc/03/48/84/564034884.db2.gz	WZWINIWMADLCHQ-UHFFFAOYSA-N	-1	0	326.201	3.995	50	0		EHAARM
CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2nccn2CC(C)C)cc1	ZINC000225529079	564047556	/nfs/dbraw/zinc/04/75/56/564047556.db2.gz	NXPPWUGPMFOXSH-CQSZACIVSA-N	-1	0	335.473	3.853	50	0		EHAARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2cccc(C)c2)cc1	ZINC000003623652	564060081	/nfs/dbraw/zinc/06/00/81/564060081.db2.gz	ALORHDQVCRIEBJ-SFHVURJKSA-N	-1	0	341.407	3.730	50	0		EHAARM
COc1ccc(OC)c(-c2noc([N-]c3cc(C)ccc3OC)n2)c1	ZINC000015680436	564070695	/nfs/dbraw/zinc/07/06/95/564070695.db2.gz	MGSKGMJAOONKBF-UHFFFAOYSA-N	-1	0	341.367	3.814	50	0		EHAARM
CC(C)c1ccc([C@@H](NCc2ccccc2F)[P@@](=O)([O-])O)cc1	ZINC000012949561	564079860	/nfs/dbraw/zinc/07/98/60/564079860.db2.gz	UTYWMIQLAYGQBT-KRWDZBQOSA-N	-1	0	337.331	3.915	50	0		EHAARM
CC[C@H](NC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000239433189	564088150	/nfs/dbraw/zinc/08/81/50/564088150.db2.gz	XIKYNLRAQBQZED-SIUZAQLESA-N	-1	0	345.483	3.765	50	0		EHAARM
CC1CCC(OC2CCN(C(=O)c3ccc(C(=O)[O-])cc3)CC2)CC1	ZINC000262144198	564090038	/nfs/dbraw/zinc/09/00/38/564090038.db2.gz	NSWWRTLMECBJKK-UHFFFAOYSA-N	-1	0	345.439	3.585	50	0		EHAARM
CC(C)c1nc2sc3c([n-]cnc3=O)c2c2c1COC(C)(C)C2	ZINC000006664252	564095626	/nfs/dbraw/zinc/09/56/26/564095626.db2.gz	XDFBXFAZOWQEAF-UHFFFAOYSA-N	-1	0	329.425	3.508	50	0		EHAARM
Cc1nn(-c2ccc(C)cc2)c(C)c1S(=O)(=O)[N-]c1ccccc1	ZINC000064947040	564098209	/nfs/dbraw/zinc/09/82/09/564098209.db2.gz	QBPUOJPIPCYXIB-UHFFFAOYSA-N	-1	0	341.436	3.598	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3C)o2)c1C	ZINC000064958554	564098527	/nfs/dbraw/zinc/09/85/27/564098527.db2.gz	GNZDDBGLAIDOKG-UHFFFAOYSA-N	-1	0	346.408	3.969	50	0		EHAARM
Cc1cn2c(nc(C(C)C)c2S(=O)(=O)[N-]c2ccccc2)s1	ZINC000065183556	564102461	/nfs/dbraw/zinc/10/24/61/564102461.db2.gz	RJHXZLWTUMGQGA-UHFFFAOYSA-N	-1	0	335.454	3.628	50	0		EHAARM
Cc1cn2c(nc(C(C)C)c2S(=O)(=O)[N-]c2cccc(C)c2)s1	ZINC000065183554	564102479	/nfs/dbraw/zinc/10/24/79/564102479.db2.gz	KIIJRXVRESZGOA-UHFFFAOYSA-N	-1	0	349.481	3.937	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cc(F)ccc2C)c2cccnc21	ZINC000065242259	564103409	/nfs/dbraw/zinc/10/34/09/564103409.db2.gz	JPAUZMGQXPHBRL-UHFFFAOYSA-N	-1	0	347.415	3.695	50	0		EHAARM
O=S(=O)([N-]c1ccc2c(c1)CCC2)c1ccccc1C(F)(F)F	ZINC000007050596	564103739	/nfs/dbraw/zinc/10/37/39/564103739.db2.gz	SPGGWKRLWMSAOJ-UHFFFAOYSA-N	-1	0	341.354	3.995	50	0		EHAARM
Cc1[nH]c2c(cccc2C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)c1C	ZINC000237724166	564117786	/nfs/dbraw/zinc/11/77/86/564117786.db2.gz	MERUNZJNXFVLAM-AWEZNQCLSA-N	-1	0	328.412	3.502	50	0		EHAARM
COc1ccc(O)c(C(C)=NNc2ccc(Cl)c(C(=O)[O-])c2)c1	ZINC000252474330	564118935	/nfs/dbraw/zinc/11/89/35/564118935.db2.gz	BBVWLMZDQCATEU-UHFFFAOYSA-N	-1	0	334.759	3.589	50	0		EHAARM
CC(C)C[C@H](C(=O)[O-])[C@@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002272711	564125563	/nfs/dbraw/zinc/12/55/63/564125563.db2.gz	DFNZDMUCEFEEPF-HOCLYGCPSA-N	-1	0	343.427	3.584	50	0		EHAARM
C[C@H](NC(=O)N1CCC(C(=O)[O-])CC1)c1cc(Cl)ccc1Cl	ZINC000263056518	564159411	/nfs/dbraw/zinc/15/94/11/564159411.db2.gz	RPZUZAKJRAHZFA-VIFPVBQESA-N	-1	0	345.226	3.561	50	0		EHAARM
Cc1[n-]n(-c2nc3ccccc3[nH]2)c(=O)c1Cc1ccc(Cl)cc1	ZINC000009060067	564168716	/nfs/dbraw/zinc/16/87/16/564168716.db2.gz	HULOUGOQMNOMLH-UHFFFAOYSA-N	-1	0	338.798	3.595	50	0		EHAARM
O=C(c1ccc([O-])c(Cl)c1)N1CC[C@@H](COCc2ccccc2)C1	ZINC000075161289	564176461	/nfs/dbraw/zinc/17/64/61/564176461.db2.gz	GUTIHROSXGKDAH-OAHLLOKOSA-N	-1	0	345.826	3.725	50	0		EHAARM
O=C([O-])c1ccccc1CC(=O)N[C@H](C1CCCCC1)C(F)(F)F	ZINC000668301041	954567418	/nfs/dbraw/zinc/56/74/18/954567418.db2.gz	BPLJLBKQKPBWFM-OAHLLOKOSA-N	-1	0	343.345	3.555	50	0		EHAARM
Cc1cc(Br)cc(C(=O)[O-])c1NC(=O)OC(C)(C)C	ZINC000725376892	1034441921	/nfs/dbraw/zinc/44/19/21/1034441921.db2.gz	YFQZIHMTNAMPRQ-UHFFFAOYSA-N	-1	0	330.178	3.803	50	0		EHAARM
COc1cccc(C[C@@H](CC(=O)Nc2cc(C)ccc2C)C(=O)[O-])c1	ZINC000004977254	1042700890	/nfs/dbraw/zinc/70/08/90/1042700890.db2.gz	VRIPSUIDZXILHM-INIZCTEOSA-N	-1	0	341.407	3.584	50	0		EHAARM
Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@@H](C)C(=O)[O-]	ZINC000563128866	1130650644	/nfs/dbraw/zinc/65/06/44/1130650644.db2.gz	WUAWOZFEUXJSKO-ZIAGYGMSSA-N	-1	0	327.380	3.794	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)cc1	ZINC000630327399	1137354217	/nfs/dbraw/zinc/35/42/17/1137354217.db2.gz	GBEBGZADEYHDGI-XLAORIBOSA-N	-1	0	339.366	3.756	50	0		EHAARM
COc1cccc(Cn2c(=O)c3oc4ccccc4c3[n-]c2=S)c1	ZINC000100021203	219088085	/nfs/dbraw/zinc/08/80/85/219088085.db2.gz	HYGINYJKDVFMEG-UHFFFAOYSA-N	-1	0	338.388	3.862	50	0		EHAARM
COc1cc(C(=O)[O-])cc(Br)c1OCc1ccccc1	ZINC000003298672	210000612	/nfs/dbraw/zinc/00/06/12/210000612.db2.gz	PQTFMSZHBFKPMZ-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
COc1ccc(-c2noc([N-]c3cc(OC)cc(OC)c3)n2)cc1	ZINC000020996782	202061262	/nfs/dbraw/zinc/06/12/62/202061262.db2.gz	FJFGAWLJMJUKNT-UHFFFAOYSA-N	-1	0	327.340	3.506	50	0		EHAARM
Cc1ccc(OC2CCN(C(=O)c3cc(F)c([O-])c(F)c3)CC2)cc1	ZINC000186816492	236031130	/nfs/dbraw/zinc/03/11/30/236031130.db2.gz	DUNKXRFXRLGKIT-UHFFFAOYSA-N	-1	0	347.361	3.662	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1c(C)cccc1C	ZINC000032971273	202245113	/nfs/dbraw/zinc/24/51/13/202245113.db2.gz	VCKNKDCZQUJKQL-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
CCOc1ccc(NC(=O)C[C@H](C(=O)[O-])[C@@H](C)c2ccccc2)cc1	ZINC000035142197	213009794	/nfs/dbraw/zinc/00/97/94/213009794.db2.gz	BALWTZPZJNFWNG-KSSFIOAISA-N	-1	0	341.407	3.918	50	0		EHAARM
CC(C)(C)OC(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)[O-]	ZINC000039959772	202416221	/nfs/dbraw/zinc/41/62/21/202416221.db2.gz	BFBAJLQTONSFEB-INIZCTEOSA-N	-1	0	329.396	3.608	50	0		EHAARM
CC(C)OC(=O)[C@H]1[C@H](c2ccccc2)[C@@H](C(=O)[O-])[C@@H]1c1ccccc1	ZINC000244695589	201152552	/nfs/dbraw/zinc/15/25/52/201152552.db2.gz	JPDDMZAETFWSGR-QGFMHUBQSA-N	-1	0	338.403	3.836	50	0		EHAARM
O=C([O-])c1cnc(/C=C\c2cc(Cl)c3c(c2)OCCCO3)s1	ZINC000096402161	201376425	/nfs/dbraw/zinc/37/64/25/201376425.db2.gz	OITIHZNKHLBRGQ-IHWYPQMZSA-N	-1	0	337.784	3.826	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@H](C(=O)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000000106225	201435205	/nfs/dbraw/zinc/43/52/05/201435205.db2.gz	XBNFYFUGSSJTKU-QWHCGFSZSA-N	-1	0	343.301	3.581	50	0		EHAARM
O=C([O-])c1cn(-c2ccc(F)cc2)c2cc(Cl)c(F)cc2c1=O	ZINC000000386998	201467867	/nfs/dbraw/zinc/46/78/67/201467867.db2.gz	FBAMWRYINJFGPJ-UHFFFAOYSA-N	-1	0	335.693	3.621	50	0	in-vitro	EHAARM
Cc1ccc(CO)cc1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000071916510	203150819	/nfs/dbraw/zinc/15/08/19/203150819.db2.gz	APPROJWPDSJPLE-UHFFFAOYSA-N	-1	0	346.235	3.595	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)COc2ccccc2Cl)cc1Cl	ZINC000020144563	212105612	/nfs/dbraw/zinc/10/56/12/212105612.db2.gz	GSMXPBUPMZYKBG-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
CC[C@H](Nc1nccc(-c2cc(C(=O)[O-])ccn2)n1)c1cc(C)ccn1	ZINC000072408503	203216591	/nfs/dbraw/zinc/21/65/91/203216591.db2.gz	UWEJOBUOXZQSQP-AWEZNQCLSA-N	-1	0	349.394	3.503	50	0		EHAARM
CCOc1ccc([N-]S(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1	ZINC000000347114	206234360	/nfs/dbraw/zinc/23/43/60/206234360.db2.gz	GZOFAFIGHQMKMJ-UHFFFAOYSA-N	-1	0	347.223	3.588	50	0		EHAARM
C[C@@]1(c2ccc(C(=O)[O-])cc2)CC1(Br)Br	ZINC000000495046	206236965	/nfs/dbraw/zinc/23/69/65/206236965.db2.gz	BOIGKTDSXXTJSY-JTQLQIEISA-N	-1	0	334.007	3.532	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000000397534	206237369	/nfs/dbraw/zinc/23/73/69/206237369.db2.gz	VSICLTFAVYHARZ-UHFFFAOYSA-N	-1	0	331.371	3.904	50	0		EHAARM
CC[C@H](C)[C@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)c1ccccc1	ZINC000095361109	218294568	/nfs/dbraw/zinc/29/45/68/218294568.db2.gz	IORYCVSFYDWOFH-SJCJKPOMSA-N	-1	0	329.396	3.732	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000013021853	207270056	/nfs/dbraw/zinc/27/00/56/207270056.db2.gz	RXRPOEJOFUHQDK-RTBURBONSA-N	-1	0	333.387	3.863	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000043583361	262513134	/nfs/dbraw/zinc/51/31/34/262513134.db2.gz	ZYYGWBDLTYVADV-SNVBAGLBSA-N	-1	0	330.211	3.710	50	0		EHAARM
O=c1c(-c2ccc(Br)cc2)coc2cc([O-])cc(O)c12	ZINC000000304562	563277427	/nfs/dbraw/zinc/27/74/27/563277427.db2.gz	TWOWQJIYFREVJJ-UHFFFAOYSA-N	-1	0	333.137	3.634	50	0	biogenic	EHAARM
Cc1ccccc1OCCn1c2ccccc2nc1SCC(=O)[O-]	ZINC000000316323	563282962	/nfs/dbraw/zinc/28/29/62/563282962.db2.gz	WVQOZCSNHXAYHV-UHFFFAOYSA-N	-1	0	342.420	3.600	50	0		EHAARM
Cc1c(Br)cc(Br)c([O-])c1Br	ZINC000000404196	563306310	/nfs/dbraw/zinc/30/63/10/563306310.db2.gz	QKHROXOPRBWBDD-UHFFFAOYSA-N	-1	0	344.828	3.988	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)OCCCC(F)(F)C(F)(F)F	ZINC000002070754	563421308	/nfs/dbraw/zinc/42/13/08/563421308.db2.gz	UKGIEAZBRIUEFZ-UHFFFAOYSA-N	-1	0	326.217	3.519	50	0		EHAARM
O=C([O-])COn1c2cc(Cl)ccc2nc1-c1ccc(Cl)cc1	ZINC000002508520	563434872	/nfs/dbraw/zinc/43/48/72/563434872.db2.gz	DUIXFEGMIVJRMF-UHFFFAOYSA-N	-1	0	337.162	3.523	50	0		EHAARM
C[C@@H](Sc1nc(-c2ccc(F)cc2)cc(C(F)(F)F)n1)C(=O)[O-]	ZINC000002798538	563451126	/nfs/dbraw/zinc/45/11/26/563451126.db2.gz	FJSPJFPEEQZYCN-SSDOTTSWSA-N	-1	0	346.305	3.867	50	0		EHAARM
O=C([O-])c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000003885971	563490563	/nfs/dbraw/zinc/49/05/63/563490563.db2.gz	VFTFNANXAXYBHK-UHFFFAOYSA-N	-1	0	345.464	3.562	50	0		EHAARM
CCCc1nc([N-]c2nc3ccccc3s2)ncc1C(=O)OCC	ZINC000008997089	563641560	/nfs/dbraw/zinc/64/15/60/563641560.db2.gz	WRQWAAGFPPBUGW-UHFFFAOYSA-N	-1	0	342.424	3.959	50	0		EHAARM
Cc1cc(C)nc([N-]c2n[nH]c(COc3ccc4ccccc4c3)n2)n1	ZINC000009318012	563643382	/nfs/dbraw/zinc/64/33/82/563643382.db2.gz	GSARPZNTMPVEFD-UHFFFAOYSA-N	-1	0	346.394	3.687	50	0		EHAARM
Cc1nn(-c2ccc(F)cc2)c2nc(-c3cccnc3)cc(C(=O)[O-])c12	ZINC000012396158	563659632	/nfs/dbraw/zinc/65/96/32/563659632.db2.gz	RTJBYVBLTBYFHB-UHFFFAOYSA-N	-1	0	348.337	3.628	50	0		EHAARM
O=C([O-])Cn1nc(C2CC2)c2c1nc(-c1ccccc1)cc2C(F)F	ZINC000012395318	563659709	/nfs/dbraw/zinc/65/97/09/563659709.db2.gz	ZQOVEZAIQBWRMR-UHFFFAOYSA-N	-1	0	343.333	3.998	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2n[nH]cc2-c2cccc(Cl)c2)cc1	ZINC000012415342	563660305	/nfs/dbraw/zinc/66/03/05/563660305.db2.gz	DPSPWYJFWDWNOZ-UHFFFAOYSA-N	-1	0	347.827	3.839	50	0		EHAARM
C=Cc1ccc(CSC2=Nc3ccccc3S(=O)(=O)[N-]2)cc1	ZINC000004372176	563674410	/nfs/dbraw/zinc/67/44/10/563674410.db2.gz	WKKUAVFMGDBXNB-UHFFFAOYSA-N	-1	0	330.434	3.733	50	0		EHAARM
Cc1cccc(NC(=O)c2nc[n-]c2C(=O)Nc2cccc(C)c2)c1	ZINC000000091133	563725688	/nfs/dbraw/zinc/72/56/88/563725688.db2.gz	GHXDISAHZSPRGP-UHFFFAOYSA-N	-1	0	334.379	3.531	50	0		EHAARM
O=C(c1cnn(-c2ncc(Cl)cc2Cl)c1)c1ccccc1[O-]	ZINC000014197482	563749324	/nfs/dbraw/zinc/74/93/24/563749324.db2.gz	TZCLYHDKAULCBY-UHFFFAOYSA-N	-1	0	334.162	3.511	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000004600164	563926498	/nfs/dbraw/zinc/92/64/98/563926498.db2.gz	PXDLPTSECRXUQH-CHWSQXEVSA-N	-1	0	327.302	3.701	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])nn2-c2ccccc2Cl)cc1	ZINC000062423908	563953621	/nfs/dbraw/zinc/95/36/21/563953621.db2.gz	PKFMUTHVKXVIEX-UHFFFAOYSA-N	-1	0	328.755	3.900	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@H](CCCc2ccccc2)[C@@H]1C(=O)[O-]	ZINC000209933131	563984252	/nfs/dbraw/zinc/98/42/52/563984252.db2.gz	JJVIAYZDVHANGB-JKSUJKDBSA-N	-1	0	333.428	3.720	50	0		EHAARM
CCOc1cccc([C@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])c1	ZINC000221039587	563989636	/nfs/dbraw/zinc/98/96/36/563989636.db2.gz	DKAUKPNHISACCN-HZPDHXFCSA-N	-1	0	349.427	3.653	50	0		EHAARM
CC(C)n1[n-]c(-c2ccc(F)cc2)c(C(=O)Nc2ccccc2)c1=O	ZINC000225574094	563991654	/nfs/dbraw/zinc/99/16/54/563991654.db2.gz	HJCSIVAIABIWGQ-UHFFFAOYSA-N	-1	0	339.370	3.816	50	0		EHAARM
O=C([O-])CC1(NC(=O)N2CC[C@@H](c3ccc(F)cc3)C2)CCCCC1	ZINC000426490295	563995795	/nfs/dbraw/zinc/99/57/95/563995795.db2.gz	YYFQXAROGKMNMF-OAHLLOKOSA-N	-1	0	348.418	3.502	50	0		EHAARM
O=C([O-])CC1(NC(=O)N2CC[C@H](c3ccc(F)cc3)C2)CCCCC1	ZINC000426490294	563995821	/nfs/dbraw/zinc/99/58/21/563995821.db2.gz	YYFQXAROGKMNMF-HNNXBMFYSA-N	-1	0	348.418	3.502	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cc3c[nH]nc3cc2C)c(Cl)c1	ZINC000252492661	563997796	/nfs/dbraw/zinc/99/77/96/563997796.db2.gz	MRUOFRUHRPMLSW-UHFFFAOYSA-N	-1	0	335.816	3.634	50	0		EHAARM
CC(=O)Nc1c(C)cc(NC(=O)CC2(C(=O)[O-])CCCCC2)cc1C	ZINC000079382447	564000992	/nfs/dbraw/zinc/00/09/92/564000992.db2.gz	CDZAFMYPFNIASY-UHFFFAOYSA-N	-1	0	346.427	3.626	50	0		EHAARM
O=c1nc(CSc2nc3cc(Cl)ccc3[nH]2)[n-]c2ccsc21	ZINC000005173947	564005844	/nfs/dbraw/zinc/00/58/44/564005844.db2.gz	AISUWLSUOICQBZ-UHFFFAOYSA-N	-1	0	348.840	3.807	50	0		EHAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2cccc3ccccc32)c1	ZINC000004660878	564013862	/nfs/dbraw/zinc/01/38/62/564013862.db2.gz	QLLWYCFKHWFPBM-UHFFFAOYSA-N	-1	0	343.404	3.658	50	0		EHAARM
COc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccc(Cl)cn1	ZINC000006706879	564014955	/nfs/dbraw/zinc/01/49/55/564014955.db2.gz	JFFNIPTVTGLZRU-UHFFFAOYSA-N	-1	0	347.223	3.506	50	0		EHAARM
O=C([O-])C1=Nc2cc(-c3ccccc3)nn2[C@H](c2ccccc2F)C1	ZINC000101353787	564019373	/nfs/dbraw/zinc/01/93/73/564019373.db2.gz	CBMUACUVJPRLLY-KRWDZBQOSA-N	-1	0	335.338	3.673	50	0		EHAARM
Cc1ccsc1CN(C)C(=O)c1ccc2c(=O)[nH]c(=S)[n-]c2c1	ZINC000047058426	564025693	/nfs/dbraw/zinc/02/56/93/564025693.db2.gz	MBXTULCWWBFKLS-UHFFFAOYSA-N	-1	0	345.449	3.640	50	0		EHAARM
O=C([O-])c1ccc(OCc2cccc(F)c2)c(Br)c1	ZINC000007603969	564034376	/nfs/dbraw/zinc/03/43/76/564034376.db2.gz	SBGYINYSYYCFTI-UHFFFAOYSA-N	-1	0	325.133	3.865	50	0		EHAARM
O=C([O-])C1(CC(=O)N2CCC(c3c[nH]c4ccccc43)CC2)CCC1	ZINC000262563887	564051440	/nfs/dbraw/zinc/05/14/40/564051440.db2.gz	XFQZHVQUVXAYGT-UHFFFAOYSA-N	-1	0	340.423	3.519	50	0		EHAARM
C[C@H](O)[C@@H]1CC[C@@H]2[C@@H]3CCC(=O)[C@](C)(CCC(=O)[O-])[C@H]3CC[C@@]12C	ZINC000248378469	564053178	/nfs/dbraw/zinc/05/31/78/564053178.db2.gz	JPPQYWISPXWYPP-HIQFOQTISA-N	-1	0	336.472	3.660	50	0		EHAARM
Cc1c2c([O-])nn(-c3ccccc3)c2oc(=O)c1Cc1ccccc1	ZINC000005955667	564057291	/nfs/dbraw/zinc/05/72/91/564057291.db2.gz	YDSHVHFKTCNISN-UHFFFAOYSA-N	-1	0	332.359	3.584	50	0		EHAARM
O=C([O-])c1ccc(CN2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)cc1	ZINC000263565240	564058142	/nfs/dbraw/zinc/05/81/42/564058142.db2.gz	FJLVCLLRILIBDX-QGZVFWFLSA-N	-1	0	349.789	3.751	50	0		EHAARM
Cc1ccc(-c2oc3c(C)cc(C)cc3c(=O)c2OCC(=O)[O-])cc1	ZINC000001287313	564062916	/nfs/dbraw/zinc/06/29/16/564062916.db2.gz	GUQFKKRMDLFWAY-UHFFFAOYSA-N	-1	0	338.359	3.849	50	0		EHAARM
O=C([O-])c1ccc(N2CCC[C@@H](c3n[nH]cc3-c3ccccc3)C2)nc1	ZINC000067895088	564075019	/nfs/dbraw/zinc/07/50/19/564075019.db2.gz	FXNJGWGHXINWEE-MRXNPFEDSA-N	-1	0	348.406	3.554	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3cc(NC(C)=O)ccc3n2)cc1	ZINC000012893206	564077627	/nfs/dbraw/zinc/07/76/27/564077627.db2.gz	RSSZXIUWKKUWTA-UHFFFAOYSA-N	-1	0	336.347	3.567	50	0		EHAARM
COc1ccc(C(=O)[O-])cc1-c1cc(F)ccc1OC[C@H]1CCOC1	ZINC000564584400	564079033	/nfs/dbraw/zinc/07/90/33/564079033.db2.gz	DSLCWORRRMDIND-LBPRGKRZSA-N	-1	0	346.354	3.615	50	0		EHAARM
O=c1[nH]c2ccccc2c([O-])c1-c1nc(-c2cccc(Cl)c2)no1	ZINC000075536628	564087920	/nfs/dbraw/zinc/08/79/20/564087920.db2.gz	JKJJHLSLUYHFKU-UHFFFAOYSA-N	-1	0	339.738	3.604	50	0		EHAARM
Cc1nnc(-c2csc(S(=O)(=O)[N-]c3ccc(C)c(C)c3)c2)o1	ZINC000065098566	564101094	/nfs/dbraw/zinc/10/10/94/564101094.db2.gz	REKCMEMYBDEVNA-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(-c3ccsc3)no2)c1	ZINC000065153416	564102072	/nfs/dbraw/zinc/10/20/72/564102072.db2.gz	IBYFGTIVZVRDTR-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2ccccc2Cl)c1=O	ZINC000065215435	564102874	/nfs/dbraw/zinc/10/28/74/564102874.db2.gz	DEKAOMAPKPCRPW-UHFFFAOYSA-N	-1	0	348.811	3.694	50	0		EHAARM
O=C([O-])c1cc2cc(-c3cccc(C(F)(F)F)c3)ccc2[nH]c1=O	ZINC000170623621	564110428	/nfs/dbraw/zinc/11/04/28/564110428.db2.gz	RETWPBUQKFZQNX-UHFFFAOYSA-N	-1	0	333.265	3.912	50	0		EHAARM
Cc1nsc2ncc(C(=O)c3cc(Br)ccc3[O-])cc12	ZINC000010025152	564111024	/nfs/dbraw/zinc/11/10/24/564111024.db2.gz	CESAQZSUBSVTFB-UHFFFAOYSA-N	-1	0	349.209	3.699	50	0		EHAARM
CC(=NNc1ccc(C(=O)[O-])cc1)c1cc(Br)ccc1O	ZINC000252475279	564119005	/nfs/dbraw/zinc/11/90/05/564119005.db2.gz	XMRZDXIJBKMZLA-UHFFFAOYSA-N	-1	0	349.184	3.689	50	0		EHAARM
Cc1[nH]nc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c1CC(C)C	ZINC000095944040	564142140	/nfs/dbraw/zinc/14/21/40/564142140.db2.gz	FSCRYEQRVZXYSG-UHFFFAOYSA-N	-1	0	345.827	3.510	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3C)s2)n[nH]1	ZINC000009686417	564174426	/nfs/dbraw/zinc/17/44/26/564174426.db2.gz	XRIYFJPHPJAMKM-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
CC(C)c1ccc(NS(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1	ZINC000096747791	601317745	/nfs/dbraw/zinc/31/77/45/601317745.db2.gz	FJQOJYSQWHCAKT-XGICHPGQSA-N	-1	0	345.420	3.709	50	0		EHAARM
O=C([O-])[C@@H]1CCN(C(=O)[C@H]2CCCc3ccccc32)c2ccccc21	ZINC000327396517	971395570	/nfs/dbraw/zinc/39/55/70/971395570.db2.gz	STARTMRHHKVCMM-ZWKOTPCHSA-N	-1	0	335.403	3.712	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NC(=O)[C@H]2CCCc3ccccc32)cc1	ZINC000630327344	975254415	/nfs/dbraw/zinc/25/44/15/975254415.db2.gz	DGQJKVOHZBMASA-GBESFXJTSA-N	-1	0	335.403	3.933	50	0		EHAARM
Cc1ccc(OC2CCCC2)c(-c2cnc3cc(C(=O)[O-])nn3c2)c1	ZINC000874969878	1123269912	/nfs/dbraw/zinc/26/99/12/1123269912.db2.gz	HINKSCQEJQQJEV-UHFFFAOYSA-N	-1	0	337.379	3.724	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)Nc1ccccc1C(=O)c1ccccc1	ZINC000004542543	210217586	/nfs/dbraw/zinc/21/75/86/210217586.db2.gz	OGXJPSXYWISJPN-UHFFFAOYSA-N	-1	0	345.354	3.868	50	0		EHAARM
Cc1ccc2nc([N-]c3ncc4c(n3)C[C@H](C)CC4=O)nc(C)c2c1	ZINC000010157460	201795164	/nfs/dbraw/zinc/79/51/64/201795164.db2.gz	XHMDFOFSMPUHGP-NSHDSACASA-N	-1	0	333.395	3.545	50	0		EHAARM
Cc1ccccc1Oc1nc2ccccc2nc1SCC(=O)[O-]	ZINC000013362953	201891857	/nfs/dbraw/zinc/89/18/57/201891857.db2.gz	MHMTYMJZAMVPRM-UHFFFAOYSA-N	-1	0	326.377	3.907	50	0		EHAARM
Cc1ccc(NC(=O)Cc2cc(C(=O)[O-])c3ccccc3n2)c(C)c1	ZINC000019973430	202028582	/nfs/dbraw/zinc/02/85/82/202028582.db2.gz	ZACFHUXCBGBLQB-UHFFFAOYSA-N	-1	0	334.375	3.731	50	0		EHAARM
CCN(CC)C(=O)c1cccc(NC(=O)c2cc(Cl)ccc2[O-])c1	ZINC000022416849	202085349	/nfs/dbraw/zinc/08/53/49/202085349.db2.gz	PQNOSPBRAXQHKP-UHFFFAOYSA-N	-1	0	346.814	3.780	50	0		EHAARM
Cc1cccc(OCC(=O)Nc2cc(-c3ccc(F)cc3)no2)c1	ZINC000027994013	202162347	/nfs/dbraw/zinc/16/23/47/202162347.db2.gz	IHRLBUHTMPLXNI-UHFFFAOYSA-N	-1	0	326.327	3.807	50	0		EHAARM
Cc1csc([N-]S(=O)(=O)c2ccc(C3CCCCC3)cc2)n1	ZINC000028248762	202167673	/nfs/dbraw/zinc/16/76/73/202167673.db2.gz	VVSDOVRPDNEIMC-UHFFFAOYSA-N	-1	0	336.482	3.722	50	0		EHAARM
O=C([O-])C(F)(F)c1ccc(OC(F)(F)F)c(Br)c1	ZINC000036533713	202325987	/nfs/dbraw/zinc/32/59/87/202325987.db2.gz	XMWNWBBKIPEOIQ-UHFFFAOYSA-N	-1	0	335.022	3.524	50	0		EHAARM
CC(C)(C)c1nc2cc([N-]S(=O)(=O)c3ccccc3F)ccc2[nH]1	ZINC000075567975	202381290	/nfs/dbraw/zinc/38/12/90/202381290.db2.gz	GHBDUEGGKPJBOV-UHFFFAOYSA-N	-1	0	347.415	3.800	50	0		EHAARM
O=C([O-])c1cn(-c2ccccc2)c2c1NC(=O)C[C@@H]2c1ccncc1	ZINC000040288284	202432694	/nfs/dbraw/zinc/43/26/94/202432694.db2.gz	UGKHZHAHEXGQIP-CQSZACIVSA-N	-1	0	333.347	3.694	50	0		EHAARM
CCc1cc2c(nc(-c3ccccc3)nc2NCCC(=O)[O-])s1	ZINC000041090417	202471755	/nfs/dbraw/zinc/47/17/55/202471755.db2.gz	DITNEEPZCVEFCU-UHFFFAOYSA-N	-1	0	327.409	3.807	50	0		EHAARM
CCCOC(=O)c1ccc(Oc2coc3cc([O-])ccc3c2=O)cc1	ZINC000005898923	201361228	/nfs/dbraw/zinc/36/12/28/201361228.db2.gz	SQFGBFBIJMOAJT-UHFFFAOYSA-N	-1	0	340.331	3.858	50	0	biogenic	EHAARM
CCOc1ccc(NC(=O)[C@@H](CC(=O)[O-])Cc2ccc(C)cc2)cc1	ZINC000000249108	201453616	/nfs/dbraw/zinc/45/36/16/201453616.db2.gz	SNAHCYLESZADEH-MRXNPFEDSA-N	-1	0	341.407	3.666	50	0		EHAARM
COc1ccc(C(=O)[O-])cc1COc1ccccc1Br	ZINC000000373417	201465878	/nfs/dbraw/zinc/46/58/78/201465878.db2.gz	DZKXUGHPHMDUPI-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
O=C([O-])c1cccc(Nc2c(-c3ccccc3O)nc3cnccn32)c1	ZINC000065322795	202835971	/nfs/dbraw/zinc/83/59/71/202835971.db2.gz	OMHUOQUIWKDGHK-UHFFFAOYSA-N	-1	0	346.346	3.544	50	0		EHAARM
CC(C)(C)c1nnc([N-]C(=O)c2ncoc2-c2cccs2)s1	ZINC000069775867	203048666	/nfs/dbraw/zinc/04/86/66/203048666.db2.gz	XEDXLYCZVCMHAW-UHFFFAOYSA-N	-1	0	334.426	3.804	50	0		EHAARM
O=S(=O)([N-]c1ccccc1C(F)(F)F)c1cc(F)cc(F)c1	ZINC000078276233	203414850	/nfs/dbraw/zinc/41/48/50/203414850.db2.gz	BEZDWVBMWFWUCL-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cnc(-c3ccccc3)s2)C1	ZINC000238021798	204854654	/nfs/dbraw/zinc/85/46/54/204854654.db2.gz	OEFITTPOAFWXHD-CYBMUJFWSA-N	-1	0	344.436	3.527	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2ccccc2-n2cccn2)CCCCC1	ZINC000000129855	206208848	/nfs/dbraw/zinc/20/88/48/206208848.db2.gz	VNHXXIPMJRAAOV-UHFFFAOYSA-N	-1	0	341.411	3.626	50	0		EHAARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000000266351	206221879	/nfs/dbraw/zinc/22/18/79/206221879.db2.gz	SGECJYRJOBMYEM-UHFFFAOYSA-N	-1	0	347.436	3.572	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000368923	206235657	/nfs/dbraw/zinc/23/56/57/206235657.db2.gz	UFJUJIGDWOIYFD-NXEZZACHSA-N	-1	0	336.800	3.555	50	0		EHAARM
Cc1cccc2sc(NC(=O)[C@H]3CC(C)=CC[C@@H]3C(=O)[O-])nc21	ZINC000006217823	210601937	/nfs/dbraw/zinc/60/19/37/210601937.db2.gz	GJCVSXKJGOPOAN-RYUDHWBXSA-N	-1	0	330.409	3.600	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)c1ccccc1C(F)(F)F)c1ccccc1	ZINC000013223934	207366358	/nfs/dbraw/zinc/36/63/58/207366358.db2.gz	VBSPIKRUBQZDGD-CQSZACIVSA-N	-1	0	337.297	3.651	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)[C@@H]2CC[C@@](C)(C(=O)[O-])C2(C)C)cc1	ZINC000000223918	563262593	/nfs/dbraw/zinc/26/25/93/563262593.db2.gz	DUOIEPVTIVMMNP-JXFKEZNVSA-N	-1	0	346.471	3.998	50	0		EHAARM
Cc1ccc([C@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1	ZINC000000226863	563263144	/nfs/dbraw/zinc/26/31/44/563263144.db2.gz	BRZQPRHKSQMCSZ-NEPJUHHUSA-N	-1	0	325.290	3.550	50	0		EHAARM
CC(C)c1ccc(C(=O)NC(=S)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000000309941	563280191	/nfs/dbraw/zinc/28/01/91/563280191.db2.gz	LUDZMGOHPHOLTG-UHFFFAOYSA-N	-1	0	342.420	3.635	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)[O-])n2)cc1	ZINC000000483892	563337822	/nfs/dbraw/zinc/33/78/22/563337822.db2.gz	MSWQGSUCTSKSLI-KGLIPLIRSA-N	-1	0	344.436	3.948	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccc(OC)c(Cl)c1	ZINC000000571611	563350114	/nfs/dbraw/zinc/35/01/14/563350114.db2.gz	BPGFNBXVULENPF-UHFFFAOYSA-N	-1	0	341.816	3.548	50	0		EHAARM
Cc1ccc2[nH]c(-c3ccc(NC(=O)CCCC(=O)[O-])cc3)nc2c1	ZINC000009694254	563368674	/nfs/dbraw/zinc/36/86/74/563368674.db2.gz	ZBZSKELWLIHHHM-UHFFFAOYSA-N	-1	0	337.379	3.732	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c3cccnc23)cc1	ZINC000001233332	563380502	/nfs/dbraw/zinc/38/05/02/563380502.db2.gz	SUAWQKBCCJDMLS-UHFFFAOYSA-N	-1	0	332.812	3.997	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1ccc(C(F)(F)F)cc1	ZINC000002385890	563430898	/nfs/dbraw/zinc/43/08/98/563430898.db2.gz	UKFKHDUXBBWVHB-GFCCVEGCSA-N	-1	0	347.333	3.616	50	0		EHAARM
Cc1c(C(=O)[O-])cc(C(C)(C)C)n1CCCNC(=O)OC(C)(C)C	ZINC000002380618	563430923	/nfs/dbraw/zinc/43/09/23/563430923.db2.gz	DIOWQCJIBSMJSL-UHFFFAOYSA-N	-1	0	338.448	3.707	50	0		EHAARM
C[C@@H](Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(=O)[O-]	ZINC000002562444	563441887	/nfs/dbraw/zinc/44/18/87/563441887.db2.gz	YUVKUEAFAVKILW-SECBINFHSA-N	-1	0	327.258	3.745	50	0	in-vitro	EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1csc2ccccc12	ZINC000002575630	563442451	/nfs/dbraw/zinc/44/24/51/563442451.db2.gz	VRUFHPBCNHYEPJ-LBPRGKRZSA-N	-1	0	335.425	3.812	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1cccc(C(F)(F)F)c1	ZINC000002575653	563442524	/nfs/dbraw/zinc/44/25/24/563442524.db2.gz	ATUJVGXTABSYTK-LBPRGKRZSA-N	-1	0	347.333	3.616	50	0		EHAARM
Cc1cc(OCC(=O)Nc2cccc(C(=O)[O-])c2)cc(C)c1Cl	ZINC000002868505	563458689	/nfs/dbraw/zinc/45/86/89/563458689.db2.gz	RCRDWYSMOQTPMJ-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1Cl	ZINC000003128430	563473546	/nfs/dbraw/zinc/47/35/46/563473546.db2.gz	IDUVYRFOWMBTGD-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
CCCc1cc2c(cc1OCC(=O)[O-])oc(=O)cc2-c1ccccc1	ZINC000004086347	563493754	/nfs/dbraw/zinc/49/37/54/563493754.db2.gz	JAQZXCDMRWQOGH-UHFFFAOYSA-N	-1	0	338.359	3.876	50	0		EHAARM
O=C([O-])CCC(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000004652515	563506520	/nfs/dbraw/zinc/50/65/20/563506520.db2.gz	MIKUYYTUOKLGCD-UHFFFAOYSA-N	-1	0	345.207	3.920	50	0		EHAARM
CCCc1cc2c([O-])c(-c3ccc4c(c3)OCO4)c(=O)oc2cc1O	ZINC000005686281	563545585	/nfs/dbraw/zinc/54/55/85/563545585.db2.gz	QZYZCUKSRGPQPV-UHFFFAOYSA-N	-1	0	340.331	3.552	50	0		EHAARM
O=S(=O)(Nc1ccc(Cl)cc1)c1ccc2oc(=S)[n-]c2c1	ZINC000006189443	563561065	/nfs/dbraw/zinc/56/10/65/563561065.db2.gz	KJWXTVJPBJYXSI-UHFFFAOYSA-N	-1	0	340.813	3.571	50	0		EHAARM
C[C@H](Oc1cccnc1)C(=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000097379060	563613108	/nfs/dbraw/zinc/61/31/08/563613108.db2.gz	WPOREYBTPYCSCD-QMMMGPOBSA-N	-1	0	327.167	3.500	50	0		EHAARM
CCCN(c1ccccc1C(=O)[O-])S(=O)(=O)c1ccc(C)cc1C	ZINC000011691483	563650796	/nfs/dbraw/zinc/65/07/96/563650796.db2.gz	GEJVBHSJVRBAMX-UHFFFAOYSA-N	-1	0	347.436	3.607	50	0		EHAARM
C[C@@H](C[NH2+][C@@H](c1cccc(Cl)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997522	563683835	/nfs/dbraw/zinc/68/38/35/563683835.db2.gz	ASGIEMFZUXVBFN-BLLLJJGKSA-N	-1	0	339.759	3.910	50	0		EHAARM
CCn1cc(S(=O)(=O)[N-]c2c(C(C)C)cccc2C(C)C)cn1	ZINC000013948605	563732881	/nfs/dbraw/zinc/73/28/81/563732881.db2.gz	RAEQSABHPBRXPQ-UHFFFAOYSA-N	-1	0	335.473	3.951	50	0		EHAARM
COc1ccc(Nc2nc(-c3ccccc3)cc(=O)[nH]2)cc1Cl	ZINC000041662796	563924568	/nfs/dbraw/zinc/92/45/68/563924568.db2.gz	FOOAZLQKCVZGJC-UHFFFAOYSA-N	-1	0	327.771	3.843	50	0		EHAARM
CCc1nc(C)c([C@H](C)N(C)Cc2nc(=O)c3sccc3[n-]2)s1	ZINC000096424497	563952020	/nfs/dbraw/zinc/95/20/20/563952020.db2.gz	DDBIRWSXNZDJGJ-JTQLQIEISA-N	-1	0	348.497	3.505	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)o1	ZINC000238012334	563962173	/nfs/dbraw/zinc/96/21/73/563962173.db2.gz	VGXIVBLCFHMLMS-OAHLLOKOSA-N	-1	0	338.363	3.827	50	0		EHAARM
COC(=O)N=c1[n-]nc([C@H](C)Oc2ccc(Cl)c(C)c2)s1	ZINC000004695005	563964544	/nfs/dbraw/zinc/96/45/44/563964544.db2.gz	DTSULULNXGMUFQ-QMMMGPOBSA-N	-1	0	327.793	3.818	50	0		EHAARM
Cc1ccc(-c2noc(COc3ccc(CCC(=O)[O-])cc3)n2)cc1	ZINC000097103288	563967598	/nfs/dbraw/zinc/96/75/98/563967598.db2.gz	TXJLEBKEZJIHEF-UHFFFAOYSA-N	-1	0	338.363	3.641	50	0		EHAARM
C[C@H](C(=O)[O-])[C@H](NC(=O)c1ccc(F)cc1Cl)c1ccccc1	ZINC000097018280	563971019	/nfs/dbraw/zinc/97/10/19/563971019.db2.gz	HOMZQDZQJYQNIA-BONVTDFDSA-N	-1	0	335.762	3.671	50	0		EHAARM
O=C([O-])c1cccc(Cn2cnc(-c3ccccc3)c2[C@@H]2CCOC2)c1	ZINC000091694513	563975681	/nfs/dbraw/zinc/97/56/81/563975681.db2.gz	CZRLQKIFAQRGRD-GOSISDBHSA-N	-1	0	348.402	3.801	50	0		EHAARM
O=C([O-])c1cccc(Nc2nc(-c3ccc(O)cc3O)cs2)c1	ZINC000000090754	563976508	/nfs/dbraw/zinc/97/65/08/563976508.db2.gz	OSICASGPBKFBQV-UHFFFAOYSA-N	-1	0	328.349	3.663	50	0		EHAARM
Cc1cc([C@@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])ccc1F	ZINC000072233769	563986037	/nfs/dbraw/zinc/98/60/37/563986037.db2.gz	VVAKZLAABFIUDS-DZGCQCFKSA-N	-1	0	337.391	3.702	50	0		EHAARM
C[C@H](CC(=O)N1CC[C@@](C)(C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237541929	563993130	/nfs/dbraw/zinc/99/31/30/563993130.db2.gz	LKJAXSMXGVKMGF-BDJLRTHQSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])c1cccc(COc2ccc(F)cc2Br)c1	ZINC000011994886	563995658	/nfs/dbraw/zinc/99/56/58/563995658.db2.gz	XYWOMEOYUJCMQG-UHFFFAOYSA-N	-1	0	325.133	3.865	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c(OC)c1	ZINC000002640285	564003959	/nfs/dbraw/zinc/00/39/59/564003959.db2.gz	WZACTRHOIORDCH-UHFFFAOYSA-N	-1	0	335.425	3.628	50	0		EHAARM
CC(C)N(C(=O)CSc1ccccc1C(=O)[O-])c1ccccc1	ZINC000005633173	564006766	/nfs/dbraw/zinc/00/67/66/564006766.db2.gz	OPXOIUJEZJBHKR-UHFFFAOYSA-N	-1	0	329.421	3.919	50	0		EHAARM
O=S(=O)([N-]c1cccc(Cl)c1)c1ccc(-c2ccno2)s1	ZINC000044901387	564027621	/nfs/dbraw/zinc/02/76/21/564027621.db2.gz	MNINTOMFOXZUTM-UHFFFAOYSA-N	-1	0	340.813	3.857	50	0		EHAARM
CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2nccn2CC(C)C)cc1	ZINC000225529050	564047538	/nfs/dbraw/zinc/04/75/38/564047538.db2.gz	NXPPWUGPMFOXSH-AWEZNQCLSA-N	-1	0	335.473	3.853	50	0		EHAARM
C[C@@H]1CCN(C(=O)Cc2ccc(C(=O)[O-])cc2)[C@@H](c2ccco2)C1	ZINC000263334707	564056254	/nfs/dbraw/zinc/05/62/54/564056254.db2.gz	NCFVGDHRGNCBRK-CZUORRHYSA-N	-1	0	327.380	3.520	50	0		EHAARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(C)cc2)cc1	ZINC000003623789	564060053	/nfs/dbraw/zinc/06/00/53/564060053.db2.gz	YYCDUTQPZQNVCW-GOSISDBHSA-N	-1	0	341.407	3.730	50	0		EHAARM
Cc1cccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c1C	ZINC000001252433	564062756	/nfs/dbraw/zinc/06/27/56/564062756.db2.gz	KTVHSHFZWPSNGC-UHFFFAOYSA-N	-1	0	348.402	3.522	50	0		EHAARM
Cc1ccc2c(C)nc([N-]c3ncc4c(n3)CC(C)(C)CC4=O)nc2c1	ZINC000001275371	564062847	/nfs/dbraw/zinc/06/28/47/564062847.db2.gz	AVSLGHYAYPFNOO-UHFFFAOYSA-N	-1	0	347.422	3.935	50	0		EHAARM
CSCc1cc(C(=O)N2CCCC[C@@H]2CCC(=O)[O-])ccc1F	ZINC000237380012	564074125	/nfs/dbraw/zinc/07/41/25/564074125.db2.gz	AGTRQECEBDTVSZ-CQSZACIVSA-N	-1	0	339.432	3.548	50	0		EHAARM
Cc1cc(F)ccc1NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000063809419	564077234	/nfs/dbraw/zinc/07/72/34/564077234.db2.gz	IGPTVESYNYCVGJ-UHFFFAOYSA-N	-1	0	329.356	3.698	50	0		EHAARM
O=P([O-])([O-])[C@@H]([NH2+]C[C@H]1CCCc2ccccc21)c1ccc(F)cc1	ZINC000012949504	564079801	/nfs/dbraw/zinc/07/98/01/564079801.db2.gz	IZVZWRXPGQHJMQ-CRAIPNDOSA-N	-1	0	349.342	3.712	50	0		EHAARM
O=S1(=O)[N-]C(SCc2cccc(Cl)c2)=Nc2ccccc21	ZINC000006918549	564101362	/nfs/dbraw/zinc/10/13/62/564101362.db2.gz	CRZJDSLDQXBXGL-UHFFFAOYSA-N	-1	0	338.841	3.744	50	0		EHAARM
CCCCc1ccc(NC(=O)c2c([O-])c3sccc3[nH]c2=O)cc1	ZINC000065215259	564102844	/nfs/dbraw/zinc/10/28/44/564102844.db2.gz	AJHSBDQGUOAYER-UHFFFAOYSA-N	-1	0	342.420	3.890	50	0		EHAARM
Cc1ccc2[nH]c(=O)c(-c3nc(-c4ccc(C)c(C)c4)no3)c([O-])c2c1	ZINC000065248635	564103338	/nfs/dbraw/zinc/10/33/38/564103338.db2.gz	PJYOLWJOBSLZDB-UHFFFAOYSA-N	-1	0	347.374	3.876	50	0		EHAARM
O=C(NCCc1ccc(C(F)(F)F)cc1)c1c([O-])cc(F)cc1F	ZINC000066041591	564123481	/nfs/dbraw/zinc/12/34/81/564123481.db2.gz	BRXUDTPJRWRLJN-UHFFFAOYSA-N	-1	0	345.267	3.662	50	0		EHAARM
COc1ccc(C[C@@H]2CCCN2C(=O)c2c([O-])cc(F)cc2F)cc1	ZINC000066047742	564123915	/nfs/dbraw/zinc/12/39/15/564123915.db2.gz	RBSCKBFFAUUWFU-AWEZNQCLSA-N	-1	0	347.361	3.526	50	0		EHAARM
O=C(NCCc1ccccc1C(F)(F)F)c1c([O-])cc(F)cc1F	ZINC000066050304	564123957	/nfs/dbraw/zinc/12/39/57/564123957.db2.gz	CTQYVKWWTCQBHX-UHFFFAOYSA-N	-1	0	345.267	3.662	50	0		EHAARM
CC[C@@H](C(=O)[O-])n1cnc2scc(-c3ccc(C)c(C)c3)c2c1=O	ZINC000003642062	564125078	/nfs/dbraw/zinc/12/50/78/564125078.db2.gz	VRHVVZPZKNQPIZ-AWEZNQCLSA-N	-1	0	342.420	3.778	50	0		EHAARM
Cn1nc(C(F)F)c(C(=O)[O-])c1Oc1cccc(C(F)(F)F)c1	ZINC000114752754	564128781	/nfs/dbraw/zinc/12/87/81/564128781.db2.gz	PSZGSAQBIBBCRP-UHFFFAOYSA-N	-1	0	336.216	3.867	50	0		EHAARM
O=S(=O)([N-]c1nccc(-c2ccccc2)n1)c1cccc(Cl)c1	ZINC000095944017	564142148	/nfs/dbraw/zinc/14/21/48/564142148.db2.gz	GHOVZLPYQNLCDM-UHFFFAOYSA-N	-1	0	345.811	3.598	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(CCC(F)(F)F)C2CCCC2)cc1	ZINC000095989973	564144090	/nfs/dbraw/zinc/14/40/90/564144090.db2.gz	MGOCCCFIRMIXPX-UHFFFAOYSA-N	-1	0	329.318	3.722	50	0		EHAARM
CC(C)Nc1ccc(F)cc1NC(=O)CCc1ccccc1C(=O)[O-]	ZINC000095991813	564144171	/nfs/dbraw/zinc/14/41/71/564144171.db2.gz	TVUSIZFWIGRHGM-UHFFFAOYSA-N	-1	0	344.386	3.916	50	0		EHAARM
CC(C)c1cccc(NS(=O)(=O)c2ccc(CCC(=O)[O-])cc2)c1	ZINC000008108765	564162740	/nfs/dbraw/zinc/16/27/40/564162740.db2.gz	QEDXXAZOGMBSTC-UHFFFAOYSA-N	-1	0	347.436	3.628	50	0		EHAARM
Cc1nc2ccccc2c(SCc2nc(=O)c3sccc3[n-]2)n1	ZINC000008425059	564165216	/nfs/dbraw/zinc/16/52/16/564165216.db2.gz	PJGQPEJILKMQAX-UHFFFAOYSA-N	-1	0	340.433	3.529	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3C)s2)n[nH]1	ZINC000009686486	564174450	/nfs/dbraw/zinc/17/44/50/564174450.db2.gz	YTXBZTHBYSRBAP-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
O=C([O-])[C@H](CNC(=O)c1cccc(C(F)F)c1)C1CCCCC1	ZINC000630268028	975211732	/nfs/dbraw/zinc/21/17/32/975211732.db2.gz	UKZMOVCJNIUBMC-CQSZACIVSA-N	-1	0	325.355	3.635	50	0		EHAARM
C[Si](C)(C)CCOCn1c(C(=O)[O-])cc2cc(Cl)ncc21	ZINC000169919435	1032310394	/nfs/dbraw/zinc/31/03/94/1032310394.db2.gz	QJCKWAHWIGYBGW-UHFFFAOYSA-N	-1	0	326.856	3.700	50	0		EHAARM
C=CCn1c2ccccc2c([O-])c(C(=O)Nc2c(C)cccc2C)c1=O	ZINC000005730737	1043848201	/nfs/dbraw/zinc/84/82/01/1043848201.db2.gz	SJAGVEWUAKYPMZ-UHFFFAOYSA-N	-1	0	348.402	3.762	50	0		EHAARM
CC[C@H](C)C(=O)Nc1ccccc1NC(=O)c1cccc(C(=O)[O-])c1	ZINC000952981424	1137485269	/nfs/dbraw/zinc/48/52/69/1137485269.db2.gz	ZAVVCNDXNZOZNK-LBPRGKRZSA-N	-1	0	340.379	3.622	50	0		EHAARM
COc1ccc(-n2nc(C3CC3)c3c2nc(C2CC2)cc3C(=O)[O-])cc1	ZINC000012396129	201843399	/nfs/dbraw/zinc/84/33/99/201843399.db2.gz	OEBVSQIMIYWZAJ-UHFFFAOYSA-N	-1	0	349.390	3.882	50	0		EHAARM
Cc1cc(C)nc([N-]c2nc3n(n2)C2(CCCC2)Nc2ccccc2-3)n1	ZINC000022607168	202087261	/nfs/dbraw/zinc/08/72/61/202087261.db2.gz	WMHBTUOUNZBGDD-UHFFFAOYSA-N	-1	0	347.426	3.748	50	0		EHAARM
Cc1ccc([C@@H]([N-]S(=O)(=O)c2ccc(C)cc2)C(F)(F)F)cc1	ZINC000040155822	202181294	/nfs/dbraw/zinc/18/12/94/202181294.db2.gz	KNFOOSXEQQDMCJ-OAHLLOKOSA-N	-1	0	343.370	3.885	50	0		EHAARM
Cc1ccc2sc(-c3ccc(NC(=O)/C=C\C(=O)[O-])cc3)nc2c1	ZINC000032625325	202228559	/nfs/dbraw/zinc/22/85/59/202228559.db2.gz	PEXIQNCFSAYDOH-HJWRWDBZSA-N	-1	0	338.388	3.851	50	0		EHAARM
CCCCc1nnc([N-]C(=O)c2cc(-c3ccccc3)no2)s1	ZINC000032913667	202241533	/nfs/dbraw/zinc/24/15/33/202241533.db2.gz	MVEYMPKVWIMSQG-UHFFFAOYSA-N	-1	0	328.397	3.788	50	0		EHAARM
COc1ccc(-c2[nH]c3ccccc3c2C(=O)[O-])c(OC)c1OC	ZINC000034792414	202277083	/nfs/dbraw/zinc/27/70/83/202277083.db2.gz	SKIQDPCJMFTBLL-UHFFFAOYSA-N	-1	0	327.336	3.559	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC2(C[C@H](CC(=O)[O-])c3ccccc32)CC1	ZINC000035571284	202307335	/nfs/dbraw/zinc/30/73/35/202307335.db2.gz	FARYIPWNEVTXDV-AWEZNQCLSA-N	-1	0	345.439	3.917	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)c(Cl)c1	ZINC000049409480	202622062	/nfs/dbraw/zinc/62/20/62/202622062.db2.gz	QYROKZXGCDNJES-UHFFFAOYSA-N	-1	0	348.811	3.520	50	0		EHAARM
CSc1ccc([C@H]2[C@@H](C(=O)[O-])CC(=O)N2Cc2ccccc2)cc1	ZINC000022129926	212277935	/nfs/dbraw/zinc/27/79/35/212277935.db2.gz	UJHRKLBHWDTEQV-WMZOPIPTSA-N	-1	0	341.432	3.583	50	0		EHAARM
O=C([O-])CCc1ccc(-c2ccc(N3CCCCCC3)nn2)cc1	ZINC000215602036	241133797	/nfs/dbraw/zinc/13/37/97/241133797.db2.gz	CQVVROFQFIJNBM-UHFFFAOYSA-N	-1	0	325.412	3.541	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])c1cccc(C(F)(F)F)c1	ZINC000002585858	201535887	/nfs/dbraw/zinc/53/58/87/201535887.db2.gz	UPKLBXIBSSZUID-LLVKDONJSA-N	-1	0	333.306	3.746	50	0		EHAARM
O=c1[nH]n(C2CCCCC2)c2c1[C@H](c1cccc(O)c1)CC(=O)N2	ZINC000071279269	203088799	/nfs/dbraw/zinc/08/87/99/203088799.db2.gz	LGIPIRRHOBRVHH-AWEZNQCLSA-N	-1	0	327.384	3.511	50	0		EHAARM
O=c1[nH]n(C2CCCCCC2)c2c1[C@@H](c1cccc(O)c1)CC(=O)N2	ZINC000071280222	203089228	/nfs/dbraw/zinc/08/92/28/203089228.db2.gz	AMURRZXVALVHJG-OAHLLOKOSA-N	-1	0	341.411	3.901	50	0		EHAARM
Cc1cc(C)cc(C[C@@H](C(=O)[O-])[C@@H](C)C(=O)Nc2ccccc2)c1	ZINC000071405948	203095633	/nfs/dbraw/zinc/09/56/33/203095633.db2.gz	ANBMXTJXOBLPPU-CRAIPNDOSA-N	-1	0	325.408	3.822	50	0		EHAARM
O=C([O-])[C@]1(Cc2cccc(Cl)c2)CCCN(c2ncccc2F)C1	ZINC000071721292	203105109	/nfs/dbraw/zinc/10/51/09/203105109.db2.gz	IESGEADFIMIWIY-SFHVURJKSA-N	-1	0	348.805	3.788	50	0		EHAARM
O=C([O-])c1ccc2[nH]c(-c3c[nH]nc3-c3ccc(F)cc3F)nc2c1	ZINC000072473599	203230640	/nfs/dbraw/zinc/23/06/40/203230640.db2.gz	UBYLUVRGMNNDHU-UHFFFAOYSA-N	-1	0	340.289	3.596	50	0		EHAARM
Cc1sc(-c2ccno2)cc1S(=O)(=O)[N-]c1cccc(C)c1	ZINC000075436561	203315119	/nfs/dbraw/zinc/31/51/19/203315119.db2.gz	DUVGRUMOMMIXOB-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CSc1ccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)cc1	ZINC000075519010	203316160	/nfs/dbraw/zinc/31/61/60/203316160.db2.gz	XJXZDHOXRGMDCJ-UHFFFAOYSA-N	-1	0	349.437	3.501	50	0		EHAARM
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccccc2C(C)C)c1C	ZINC000006919659	206520380	/nfs/dbraw/zinc/52/03/80/206520380.db2.gz	CXDRULXWFJPTNS-UHFFFAOYSA-N	-1	0	347.436	3.926	50	0		EHAARM
C[C@@H](c1ccccc1)N(C)C(=O)CSc1ccccc1C(=O)[O-]	ZINC000012895820	207259147	/nfs/dbraw/zinc/25/91/47/207259147.db2.gz	HONPOOWGCGNTJF-ZDUSSCGKSA-N	-1	0	329.421	3.697	50	0		EHAARM
CCC[C@H](NS(=O)(=O)c1ccc(C)c(C(=O)[O-])c1)c1ccccc1	ZINC000013089468	207285899	/nfs/dbraw/zinc/28/58/99/207285899.db2.gz	ZZUPRWOYNQXCGW-KRWDZBQOSA-N	-1	0	347.436	3.513	50	0		EHAARM
CC(C)(C)c1ccccc1OCC(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000000133620	563239473	/nfs/dbraw/zinc/23/94/73/563239473.db2.gz	NFKPREPBEUHVCX-UHFFFAOYSA-N	-1	0	327.380	3.700	50	0		EHAARM
O=S(=O)([N-]c1cccc2cccnc21)c1cccc2cccnc21	ZINC000000175216	563252680	/nfs/dbraw/zinc/25/26/80/563252680.db2.gz	GMSBWTPQXILZOK-UHFFFAOYSA-N	-1	0	335.388	3.584	50	0		EHAARM
COc1cccc([N-]S(=O)(=O)c2c(Cl)cccc2Cl)c1	ZINC000000465136	563328053	/nfs/dbraw/zinc/32/80/53/563328053.db2.gz	SESRYSWDEPBFQB-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@H]3CCCC[C@H]3C(=O)[O-])n2)cc1	ZINC000000483889	563337748	/nfs/dbraw/zinc/33/77/48/563337748.db2.gz	MSWQGSUCTSKSLI-UONOGXRCSA-N	-1	0	344.436	3.948	50	0		EHAARM
CSc1ccccc1[N-]S(=O)(=O)c1cccc2cccnc21	ZINC000002770677	563450273	/nfs/dbraw/zinc/45/02/73/563450273.db2.gz	YBRMJNYNDSJRDP-UHFFFAOYSA-N	-1	0	330.434	3.758	50	0		EHAARM
O=C([O-])c1ccccc1SCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000003223090	563477329	/nfs/dbraw/zinc/47/73/29/563477329.db2.gz	LVJMOIGUACVSLW-MRXNPFEDSA-N	-1	0	341.432	3.671	50	0		EHAARM
COc1ccc([C@@H]2[C@H](C(=O)[O-])CCC(=O)N2c2ccc(C)cc2)cc1	ZINC000003888157	563490586	/nfs/dbraw/zinc/49/05/86/563490586.db2.gz	WUXFDDOWIRXNME-IEBWSBKVSA-N	-1	0	339.391	3.573	50	0		EHAARM
C[C@@H](c1ccc2ccccc2c1)[C@H](NC(=O)OC(C)(C)C)C(=O)[O-]	ZINC000005721765	563547401	/nfs/dbraw/zinc/54/74/01/563547401.db2.gz	WUVVJXQHWJQEQZ-LRDDRELGSA-N	-1	0	329.396	3.921	50	0		EHAARM
CCCOc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1cccnc1	ZINC000008714753	563636720	/nfs/dbraw/zinc/63/67/20/563636720.db2.gz	SZRBFRGVVHWBGN-UHFFFAOYSA-N	-1	0	340.832	3.633	50	0		EHAARM
O=c1nc(Nc2cccc(Cl)c2)[n-]nc1Cc1ccc(Cl)cc1	ZINC000008742482	563638826	/nfs/dbraw/zinc/63/88/26/563638826.db2.gz	GMQFLUXTTHNVKM-UHFFFAOYSA-N	-1	0	347.205	3.806	50	0		EHAARM
COc1ccc(-c2c(C)[n-]n3c2nc(-c2ccccc2C)cc3=O)cc1	ZINC000009935376	563645189	/nfs/dbraw/zinc/64/51/89/563645189.db2.gz	DHTNXBBZNTXTKU-UHFFFAOYSA-N	-1	0	345.402	3.982	50	0		EHAARM
CN1C(=O)c2ccccc2N[C@@H]1c1ccc(-c2ccc(C(=O)[O-])cc2)o1	ZINC000013462182	563698399	/nfs/dbraw/zinc/69/83/99/563698399.db2.gz	NUJHJTSSOLHMBL-SFHVURJKSA-N	-1	0	348.358	3.841	50	0		EHAARM
CCCOc1ccc2cc(S(=O)(=O)[N-]c3cccnc3)ccc2c1	ZINC000016626423	563818081	/nfs/dbraw/zinc/81/80/81/563818081.db2.gz	VCJVTROZAYNWES-UHFFFAOYSA-N	-1	0	342.420	3.824	50	0		EHAARM
Cc1[n-]n(-c2nc(C)cc(C)n2)c(=O)c1Cc1cccc2ccccc21	ZINC000018240673	563851386	/nfs/dbraw/zinc/85/13/86/563851386.db2.gz	RWEOPSULUDRVEY-LJQANCHMSA-N	-1	0	344.418	3.828	50	0		EHAARM
O=C([O-])c1cccc(-n2nc(-c3ccccc3)c3ccccc3c2=O)c1	ZINC000003190441	563918811	/nfs/dbraw/zinc/91/88/11/563918811.db2.gz	HHQKBSQQKXJOMJ-UHFFFAOYSA-N	-1	0	342.354	3.751	50	0		EHAARM
COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cn2)c2ccccc12	ZINC000041095712	563924287	/nfs/dbraw/zinc/92/42/87/563924287.db2.gz	BXGNRQJAPOLKJN-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
O=C([O-])c1c(CO[C@@H]2CCCCO2)onc1-c1ccc(Cl)cc1	ZINC000045796233	563929400	/nfs/dbraw/zinc/92/94/00/563929400.db2.gz	DMKLSZDLNZOCLK-CYBMUJFWSA-N	-1	0	337.759	3.736	50	0		EHAARM
CC(C)(C)c1ccc([C@H](CC(=O)[O-])NC(=O)c2cccs2)cc1	ZINC000004600859	563929577	/nfs/dbraw/zinc/92/95/77/563929577.db2.gz	RKQYFXQZQGKKLW-AWEZNQCLSA-N	-1	0	331.437	3.991	50	0		EHAARM
CCN(C(=O)c1n[n-]c2ccccc2c1=O)[C@H](C)c1ccc(F)cc1	ZINC000096411200	563950633	/nfs/dbraw/zinc/95/06/33/563950633.db2.gz	GESKNOHYFPDOQP-GFCCVEGCSA-N	-1	0	339.370	3.698	50	0		EHAARM
O=C([O-])Cc1ccc(-n2ccc(-c3cc(Cl)ccc3O)n2)cc1	ZINC000067880217	563962959	/nfs/dbraw/zinc/96/29/59/563962959.db2.gz	SYKZBQQLJCVPEA-UHFFFAOYSA-N	-1	0	328.755	3.525	50	0		EHAARM
COc1ccccc1NC(=O)[C@H](CC(=O)[O-])Cc1cc(C)cc(C)c1	ZINC000004713301	563966009	/nfs/dbraw/zinc/96/60/09/563966009.db2.gz	MOGPUHILORRIEV-INIZCTEOSA-N	-1	0	341.407	3.584	50	0		EHAARM
Cc1cc(C)cc(C[C@H](C(=O)Nc2ccccc2)[C@H](C)C(=O)[O-])c1	ZINC000000037848	563968370	/nfs/dbraw/zinc/96/83/70/563968370.db2.gz	DDUJKVMTEJMQQH-YJBOKZPZSA-N	-1	0	325.408	3.822	50	0		EHAARM
Cc1cccc2c(CCC(=O)N3CCC[C@H](CCC(=O)[O-])C3)c[nH]c21	ZINC000237760350	563993770	/nfs/dbraw/zinc/99/37/70/563993770.db2.gz	JJKVYRMVUUVGCB-OAHLLOKOSA-N	-1	0	342.439	3.512	50	0		EHAARM
Cc1cccc(NC2CCN(C(=O)c3cc(F)c([O-])c(F)c3)CC2)c1	ZINC000180059891	564008177	/nfs/dbraw/zinc/00/81/77/564008177.db2.gz	HXHCWYLBGXZHIB-UHFFFAOYSA-N	-1	0	346.377	3.696	50	0		EHAARM
C[C@H](NC(=O)C(C)(C)C1CCCC1)c1ccc(OCC(=O)[O-])cc1	ZINC000262868883	564013019	/nfs/dbraw/zinc/01/30/19/564013019.db2.gz	AVIKCVNACMTVBD-ZDUSSCGKSA-N	-1	0	333.428	3.544	50	0		EHAARM
O=C([O-])Cc1ccc(NC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000005041247	564013936	/nfs/dbraw/zinc/01/39/36/564013936.db2.gz	IEAMAUKFMWPNQA-UHFFFAOYSA-N	-1	0	338.285	3.977	50	0		EHAARM
O=C(c1cccc(Cl)c1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000000507220	564019671	/nfs/dbraw/zinc/01/96/71/564019671.db2.gz	MCLJEEJRFVQVLS-RISCZKNCSA-N	-1	0	346.736	3.593	50	0		EHAARM
COc1cc(C)c(C(C)C)cc1S(=O)(=O)[N-]c1cccc(O)c1	ZINC000230514804	564051089	/nfs/dbraw/zinc/05/10/89/564051089.db2.gz	VCMCKZAXLAWBQP-UHFFFAOYSA-N	-1	0	335.425	3.633	50	0		EHAARM
O=c1[nH]c2ccccc2c([O-])c1-c1nc(-c2ccc(Cl)cc2)no1	ZINC000075536630	564087940	/nfs/dbraw/zinc/08/79/40/564087940.db2.gz	POUZTMJHPUSNEE-UHFFFAOYSA-N	-1	0	339.738	3.604	50	0		EHAARM
Cc1ccc(-c2oc3ccc(C)cc3c(=O)c2O[C@H](C)C(=O)[O-])cc1	ZINC000001941795	564090308	/nfs/dbraw/zinc/09/03/08/564090308.db2.gz	ZLGKDTAOASUYFH-CYBMUJFWSA-N	-1	0	338.359	3.929	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2cc(-c3ccnn3C)cs2)c1C	ZINC000065112344	564101295	/nfs/dbraw/zinc/10/12/95/564101295.db2.gz	YYSQYOWLAYNFPJ-UHFFFAOYSA-N	-1	0	347.465	3.566	50	0		EHAARM
CC(C)n1cc(S(=O)(=O)[N-]c2cccc(F)c2)c2cccnc21	ZINC000065242210	564103393	/nfs/dbraw/zinc/10/33/93/564103393.db2.gz	FXHBNRPAMQOEHD-UHFFFAOYSA-N	-1	0	333.388	3.557	50	0		EHAARM
Cc1cc(C(=O)N[C@](C)(C(=O)[O-])C2CC2)sc1-c1ccc(F)cc1	ZINC000170592082	564108865	/nfs/dbraw/zinc/10/88/65/564108865.db2.gz	ZUQOTXORLJLHHF-SFHVURJKSA-N	-1	0	347.411	3.846	50	0		EHAARM
O=C([O-])c1ccccc1NCC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000096191919	564145943	/nfs/dbraw/zinc/14/59/43/564145943.db2.gz	BQVAKZJCWOKAQW-UHFFFAOYSA-N	-1	0	339.178	3.742	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc1	ZINC000096479736	564148565	/nfs/dbraw/zinc/14/85/65/564148565.db2.gz	SMHBKWURIKRXSW-GOSISDBHSA-N	-1	0	341.382	3.820	50	0		EHAARM
CCOC(=O)c1ccc(-c2c(C)oc3cc([O-])c(CC)cc3c2=O)o1	ZINC000004025172	564160076	/nfs/dbraw/zinc/16/00/76/564160076.db2.gz	SUIRYMVHONJRHX-UHFFFAOYSA-N	-1	0	342.347	3.806	50	0	biogenic	EHAARM
Cc1ccc([C@H]2[C@H](C(=O)[O-])CCC(=O)N2CCc2cccs2)s1	ZINC000069664815	564171370	/nfs/dbraw/zinc/17/13/70/564171370.db2.gz	OUKBJPIOKYHCDC-CZUORRHYSA-N	-1	0	349.477	3.725	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2cccc3cccc(C(=O)[O-])c32)cc1	ZINC000041124581	564173386	/nfs/dbraw/zinc/17/33/86/564173386.db2.gz	KIIQXQYEFQKVAD-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
Cc1[nH]nc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3)s2)c1C	ZINC000009686854	564174440	/nfs/dbraw/zinc/17/44/40/564174440.db2.gz	PRUXNJBSTBZOHO-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
O=C([O-])c1ccc(Nc2c(-c3cccc(O)c3)nc3cnccn32)cc1	ZINC000065322758	564177744	/nfs/dbraw/zinc/17/77/44/564177744.db2.gz	NGFVIGQNVXNSPY-UHFFFAOYSA-N	-1	0	346.346	3.544	50	0		EHAARM
O=C([O-])c1cccc(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)n1	ZINC000262417471	599852703	/nfs/dbraw/zinc/85/27/03/599852703.db2.gz	PLYJRGJDPGXFPO-SFHVURJKSA-N	-1	0	349.390	3.629	50	0		EHAARM
CCc1sc(C(=O)N2CC[C@@H](C(=O)[O-])c3ccccc32)cc1C	ZINC000322412615	970885071	/nfs/dbraw/zinc/88/50/71/970885071.db2.gz	ZQTJPUOAJLANMD-CYBMUJFWSA-N	-1	0	329.421	3.838	50	0		EHAARM
Cc1cc(C)c(C(=O)[O-])cc1NC(=O)[C@@H]1CCc2cc(F)ccc21	ZINC000566020711	974593865	/nfs/dbraw/zinc/59/38/65/974593865.db2.gz	AWTBNGMMDZBRFW-OAHLLOKOSA-N	-1	0	327.355	3.809	50	0		EHAARM
COc1cc2c(c(/C=C/c3ncc(/C=C/C(=O)[O-])s3)c1)O[C@@H](C)C2	ZINC000079943535	1028238429	/nfs/dbraw/zinc/23/84/29/1028238429.db2.gz	YHZWTINXCUQXJF-OOHMDPRISA-N	-1	0	343.404	3.743	50	0		EHAARM
COc1ccc(C=NNc2ccc(Cl)c(C(=O)[O-])c2)cc1OC	ZINC000254516053	1040187860	/nfs/dbraw/zinc/18/78/60/1040187860.db2.gz	FYWULONBYRKVBM-UHFFFAOYSA-N	-1	0	334.759	3.501	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N2CCC[C@H](Cc3ccccc3)C2)c(F)c1	ZINC000263553420	1124087116	/nfs/dbraw/zinc/08/71/16/1124087116.db2.gz	XPUKOYPIJNQPEW-OAHLLOKOSA-N	-1	0	341.382	3.619	50	0		EHAARM
CC(C)n1ccc2c1cccc2C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1	ZINC000952963400	1137483737	/nfs/dbraw/zinc/48/37/37/1137483737.db2.gz	QVKFYIDSFLTJFT-SHTZXODSSA-N	-1	0	342.439	3.843	50	0		EHAARM
CC(C)CC(=O)Nc1cccc(C(=O)Nc2ccc(C(=O)[O-])cc2)c1	ZINC000004575145	210225077	/nfs/dbraw/zinc/22/50/77/210225077.db2.gz	RIABSTQTORBXER-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
O=S(=O)(C=C([O-])c1ccc(Cl)s1)c1ccc(Cl)cc1	ZINC000019849368	202023762	/nfs/dbraw/zinc/02/37/62/202023762.db2.gz	RFSFEVRWHSZENX-UHFFFAOYSA-N	-1	0	335.233	3.712	50	0		EHAARM
CCCn1nc(C)cc1[N-]S(=O)(=O)c1ccc2ccccc2c1	ZINC000032609930	212817661	/nfs/dbraw/zinc/81/76/61/212817661.db2.gz	CEEKYCPZBLGXDY-UHFFFAOYSA-N	-1	0	329.425	3.556	50	0		EHAARM
Cc1nnc(S[C@H](C(=O)[O-])c2ccccc2)n1Cc1ccccc1	ZINC000036646401	202328610	/nfs/dbraw/zinc/32/86/10/202328610.db2.gz	ILXDTAJERRCAOM-INIZCTEOSA-N	-1	0	339.420	3.553	50	0		EHAARM
Cc1ccc([C@@H]2[C@@H](C(=O)[O-])CCC(=O)N2[C@@H](C)c2cc(C)oc2C)o1	ZINC000071857728	202355397	/nfs/dbraw/zinc/35/53/97/202355397.db2.gz	ZWQLKOMDUDWMDL-YEWDVWPNSA-N	-1	0	345.395	3.923	50	0		EHAARM
CC(C)(CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000039778404	202414801	/nfs/dbraw/zinc/41/48/01/202414801.db2.gz	YQSADVVFFDZPHI-UHFFFAOYSA-N	-1	0	339.391	3.636	50	0		EHAARM
CCc1ccc(C=Cc2nc(=O)c3c(C)c(C(=O)[O-])sc3[nH]2)cc1	ZINC000033496233	201074347	/nfs/dbraw/zinc/07/43/47/201074347.db2.gz	PHNQJVJDAFFDHI-HJWRWDBZSA-N	-1	0	340.404	3.724	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CCCCC2)C12CCCC2	ZINC000045895551	202559164	/nfs/dbraw/zinc/55/91/64/202559164.db2.gz	BGXXEKUQVJLQMB-QGZVFWFLSA-N	-1	0	327.424	3.956	50	0		EHAARM
Cc1cccc(C(=O)N[C@@H](CC(=O)[O-])c2ccc(OC(C)C)cc2)c1	ZINC000000106244	201435658	/nfs/dbraw/zinc/43/56/58/201435658.db2.gz	ZLFFJJNPPDYXLE-SFHVURJKSA-N	-1	0	341.407	3.728	50	0		EHAARM
O=C([O-])CCCCN1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1	ZINC000195559401	241009977	/nfs/dbraw/zinc/00/99/77/241009977.db2.gz	PCQBPESYGIEBNB-AWEZNQCLSA-N	-1	0	332.227	3.622	50	0		EHAARM
O=C([O-])CCCCCNC(=O)C(c1ccccc1)c1ccccc1	ZINC000002285469	201528719	/nfs/dbraw/zinc/52/87/19/201528719.db2.gz	SLHUWGKQUUUINF-UHFFFAOYSA-N	-1	0	325.408	3.580	50	0		EHAARM
CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000005008237	201634115	/nfs/dbraw/zinc/63/41/15/201634115.db2.gz	PIPHJIAVRSNMCM-JQWIXIFHSA-N	-1	0	328.195	3.915	50	0		EHAARM
COc1cc(C(=O)[O-])cc(-c2ccc(C(=O)N3CCCCC3)cc2)c1	ZINC000065355341	202836347	/nfs/dbraw/zinc/83/63/47/202836347.db2.gz	SHYRKVICVFHZQC-UHFFFAOYSA-N	-1	0	339.391	3.687	50	0		EHAARM
CN(CCCC(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000070915449	203084223	/nfs/dbraw/zinc/08/42/23/203084223.db2.gz	FBMGMJCITYNTQX-UHFFFAOYSA-N	-1	0	339.391	3.732	50	0		EHAARM
Cc1cc(C)cc(C[C@H](C(=O)[O-])[C@H](C)C(=O)Nc2ccccc2)c1	ZINC000071405949	203094991	/nfs/dbraw/zinc/09/49/91/203094991.db2.gz	ANBMXTJXOBLPPU-YJBOKZPZSA-N	-1	0	325.408	3.822	50	0		EHAARM
CC[C@@H](Nc1nccc(-c2cc(C(=O)[O-])ccn2)n1)c1cc(C)ccn1	ZINC000072408504	203216600	/nfs/dbraw/zinc/21/66/00/203216600.db2.gz	UWEJOBUOXZQSQP-CQSZACIVSA-N	-1	0	349.394	3.503	50	0		EHAARM
O=C([O-])[C@H](NC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccc(F)cc1	ZINC000095520827	203755406	/nfs/dbraw/zinc/75/54/06/203755406.db2.gz	CJJSXJUHVLPDRI-TXTVKVCSSA-N	-1	0	345.414	3.674	50	0		EHAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)c2ccc(-c3ccccc3Cl)o2)C1	ZINC000237658747	204705525	/nfs/dbraw/zinc/70/55/25/204705525.db2.gz	IUWIMUHPHFNBRA-QGZVFWFLSA-N	-1	0	333.771	3.537	50	0		EHAARM
Cc1cc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)c(C)s1	ZINC000237846573	204792809	/nfs/dbraw/zinc/79/28/09/204792809.db2.gz	YKNPZRWPNRFEPB-UHFFFAOYSA-N	-1	0	343.448	3.624	50	0		EHAARM
Cc1nc(CN2CCCC[C@@H]2C(=O)[O-])oc1-c1ccc(Cl)cc1	ZINC000158507780	206195232	/nfs/dbraw/zinc/19/52/32/206195232.db2.gz	KJNPHWZCEVGGGS-CQSZACIVSA-N	-1	0	334.803	3.743	50	0		EHAARM
O=C([O-])c1cc(NC(=O)c2ccc(Cl)c(Cl)c2)ccc1O	ZINC000008189648	206528806	/nfs/dbraw/zinc/52/88/06/206528806.db2.gz	RSKRPBIPBKMKAK-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
O=c1[n-]c(SCc2c(F)cccc2Cl)nnc1-c1ccccc1	ZINC000011990969	207055023	/nfs/dbraw/zinc/05/50/23/207055023.db2.gz	KGWPNIMQHLWWIA-UHFFFAOYSA-N	-1	0	347.802	3.917	50	0		EHAARM
C[C@H](c1ccccc1)N(C)C(=O)CSc1ccccc1C(=O)[O-]	ZINC000012895815	207258837	/nfs/dbraw/zinc/25/88/37/207258837.db2.gz	HONPOOWGCGNTJF-CYBMUJFWSA-N	-1	0	329.421	3.697	50	0		EHAARM
CC(C)(C)c1ccc(OCC(=O)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000000101114	563226027	/nfs/dbraw/zinc/22/60/27/563226027.db2.gz	LZHCYHMPYWQGBN-UHFFFAOYSA-N	-1	0	327.380	3.700	50	0		EHAARM
O=C([O-])COc1cc2oc(=O)cc(-c3ccccc3)c2cc1Cl	ZINC000000146731	563244527	/nfs/dbraw/zinc/24/45/27/563244527.db2.gz	UNEWDNFSEHCUCG-UHFFFAOYSA-N	-1	0	330.723	3.577	50	0		EHAARM
Cn1nc(-c2ccc(Cl)cc2)cc1NC(=O)CC(C)(C)CC(=O)[O-]	ZINC000000154954	563247346	/nfs/dbraw/zinc/24/73/46/563247346.db2.gz	ZTTZBWMFYNGJFG-UHFFFAOYSA-N	-1	0	349.818	3.570	50	0		EHAARM
Cc1sc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204911	563259389	/nfs/dbraw/zinc/25/93/89/563259389.db2.gz	OAJOTIZEIAAZEE-KGLIPLIRSA-N	-1	0	344.436	3.948	50	0		EHAARM
COc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000000367847	563296859	/nfs/dbraw/zinc/29/68/59/563296859.db2.gz	KAPSFLYALNYKCE-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
O=S(=O)([N-]c1ccccn1)c1cc(Cl)c(Cl)cc1Cl	ZINC000000446157	563317056	/nfs/dbraw/zinc/31/70/56/563317056.db2.gz	XTTJXJFYPKFDKV-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2ncccc2C)c2ccccc12	ZINC000000781585	563363524	/nfs/dbraw/zinc/36/35/24/563363524.db2.gz	IJQVLMCYHBBANM-UHFFFAOYSA-N	-1	0	342.420	3.743	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](C(=O)[O-])C(c1ccccc1)c1ccccc1	ZINC000002556726	563440950	/nfs/dbraw/zinc/44/09/50/563440950.db2.gz	TYJDOLCFYZSNQC-KRWDZBQOSA-N	-1	0	341.407	3.796	50	0		EHAARM
CCCCOc1ccc([N-]S(=O)(=O)c2cc(C)ccc2OC)cc1	ZINC000002882961	563461478	/nfs/dbraw/zinc/46/14/78/563461478.db2.gz	ONSYYQXIRQUEJV-UHFFFAOYSA-N	-1	0	349.452	3.983	50	0		EHAARM
C[C@@H](c1ccc2ccccc2c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)[O-]	ZINC000005721770	563547427	/nfs/dbraw/zinc/54/74/27/563547427.db2.gz	WUVVJXQHWJQEQZ-BLLLJJGKSA-N	-1	0	329.396	3.921	50	0		EHAARM
Cc1cc(C)c(S(=O)(=O)[N-]c2cc(Cl)ccc2O)c(C)c1	ZINC000006667885	563577155	/nfs/dbraw/zinc/57/71/55/563577155.db2.gz	LRQXBMCADQQQAY-UHFFFAOYSA-N	-1	0	325.817	3.772	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000002747131	563611705	/nfs/dbraw/zinc/61/17/05/563611705.db2.gz	LLRZMGIWYNSYSC-STQMWFEESA-N	-1	0	346.383	3.555	50	0		EHAARM
CC(C)C[C@@H](Nc1nc(C(F)(F)F)nc2ccccc21)C(=O)[O-]	ZINC000011990429	563652233	/nfs/dbraw/zinc/65/22/33/563652233.db2.gz	XJGFREGMJLZEQG-LLVKDONJSA-N	-1	0	327.306	3.560	50	0		EHAARM
Cc1cc(Cl)c(Cl)cc1S(=O)(=O)[N-]c1ccccc1O	ZINC000032601998	563663902	/nfs/dbraw/zinc/66/39/02/563663902.db2.gz	AQCVNPPEUZEKGD-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
Cc1oc(CN(C)C(=O)C2(c3ccc(Cl)cc3)CC2)cc1C(=O)[O-]	ZINC000268948460	563909861	/nfs/dbraw/zinc/90/98/61/563909861.db2.gz	XSYARLMPOSYELY-UHFFFAOYSA-N	-1	0	347.798	3.630	50	0		EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(Cc2ccco2)C12CCCCC2	ZINC000049466997	563930972	/nfs/dbraw/zinc/93/09/72/563930972.db2.gz	ZIYUSOBSWLSTQF-KRWDZBQOSA-N	-1	0	339.391	3.807	50	0		EHAARM
Cc1ccc(CN(C(=O)CCc2cc(=O)[n-]o2)C2CCCC2)s1	ZINC000055342961	563934396	/nfs/dbraw/zinc/93/43/96/563934396.db2.gz	HXHUURLJQIWMSP-UHFFFAOYSA-N	-1	0	334.441	3.654	50	0		EHAARM
O=C([O-])Cc1ccc(OCc2coc(-c3cccc(F)c3)n2)cc1	ZINC000096997963	563970926	/nfs/dbraw/zinc/97/09/26/563970926.db2.gz	UEYMTNZXZFWTFN-UHFFFAOYSA-N	-1	0	327.311	3.687	50	0		EHAARM
CC(C)(C(=O)[O-])[C@H]1CCCN(C(=O)c2csc3c2CCCC3)C1	ZINC000097032928	563971196	/nfs/dbraw/zinc/97/11/96/563971196.db2.gz	UUEAZNFSWHFRAU-LBPRGKRZSA-N	-1	0	335.469	3.590	50	0		EHAARM
O=C([O-])c1ccc(-c2nccn2-c2cccc(-c3c[nH]cn3)c2)cc1	ZINC000082166860	563972866	/nfs/dbraw/zinc/97/28/66/563972866.db2.gz	ZLYXJPXLJFMZDM-UHFFFAOYSA-N	-1	0	330.347	3.628	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)c3ccc4cc[nH]c4c3)C2)cc1	ZINC000095360734	563976734	/nfs/dbraw/zinc/97/67/34/563976734.db2.gz	BRWNHGROPGKPET-GOSISDBHSA-N	-1	0	348.402	3.886	50	0		EHAARM
CC[C@@](C)(CC(=O)[O-])NC(=O)c1sc2nc(C)cc(C)c2c1C	ZINC000119562553	563982792	/nfs/dbraw/zinc/98/27/92/563982792.db2.gz	AIFHUMQBIUIPNX-KRWDZBQOSA-N	-1	0	334.441	3.595	50	0		EHAARM
C[C@H](NC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-])c1ccc(Cl)cc1Cl	ZINC000248268121	563995650	/nfs/dbraw/zinc/99/56/50/563995650.db2.gz	UJTNSTILXGVWSW-ZWKOPEQDSA-N	-1	0	342.222	3.838	50	0		EHAARM
O=C([O-])[C@H]1CC[C@H](C(=O)N2CCC[C@H]2/C=C/c2ccccc2)CC1	ZINC000253429186	563999238	/nfs/dbraw/zinc/99/92/38/563999238.db2.gz	CCVYJVPFPYGVPC-JRKMHLNQSA-N	-1	0	327.424	3.582	50	0		EHAARM
COc1cc(/C=C/c2ccc3ccccc3n2)ccc1OCC(=O)[O-]	ZINC000006787259	564033498	/nfs/dbraw/zinc/03/34/98/564033498.db2.gz	XWQKSSWWDZIVAJ-RMKNXTFCSA-N	-1	0	335.359	3.877	50	0		EHAARM
CC(C)[C@H](NC(=O)CC1(C(=O)[O-])CCCCCC1)c1ccccn1	ZINC000225404365	564046494	/nfs/dbraw/zinc/04/64/94/564046494.db2.gz	GQSVSCGUJAFNMS-KRWDZBQOSA-N	-1	0	332.444	3.710	50	0		EHAARM
Cc1ccc(-c2csc([N-]S(=O)(=O)c3ccccc3)n2)c(C)c1	ZINC000005925285	564057014	/nfs/dbraw/zinc/05/70/14/564057014.db2.gz	ULLQJLDMRLWVHC-UHFFFAOYSA-N	-1	0	344.461	3.650	50	0		EHAARM
Cc1ccc(NC(=O)[C@@H](SCC(=O)[O-])c2ccccc2)cc1C	ZINC000001402889	564065112	/nfs/dbraw/zinc/06/51/12/564065112.db2.gz	RTSNGAJLQKAACD-KRWDZBQOSA-N	-1	0	329.421	3.801	50	0		EHAARM
Cc1cc(CCCC(=O)N2CCC[C@@H](CCC(=O)[O-])C2)c(C)s1	ZINC000237604441	564083604	/nfs/dbraw/zinc/08/36/04/564083604.db2.gz	QJHRRNHSPKUUPS-HNNXBMFYSA-N	-1	0	337.485	3.791	50	0		EHAARM
CC[C@H](C)[C@@H](NC(=O)c1cc(F)c(F)c([O-])c1F)C(F)(F)F	ZINC000278223739	564084573	/nfs/dbraw/zinc/08/45/73/564084573.db2.gz	UQXHEBFDAIOSLM-ULHQUTTKSA-N	-1	0	329.240	3.516	50	0		EHAARM
CC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2C(F)(F)F)c1	ZINC000035670930	564086089	/nfs/dbraw/zinc/08/60/89/564086089.db2.gz	DXHXIQYOCNJCOL-UHFFFAOYSA-N	-1	0	343.326	3.709	50	0		EHAARM
Cc1cnc2c(cccc2S(=O)(=O)[N-]c2cc(F)ccc2C)c1	ZINC000013008202	564086491	/nfs/dbraw/zinc/08/64/91/564086491.db2.gz	XXQFUDZJRXTWBQ-UHFFFAOYSA-N	-1	0	330.384	3.792	50	0		EHAARM
C[S@](=O)Cc1ccccc1NC(=O)Nc1ccc(O)c(Cl)c1	ZINC000192266885	564090057	/nfs/dbraw/zinc/09/00/57/564090057.db2.gz	PCHYHWOTMSUDOY-QFIPXVFZSA-N	-1	0	338.816	3.568	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@@H](C(=O)[O-])[C@@H](C)CC)n1	ZINC000006555994	564092017	/nfs/dbraw/zinc/09/20/17/564092017.db2.gz	QULZSYPFJAEODG-IINYFYTJSA-N	-1	0	327.384	3.850	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2ccc(-c3ccccc3F)o2)C1	ZINC000237971249	564092148	/nfs/dbraw/zinc/09/21/48/564092148.db2.gz	HDPUGYLJFWOYGC-ZDUSSCGKSA-N	-1	0	345.370	3.803	50	0		EHAARM
Cc1ncc(-c2ccc(S(=O)(=O)[N-]c3ccc(F)cc3)s2)o1	ZINC000065003798	564099432	/nfs/dbraw/zinc/09/94/32/564099432.db2.gz	WWLCQIWMOCFVDI-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
CC(C)c1ccc(NC(=O)c2c([O-])c3sccc3[nH]c2=O)cc1	ZINC000065215247	564102832	/nfs/dbraw/zinc/10/28/32/564102832.db2.gz	CLEHPAGJOPQDDD-UHFFFAOYSA-N	-1	0	328.393	3.671	50	0		EHAARM
CCCCn1cc(S(=O)(=O)[N-]c2cccc(C)c2)c2cccnc21	ZINC000065242325	564103460	/nfs/dbraw/zinc/10/34/60/564103460.db2.gz	AGQNPMSQLCMBMP-UHFFFAOYSA-N	-1	0	343.452	3.946	50	0		EHAARM
Cc1ccc([C@H](C)C(=O)Nc2ccc(C)c(O[C@@H](C)C(=O)[O-])c2)cc1	ZINC000170067794	564105192	/nfs/dbraw/zinc/10/51/92/564105192.db2.gz	IOUHBHZLGHKSOZ-GJZGRUSLSA-N	-1	0	341.407	3.898	50	0		EHAARM
Cc1cccc(O)c1[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000194241507	564120449	/nfs/dbraw/zinc/12/04/49/564120449.db2.gz	LZTSMFUDIGQIAJ-UHFFFAOYSA-N	-1	0	331.315	3.520	50	0		EHAARM
NC(=O)c1cc2ccc(O)cc2oc1=Nc1cccc2ccccc21	ZINC000252669807	564124796	/nfs/dbraw/zinc/12/47/96/564124796.db2.gz	ISNKGXGHWITGHS-UHFFFAOYSA-N	-1	0	330.343	3.623	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC000253371014	564130359	/nfs/dbraw/zinc/13/03/59/564130359.db2.gz	ZMKQHAOCSWUPGS-RCBQFDQVSA-N	-1	0	335.831	3.547	50	0		EHAARM
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1cccc(C(=O)[O-])c1	ZINC000095349555	564139216	/nfs/dbraw/zinc/13/92/16/564139216.db2.gz	WKLJKQBZYLELCP-UHFFFAOYSA-N	-1	0	336.347	3.529	50	0		EHAARM
O=C([O-])C1CCC(c2ccc(I)cc2)CC1	ZINC000003108759	564155225	/nfs/dbraw/zinc/15/52/25/564155225.db2.gz	ZCUCCVBDVQWDLM-UHFFFAOYSA-N	-1	0	330.165	3.650	50	0		EHAARM
O=C([O-])[C@H]1CCCCN1Cc1nc(-c2c(F)cccc2F)cs1	ZINC000263563873	564163954	/nfs/dbraw/zinc/16/39/54/564163954.db2.gz	DPNRJENYAHONLL-CYBMUJFWSA-N	-1	0	338.379	3.527	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3c(n2)onc3C(C)C)c(F)c1	ZINC000008394152	564165056	/nfs/dbraw/zinc/16/50/56/564165056.db2.gz	OKDLDSIFZFFODX-UHFFFAOYSA-N	-1	0	330.315	3.859	50	0		EHAARM
COc1ccccc1-n1[n-]c(C)c(Cc2cccc(Cl)c2)c1=O	ZINC000009482860	564173880	/nfs/dbraw/zinc/17/38/80/564173880.db2.gz	KELJHAYVDVPAPN-UHFFFAOYSA-N	-1	0	328.799	3.727	50	0		EHAARM
CCCCOc1ccc(/C=C\C(=O)[O-])cc1I	ZINC000005895201	1027290715	/nfs/dbraw/zinc/29/07/15/1027290715.db2.gz	GRRQLQVOPZONQP-ALCCZGGFSA-N	-1	0	346.164	3.568	50	0		EHAARM
O=C(/C=C\c1ccco1)Nc1sc2c(c1C(=O)[O-])CCCCC2	ZINC000016696294	1035421181	/nfs/dbraw/zinc/42/11/81/1035421181.db2.gz	OBEFKLGRNKGNHE-HJWRWDBZSA-N	-1	0	331.393	3.960	50	0		EHAARM
Cc1ccc([C@@H]2CCN(C(=O)C[C@@H](C(=O)[O-])c3ccccc3)C2)cc1	ZINC000634944183	1137481085	/nfs/dbraw/zinc/48/10/85/1137481085.db2.gz	QFRKYIIWAJWXRS-RTBURBONSA-N	-1	0	337.419	3.569	50	0		EHAARM
Cc1nc(=O)c(-c2ccccc2)c(C)n1-c1cccc(/C=C\C(=O)[O-])c1	ZINC000005695752	1138483970	/nfs/dbraw/zinc/48/39/70/1138483970.db2.gz	LANYIAFGUJOXJZ-QXMHVHEDSA-N	-1	0	346.386	3.614	50	0		EHAARM
CC(C)Oc1c(Br)cc(C(=O)[O-])cc1Br	ZINC000098087290	219081661	/nfs/dbraw/zinc/08/16/61/219081661.db2.gz	JXBXPZOSSBPFEB-UHFFFAOYSA-N	-1	0	337.995	3.697	50	0		EHAARM
O=C(Nc1nc(-c2cccnc2)cs1)c1cc(Cl)ccc1[O-]	ZINC000022066303	202079091	/nfs/dbraw/zinc/07/90/91/202079091.db2.gz	WKKPAGJMFYKPKV-UHFFFAOYSA-N	-1	0	331.784	3.816	50	0		EHAARM
O=C([N-]c1nonc1-c1ccccc1)c1cc(-c2ccccc2)on1	ZINC000027794045	202160797	/nfs/dbraw/zinc/16/07/97/202160797.db2.gz	RNCSWOXXNCKYGK-UHFFFAOYSA-N	-1	0	332.319	3.644	50	0		EHAARM
O=C(NCc1ccccc1OC(F)F)c1ccc([O-])c(Cl)c1	ZINC000032889487	202240008	/nfs/dbraw/zinc/24/00/08/202240008.db2.gz	MDISOBSADXQLAI-UHFFFAOYSA-N	-1	0	327.714	3.577	50	0		EHAARM
Cc1cc([C@@H]2CC[C@H](C(=O)[O-])CN2C(=O)C2CCCC2)ccc1F	ZINC000034714557	202276903	/nfs/dbraw/zinc/27/69/03/202276903.db2.gz	UYHGDIJJRBCYTQ-RDJZCZTQSA-N	-1	0	333.403	3.689	50	0		EHAARM
COc1ccc(/C=C(\CC(=O)[O-])c2nc3ccccc3o2)cc1OC	ZINC000007913953	201056901	/nfs/dbraw/zinc/05/69/01/201056901.db2.gz	HPDDOUNPHBRJEY-UKTHLTGXSA-N	-1	0	339.347	3.860	50	0		EHAARM
O=S(=O)(Cc1ccccc1C(F)(F)F)c1nc2ccccc2[n-]1	ZINC000047940062	202588159	/nfs/dbraw/zinc/58/81/59/202588159.db2.gz	XTSUMYHLCZFZTN-UHFFFAOYSA-N	-1	0	340.326	3.556	50	0		EHAARM
Cc1sc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204925	201448012	/nfs/dbraw/zinc/44/80/12/201448012.db2.gz	WBTSRBHBHLSUHT-KGLIPLIRSA-N	-1	0	342.420	3.724	50	0		EHAARM
COCc1cccc(NC(=O)C[C@H](CC(=O)[O-])c2ccc(F)cc2)c1	ZINC000226753729	242112542	/nfs/dbraw/zinc/11/25/42/242112542.db2.gz	SZMTUMPZWSYRGO-OAHLLOKOSA-N	-1	0	345.370	3.559	50	0		EHAARM
O=C([O-])CCc1ccc(-c2ccccc2)n1NC(=O)c1cccs1	ZINC000004820936	201620714	/nfs/dbraw/zinc/62/07/14/201620714.db2.gz	VWVJEYKKXYWGRG-UHFFFAOYSA-N	-1	0	340.404	3.618	50	0		EHAARM
Cc1ncc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3)s2)o1	ZINC000065003960	202823051	/nfs/dbraw/zinc/82/30/51/202823051.db2.gz	YOINBDUENLBASJ-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CCOC(=O)c1cnc([N-]c2nc(-c3ccccc3)cs2)nc1C	ZINC000020673442	212162023	/nfs/dbraw/zinc/16/20/23/212162023.db2.gz	OGFGKGQLNFUXTN-UHFFFAOYSA-N	-1	0	340.408	3.829	50	0		EHAARM
O=C([O-])c1cc(-c2ccc(F)cc2)nc2c(-c3ccccc3)cnn21	ZINC000020616366	212155808	/nfs/dbraw/zinc/15/58/08/212155808.db2.gz	DUBXCPGFHGBMDC-UHFFFAOYSA-N	-1	0	333.322	3.901	50	0		EHAARM
CCc1ccc(OC)c(S(=O)(=O)[N-]c2cnc3ccccc3c2)c1	ZINC000072414247	203218954	/nfs/dbraw/zinc/21/89/54/203218954.db2.gz	AFXUSOZUMGMEJM-UHFFFAOYSA-N	-1	0	342.420	3.607	50	0		EHAARM
O=[N+]([O-])C=C1CN=C(c2ccccc2F)c2cc(Cl)ccc2[N-]1	ZINC000100169089	206217117	/nfs/dbraw/zinc/21/71/17/206217117.db2.gz	URZUOAKBDKORRD-LUAWRHEFSA-N	-1	0	331.734	3.860	50	0		EHAARM
O=C([O-])c1ccc([C@H]2SCCN2C(=O)CCc2ccccc2)cc1	ZINC000206579981	206565283	/nfs/dbraw/zinc/56/52/83/206565283.db2.gz	HPUXTGZELVTEMB-GOSISDBHSA-N	-1	0	341.432	3.592	50	0		EHAARM
CC(=O)Nc1ccc(NC(=O)[C@@](C)(CC(=O)[O-])C2CCCCC2)cc1	ZINC000169975452	206568538	/nfs/dbraw/zinc/56/85/38/206568538.db2.gz	AFHZWOPWIWMWOR-IBGZPJMESA-N	-1	0	346.427	3.645	50	0		EHAARM
C[C@H](C[NH2+][C@@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997531	207264084	/nfs/dbraw/zinc/26/40/84/207264084.db2.gz	VOOWOTDGINXRPG-BDJLRTHQSA-N	-1	0	341.294	3.534	50	0		EHAARM
CSc1cccc(NC(=O)C[C@@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000013253264	207367529	/nfs/dbraw/zinc/36/75/29/207367529.db2.gz	NSRDBPCWYWTKRJ-GOSISDBHSA-N	-1	0	329.421	3.780	50	0		EHAARM
C[C@](CC(=O)Nc1ccc(F)c(Cl)c1)(C(=O)[O-])c1ccccc1	ZINC000013252610	207368367	/nfs/dbraw/zinc/36/83/67/207368367.db2.gz	SWDWOJWJBDYSLL-QGZVFWFLSA-N	-1	0	335.762	3.850	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2c3ccccc3C(=O)N2Cc2ccccc2)o1	ZINC000334163153	258016059	/nfs/dbraw/zinc/01/60/59/258016059.db2.gz	MRABAWUKIDMVPO-SFHVURJKSA-N	-1	0	333.343	3.723	50	0		EHAARM
Cc1noc(C)c1[C@@H](C)NC(=O)c1c([O-])cc(Cl)cc1Cl	ZINC000080028095	564000987	/nfs/dbraw/zinc/00/09/87/564000987.db2.gz	ZARHJBBMKLEUBN-ZCFIWIBFSA-N	-1	0	329.183	3.795	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2ccc(OC(F)(F)F)cc2)CCCC1	ZINC000000069287	563214831	/nfs/dbraw/zinc/21/48/31/563214831.db2.gz	BWDAUPODJWCQRG-UHFFFAOYSA-N	-1	0	345.317	3.949	50	0		EHAARM
COc1ccccc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000000302278	563276120	/nfs/dbraw/zinc/27/61/20/563276120.db2.gz	QMRNYNJYQSJTAB-UHFFFAOYSA-N	-1	0	331.315	3.515	50	0		EHAARM
Cc1ccc(OCCn2c3ccccc3nc2SCC(=O)[O-])cc1	ZINC000000310946	563280988	/nfs/dbraw/zinc/28/09/88/563280988.db2.gz	VEQKRKNBWXIGHQ-UHFFFAOYSA-N	-1	0	342.420	3.600	50	0		EHAARM
CCOc1ccc2nc([N-]S(=O)(=O)c3cccs3)sc2c1	ZINC000000620236	563361627	/nfs/dbraw/zinc/36/16/27/563361627.db2.gz	OVBXVFMPVZOVCL-UHFFFAOYSA-N	-1	0	340.451	3.557	50	0		EHAARM
CCOc1ccc([C@H]2[C@H](C(=O)[O-])CCC(=O)N2C2CCCCC2)cc1	ZINC000001394558	563386336	/nfs/dbraw/zinc/38/63/36/563386336.db2.gz	IGAXLNWFPCVKLI-MJGOQNOKSA-N	-1	0	345.439	3.782	50	0		EHAARM
COc1cc2[n-]c(=S)n(CCC3=CCCCC3)c(=O)c2cc1OC	ZINC000003289695	563478773	/nfs/dbraw/zinc/47/87/73/563478773.db2.gz	FIBFYPXKMSYKFM-UHFFFAOYSA-N	-1	0	346.452	3.967	50	0		EHAARM
Cc1ccc(Oc2ccc(N3C[C@H](C(=O)[O-])CC3=O)cc2)cc1C	ZINC000004385068	563502077	/nfs/dbraw/zinc/50/20/77/563502077.db2.gz	HSLLPRNNVWFBGE-CQSZACIVSA-N	-1	0	325.364	3.533	50	0		EHAARM
Cc1nc(-c2ccc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])cc2)cs1	ZINC000006668240	563577474	/nfs/dbraw/zinc/57/74/74/563577474.db2.gz	PYYXNAANQQHGKL-GJZGRUSLSA-N	-1	0	342.420	3.724	50	0		EHAARM
COC(=O)c1ccc(/C=C/c2cc(C(=O)[O-])c3ccccc3n2)cc1	ZINC000008320931	563626144	/nfs/dbraw/zinc/62/61/44/563626144.db2.gz	NRCMQGJQHJQTQB-DHZHZOJOSA-N	-1	0	333.343	3.890	50	0		EHAARM
CCCc1nc([N-]c2nc3ccccc3o2)nc(C)c1C(=O)OCC	ZINC000009009761	563641524	/nfs/dbraw/zinc/64/15/24/563641524.db2.gz	JYZYGVPRZCICDF-UHFFFAOYSA-N	-1	0	340.383	3.799	50	0		EHAARM
COc1cccc(C(=O)[O-])c1OCc1ccc(Br)cc1	ZINC000011953876	563652213	/nfs/dbraw/zinc/65/22/13/563652213.db2.gz	UIKFIHSUMKOQTD-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
O=C([O-])[C@@H]1CCC[C@H](CC(=O)c2ccc(Br)cc2)C1	ZINC000043879453	563925937	/nfs/dbraw/zinc/92/59/37/563925937.db2.gz	WVEXAXHAJBDHPX-CMPLNLGQSA-N	-1	0	325.202	3.913	50	0		EHAARM
Cc1oc(-c2ccsc2)nc1CC(=O)Nc1cccc(C(=O)[O-])c1	ZINC000096480344	563955296	/nfs/dbraw/zinc/95/52/96/563955296.db2.gz	GWDITXWUDOUKDZ-UHFFFAOYSA-N	-1	0	342.376	3.591	50	0		EHAARM
O=C([O-])C[C@H](CNC(=O)OCc1ccccc1)c1ccc(Cl)cc1	ZINC000064038026	563956608	/nfs/dbraw/zinc/95/66/08/563956608.db2.gz	SFFATUNMKIFTNL-OAHLLOKOSA-N	-1	0	347.798	3.825	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)CSc1ccccc1)c1cccc(Cl)c1	ZINC000004686103	563964025	/nfs/dbraw/zinc/96/40/25/563964025.db2.gz	XZSUEMNKDLEHQX-OAHLLOKOSA-N	-1	0	349.839	3.764	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)CCCc1ccccc1)c1ccc(Cl)cc1	ZINC000004689764	563964401	/nfs/dbraw/zinc/96/44/01/563964401.db2.gz	IVGXJSCHQKQFOR-KRWDZBQOSA-N	-1	0	345.826	3.995	50	0		EHAARM
CC(C)(C(=O)[O-])[C@@H]1CCCN(C(=O)c2csc3c2CCCC3)C1	ZINC000097032927	563971195	/nfs/dbraw/zinc/97/11/95/563971195.db2.gz	UUEAZNFSWHFRAU-GFCCVEGCSA-N	-1	0	335.469	3.590	50	0		EHAARM
Cc1ccccc1OC1CCN(c2ccc(Cl)c(C(=O)[O-])n2)CC1	ZINC000095530080	563977541	/nfs/dbraw/zinc/97/75/41/563977541.db2.gz	UAEWPWBZQGFGEG-UHFFFAOYSA-N	-1	0	346.814	3.789	50	0		EHAARM
COc1ccc(-n2c([S-])nc3c(-c4ccccc4)c[nH]c3c2=O)cc1	ZINC000100071642	563982337	/nfs/dbraw/zinc/98/23/37/563982337.db2.gz	LJBDMWRSXZASFZ-UHFFFAOYSA-N	-1	0	349.415	3.678	50	0		EHAARM
Cc1ccc2c(c1)c(CC(=O)Nc1ccc(F)cc1)c(C(=O)[O-])n2C	ZINC000004821727	563983192	/nfs/dbraw/zinc/98/31/92/563983192.db2.gz	BQTFLHFBGWIXKN-UHFFFAOYSA-N	-1	0	340.354	3.505	50	0		EHAARM
CCOc1cccc([C@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])c1	ZINC000221039539	563989634	/nfs/dbraw/zinc/98/96/34/563989634.db2.gz	DKAUKPNHISACCN-CVEARBPZSA-N	-1	0	349.427	3.653	50	0		EHAARM
O=C([O-])CCc1c(-c2ccc(Br)cc2)nc2ccccn21	ZINC000005126805	563994471	/nfs/dbraw/zinc/99/44/71/563994471.db2.gz	SIXPQGMGDNVPQA-UHFFFAOYSA-N	-1	0	345.196	3.781	50	0		EHAARM
Cc1ccc(-c2cccc(NC(=O)[C@@H]3[C@H]4C=C[C@H](C4)[C@@H]3C(=O)[O-])c2)o1	ZINC000000510428	564020080	/nfs/dbraw/zinc/02/00/80/564020080.db2.gz	VAMWDEDFRKPIHI-JFTQMJAMSA-N	-1	0	337.375	3.716	50	0		EHAARM
CC(C)OCc1cccc(CNC(=O)c2ccc([O-])c(Cl)c2)c1	ZINC000048374130	564031576	/nfs/dbraw/zinc/03/15/76/564031576.db2.gz	DLXAQAOQCCCCBS-UHFFFAOYSA-N	-1	0	333.815	3.901	50	0		EHAARM
O=C([O-])CSc1nc2ccc(NC(=O)c3ccccc3)cc2s1	ZINC000022135490	564034239	/nfs/dbraw/zinc/03/42/39/564034239.db2.gz	UMJHXGNNNDYLQS-UHFFFAOYSA-N	-1	0	344.417	3.725	50	0		EHAARM
Cc1ccc(F)c(C(=O)NC2(CC(=O)[O-])CCCCC2)c1Cl	ZINC000223739048	564040737	/nfs/dbraw/zinc/04/07/37/564040737.db2.gz	VPXWONVXBLTUDO-UHFFFAOYSA-N	-1	0	327.783	3.695	50	0		EHAARM
C[C@H](Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(=O)[O-]	ZINC000006020163	564057650	/nfs/dbraw/zinc/05/76/50/564057650.db2.gz	ABOOPXYCKNFDNJ-JTQLQIEISA-N	-1	0	344.754	3.927	50	0	in-vivo	EHAARM
O=c1nc(CN(Cc2cccc(F)c2)C2CC2)[n-]c2ccsc21	ZINC000053231783	564074046	/nfs/dbraw/zinc/07/40/46/564074046.db2.gz	PLGQQFFLCUAPJT-UHFFFAOYSA-N	-1	0	329.400	3.701	50	0		EHAARM
Cc1cc(NC(=O)c2cc(Cl)ccc2[O-])ccc1N1CCCC1=O	ZINC000012822910	564074708	/nfs/dbraw/zinc/07/47/08/564074708.db2.gz	MSAVVDDCHBPJDO-UHFFFAOYSA-N	-1	0	344.798	3.733	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000016147672	564079865	/nfs/dbraw/zinc/07/98/65/564079865.db2.gz	YEYRVMSVHFSCGB-UHFFFAOYSA-N	-1	0	345.342	3.905	50	0		EHAARM
COc1cccc(NS(=O)(=O)c2ccc(OC)c3ccccc32)c1	ZINC000035685545	564085869	/nfs/dbraw/zinc/08/58/69/564085869.db2.gz	XYCYBIJLVKDANE-UHFFFAOYSA-N	-1	0	343.404	3.658	50	0		EHAARM
Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)c1ccc(C(=O)[O-])o1	ZINC000191648041	564087147	/nfs/dbraw/zinc/08/71/47/564087147.db2.gz	BVHRSRLTBDZBSC-JTQLQIEISA-N	-1	0	336.413	3.699	50	0		EHAARM
CCc1ccc2oc(-c3ccccc3)c(O[C@H](C)C(=O)[O-])c(=O)c2c1	ZINC000001987546	564090380	/nfs/dbraw/zinc/09/03/80/564090380.db2.gz	MOBRXFKKPLRVOT-GFCCVEGCSA-N	-1	0	338.359	3.874	50	0		EHAARM
O=S(=O)([N-]c1ccccc1)c1cccnc1Nc1ccc(F)cc1	ZINC000064757480	564096048	/nfs/dbraw/zinc/09/60/48/564096048.db2.gz	LTXPLZSHQRIQFP-UHFFFAOYSA-N	-1	0	343.383	3.765	50	0		EHAARM
CC1CCN(c2ccc(C(=O)[O-])cc2NC(=O)c2ccccc2)CC1	ZINC000064820594	564096576	/nfs/dbraw/zinc/09/65/76/564096576.db2.gz	BWXVIOANJQAFQD-UHFFFAOYSA-N	-1	0	338.407	3.873	50	0		EHAARM
CCc1cccc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)c1	ZINC000065031141	564099796	/nfs/dbraw/zinc/09/97/96/564099796.db2.gz	AALNQQWQGDGRJZ-UHFFFAOYSA-N	-1	0	334.422	3.766	50	0		EHAARM
CCc1ccc(-c2noc(-c3c([O-])c4cc(C)ccc4[nH]c3=O)n2)cc1	ZINC000065248636	564103347	/nfs/dbraw/zinc/10/33/47/564103347.db2.gz	DVVISJIPNJAHSG-UHFFFAOYSA-N	-1	0	347.374	3.822	50	0		EHAARM
CC[C@H](C)c1ccccc1NS(=O)(=O)c1cccc(C(=O)[O-])c1	ZINC000007057658	564103990	/nfs/dbraw/zinc/10/39/90/564103990.db2.gz	LHHDKRDUKMEJKJ-LBPRGKRZSA-N	-1	0	333.409	3.699	50	0		EHAARM
Cc1c(C(=O)N2CCCC[C@@H]2CC(=O)[O-])oc2c1c(C)ccc2C	ZINC000170071370	564105236	/nfs/dbraw/zinc/10/52/36/564105236.db2.gz	LCYOOHRKIRUXPD-CQSZACIVSA-N	-1	0	329.396	3.827	50	0		EHAARM
Cc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1ccc(C(C)C)cc1	ZINC000014097309	564112199	/nfs/dbraw/zinc/11/21/99/564112199.db2.gz	FPSXCVWBJHMQII-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(NCCCCCC(=O)[O-])n1	ZINC000002403160	564134577	/nfs/dbraw/zinc/13/45/77/564134577.db2.gz	LNCUPPIHAMGCAN-UHFFFAOYSA-N	-1	0	327.384	3.995	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@H]2c2cccc(F)c2)cc1	ZINC000225457926	564134956	/nfs/dbraw/zinc/13/49/56/564134956.db2.gz	QACNYQXWKWFVLQ-SFHVURJKSA-N	-1	0	341.382	3.820	50	0		EHAARM
O=C(Cc1coc2ccc3ccccc3c12)[N-]O[C@H]1CCCCO1	ZINC000095393492	564139389	/nfs/dbraw/zinc/13/93/89/564139389.db2.gz	LGDWDPQQICIZJW-SFHVURJKSA-N	-1	0	325.364	3.703	50	0		EHAARM
O=C([O-])CCc1ccc(NC(=O)C2(c3ccccc3F)CC2)cc1	ZINC000095425539	564140201	/nfs/dbraw/zinc/14/02/01/564140201.db2.gz	LBYAEVOMCBDKQB-UHFFFAOYSA-N	-1	0	327.355	3.513	50	0		EHAARM
Cc1cccc([C@@H]2CC(c3ccco3)=NN2C(=O)CCCC(=O)[O-])c1	ZINC000095946185	564142204	/nfs/dbraw/zinc/14/22/04/564142204.db2.gz	ACOMTAAAVYEXTI-INIZCTEOSA-N	-1	0	340.379	3.521	50	0		EHAARM
O=C([O-])Cc1cccc(NC(=O)Cc2ccccc2C(F)(F)F)c1	ZINC000095971408	564143413	/nfs/dbraw/zinc/14/34/13/564143413.db2.gz	SZYYDNJAMVSUBY-UHFFFAOYSA-N	-1	0	337.297	3.514	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)NC2CCC(C(F)(F)F)CC2)cc1	ZINC000096479751	564148622	/nfs/dbraw/zinc/14/86/22/564148622.db2.gz	APTANHLUFWPGDR-UHFFFAOYSA-N	-1	0	343.345	3.555	50	0		EHAARM
COc1cc2cccnc2c([N-]S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000008778892	564167421	/nfs/dbraw/zinc/16/74/21/564167421.db2.gz	GZAREAKFFOFSBH-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
COc1ccccc1-c1csc(NC(=O)[C@@H](C(=O)[O-])C(C)(C)C)n1	ZINC000656848615	954307113	/nfs/dbraw/zinc/30/71/13/954307113.db2.gz	GFVZJYZMXHRUCT-ZDUSSCGKSA-N	-1	0	348.424	3.504	50	0		EHAARM
Cc1ccc(C=C(Cl)c2nc3cc(C(=O)[O-])ccc3c(=O)[nH]2)s1	ZINC000005902611	956875191	/nfs/dbraw/zinc/87/51/91/956875191.db2.gz	XEDJAYLDKKGKAW-GHXNOFRVSA-N	-1	0	346.795	3.728	50	0		EHAARM
Cc1cc(C=NNc2nc(C)cc(=O)[nH]2)c(C)n1-c1ccc(C)cc1	ZINC000254821064	1014690586	/nfs/dbraw/zinc/69/05/86/1014690586.db2.gz	BRRPYGHUZUUCHA-UHFFFAOYSA-N	-1	0	335.411	3.653	50	0		EHAARM
Cc1nc(C=Cc2cc3ccccc3s2)[nH]c(=O)c1CCC(=O)[O-]	ZINC000588619095	1033524234	/nfs/dbraw/zinc/52/42/34/1033524234.db2.gz	JXPMGRGBSSCNRN-VURMDHGXSA-N	-1	0	340.404	3.893	50	0		EHAARM
Cc1ccc(/C=C2\SC(=S)N(CCCC(=O)[O-])C2=S)s1	ZINC000032929459	1122211638	/nfs/dbraw/zinc/21/16/38/1122211638.db2.gz	QBYJJYYFOOWOQD-YFHOEESVSA-N	-1	0	343.520	3.923	50	0		EHAARM
O=C([O-])[C@@H](CC(=O)N1CCc2sc(Cl)cc2C1)c1ccccc1	ZINC000634922861	1137481070	/nfs/dbraw/zinc/48/10/70/1137481070.db2.gz	MCYFDIHIBXOBHB-ZDUSSCGKSA-N	-1	0	349.839	3.545	50	0		EHAARM
O=c1nc(CN(Cc2ccc(F)cc2F)C2CC2)[n-]c2ccsc21	ZINC000053131908	214165643	/nfs/dbraw/zinc/16/56/43/214165643.db2.gz	OZZZOPBMDIRMQR-UHFFFAOYSA-N	-1	0	347.390	3.840	50	0		EHAARM
Oc1ccc(-c2n[n-]c(=S)n2-c2cccc3ncccc32)c(O)c1	ZINC000004710609	210256707	/nfs/dbraw/zinc/25/67/07/210256707.db2.gz	RANGGRFKXIPVTL-UHFFFAOYSA-N	-1	0	336.376	3.556	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C)cc1C	ZINC000004667302	210241122	/nfs/dbraw/zinc/24/11/22/210241122.db2.gz	JHZKJIUBFLDEDI-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
Cc1[n-]n2c(nc3c(c2=O)CCC3)c1-c1ccc(Br)cc1	ZINC000101083933	219116167	/nfs/dbraw/zinc/11/61/67/219116167.db2.gz	MHDVHMBCSPKLEU-UHFFFAOYSA-N	-1	0	344.212	3.662	50	0		EHAARM
CCCCCCC(O)=C1C(=O)[N-]C(=O)N(c2ccc(C)c(C)c2)C1=O	ZINC000101086368	219116376	/nfs/dbraw/zinc/11/63/76/219116376.db2.gz	KBELPFXZFCESID-FOCLMDBBSA-N	-1	0	344.411	3.669	50	0		EHAARM
Cc1cc(-c2c(C)[n-]n(-c3ccccc3)c2=O)n(-c2ccccc2)n1	ZINC000101356711	219124194	/nfs/dbraw/zinc/12/41/94/219124194.db2.gz	WYVQTSJWCZXENQ-IBGZPJMESA-N	-1	0	330.391	3.687	50	0		EHAARM
COc1ccc(OC)c(-c2cc(C(=O)[O-])c3cccc(OC)c3n2)c1	ZINC000004227724	210149094	/nfs/dbraw/zinc/14/90/94/210149094.db2.gz	PAHAAJMCNLGVPJ-UHFFFAOYSA-N	-1	0	339.347	3.626	50	0		EHAARM
O=C([O-])[C@@H]1[C@H](C(=O)Nc2ccc(Cl)c(Cl)c2)[C@@H]2CC[C@H]1C2	ZINC000004018757	210101057	/nfs/dbraw/zinc/10/10/57/210101057.db2.gz	HKQNHESHJCTPJH-BCWBERDBSA-N	-1	0	328.195	3.679	50	0		EHAARM
O=C([O-])c1cc(-c2cccnc2)nc2c(Br)cccc12	ZINC000003756625	210073021	/nfs/dbraw/zinc/07/30/21/210073021.db2.gz	YIDGHQSZKRIVOT-UHFFFAOYSA-N	-1	0	329.153	3.758	50	0		EHAARM
Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccccc1Br	ZINC000003458822	210045293	/nfs/dbraw/zinc/04/52/93/210045293.db2.gz	ROMCDGKAZKXZPP-UHFFFAOYSA-N	-1	0	344.205	3.697	50	0		EHAARM
COc1ccccc1CNC(=O)c1cc(Cl)c([O-])c(Cl)c1	ZINC000003372540	210021646	/nfs/dbraw/zinc/02/16/46/210021646.db2.gz	UXNWTGVNJQMTSD-UHFFFAOYSA-N	-1	0	326.179	3.638	50	0		EHAARM
Cc1cc(C)cc(S(=O)(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)c1	ZINC000067172783	215120897	/nfs/dbraw/zinc/12/08/97/215120897.db2.gz	DEASTGAWLNZTCA-UHFFFAOYSA-N	-1	0	349.358	3.668	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccccc2C(F)(F)F)cc1	ZINC000003307920	210002785	/nfs/dbraw/zinc/00/27/85/210002785.db2.gz	NMOHGMWCNKITMQ-UHFFFAOYSA-N	-1	0	331.315	3.515	50	0		EHAARM
C[C@@H](Oc1ccc2oc(-c3ccc(Cl)cc3)cc(=O)c2c1)C(=O)[O-]	ZINC000001978017	209809574	/nfs/dbraw/zinc/80/95/74/209809574.db2.gz	IUVREUUECMFWBG-SNVBAGLBSA-N	-1	0	344.750	3.965	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@H](C(=O)Nc2cc(Cl)cc(Cl)c2)C1	ZINC000039632464	213240715	/nfs/dbraw/zinc/24/07/15/213240715.db2.gz	QVKSDHWLOJFLMX-CHWSQXEVSA-N	-1	0	328.195	3.989	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000000268430	209512080	/nfs/dbraw/zinc/51/20/80/209512080.db2.gz	GLTIFAPRQURZFG-KGLIPLIRSA-N	-1	0	331.412	3.598	50	0		EHAARM
O=S(=O)([N-]c1cc(F)cc(F)c1)c1ccccc1Br	ZINC000028781244	212635833	/nfs/dbraw/zinc/63/58/33/212635833.db2.gz	BTRHCYHUWMIYFV-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
Cc1cc(C)c(S(=O)(=O)[N-]c2cccc3cccnc32)c(C)c1	ZINC000000175215	209465288	/nfs/dbraw/zinc/46/52/88/209465288.db2.gz	IVESLTHGGMMWTQ-UHFFFAOYSA-N	-1	0	326.421	3.961	50	0		EHAARM
Cc1oc2cc(O[C@@H](C)C(=O)[O-])ccc2c(=O)c1Oc1ccccc1	ZINC000000123797	209436183	/nfs/dbraw/zinc/43/61/83/209436183.db2.gz	FYIKHLLVPYVBTH-LBPRGKRZSA-N	-1	0	340.331	3.746	50	0	biogenic	EHAARM
CCc1ncc(CN(C)C(=O)c2ccc3[n-]c(=S)oc3c2)s1	ZINC000073498505	216390093	/nfs/dbraw/zinc/39/00/93/216390093.db2.gz	DLJCKQFSRAUZGJ-UHFFFAOYSA-N	-1	0	333.438	3.781	50	0		EHAARM
CCc1nc2sc([C@H](c3cccs3)N3CCCCC3)c([O-])n2n1	ZINC000022853153	212329552	/nfs/dbraw/zinc/32/95/52/212329552.db2.gz	DRPHTTUZPPPRLI-ZDUSSCGKSA-N	-1	0	348.497	3.696	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000226760789	242115821	/nfs/dbraw/zinc/11/58/21/242115821.db2.gz	ATKSNULKWZHSKM-UHFFFAOYSA-N	-1	0	332.359	3.623	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cnc(-c3ccccc3)s2)C1	ZINC000237973718	242881825	/nfs/dbraw/zinc/88/18/25/242881825.db2.gz	OEFITTPOAFWXHD-ZDUSSCGKSA-N	-1	0	344.436	3.527	50	0		EHAARM
O=C([O-])C1CCN(C(=O)CCCc2ccc(Cl)c(Cl)c2)CC1	ZINC000238101429	242932649	/nfs/dbraw/zinc/93/26/49/242932649.db2.gz	BLEVWZJDMKAHMS-UHFFFAOYSA-N	-1	0	344.238	3.639	50	0		EHAARM
Cc1cc(Cl)cc2c1ncc(C(=O)[O-])c2Nc1ccc(O)cc1	ZINC000019795507	212068593	/nfs/dbraw/zinc/06/85/93/212068593.db2.gz	PMBSEXLXDXGRDZ-UHFFFAOYSA-N	-1	0	328.755	3.766	50	0		EHAARM
CCc1c(C)nc2[n-]c(SCc3ccccc3Cl)nn2c1=O	ZINC000018240909	211992257	/nfs/dbraw/zinc/99/22/57/211992257.db2.gz	YFODNVBZNLVQTH-UHFFFAOYSA-N	-1	0	334.832	3.646	50	0		EHAARM
Cc1cccc([C@@H]2CC(c3cccs3)=NN2C(=O)CCC(=O)[O-])c1	ZINC000079106323	217195837	/nfs/dbraw/zinc/19/58/37/217195837.db2.gz	MAIOQASIRVPYGQ-HNNXBMFYSA-N	-1	0	342.420	3.599	50	0		EHAARM
O=C([O-])c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1	ZINC000012505367	211395024	/nfs/dbraw/zinc/39/50/24/211395024.db2.gz	XDUALWDFCVYFFX-UHFFFAOYSA-N	-1	0	339.298	3.713	50	0		EHAARM
Cc1ccc(NC(=O)Cc2cccc3c2cccc3[S@](=O)[O-])cc1	ZINC000012461631	211388695	/nfs/dbraw/zinc/38/86/95/211388695.db2.gz	KSHCLIFFNQVIBC-UHFFFAOYSA-N	-1	0	339.416	3.910	50	0		EHAARM
Cc1ccc([C@H](C(=O)[O-])N2CCN(c3ccc(C)c(C)c3)CC2)cc1	ZINC000091690106	218047860	/nfs/dbraw/zinc/04/78/60/218047860.db2.gz	DUKSJSLNWPJDIV-HXUWFJFHSA-N	-1	0	338.451	3.560	50	0		EHAARM
CCOc1ccccc1CSCc1nc(=O)c2sccc2[n-]1	ZINC000009995877	211139597	/nfs/dbraw/zinc/13/95/97/211139597.db2.gz	MICVHWZIMQWMCE-UHFFFAOYSA-N	-1	0	332.450	3.817	50	0		EHAARM
Cc1csc([C@H](C2CC2)n2c(=O)c3ccccc3[n-]c2=S)n1	ZINC000095402818	218337604	/nfs/dbraw/zinc/33/76/04/218337604.db2.gz	UREOHHUVMNYKKP-ZDUSSCGKSA-N	-1	0	329.450	3.823	50	0		EHAARM
Cc1ccc(C)c(S(=O)(=O)Nc2cccc3ccc(O)cc32)c1	ZINC000095431812	218373545	/nfs/dbraw/zinc/37/35/45/218373545.db2.gz	LYDBCQDAJTWLAA-UHFFFAOYSA-N	-1	0	327.405	3.963	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000004898196	210315475	/nfs/dbraw/zinc/31/54/75/210315475.db2.gz	MMLMUEBHVMHOEP-ROUUACIJSA-N	-1	0	337.419	3.783	50	0		EHAARM
CCOc1ccc(Cl)cc1S(=O)(=O)Nc1ccccc1F	ZINC000004857000	210303022	/nfs/dbraw/zinc/30/30/22/210303022.db2.gz	DNQXUYMTEZUISS-UHFFFAOYSA-N	-1	0	329.780	3.679	50	0		EHAARM
CC(C)(C)c1ccc(OCC(=O)Nc2ccc(CC(=O)[O-])cc2)cc1	ZINC000004868817	210308840	/nfs/dbraw/zinc/30/88/40/210308840.db2.gz	PUNFTHNDCYHYIG-UHFFFAOYSA-N	-1	0	341.407	3.629	50	0		EHAARM
Cc1cccc(C)c1NC(=O)c1c([O-])c2cccc3c2n(c1=O)[C@H](C)C3	ZINC000299738214	257986177	/nfs/dbraw/zinc/98/61/77/257986177.db2.gz	KBTMJHKAXHWMEZ-CYBMUJFWSA-N	-1	0	348.402	3.693	50	0		EHAARM
Cc1ccc2nc(N3CCC(C(=O)[O-])CC3)nc(-c3ccccc3)c2c1	ZINC000004326675	135663547	/nfs/dbraw/zinc/66/35/47/135663547.db2.gz	XGZBNKCIQQIWER-UHFFFAOYSA-N	-1	0	347.418	3.906	50	0		EHAARM
O=S(=O)([N-]c1cccc(Br)c1)c1cc(F)cc(F)c1	ZINC000016100047	563803570	/nfs/dbraw/zinc/80/35/70/563803570.db2.gz	JLZNNLMWWFZCHC-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
C[C@@H](Sc1nc(-c2ccccc2)cc(C(F)(F)F)n1)C(=O)[O-]	ZINC000000268089	563269372	/nfs/dbraw/zinc/26/93/72/563269372.db2.gz	WUJPUDGNAYCPGB-MRVPVSSYSA-N	-1	0	328.315	3.728	50	0		EHAARM
O=S(=O)([N-]c1nc2cc(Cl)c(Cl)cc2[nH]1)c1ccccc1	ZINC000000382823	563300619	/nfs/dbraw/zinc/30/06/19/563300619.db2.gz	NZRSTRUSBREQFC-UHFFFAOYSA-N	-1	0	342.207	3.671	50	0		EHAARM
O=C([O-])/C=C/c1c(-c2ccc(Br)cc2)nc2ccccn12	ZINC000002510956	563435241	/nfs/dbraw/zinc/43/52/41/563435241.db2.gz	LKOMYOGCCIFNPJ-CMDGGOBGSA-N	-1	0	343.180	3.862	50	0		EHAARM
O=C([O-])COc1ccccc1[C@@H]1CC(=O)Nc2ccc3ccccc3c21	ZINC000002886487	563461769	/nfs/dbraw/zinc/46/17/69/563461769.db2.gz	LCMAXLRPWMKKOM-INIZCTEOSA-N	-1	0	347.370	3.777	50	0		EHAARM
O=S(=O)(Nc1ccccc1Cl)c1ccc2oc(=S)[n-]c2c1	ZINC000006508253	563570642	/nfs/dbraw/zinc/57/06/42/563570642.db2.gz	AYQGLNAXPQJGBZ-UHFFFAOYSA-N	-1	0	340.813	3.571	50	0		EHAARM
CCc1ccc([C@@H]2C[C@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000013959105	563733093	/nfs/dbraw/zinc/73/30/93/563733093.db2.gz	GFBPCMJFMGYTKE-WCQYABFASA-N	-1	0	339.317	3.804	50	0		EHAARM
Cc1ccccc1N1C(=O)c2cccc3c(C(=O)[O-])ccc(c32)C1=O	ZINC000000097004	563743610	/nfs/dbraw/zinc/74/36/10/563743610.db2.gz	SQAIVGHGCRVFGY-UHFFFAOYSA-N	-1	0	331.327	3.647	50	0		EHAARM
Cc1ccc(-c2cc(C(=O)[N-]c3nnc(C(C)C)s3)on2)cc1	ZINC000032833427	563759718	/nfs/dbraw/zinc/75/97/18/563759718.db2.gz	LNAPMBHSZNLZDV-UHFFFAOYSA-N	-1	0	328.397	3.877	50	0		EHAARM
CCc1c([O-])nc(SCc2ccccc2)n(-c2ccccc2)c1=O	ZINC000016513210	563814008	/nfs/dbraw/zinc/81/40/08/563814008.db2.gz	PEUURWCONUAIEX-UHFFFAOYSA-N	-1	0	338.432	3.793	50	0		EHAARM
C[C@H](c1cc2ccccc2o1)N(C)Cc1nc(=O)c2sccc2[n-]1	ZINC000030005543	563909183	/nfs/dbraw/zinc/90/91/83/563909183.db2.gz	XPBMANWMAUCSTO-LLVKDONJSA-N	-1	0	339.420	3.924	50	0		EHAARM
O=S(=O)([N-]c1cccnc1)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000000464508	563917633	/nfs/dbraw/zinc/91/76/33/563917633.db2.gz	SHOLLWAGMFQDPW-UHFFFAOYSA-N	-1	0	336.722	3.555	50	0		EHAARM
CCc1nc(/C(C#N)=C\c2cccc(O[C@@H](C)C(=O)[O-])c2)sc1C	ZINC000070006119	563935892	/nfs/dbraw/zinc/93/58/92/563935892.db2.gz	FCYJCNVQEYXYTJ-KSSSLANASA-N	-1	0	342.420	3.930	50	0		EHAARM
C[C@@H](c1cccs1)N(C)C(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000058417515	563945509	/nfs/dbraw/zinc/94/55/09/563945509.db2.gz	BJHQSJKKMKBSBU-VIFPVBQESA-N	-1	0	345.449	3.893	50	0		EHAARM
O=C(Nc1cccc(Cl)c1[O-])c1cc(N2CCCC2=O)ccc1F	ZINC000096436515	563952576	/nfs/dbraw/zinc/95/25/76/563952576.db2.gz	NODUVKMKADHOFQ-UHFFFAOYSA-N	-1	0	348.761	3.564	50	0		EHAARM
Cc1noc(C)c1[C@H](C)CNC(=O)c1c([O-])cc(Cl)cc1Cl	ZINC000096483795	563955378	/nfs/dbraw/zinc/95/53/78/563955378.db2.gz	AIHCLRRWOSIAED-SSDOTTSWSA-N	-1	0	343.210	3.837	50	0		EHAARM
CCc1[nH]c2ccc(CNC(=O)c3ccc(O)c(OC)c3)cc2c1C	ZINC000071721655	563964799	/nfs/dbraw/zinc/96/47/99/563964799.db2.gz	PSOAHUJRVWTULD-UHFFFAOYSA-N	-1	0	338.407	3.683	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)Cc1csc(C(C)(C)C)n1	ZINC000097018378	563966757	/nfs/dbraw/zinc/96/67/57/563966757.db2.gz	DQVHNFWETCGUDN-UHFFFAOYSA-N	-1	0	332.425	3.628	50	0		EHAARM
CC(C)(Oc1ccc2c(c1)CC/C(=C\c1cccnc1)C2=O)C(=O)[O-]	ZINC000071853626	563971879	/nfs/dbraw/zinc/97/18/79/563971879.db2.gz	PHFGQSKQSKPLPW-XNTDXEJSSA-N	-1	0	337.375	3.536	50	0		EHAARM
Cc1ccc(S(=O)(=O)c2c[n-]c3c(F)cccc3c2=O)cc1C	ZINC000096511489	563980838	/nfs/dbraw/zinc/98/08/38/563980838.db2.gz	CZBNZGDBKDUQCC-UHFFFAOYSA-N	-1	0	331.368	3.529	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@H](Cc2ccc(Cl)cc2)[C@H]1C(=O)[O-]	ZINC000221038504	563989629	/nfs/dbraw/zinc/98/96/29/563989629.db2.gz	WGOZBWNNXCXPKD-OCCSQVGLSA-N	-1	0	339.819	3.593	50	0		EHAARM
Cc1c(Cl)cccc1NC(=O)C[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000000266829	563989977	/nfs/dbraw/zinc/98/99/77/563989977.db2.gz	COZVUYJGDRAAMY-CQSZACIVSA-N	-1	0	331.799	3.921	50	0		EHAARM
O=C([N-]C1(c2csc([C@@H]3CCCO3)n2)CCCCC1)C(F)(F)F	ZINC000408524396	563993271	/nfs/dbraw/zinc/99/32/71/563993271.db2.gz	TZAFVXLYIVCVFP-JTQLQIEISA-N	-1	0	348.390	3.833	50	0		EHAARM
O=C([O-])CC1(c2ccc3ccccc3c2)C(=O)c2ccccc2C1=O	ZINC000220134385	563999645	/nfs/dbraw/zinc/99/96/45/563999645.db2.gz	MBVOZCQEVMTCLC-UHFFFAOYSA-N	-1	0	330.339	3.632	50	0		EHAARM
Cc1cc(C)c([N-]S(=O)(=O)c2cccc3cccnc32)c(C)c1	ZINC000000516935	564020457	/nfs/dbraw/zinc/02/04/57/564020457.db2.gz	BONBZRINXOFXQH-UHFFFAOYSA-N	-1	0	326.421	3.961	50	0		EHAARM
CC(C)c1nc2cc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])ccc2o1	ZINC000046834813	564025386	/nfs/dbraw/zinc/02/53/86/564025386.db2.gz	JLBYQXXZLIBVSW-QWHCGFSZSA-N	-1	0	328.368	3.557	50	0		EHAARM
Cc1ccccc1[C@H](C)NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000047931914	564029817	/nfs/dbraw/zinc/02/98/17/564029817.db2.gz	RZTINOUUSCBECY-NSHDSACASA-N	-1	0	339.420	3.797	50	0		EHAARM
COc1cc(C(=O)/C=C\c2cccs2)ccc1SCC(=O)[O-]	ZINC000096256286	564049719	/nfs/dbraw/zinc/04/97/19/564049719.db2.gz	GNFSSIBEDLHWHJ-WAYWQWQTSA-N	-1	0	334.418	3.830	50	0		EHAARM
O=C([O-])Cc1ccccc1NC(=O)[C@@H]1C[C@]12CCCc1ccccc12	ZINC000238084345	564051513	/nfs/dbraw/zinc/05/15/13/564051513.db2.gz	LLSCCVUOCFYHFJ-UWJYYQICSA-N	-1	0	335.403	3.546	50	0		EHAARM
Cc1cc([N-]S(=O)(=O)c2cc(Cl)c(Cl)cc2Cl)no1	ZINC000002380858	564074839	/nfs/dbraw/zinc/07/48/39/564074839.db2.gz	HFFXLYHRNRKAPM-UHFFFAOYSA-N	-1	0	341.603	3.744	50	0	in-vitro	EHAARM
O=C([O-])CCN1c2ccccc2S[C@@H](c2ccccc2)CC1=O	ZINC000075249353	564081181	/nfs/dbraw/zinc/08/11/81/564081181.db2.gz	AAISIVGGBORMIZ-MRXNPFEDSA-N	-1	0	327.405	3.731	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c1C	ZINC000075351823	564082033	/nfs/dbraw/zinc/08/20/33/564082033.db2.gz	XBPMDZZRFWTKSE-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
Cc1sc(-c2ccno2)cc1S(=O)(=O)[N-]c1cccc(F)c1	ZINC000075436381	564084705	/nfs/dbraw/zinc/08/47/05/564084705.db2.gz	VJOZGNVQAIDRST-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
Cc1ccc(-c2noc(-c3c([O-])c4ccccc4[nH]c3=O)n2)cc1C	ZINC000075536601	564087923	/nfs/dbraw/zinc/08/79/23/564087923.db2.gz	ZKWVRBAOCHFRTJ-UHFFFAOYSA-N	-1	0	333.347	3.568	50	0		EHAARM
O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)c1ccc([O-])c(Cl)c1	ZINC000143557778	564093446	/nfs/dbraw/zinc/09/34/46/564093446.db2.gz	QIRXZCKVNGEQES-QAPCUYQASA-N	-1	0	345.826	3.943	50	0		EHAARM
CC[C@H](NC(=O)[C@@H](C)c1ccc(-c2ccccc2)c(F)c1)C(=O)[O-]	ZINC000006760088	564097302	/nfs/dbraw/zinc/09/73/02/564097302.db2.gz	ZQADHETUQGSDGN-SJCJKPOMSA-N	-1	0	329.371	3.576	50	0		EHAARM
CC(=O)c1cccc(NC(=O)[C@@](C)(CC(=O)[O-])C2CCCCC2)c1	ZINC000169975464	564104129	/nfs/dbraw/zinc/10/41/29/564104129.db2.gz	OLGYTFTZAUMNAF-IBGZPJMESA-N	-1	0	331.412	3.889	50	0		EHAARM
Cc1ccc(O)c(S(=O)(=O)[N-]c2ccc3c4c(cccc42)CC3)c1	ZINC000065564926	564107061	/nfs/dbraw/zinc/10/70/61/564107061.db2.gz	NGZZBXNJZFASQV-UHFFFAOYSA-N	-1	0	339.416	3.753	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc2nc(C)sc2c1	ZINC000007419829	564108197	/nfs/dbraw/zinc/10/81/97/564108197.db2.gz	UPIYWLQVANIBCZ-UHFFFAOYSA-N	-1	0	348.449	3.723	50	0		EHAARM
Cc1c2cccc(C)c2oc1C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000237752101	564117770	/nfs/dbraw/zinc/11/77/70/564117770.db2.gz	FFIAXWGHWJXUHE-CQSZACIVSA-N	-1	0	329.396	3.767	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)C1	ZINC000195552067	564123719	/nfs/dbraw/zinc/12/37/19/564123719.db2.gz	UYFZCNMOEGGLPX-APHBMKBZSA-N	-1	0	335.831	3.547	50	0		EHAARM
Cc1cn2c(nc(C(C)C)c2S(=O)(=O)[N-]c2ccc(C)cc2)s1	ZINC000096101762	564145252	/nfs/dbraw/zinc/14/52/52/564145252.db2.gz	PGXJZSXHPOYCQO-UHFFFAOYSA-N	-1	0	349.481	3.937	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)/C=C\c2ccc(Cl)s2)C1	ZINC000218456712	564160024	/nfs/dbraw/zinc/16/00/24/564160024.db2.gz	YDTCJJHASGYGEY-JPVGGKMYSA-N	-1	0	327.833	3.518	50	0		EHAARM
COc1ncc(-c2ncc(C(F)(F)F)cc2Cl)cc1C(=O)[O-]	ZINC000261494727	568419341	/nfs/dbraw/zinc/41/93/41/568419341.db2.gz	AOOSPGPDJSCABG-UHFFFAOYSA-N	-1	0	332.665	3.523	50	0		EHAARM
O=C([O-])[C@H]1C[C@H](NC(=O)C[C@@H]2CCc3ccccc32)c2ccccc21	ZINC000653330307	954159848	/nfs/dbraw/zinc/15/98/48/954159848.db2.gz	CRNFRWADMYJIOW-JVPBZIDWSA-N	-1	0	335.403	3.536	50	0		EHAARM
O=C([O-])[C@H]1C[C@@H](NC(=O)C[C@@H]2CCc3ccccc32)c2ccccc21	ZINC000653330309	954160051	/nfs/dbraw/zinc/16/00/51/954160051.db2.gz	CRNFRWADMYJIOW-ZOCIIQOWSA-N	-1	0	335.403	3.536	50	0		EHAARM
Cc1ccc(C(=O)CCC(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000075288724	957742154	/nfs/dbraw/zinc/74/21/54/957742154.db2.gz	NHYJHLXNFNFZFI-UHFFFAOYSA-N	-1	0	345.782	3.948	50	0		EHAARM
C[C@@H](Cc1ccc(NC(=O)[C@@H]2CCc3cc(F)ccc32)cc1)C(=O)[O-]	ZINC000563451651	974533176	/nfs/dbraw/zinc/53/31/76/974533176.db2.gz	ZZOYREMPIFTHOO-KPZWWZAWSA-N	-1	0	341.382	3.757	50	0		EHAARM
CCn1cc(C2CCN(C(=O)c3ccc(C(C)C)cc3O)CC2)cn1	ZINC000265674017	1034206991	/nfs/dbraw/zinc/20/69/91/1034206991.db2.gz	FIPUYUVEEWPBJJ-UHFFFAOYSA-N	-1	0	341.455	3.752	50	0		EHAARM
Cc1ccc2nc(C)c(C(=O)N3CCCC[C@H]3CCC(=O)[O-])cc2c1	ZINC000055392898	214317260	/nfs/dbraw/zinc/31/72/60/214317260.db2.gz	MFWHADRGQPSTOV-INIZCTEOSA-N	-1	0	340.423	3.711	50	0		EHAARM
CCOc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(C)cc1	ZINC000004660782	210240099	/nfs/dbraw/zinc/24/00/99/210240099.db2.gz	PEJMFEWFMCBGAQ-UHFFFAOYSA-N	-1	0	325.817	3.848	50	0		EHAARM
CCCc1nc2c(-c3ccc(OC)cc3)c(C)[n-]n2c(=O)c1Cl	ZINC000100648876	219103460	/nfs/dbraw/zinc/10/34/60/219103460.db2.gz	SPBQLGXMDQHFOI-UHFFFAOYSA-N	-1	0	331.803	3.613	50	0		EHAARM
CC(C)(C)c1nc2cc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])ccc2o1	ZINC000046834807	213811040	/nfs/dbraw/zinc/81/10/40/213811040.db2.gz	SHVUYRASNIKGOH-CHWSQXEVSA-N	-1	0	342.395	3.731	50	0		EHAARM
Cc1c2cc3c(cc2oc(=O)c1CCC(=O)[O-])oc1c3CCCC1	ZINC000004045126	210107608	/nfs/dbraw/zinc/10/76/08/210107608.db2.gz	PLOVHSNHAJMCGX-UHFFFAOYSA-N	-1	0	326.348	3.744	50	0	biogenic	EHAARM
Cc1c(C)c2ccc(O[C@H](C(=O)[O-])c3ccccc3)c(C)c2oc1=O	ZINC000004039262	210106558	/nfs/dbraw/zinc/10/65/58/210106558.db2.gz	KQIOIIZICLVPHO-SFHVURJKSA-N	-1	0	338.359	3.923	50	0	biogenic	EHAARM
O=C([O-])C[C@@H](NC(=O)CCc1ccccc1)c1ccc(Cl)cc1	ZINC000003628934	210068247	/nfs/dbraw/zinc/06/82/47/210068247.db2.gz	CQMBWBPNWXHUKA-MRXNPFEDSA-N	-1	0	331.799	3.605	50	0		EHAARM
COc1ccc([C@@H]2Nc3nonc3N=C3CC(C)(C)CC(=O)C32)cc1	ZINC000102742134	219226403	/nfs/dbraw/zinc/22/64/03/219226403.db2.gz	NLQQWYLFCGASAB-HNNXBMFYSA-N	-1	0	340.383	3.950	50	0		EHAARM
CCCCC[C@H]1c2[nH]c3ccccc3c2C[C@@H](C(=O)[O-])N1C(C)=O	ZINC000003024596	209954865	/nfs/dbraw/zinc/95/48/65/209954865.db2.gz	LKEGYTFONVXESR-IRXDYDNUSA-N	-1	0	328.412	3.647	50	0		EHAARM
Cc1cc(C(=O)N2CC[C@@H](c3ccccc3C(=O)[O-])C2)ccc1Cl	ZINC000072172572	216063963	/nfs/dbraw/zinc/06/39/63/216063963.db2.gz	OBLFCSULSDYDDG-CQSZACIVSA-N	-1	0	343.810	3.976	50	0		EHAARM
Cc1cc(OCC(=O)Nc2ccccc2C(=O)[O-])cc(C)c1Cl	ZINC000000367813	209554796	/nfs/dbraw/zinc/55/47/96/209554796.db2.gz	FUHMUDGIYDWPFO-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
O=C(CSc1nc2ccccc2s1)Nc1cccc(C(=O)[O-])c1	ZINC000000181628	209469251	/nfs/dbraw/zinc/46/92/51/209469251.db2.gz	YAKFLPDNDTVXBZ-UHFFFAOYSA-N	-1	0	344.417	3.725	50	0		EHAARM
CC[C@H](C)c1ccc(O)c(NC(=O)Cc2ccccc2C(=O)[O-])c1	ZINC000072401470	216194263	/nfs/dbraw/zinc/19/42/63/216194263.db2.gz	VTAIQMQZOJDRLG-LBPRGKRZSA-N	-1	0	327.380	3.785	50	0		EHAARM
CC(=O)c1ccc(NC(=O)c2c[n-]c3ccc(Cl)cc3c2=O)cc1	ZINC000023118795	212349781	/nfs/dbraw/zinc/34/97/81/212349781.db2.gz	PDNSXMTYKJTDIC-UHFFFAOYSA-N	-1	0	340.766	3.636	50	0		EHAARM
CSc1ccc([C@@H]2[C@H](C(=O)[O-])CC(=O)N2Cc2ccccc2)cc1	ZINC000022129927	212277893	/nfs/dbraw/zinc/27/78/93/212277893.db2.gz	UJHRKLBHWDTEQV-SJLPKXTDSA-N	-1	0	341.432	3.583	50	0		EHAARM
O=C([O-])Cc1cccc(NC(=O)/C=C/c2nc3ccccc3s2)c1	ZINC000195542607	240994986	/nfs/dbraw/zinc/99/49/86/240994986.db2.gz	UBFVQEBGXGEOFC-CMDGGOBGSA-N	-1	0	338.388	3.575	50	0		EHAARM
Cc1cc(C(=O)N2CCC(C(=O)[O-])CC2)c(C)n1C1CCCCC1	ZINC000237676418	242749100	/nfs/dbraw/zinc/74/91/00/242749100.db2.gz	UOVJKLAMWQVFFP-UHFFFAOYSA-N	-1	0	332.444	3.547	50	0		EHAARM
Cc1cc(C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)c(Cl)cc1F	ZINC000237688725	242753793	/nfs/dbraw/zinc/75/37/93/242753793.db2.gz	PMNFMTOSBJXWAS-NSHDSACASA-N	-1	0	327.783	3.505	50	0		EHAARM
O=C([O-])C[C@@H]1CCCCN1C(=O)c1ccc(-c2cccc(F)c2)cc1	ZINC000244884023	243097988	/nfs/dbraw/zinc/09/79/88/243097988.db2.gz	YDTQPSKGUMLSED-SFHVURJKSA-N	-1	0	341.382	3.962	50	0		EHAARM
Cc1sc2ncnc(NCCC(=O)[O-])c2c1-c1ccc(C)cc1	ZINC000020314064	212118013	/nfs/dbraw/zinc/11/80/13/212118013.db2.gz	WKNHHKCZWREATC-UHFFFAOYSA-N	-1	0	327.409	3.862	50	0		EHAARM
COc1ccc(S(=O)(=O)[N-]c2cc[nH+]cc2C)c(Cl)c1Cl	ZINC000078936133	217151935	/nfs/dbraw/zinc/15/19/35/217151935.db2.gz	BHZIXIMVIMBZSZ-UHFFFAOYSA-N	-1	0	347.223	3.506	50	0		EHAARM
Cc1cc(C(=O)[O-])ccc1NC(=O)Cc1ccc(Br)cc1	ZINC000013391294	211553961	/nfs/dbraw/zinc/55/39/61/211553961.db2.gz	CIDLRVQFKJCIIB-UHFFFAOYSA-N	-1	0	348.196	3.637	50	0		EHAARM
COc1cccc(NC(=O)[C@H](C)Sc2ccccc2C(=O)[O-])c1	ZINC000012797278	211460451	/nfs/dbraw/zinc/46/04/51/211460451.db2.gz	FHBUSYQJUKIZQV-NSHDSACASA-N	-1	0	331.393	3.513	50	0		EHAARM
O=C([O-])c1cc(-c2cccs2)nc2c1cnn2-c1ccccc1F	ZINC000012396021	211368289	/nfs/dbraw/zinc/36/82/89/211368289.db2.gz	RDWJCUHBJUSARG-UHFFFAOYSA-N	-1	0	339.351	3.986	50	0		EHAARM
CCOc1cc(/C=C/C(=O)[O-])cc(Br)c1OCC(C)C	ZINC000012394692	211367769	/nfs/dbraw/zinc/36/77/69/211367769.db2.gz	UHJWEHULFISUOW-AATRIKPKSA-N	-1	0	343.217	3.980	50	0		EHAARM
COc1ccc2c(c1)oc(C)c(Oc1ccc(C(=O)[O-])cc1)c2=O	ZINC000011865363	211261434	/nfs/dbraw/zinc/26/14/34/211261434.db2.gz	XGWJEAWRFNRTSQ-UHFFFAOYSA-N	-1	0	326.304	3.601	50	0	biogenic	EHAARM
CC[C@](C)(CC(=O)[O-])CC(=O)Nc1ccc(Br)cc1F	ZINC000009386809	211079429	/nfs/dbraw/zinc/07/94/29/211079429.db2.gz	CRVWIGDTWSOHGX-AWEZNQCLSA-N	-1	0	346.196	3.808	50	0		EHAARM
CC(C)CC(=O)Nc1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])cc1	ZINC000009259201	211059196	/nfs/dbraw/zinc/05/91/96/211059196.db2.gz	XXBHSYDLVRHPPG-JKSUJKDBSA-N	-1	0	346.427	3.501	50	0		EHAARM
O=C([O-])c1cccc([C@@H]2CCCN(C(=O)c3cccc(F)c3)C2)c1	ZINC000095363324	218295358	/nfs/dbraw/zinc/29/53/58/218295358.db2.gz	BSPYVXNORHOBQJ-MRXNPFEDSA-N	-1	0	327.355	3.544	50	0		EHAARM
Cc1cnc(C(=O)Nc2c([O-])c(Cl)cc(Cl)c2Cl)cn1	ZINC000095448229	218392311	/nfs/dbraw/zinc/39/23/11/218392311.db2.gz	DYKWCBPECVTEIY-UHFFFAOYSA-N	-1	0	332.574	3.703	50	0		EHAARM
C[C@@H](CC(=O)N1CCC[C@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000095969520	218474310	/nfs/dbraw/zinc/47/43/10/218474310.db2.gz	GWLAJJZILZHZKA-AAEUAGOBSA-N	-1	0	343.345	3.522	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)[C@@H]1CC(C)=C(C)C[C@H]1C(=O)[O-]	ZINC000006731394	210694886	/nfs/dbraw/zinc/69/48/86/210694886.db2.gz	GARMDYLWECVQLZ-CHWSQXEVSA-N	-1	0	337.803	3.734	50	0		EHAARM
O=C([O-])COc1ccc2c(=O)c(Oc3ccc(Cl)cc3)coc2c1	ZINC000005127658	210396255	/nfs/dbraw/zinc/39/62/55/210396255.db2.gz	HLGXHKQIONFUDZ-UHFFFAOYSA-N	-1	0	346.722	3.702	50	0		EHAARM
Cc1ccc2nc(-c3ccc(NC(=O)/C=C/C(=O)[O-])cc3)sc2c1	ZINC000000038662	208554861	/nfs/dbraw/zinc/55/48/61/208554861.db2.gz	HDYOIHVTWSZHQB-CMDGGOBGSA-N	-1	0	338.388	3.851	50	0		EHAARM
COC(=O)c1ccc(NC(=O)c2cc(Cl)c([O-])c(Cl)c2)cc1	ZINC000007003464	208568991	/nfs/dbraw/zinc/56/89/91/208568991.db2.gz	VBYQCKBTFLYTTH-UHFFFAOYSA-N	-1	0	340.162	3.738	50	0		EHAARM
Cc1ccc(S(=O)(=O)C=C([O-])c2ccc(Cl)cc2Cl)cc1	ZINC000004868469	210308000	/nfs/dbraw/zinc/30/80/00/210308000.db2.gz	OFJUBRPECYWURM-UHFFFAOYSA-N	-1	0	343.231	3.958	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CSCc2ccccc2Cl)cc1	ZINC000004825648	210289036	/nfs/dbraw/zinc/28/90/36/210289036.db2.gz	WVTRGYXWTBOEJC-UHFFFAOYSA-N	-1	0	335.812	3.910	50	0		EHAARM
Cc1cc(Br)ccc1NC(=O)[C@@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000000242518	563594576	/nfs/dbraw/zinc/59/45/76/563594576.db2.gz	SIXQASFELNQYLR-NEPJUHHUSA-N	-1	0	340.217	3.587	50	0		EHAARM
COc1ccc(-c2nnc(SCc3ccc(C(=O)[O-])cc3)o2)cc1	ZINC000000097628	563224567	/nfs/dbraw/zinc/22/45/67/563224567.db2.gz	SRQNFSLEJPJFHW-UHFFFAOYSA-N	-1	0	342.376	3.736	50	0		EHAARM
Cc1sc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204906	563259341	/nfs/dbraw/zinc/25/93/41/563259341.db2.gz	OAJOTIZEIAAZEE-UONOGXRCSA-N	-1	0	344.436	3.948	50	0		EHAARM
O=S(=O)([N-]c1nc2ccccc2s1)c1ccc(Cl)s1	ZINC000000470448	563330778	/nfs/dbraw/zinc/33/07/78/563330778.db2.gz	ROKZYXRZNANQRQ-UHFFFAOYSA-N	-1	0	330.843	3.812	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(C3CCCCC3)cc2)n1	ZINC000000470278	563330827	/nfs/dbraw/zinc/33/08/27/563330827.db2.gz	ASDUIJPFESTTKK-UHFFFAOYSA-N	-1	0	330.453	3.660	50	0		EHAARM
COc1ccc(CCCC(=O)Nc2ccc(C(=O)[O-])cc2)cc1C	ZINC000000617176	563359206	/nfs/dbraw/zinc/35/92/06/563359206.db2.gz	GAWWCQSFWOCRFM-UHFFFAOYSA-N	-1	0	327.380	3.663	50	0		EHAARM
O=C([O-])[C@@H]1CS[C@H](c2ccc(OCc3ccccc3Cl)cc2)N1	ZINC000002472427	563433455	/nfs/dbraw/zinc/43/34/55/563433455.db2.gz	CYMVBODYZNMIRO-JKSUJKDBSA-N	-1	0	349.839	3.707	50	0		EHAARM
CCCCCCc1c(C)c2ccc(OCC(=O)[O-])c(C)c2oc1=O	ZINC000002479765	563433472	/nfs/dbraw/zinc/43/34/72/563433472.db2.gz	XVWAHGIUZVRYQQ-UHFFFAOYSA-N	-1	0	332.396	3.996	50	0	biogenic	EHAARM
CCOC(=O)c1sc(C)c2c1[n-]c(-c1ccc(Cl)cc1)nc2=O	ZINC000005817616	563551480	/nfs/dbraw/zinc/55/14/80/563551480.db2.gz	FROOLIRUCQIEOQ-UHFFFAOYSA-N	-1	0	348.811	3.790	50	0		EHAARM
Cc1oc2c(C)c([O-])ccc2c(=O)c1-c1cnn(-c2ccccc2)c1	ZINC000006556309	563571796	/nfs/dbraw/zinc/57/17/96/563571796.db2.gz	GHLWYUWNSCMSBF-UHFFFAOYSA-N	-1	0	332.359	3.968	50	0		EHAARM
O=C([O-])c1ccc(CSc2nnc(NC3CCCCC3)s2)o1	ZINC000012985893	563682027	/nfs/dbraw/zinc/68/20/27/563682027.db2.gz	DCVWATIKECTNQO-UHFFFAOYSA-N	-1	0	339.442	3.866	50	0		EHAARM
Cc1ccccc1CN[C@H](c1cccc(Cl)c1)[P@@](=O)([O-])O	ZINC000012997492	563683816	/nfs/dbraw/zinc/68/38/16/563683816.db2.gz	DJEFIEQGZSTSAG-HNNXBMFYSA-N	-1	0	325.732	3.615	50	0		EHAARM
CC1CCC([NH2+]C[C@@H]2CCCc3ccccc32)(P(=O)([O-])[O-])CC1	ZINC000012997518	563683821	/nfs/dbraw/zinc/68/38/21/563683821.db2.gz	LHAYQZYNMMRRSK-HQVVEAJESA-N	-1	0	337.400	3.780	50	0		EHAARM
O=C([O-])c1ccc(C(=O)Nc2nc3ccccc3n2C2CCCC2)o1	ZINC000238023036	563751672	/nfs/dbraw/zinc/75/16/72/563751672.db2.gz	NDNNHHOBZDVZRC-UHFFFAOYSA-N	-1	0	339.351	3.695	50	0		EHAARM
S=c1[n-]nc(CSCCOc2ccc(Cl)cc2Cl)o1	ZINC000015919728	563799624	/nfs/dbraw/zinc/79/96/24/563799624.db2.gz	UHSRBUVMLVJEMW-UHFFFAOYSA-N	-1	0	337.253	3.977	50	0		EHAARM
CCCCc1ccccc1[N-]S(=O)(=O)c1cc(OC)ccc1OC	ZINC000017072596	563836338	/nfs/dbraw/zinc/83/63/38/563836338.db2.gz	MSUDCPHKZPFCNC-UHFFFAOYSA-N	-1	0	349.452	3.847	50	0		EHAARM
O=C([O-])c1cnc2c(F)c(F)c(F)c(NCc3ccccc3)c2c1O	ZINC000003684527	563918794	/nfs/dbraw/zinc/91/87/94/563918794.db2.gz	TZAOWJLQYSZIKW-UHFFFAOYSA-N	-1	0	348.280	3.668	50	0		EHAARM
CC(C)Oc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccccc2F)cc1	ZINC000000104979	563986437	/nfs/dbraw/zinc/98/64/37/563986437.db2.gz	OUVUSWOWYVJWJI-QGZVFWFLSA-N	-1	0	345.370	3.559	50	0		EHAARM
Cc1sc(C(=O)N2CCC(C(=O)[O-])CC2)cc1-c1ccc(F)cc1	ZINC000237695635	563993630	/nfs/dbraw/zinc/99/36/30/563993630.db2.gz	SVABCXHWDNYQSV-UHFFFAOYSA-N	-1	0	347.411	3.799	50	0		EHAARM
CCCOC(=O)[C@H]1C2c3ccccc3C(c3ccccc32)[C@H]1C(=O)[O-]	ZINC000002496188	564003836	/nfs/dbraw/zinc/00/38/36/564003836.db2.gz	AXMPLSTZNMYFSE-GMNCBBECSA-N	-1	0	336.387	3.548	50	0		EHAARM
CC1(C)COC(c2cc3ccc2CCc2ccc(cc2C(=O)[O-])CC3)=N1	ZINC000004442247	564005152	/nfs/dbraw/zinc/00/51/52/564005152.db2.gz	RQURKWMSXZQVFP-UHFFFAOYSA-N	-1	0	349.430	3.824	50	0		EHAARM
Cc1cccc(OCCC(=O)Nc2cc(Cl)ccc2C(=O)[O-])c1	ZINC000008188294	564016060	/nfs/dbraw/zinc/01/60/60/564016060.db2.gz	SNGYHDOPIVUASF-UHFFFAOYSA-N	-1	0	333.771	3.754	50	0		EHAARM
Oc1ccc(-c2n[nH]cc2-c2ccc(Br)cc2)c(O)c1	ZINC000018054362	564017847	/nfs/dbraw/zinc/01/78/47/564017847.db2.gz	SKMRQICJTLTLTF-UHFFFAOYSA-N	-1	0	331.169	3.917	50	0		EHAARM
O=C1NC(=Cc2cccn2-c2ccccc2F)C(=O)N1c1ccccc1	ZINC000000532274	564021527	/nfs/dbraw/zinc/02/15/27/564021527.db2.gz	UBUIGERGVJBIJL-LGMDPLHJSA-N	-1	0	347.349	3.714	50	0		EHAARM
O=c1c2c3c(sc2[n-]c(=S)n1Cc1ccc(F)cc1)CCC3	ZINC000017068349	564024827	/nfs/dbraw/zinc/02/48/27/564024827.db2.gz	WCJZBIBOLNCDGC-UHFFFAOYSA-N	-1	0	332.425	3.797	50	0		EHAARM
C[C@H]1CCN(C(=O)Cc2ccc(C(=O)[O-])cc2)[C@H](c2ccco2)C1	ZINC000263334704	564056271	/nfs/dbraw/zinc/05/62/71/564056271.db2.gz	NCFVGDHRGNCBRK-BBRMVZONSA-N	-1	0	327.380	3.520	50	0		EHAARM
COc1ccc2cc(C(=O)Oc3ccc(Cl)cc3C(=O)[O-])[nH]c2c1	ZINC000083970313	564065459	/nfs/dbraw/zinc/06/54/59/564065459.db2.gz	QWBQQWIGYDMWGV-UHFFFAOYSA-N	-1	0	345.738	3.747	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@H]2c2ccsc2)cc1	ZINC000136970758	564066780	/nfs/dbraw/zinc/06/67/80/564066780.db2.gz	SXQPUZDKXAGKKM-INIZCTEOSA-N	-1	0	329.421	3.743	50	0		EHAARM
CN1C(=O)[C@@H]2CCCC[C@]2(C(=O)[O-])[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000085389091	564072752	/nfs/dbraw/zinc/07/27/52/564072752.db2.gz	ATIVYQLDEAUSKI-HEHGZKQESA-N	-1	0	342.222	3.768	50	0		EHAARM
O=C([O-])c1cccc(-c2nc3cccnc3n2Cc2ccccc2)c1	ZINC000033559092	564076096	/nfs/dbraw/zinc/07/60/96/564076096.db2.gz	VFBFNRJCKZPJKA-UHFFFAOYSA-N	-1	0	329.359	3.845	50	0		EHAARM
COc1ccccc1-c1noc(-c2c[n-]c3ccc(C)cc3c2=O)n1	ZINC000075352733	564082003	/nfs/dbraw/zinc/08/20/03/564082003.db2.gz	LDMVUPCAVWXXKU-UHFFFAOYSA-N	-1	0	333.347	3.562	50	0		EHAARM
COc1ccccc1S(=O)(=O)Nc1c(C)cc(C)cc1Cl	ZINC000006602919	564092915	/nfs/dbraw/zinc/09/29/15/564092915.db2.gz	AQEYDPIQMGSQRL-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
O=C([O-])c1cnn2c1nc(C13CC4CC(CC(C4)C1)C3)cc2C(F)F	ZINC000006828542	564098970	/nfs/dbraw/zinc/09/89/70/564098970.db2.gz	ZNJQKFCTVJNUBL-UHFFFAOYSA-N	-1	0	347.365	3.833	50	0		EHAARM
O=S(=O)([N-]c1cccnc1)c1ccc2[nH]c3c(c2c1)CCCCC3	ZINC000006887623	564100717	/nfs/dbraw/zinc/10/07/17/564100717.db2.gz	GEQWARDSGRCJEF-UHFFFAOYSA-N	-1	0	341.436	3.633	50	0		EHAARM
O=C(Nc1ccc(-c2nnco2)cc1)c1ccc2[n-]c(=S)oc2c1	ZINC000076092671	564115665	/nfs/dbraw/zinc/11/56/65/564115665.db2.gz	BUCLRZKHAGKKRF-UHFFFAOYSA-N	-1	0	338.348	3.793	50	0		EHAARM
CC(C)c1cccc(S(=O)(=O)[N-]c2cc(-c3cccnc3)on2)c1	ZINC000253430004	564131322	/nfs/dbraw/zinc/13/13/22/564131322.db2.gz	JILWXWGIHKZMHM-UHFFFAOYSA-N	-1	0	343.408	3.661	50	0		EHAARM
O=C([O-])CCCOc1ccc(NC(=O)c2cccc3cc[nH]c32)cc1	ZINC000095463966	564140919	/nfs/dbraw/zinc/14/09/19/564140919.db2.gz	MZUGXRWYVFQYGX-UHFFFAOYSA-N	-1	0	338.363	3.664	50	0		EHAARM
O=C(C=Cc1ccc(Cl)cc1)N1CCC(c2n[n-]c(=S)o2)CC1	ZINC000096257539	564146186	/nfs/dbraw/zinc/14/61/86/564146186.db2.gz	IAQWHVZISLRDAN-UTCJRWHESA-N	-1	0	349.843	3.805	50	0		EHAARM
C[C@@H](NC(=O)N1CCC(C(=O)[O-])CC1)c1ccc(Cl)cc1Cl	ZINC000261605657	564146442	/nfs/dbraw/zinc/14/64/42/564146442.db2.gz	CTZBBSRZDJBBII-SECBINFHSA-N	-1	0	345.226	3.561	50	0		EHAARM
Cc1ccc(NC(=O)CSc2nc(=O)c3sccc3[n-]2)c(F)c1	ZINC000057477630	564154408	/nfs/dbraw/zinc/15/44/08/564154408.db2.gz	VMRNCXGBXPEGGS-UHFFFAOYSA-N	-1	0	349.412	3.575	50	0		EHAARM
Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)c1c(C)coc1CC(=O)[O-]	ZINC000263478067	564162325	/nfs/dbraw/zinc/16/23/25/564162325.db2.gz	ZQUVMBMGQVLRJV-ZDUSSCGKSA-N	-1	0	345.395	3.560	50	0		EHAARM
CC(C)c1ccccc1NS(=O)(=O)c1ccc(/C=C\C(=O)[O-])cc1	ZINC000096747815	601318471	/nfs/dbraw/zinc/31/84/71/601318471.db2.gz	DJDFZPVGBGCMID-XFXZXTDPSA-N	-1	0	345.420	3.709	50	0		EHAARM
C[C@H](C(=O)[O-])c1cccc(NC(=O)[C@H]2CCc3cc(F)ccc32)c1	ZINC000574651747	974786819	/nfs/dbraw/zinc/78/68/19/974786819.db2.gz	IQSQEEVGWQKKOO-GTNSWQLSSA-N	-1	0	327.355	3.682	50	0		EHAARM
Cc1cn2c(/C=C\c3ncc(C(=O)[O-])c(C(C)C)n3)c(C)nc2s1	ZINC000255110962	1017650468	/nfs/dbraw/zinc/65/04/68/1017650468.db2.gz	AWTURFXGJUWAFZ-WAYWQWQTSA-N	-1	0	342.424	3.795	50	0		EHAARM
C[C@@H](CC(=O)[O-])CC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000565550174	1130767326	/nfs/dbraw/zinc/76/73/26/1130767326.db2.gz	VBXGCRVYJJQGGI-BEFAXECRSA-N	-1	0	337.419	3.814	50	0		EHAARM
CC[C@H](C)n1ncc2c1nc(/C=C\c1cncs1)cc2C(=O)[O-]	ZINC000566305718	1130804820	/nfs/dbraw/zinc/80/48/20/1130804820.db2.gz	ZJFVIMWTSNLBCX-LWTINBJPSA-N	-1	0	328.397	3.727	50	0		EHAARM
C[C@H](Nc1nc(N)nc2ccc(C(=O)[O-])cc21)c1ccc(Cl)cc1	ZINC000065410667	1132280877	/nfs/dbraw/zinc/28/08/77/1132280877.db2.gz	MXCSHFJIDLQSEG-VIFPVBQESA-N	-1	0	342.786	3.737	50	0		EHAARM
O=C([O-])[C@@H](CNC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)C1CCCCC1	ZINC000630266009	1137352796	/nfs/dbraw/zinc/35/27/96/1137352796.db2.gz	XLYCYYMGZBFDHN-MCIONIFRSA-N	-1	0	349.393	3.752	50	0		EHAARM
CCOc1ccc(CN(C(=O)c2ccc(F)cc2[O-])C2CC2)cc1	ZINC000055228697	214292570	/nfs/dbraw/zinc/29/25/70/214292570.db2.gz	ASOSVUNPCVNGGL-UHFFFAOYSA-N	-1	0	329.371	3.735	50	0		EHAARM
O=c1c2[nH]cc(-c3ccccc3)c2[n-]c(=S)n1Cc1ccccc1	ZINC000100071618	219089974	/nfs/dbraw/zinc/08/99/74/219089974.db2.gz	KBYSRCJILOTJND-UHFFFAOYSA-N	-1	0	333.416	3.729	50	0		EHAARM
CN(CCOc1ccccc1C(=O)[O-])Cc1nc2ccccc2s1	ZINC000183931814	529927367	/nfs/dbraw/zinc/92/73/67/529927367.db2.gz	KFWWPXOIXFIRTP-UHFFFAOYSA-N	-1	0	342.420	3.505	50	0		EHAARM
O=C([O-])[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000004018758	210101016	/nfs/dbraw/zinc/10/10/16/210101016.db2.gz	HKQNHESHJCTPJH-HTEOGMQZSA-N	-1	0	328.195	3.679	50	0		EHAARM
O=C(NCCc1ccc(F)cc1)c1cc(Cl)c([O-])c(Cl)c1	ZINC000003443710	210041605	/nfs/dbraw/zinc/04/16/05/210041605.db2.gz	SOGHRCOJBFLAPG-UHFFFAOYSA-N	-1	0	328.170	3.811	50	0		EHAARM
Cc1cc(C)n(-c2cc(C)ccc2-c2ccc([C@@H](O)C(=O)[O-])cc2)n1	ZINC000067691164	215185723	/nfs/dbraw/zinc/18/57/23/215185723.db2.gz	YZWIMVUACGGMND-LJQANCHMSA-N	-1	0	336.391	3.583	50	0		EHAARM
Cc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])c(Br)c1	ZINC000002744410	209900433	/nfs/dbraw/zinc/90/04/33/209900433.db2.gz	OQGQWGTZRYVECK-MNOVXSKESA-N	-1	0	340.217	3.587	50	0		EHAARM
CCCOC(=O)[C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1C(=O)[O-]	ZINC000002496190	209857517	/nfs/dbraw/zinc/85/75/17/209857517.db2.gz	AXMPLSTZNMYFSE-BTRQGYIVSA-N	-1	0	336.387	3.548	50	0		EHAARM
CCn1c(SCc2cccc(C(=O)[O-])c2)nnc1-c1ccccc1	ZINC000001279026	209722005	/nfs/dbraw/zinc/72/20/05/209722005.db2.gz	IWQQTCLOSLKVLN-UHFFFAOYSA-N	-1	0	339.420	3.956	50	0		EHAARM
Cc1cc(C(=O)[N-]c2nnc(-c3cc(Cl)sc3Cl)o2)on1	ZINC000035586447	213039670	/nfs/dbraw/zinc/03/96/70/213039670.db2.gz	SIYIBKPJVGPMOK-UHFFFAOYSA-N	-1	0	345.167	3.654	50	0		EHAARM
Cc1ccc(C[C@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000035141851	213009545	/nfs/dbraw/zinc/00/95/45/213009545.db2.gz	KECJLAFHJZNHLM-CQSZACIVSA-N	-1	0	331.799	3.921	50	0		EHAARM
CC(C)c1nc2cc(NC(=O)CC3(C(=O)[O-])CCCC3)ccc2o1	ZINC000071804950	215840463	/nfs/dbraw/zinc/84/04/63/215840463.db2.gz	WCTJZIYUJMQYAL-UHFFFAOYSA-N	-1	0	330.384	3.925	50	0		EHAARM
O=C([O-])c1cccc(-c2cc(NCc3cccnc3)nc3[nH]ccc32)c1	ZINC000072137045	216024594	/nfs/dbraw/zinc/02/45/94/216024594.db2.gz	IBIVFORUBNENLW-UHFFFAOYSA-N	-1	0	344.374	3.935	50	0		EHAARM
CCOc1ccc(NC(=O)[C@H](CC(=O)[O-])[C@@H](C)c2ccccc2)cc1	ZINC000000231645	209496420	/nfs/dbraw/zinc/49/64/20/209496420.db2.gz	VZJPWEDEZGGGAM-KBXCAEBGSA-N	-1	0	341.407	3.918	50	0		EHAARM
Cc1nc(-c2csc(S(=O)(=O)[N-]c3ccc(C)cc3C)c2)no1	ZINC000021701760	212240988	/nfs/dbraw/zinc/24/09/88/212240988.db2.gz	QOFNLKKDIIWWPB-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1nc(-c2csc(S(=O)(=O)[N-]c3cccc(C)c3C)c2)no1	ZINC000021701653	212240647	/nfs/dbraw/zinc/24/06/47/212240647.db2.gz	VFBSWTBHQRTXNK-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1O	ZINC000020435695	212128654	/nfs/dbraw/zinc/12/86/54/212128654.db2.gz	XNBHUADALNBFGC-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
Nc1ccccc1-c1nnc(SCc2ccccc2Cl)[n-]c1=O	ZINC000018158020	211984872	/nfs/dbraw/zinc/98/48/72/211984872.db2.gz	SUPNNYIHXAFQPL-UHFFFAOYSA-N	-1	0	344.827	3.772	50	0		EHAARM
O=C([O-])Cc1ccc(NC(=O)Nc2ccccc2C(F)(F)F)cc1	ZINC000017070967	211951168	/nfs/dbraw/zinc/95/11/68/211951168.db2.gz	VMJUBYSIBVIQQI-UHFFFAOYSA-N	-1	0	338.285	3.977	50	0		EHAARM
Cc1noc(C)c1C[C@@H](C)NC(=O)c1c([O-])cc(Cl)cc1Cl	ZINC000080029442	217273155	/nfs/dbraw/zinc/27/31/55/217273155.db2.gz	HIBXYNNIVNIULL-SSDOTTSWSA-N	-1	0	343.210	3.665	50	0		EHAARM
CCc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000013959101	211661059	/nfs/dbraw/zinc/66/10/59/211661059.db2.gz	GFBPCMJFMGYTKE-AAEUAGOBSA-N	-1	0	339.317	3.804	50	0		EHAARM
Cc1ccc(-c2cc(C(=O)[O-])n3nc4nc(C)cc(C)c4c3n2)cc1	ZINC000013645253	211596590	/nfs/dbraw/zinc/59/65/90/211596590.db2.gz	OSAYLCYEZJBDNW-UHFFFAOYSA-N	-1	0	332.363	3.568	50	0		EHAARM
COc1ccc([C@H](NC(=O)CC2(C(=O)[O-])CCCCC2)C(C)C)cc1	ZINC000013468899	211563342	/nfs/dbraw/zinc/56/33/42/211563342.db2.gz	CWJDIQZREARDCV-GOSISDBHSA-N	-1	0	347.455	3.934	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)c1occc1COc1ccccc1	ZINC000012923950	211485729	/nfs/dbraw/zinc/48/57/29/211485729.db2.gz	NBZMNJDRWJXJGD-UHFFFAOYSA-N	-1	0	337.331	3.809	50	0		EHAARM
O=c1cc([O-])c2sc3nc(-c4cccnc4)cc(C(F)F)c3c2[nH]1	ZINC000012374838	211358984	/nfs/dbraw/zinc/35/89/84/211358984.db2.gz	YXYVVYFDXGEHCC-UHFFFAOYSA-N	-1	0	345.330	3.843	50	0		EHAARM
Cc1c(C(=O)Nc2cccc(C(=O)[O-])c2C)cnn1-c1cccc(C)c1	ZINC000095349605	218283763	/nfs/dbraw/zinc/28/37/63/218283763.db2.gz	NTKYRYQHWBENJG-UHFFFAOYSA-N	-1	0	349.390	3.748	50	0		EHAARM
C[C@H](C(=O)[O-])[C@@H](NC(=O)c1ccc(F)cc1Cl)c1ccccc1	ZINC000097018284	218916099	/nfs/dbraw/zinc/91/60/99/218916099.db2.gz	HOMZQDZQJYQNIA-ZUZCIYMTSA-N	-1	0	335.762	3.671	50	0		EHAARM
O=c1[n-]c(-c2ccccc2)nc(-c2ccccc2)c1Br	ZINC000005037799	210371871	/nfs/dbraw/zinc/37/18/71/210371871.db2.gz	JWDIAOXZKTYFCH-UHFFFAOYSA-N	-1	0	327.181	3.866	50	0		EHAARM
Cc1ccc2nc(NC(=O)[C@H]3CC(C)=CC[C@H]3C(=O)[O-])sc2c1	ZINC000004976941	210346238	/nfs/dbraw/zinc/34/62/38/210346238.db2.gz	IVCSMRNUYHKNBU-NEPJUHHUSA-N	-1	0	330.409	3.600	50	0		EHAARM
CC[C@H](C)[C@H](Nc1nc(C)nc2sc3c(c21)CCCC3)C(=O)[O-]	ZINC000004863155	210304542	/nfs/dbraw/zinc/30/45/42/210304542.db2.gz	VKNRJLBBRIYWOZ-XPTSAGLGSA-N	-1	0	333.457	3.790	50	0		EHAARM
CC[C@H](Cc1ccccc1)N(C)C(=O)/C=C/c1ccc(C(=O)[O-])cc1	ZINC000328595368	258043384	/nfs/dbraw/zinc/04/33/84/258043384.db2.gz	SKGIWZSEFNLFRJ-FIIODCPWSA-N	-1	0	337.419	3.878	50	0		EHAARM
CCc1nc(CN2CCC(c3ccccc3C(=O)[O-])CC2)cs1	ZINC000328587770	258045300	/nfs/dbraw/zinc/04/53/00/258045300.db2.gz	HQEPLRQDBXVUGP-UHFFFAOYSA-N	-1	0	330.453	3.783	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])n2)cc1	ZINC000000996316	258048928	/nfs/dbraw/zinc/04/89/28/258048928.db2.gz	XSFUUEIBDYMQJY-ZIAGYGMSSA-N	-1	0	342.420	3.724	50	0		EHAARM
CCOc1ccc(N[C@H](c2ccc(F)cc2)[P@@](=O)([O-])O)cc1	ZINC000012536579	258054666	/nfs/dbraw/zinc/05/46/66/258054666.db2.gz	VJKPMEUICKFXRC-HNNXBMFYSA-N	-1	0	325.276	3.513	50	0		EHAARM
CC[C@H](C)c1ccccc1OCC(=O)Nc1ccc(O)cc1C(=O)[O-]	ZINC000004819848	522048552	/nfs/dbraw/zinc/04/85/52/522048552.db2.gz	OLNFVVYKRSFQEV-LBPRGKRZSA-N	-1	0	343.379	3.621	50	0		EHAARM
Cc1nc(-c2cc(S(=O)(=O)[N-]c3cccc(C)c3)c(C)s2)no1	ZINC000035539199	526562191	/nfs/dbraw/zinc/56/21/91/526562191.db2.gz	OSXHENQUCIFMIM-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)NCc2csc3ccccc23)C1	ZINC000000069841	563214771	/nfs/dbraw/zinc/21/47/71/563214771.db2.gz	VWDPEQJAESBSCA-CVEARBPZSA-N	-1	0	343.448	3.965	50	0		EHAARM
Cc1cc(NC(=O)c2c(C)onc2-c2c(F)cccc2Cl)no1	ZINC000000140891	563241901	/nfs/dbraw/zinc/24/19/01/563241901.db2.gz	SEUFTZADNPPDSS-UHFFFAOYSA-N	-1	0	335.722	3.991	50	0		EHAARM
Cc1ccc(C[C@@H](CC(=O)[O-])C(=O)Nc2ccc(Cl)cc2)cc1	ZINC000000249110	563266511	/nfs/dbraw/zinc/26/65/11/563266511.db2.gz	IKWJFAZZSCWTDM-AWEZNQCLSA-N	-1	0	331.799	3.921	50	0		EHAARM
CCc1cc(C(=O)[O-])c(NC(=O)/C=C/c2ccc(OC)cc2)s1	ZINC000000266489	563268790	/nfs/dbraw/zinc/26/87/90/563268790.db2.gz	OURUQWHDCYXNFZ-RMKNXTFCSA-N	-1	0	331.393	3.669	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@H](C(=O)Nc2ccc(Cl)c(Cl)c2)C1	ZINC000000315608	563282786	/nfs/dbraw/zinc/28/27/86/563282786.db2.gz	STPKQKKLSGRYFG-GHMZBOCLSA-N	-1	0	328.195	3.989	50	0		EHAARM
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc2cccnc21	ZINC000000423478	563309042	/nfs/dbraw/zinc/30/90/42/563309042.db2.gz	ZYUHDUIEAYCZNO-UHFFFAOYSA-N	-1	0	332.812	3.997	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1cccc(Cl)c1C	ZINC000000583225	563351448	/nfs/dbraw/zinc/35/14/48/563351448.db2.gz	RGACGFLXNBLTHW-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
C[C@@H](Oc1ccc(Oc2cnc3ccc(Cl)cc3n2)cc1)C(=O)[O-]	ZINC000001539116	563391817	/nfs/dbraw/zinc/39/18/17/563391817.db2.gz	NUQZXROIVGBRGR-SNVBAGLBSA-N	-1	0	344.754	3.927	50	0	in-vitro	EHAARM
Cc1ccc(C[C@]2(C(=O)[O-])CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000002513082	563435322	/nfs/dbraw/zinc/43/53/22/563435322.db2.gz	OROZSQNPVNQUHJ-LJQANCHMSA-N	-1	0	333.428	3.639	50	0		EHAARM
CCc1ccc(-c2cc(C(F)(F)F)n3nc(C(=O)[O-])cc3n2)s1	ZINC000002777552	563450883	/nfs/dbraw/zinc/45/08/83/563450883.db2.gz	SFBIIGRAKCKHEC-UHFFFAOYSA-N	-1	0	341.314	3.737	50	0		EHAARM
Cc1cc([C@H]2CC[C@@H](C(=O)[O-])CN2C(=O)C2CCCC2)ccc1F	ZINC000034714563	563463960	/nfs/dbraw/zinc/46/39/60/563463960.db2.gz	UYHGDIJJRBCYTQ-NVXWUHKLSA-N	-1	0	333.403	3.689	50	0		EHAARM
COc1ccc([C@H]2[C@@H](C(=O)[O-])CCC(=O)N2c2ccc(C)cc2)cc1	ZINC000003888160	563490503	/nfs/dbraw/zinc/49/05/03/563490503.db2.gz	WUXFDDOWIRXNME-HKUYNNGSSA-N	-1	0	339.391	3.573	50	0		EHAARM
Cc1ccccc1CSCC(=O)Nc1cccc(C(=O)[O-])c1C	ZINC000006703032	563580796	/nfs/dbraw/zinc/58/07/96/563580796.db2.gz	VNDBNVWWNBKJAQ-UHFFFAOYSA-N	-1	0	329.421	3.874	50	0		EHAARM
COc1ccc(NC(=O)c2ccc([O-])c(Cl)c2)cc1OC(F)F	ZINC000029197790	563905224	/nfs/dbraw/zinc/90/52/24/563905224.db2.gz	AUPPRYWDVSFBAZ-UHFFFAOYSA-N	-1	0	343.713	3.908	50	0		EHAARM
COc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1cccc(F)c1C	ZINC000045221866	563929098	/nfs/dbraw/zinc/92/90/98/563929098.db2.gz	DEDFRSFZGZQDGT-UHFFFAOYSA-N	-1	0	343.807	3.905	50	0		EHAARM
O=C([O-])C1CCN(C(=O)CCCc2csc3ccccc23)CC1	ZINC000097019338	563966648	/nfs/dbraw/zinc/96/66/48/563966648.db2.gz	HBUARFBJMCVBIN-UHFFFAOYSA-N	-1	0	331.437	3.547	50	0		EHAARM
O=c1ccnc(C(=Cc2ccc3c(c2)CCO3)Cc2ccccc2)[nH]1	ZINC000585139995	563973371	/nfs/dbraw/zinc/97/33/71/563973371.db2.gz	KOBRILNLHIYWKQ-JXAWBTAJSA-N	-1	0	330.387	3.900	50	0		EHAARM
COc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)c2cccnc12	ZINC000000140996	563987114	/nfs/dbraw/zinc/98/71/14/563987114.db2.gz	JBCKMLINAIRKMM-UHFFFAOYSA-N	-1	0	342.420	3.661	50	0		EHAARM
Cc1cc(C)c([C@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])cc1C	ZINC000221032731	563989597	/nfs/dbraw/zinc/98/95/97/563989597.db2.gz	MRDDWYJJPJNRBG-ZBFHGGJFSA-N	-1	0	333.428	3.789	50	0		EHAARM
O=S(=O)([N-]c1cccnc1)c1ccc(Oc2ccccc2)cc1	ZINC000000267718	563990001	/nfs/dbraw/zinc/99/00/01/563990001.db2.gz	ZKOMCXUIKAAQFN-UHFFFAOYSA-N	-1	0	326.377	3.675	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)c2ccc(C(=O)c3ccccc3)cc2)cc1	ZINC000000332914	563991319	/nfs/dbraw/zinc/99/13/19/563991319.db2.gz	CWESOEBWAGKFCI-UHFFFAOYSA-N	-1	0	345.354	3.868	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000368921	563991778	/nfs/dbraw/zinc/99/17/78/563991778.db2.gz	UFJUJIGDWOIYFD-VHSXEESVSA-N	-1	0	336.800	3.555	50	0		EHAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)CCc1ccc(Cl)s1	ZINC000237982393	563994358	/nfs/dbraw/zinc/99/43/58/563994358.db2.gz	BVYLPXDBZWIORN-LLVKDONJSA-N	-1	0	329.849	3.580	50	0		EHAARM
C[C@@H](CC(=O)N1CCC[C@H](C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000136151020	564001259	/nfs/dbraw/zinc/00/12/59/564001259.db2.gz	GOUMWXQOENSYKM-RYUDHWBXSA-N	-1	0	343.345	3.522	50	0		EHAARM
CO[C@]1(C)C[C@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C1(C)C	ZINC000081485062	564032349	/nfs/dbraw/zinc/03/23/49/564032349.db2.gz	WIOMVHIALISFIU-SUMWQHHRSA-N	-1	0	334.441	3.766	50	0		EHAARM
O=P([O-])([O-])[C@@H]([NH2+]C[C@@H]1CCCc2ccccc21)c1ccc(F)cc1	ZINC000012949499	564079813	/nfs/dbraw/zinc/07/98/13/564079813.db2.gz	IZVZWRXPGQHJMQ-MAUKXSAKSA-N	-1	0	349.342	3.712	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)o2)c(Cl)c1	ZINC000064958667	564098555	/nfs/dbraw/zinc/09/85/55/564098555.db2.gz	RWIAGZGVVHJHCR-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)Nc1ccc(C(C)C)cc1	ZINC000064980679	564098904	/nfs/dbraw/zinc/09/89/04/564098904.db2.gz	QMJGINWPLJQHJY-UHFFFAOYSA-N	-1	0	328.412	3.819	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccccc3F)s2)on1	ZINC000007005514	564102981	/nfs/dbraw/zinc/10/29/81/564102981.db2.gz	XCVVABHACGMFKH-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000007056410	564103984	/nfs/dbraw/zinc/10/39/84/564103984.db2.gz	SVLRSWHDQLUNON-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
C[C@H]1C[C@H]1c1ccc(CN(C(=O)C2CCC(C(=O)[O-])CC2)C2CC2)o1	ZINC000194390510	564120498	/nfs/dbraw/zinc/12/04/98/564120498.db2.gz	VXHKUKXJZFXOAH-VBRUCIBASA-N	-1	0	345.439	3.785	50	0		EHAARM
CN1C(=O)[C@@H]2CCCC[C@@]2(C(=O)[O-])[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000252590576	564120854	/nfs/dbraw/zinc/12/08/54/564120854.db2.gz	ATIVYQLDEAUSKI-XEZPLFJOSA-N	-1	0	342.222	3.768	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2OC(F)F)c(C)c1	ZINC000002645466	564151804	/nfs/dbraw/zinc/15/18/04/564151804.db2.gz	AGHOPFCTPCIBFR-UHFFFAOYSA-N	-1	0	327.352	3.706	50	0		EHAARM
Cc1ccc(C)c([C@H](C)NC(=O)C[C@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000008388749	564164867	/nfs/dbraw/zinc/16/48/67/564164867.db2.gz	FEUVPANUXSVSBS-KKSFZXQISA-N	-1	0	339.435	3.913	50	0		EHAARM
Cc1cc(F)ccc1[C@@H]1[C@@H](C(=O)[O-])CCC(=O)N1Cc1ccsc1	ZINC000069919897	564172817	/nfs/dbraw/zinc/17/28/17/564172817.db2.gz	QGKAVKUDQRSEQY-DOTOQJQBSA-N	-1	0	347.411	3.760	50	0		EHAARM
O=C([O-])[C@@H]1CC[C@H](C(=O)N[C@H](Cc2ccccc2)c2ccccc2)C1	ZINC000263353737	962507440	/nfs/dbraw/zinc/50/74/40/962507440.db2.gz	WKDDYLNHPXSGPO-IPMKNSEASA-N	-1	0	337.419	3.588	50	0		EHAARM
Cc1cc(C(=O)Nc2ccc(O[C@H](C)C(=O)[O-])c(F)c2)c(C)s1	ZINC000630258550	975201761	/nfs/dbraw/zinc/20/17/61/975201761.db2.gz	PRXUAFQDFMHDDQ-SECBINFHSA-N	-1	0	337.372	3.608	50	0		EHAARM
CC[C@@](C)(CC(=O)[O-])CC(=O)Nc1ccc(Br)cc1C	ZINC000006847364	1040147071	/nfs/dbraw/zinc/14/70/71/1040147071.db2.gz	MARIWOPTOQBRJX-OAHLLOKOSA-N	-1	0	342.233	3.977	50	0		EHAARM
O=C([O-])c1cc(Nc2nc(-c3ccc(O)cc3)cs2)ccc1O	ZINC000005063551	1042793782	/nfs/dbraw/zinc/79/37/82/1042793782.db2.gz	RSEQNQPZLDSQBE-UHFFFAOYSA-N	-1	0	328.349	3.663	50	0		EHAARM
COc1cc(/C=C/c2cc(C(=O)[O-])c3ccc(F)cc3n2)ccc1O	ZINC000031855794	1120533552	/nfs/dbraw/zinc/53/35/52/1120533552.db2.gz	FEAUZWWWPJRDBP-GORDUTHDSA-N	-1	0	339.322	3.957	50	0		EHAARM
CC1=CC(=O)C(=C([O-])C=Cc2ccc(-c3ccccc3)cc2)C(=O)O1	ZINC000034705144	1129823439	/nfs/dbraw/zinc/82/34/39/1129823439.db2.gz	AYDSXJQLMORBSH-DBBZSVRUSA-N	-1	0	332.355	3.582	50	0		EHAARM
CC(C)n1cc(C(=O)NC[C@H]2CC[C@H](C(=O)[O-])CC2)c2ccccc21	ZINC000952985880	1137485492	/nfs/dbraw/zinc/48/54/92/1137485492.db2.gz	AYEDYQSKQANSJI-SHTZXODSSA-N	-1	0	342.439	3.843	50	0		EHAARM
CC[C@@H](C)N(Cc1ccc(Cl)cc1)C(=O)CCc1cc(=O)[n-]o1	ZINC000055393476	214318337	/nfs/dbraw/zinc/31/83/37/214318337.db2.gz	USANBFHWJGJUHC-GFCCVEGCSA-N	-1	0	336.819	3.794	50	0		EHAARM
O=c1cc(-c2ccccc2)[n-]n1-c1c(F)c(F)c(F)c(F)c1F	ZINC000004256612	210153836	/nfs/dbraw/zinc/15/38/36/210153836.db2.gz	BBPPNBUQQSQIGV-UHFFFAOYSA-N	-1	0	326.224	3.523	50	0		EHAARM
COc1ccccc1-c1nn(Cc2ccccc2)cc1/C=C/C(=O)[O-]	ZINC000003407323	210029980	/nfs/dbraw/zinc/02/99/80/210029980.db2.gz	WDLBGYAIDUCZMC-VAWYXSNFSA-N	-1	0	334.375	3.705	50	0		EHAARM
COc1cccc([C@H]2Nc3nonc3N=C3CC(C)(C)CC(=O)C32)c1	ZINC000102740078	219226655	/nfs/dbraw/zinc/22/66/55/219226655.db2.gz	HNORHMYTGYPJMV-OAHLLOKOSA-N	-1	0	340.383	3.950	50	0		EHAARM
Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000003324963	210007364	/nfs/dbraw/zinc/00/73/64/210007364.db2.gz	SGXYZVJQZQFTGO-UHFFFAOYSA-N	-1	0	333.306	3.954	50	0		EHAARM
O=C([O-])[C@@H](Cc1cccc2ccccc21)NC(=O)OCc1ccccc1	ZINC000002567687	209868614	/nfs/dbraw/zinc/86/86/14/209868614.db2.gz	HNYQEAGTPQSPLT-LJQANCHMSA-N	-1	0	349.386	3.762	50	0		EHAARM
Cc1cc(C)c(S(=O)(=O)[N-]c2cc(Cl)ccc2O)cc1C	ZINC000035592588	213040360	/nfs/dbraw/zinc/04/03/60/213040360.db2.gz	PIEIKFXOWPDCKN-UHFFFAOYSA-N	-1	0	325.817	3.772	50	0		EHAARM
O=C([O-])c1cc(NC(=O)c2cc(Cl)cc(Cl)c2)ccc1O	ZINC000032627128	212819764	/nfs/dbraw/zinc/81/97/64/212819764.db2.gz	IKKCKOYZESGYCV-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
Cc1ccc(-c2cc3ncc(C(=O)c4ccccc4[O-])cn3n2)cc1	ZINC000021729213	212245351	/nfs/dbraw/zinc/24/53/51/212245351.db2.gz	RTFSRSJVGJWYEZ-UHFFFAOYSA-N	-1	0	329.359	3.641	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2SCC(=O)N2Cc2ccc(Cl)cc2)cc1	ZINC000226087227	242089230	/nfs/dbraw/zinc/08/92/30/242089230.db2.gz	YCSWEQCXFBJTJV-INIZCTEOSA-N	-1	0	347.823	3.812	50	0		EHAARM
CCc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)s1	ZINC000020617180	212156073	/nfs/dbraw/zinc/15/60/73/212156073.db2.gz	XZYUWMYRDNFJAQ-ONGXEEELSA-N	-1	0	345.346	3.866	50	0		EHAARM
O=C([O-])c1cnn2c1N[C@H](c1ccc(Cl)cc1)C[C@H]2C(F)(F)F	ZINC000020616579	212155994	/nfs/dbraw/zinc/15/59/94/212155994.db2.gz	ITJQPWGJQGPSCV-QWRGUYRKSA-N	-1	0	345.708	3.895	50	0		EHAARM
CCc1ccc(NC(=O)N2CCc3ccccc3[C@@H]2CC(=O)[O-])cc1	ZINC000015782050	211852766	/nfs/dbraw/zinc/85/27/66/211852766.db2.gz	JYYUNPKVUFQFPY-SFHVURJKSA-N	-1	0	338.407	3.855	50	0		EHAARM
Cc1ccc(NC(=O)c2ccccc2Br)cc1C(=O)[O-]	ZINC000110987035	220087501	/nfs/dbraw/zinc/08/75/01/220087501.db2.gz	WHGUELZSGXBCST-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
COc1ccc(S(=O)(=O)[N-]c2cccc3ccccc32)c(OC)c1	ZINC000012042979	211282508	/nfs/dbraw/zinc/28/25/08/211282508.db2.gz	CQNZJKCPBKTPGC-UHFFFAOYSA-N	-1	0	343.404	3.658	50	0		EHAARM
CCC[C@H](C(=O)NCc1ccc(OC)c(C(=O)[O-])c1)c1ccccc1	ZINC000095349933	218283884	/nfs/dbraw/zinc/28/38/84/218283884.db2.gz	JYLNUGFMYHVZSU-INIZCTEOSA-N	-1	0	341.407	3.594	50	0		EHAARM
O=C([O-])CCCC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1	ZINC000005067862	210380960	/nfs/dbraw/zinc/38/09/60/210380960.db2.gz	QIGMLTFTAYIIFG-LBPRGKRZSA-N	-1	0	348.449	3.742	50	0		EHAARM
Cc1ccc(C[C@H](C(=O)Nc2ccc(F)cc2)[C@H](C)C(=O)[O-])cc1	ZINC000004801827	210280489	/nfs/dbraw/zinc/28/04/89/210280489.db2.gz	BBRLINWIXHPXMR-GUYCJALGSA-N	-1	0	329.371	3.652	50	0		EHAARM
O=C([O-])CCCC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000000100979	563225936	/nfs/dbraw/zinc/22/59/36/563225936.db2.gz	TYMMWPFHHUNENH-UHFFFAOYSA-N	-1	0	343.223	3.918	50	0		EHAARM
CC1(C)[C@H](C(=O)Nc2cccc(C(=O)[O-])c2)[C@H]1C=C(Cl)Cl	ZINC000000041897	563212900	/nfs/dbraw/zinc/21/29/00/563212900.db2.gz	LVQFPCUAPXISCX-PWSUYJOCSA-N	-1	0	328.195	3.915	50	0		EHAARM
CC(C)(C)c1ccc(C(=O)N/C(=C/c2ccc(O)cc2)C(=O)[O-])cc1	ZINC000000144799	563243980	/nfs/dbraw/zinc/24/39/80/563243980.db2.gz	OOYNPMOKZWYNHZ-SFQUDFHCSA-N	-1	0	339.391	3.545	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)[C@H]2CC[C@](C)(C(=O)[O-])C2(C)C)cc1	ZINC000000223911	563262607	/nfs/dbraw/zinc/26/26/07/563262607.db2.gz	DUOIEPVTIVMMNP-OXQOHEQNSA-N	-1	0	346.471	3.998	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2OC)cc1	ZINC000000619318	563360950	/nfs/dbraw/zinc/36/09/50/563360950.db2.gz	ZDYNKMKOMYWABX-UHFFFAOYSA-N	-1	0	325.817	3.712	50	0		EHAARM
O=Cc1cc(Br)ccc1OCc1ccc(C(=O)[O-])cc1	ZINC000001410921	563388109	/nfs/dbraw/zinc/38/81/09/563388109.db2.gz	XPBPJNZCJKJJRK-UHFFFAOYSA-N	-1	0	335.153	3.539	50	0		EHAARM
O=C([O-])CCC(=O)Nc1nc(-c2cccc3ccccc32)cs1	ZINC000002737012	563447659	/nfs/dbraw/zinc/44/76/59/563447659.db2.gz	XKKWOISOVITETD-UHFFFAOYSA-N	-1	0	326.377	3.767	50	0		EHAARM
O=C([O-])c1cc(-c2ccc3c(c2)OCO3)nc2ccc(Cl)cc21	ZINC000003120156	563472826	/nfs/dbraw/zinc/47/28/26/563472826.db2.gz	VFXGTHADBCZERH-UHFFFAOYSA-N	-1	0	327.723	3.982	50	0		EHAARM
O=C(c1cnn(-c2nc3ccccc3s2)c1)c1cc(F)ccc1[O-]	ZINC000015232219	563780293	/nfs/dbraw/zinc/78/02/93/563780293.db2.gz	TXGMVPHNTDBTPD-UHFFFAOYSA-N	-1	0	339.351	3.558	50	0		EHAARM
Cc1noc2nc(-c3ccccc3)cc(C(=O)Nc3ncccc3O)c12	ZINC000028838299	563904324	/nfs/dbraw/zinc/90/43/24/563904324.db2.gz	RNFLQMCWWORKLA-UHFFFAOYSA-N	-1	0	346.346	3.551	50	0		EHAARM
O=C([O-])[C@@H]1CC=C[C@@H]1NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000032099104	563913327	/nfs/dbraw/zinc/91/33/27/563913327.db2.gz	UNMKIEMIGPKQSA-MJGOQNOKSA-N	-1	0	349.386	3.554	50	0		EHAARM
CC(C)(C)OC(=O)NC[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)[O-]	ZINC000044547072	563926515	/nfs/dbraw/zinc/92/65/15/563926515.db2.gz	YBONWVFBNGRRHI-SNVBAGLBSA-N	-1	0	348.226	3.761	50	0		EHAARM
COc1ccc(/C=C/c2ncc(C(=O)[O-])s2)cc1OC(F)F	ZINC000058391898	563944534	/nfs/dbraw/zinc/94/45/34/563944534.db2.gz	SHJXTLQQTXDKAP-HWKANZROSA-N	-1	0	327.308	3.622	50	0		EHAARM
CC(C)C/C=C(\CN1CCn2nc(C(=O)[O-])cc2C1)c1ccccc1	ZINC000065490872	563961527	/nfs/dbraw/zinc/96/15/27/563961527.db2.gz	DJXSEODFLYTSQO-RQZCQDPDSA-N	-1	0	339.439	3.527	50	0		EHAARM
Cc1nccn1-c1ccc(NC(=O)c2c([O-])cc(F)cc2F)cc1F	ZINC000060457419	563963580	/nfs/dbraw/zinc/96/35/80/563963580.db2.gz	ZMRFXXLPXBVDBA-UHFFFAOYSA-N	-1	0	347.296	3.556	50	0		EHAARM
O=C([O-])c1ccc(C[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000072160897	563966342	/nfs/dbraw/zinc/96/63/42/563966342.db2.gz	VUHMFWGTLKFMCQ-INIZCTEOSA-N	-1	0	338.407	3.871	50	0		EHAARM
C[C@H](C(=O)N1CCC[C@H](CCC(=O)[O-])C1)c1cc2ccccc2o1	ZINC000097039519	563966910	/nfs/dbraw/zinc/96/69/10/563966910.db2.gz	XHEYQPURYRSSIK-UONOGXRCSA-N	-1	0	329.396	3.640	50	0		EHAARM
C[C@H](Oc1ccc(CCC(=O)[O-])cc1)c1nc(-c2ccccc2)no1	ZINC000097166002	563968549	/nfs/dbraw/zinc/96/85/49/563968549.db2.gz	GKFZNERTDDLVDF-ZDUSSCGKSA-N	-1	0	338.363	3.894	50	0		EHAARM
Cc1ccc(C)c(N(C)C(=O)Cc2c3ccccc3[nH]c2C(=O)[O-])c1	ZINC000000201594	563988355	/nfs/dbraw/zinc/98/83/55/563988355.db2.gz	IQCFXRZFSUYQQF-UHFFFAOYSA-N	-1	0	336.391	3.688	50	0		EHAARM
Cc1cc(Br)ccc1NC(=O)CC1(C(=O)[O-])CCCC1	ZINC000012685951	564018778	/nfs/dbraw/zinc/01/87/78/564018778.db2.gz	WFELBAOTYKBGSK-UHFFFAOYSA-N	-1	0	340.217	3.731	50	0		EHAARM
CCn1c2ccccc2c([O-])c(-c2nc(-c3cccc(C)c3)no2)c1=O	ZINC000101725572	564019542	/nfs/dbraw/zinc/01/95/42/564019542.db2.gz	ZWQKHIBTKAJUKV-UHFFFAOYSA-N	-1	0	347.374	3.752	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)c1cc(F)c(F)cc1Cl)c1ccccc1	ZINC000013224116	564019643	/nfs/dbraw/zinc/01/96/43/564019643.db2.gz	VGVMDVGXXIYEJD-CQSZACIVSA-N	-1	0	339.725	3.564	50	0		EHAARM
C[C@@](CC(=O)Nc1cc(Cl)ccc1F)(C(=O)[O-])c1ccccc1	ZINC000013254244	564019655	/nfs/dbraw/zinc/01/96/55/564019655.db2.gz	JBLRHQJKFYNRLQ-KRWDZBQOSA-N	-1	0	335.762	3.850	50	0		EHAARM
Cc1ccc(C(F)(F)F)cc1C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000223667188	564040566	/nfs/dbraw/zinc/04/05/66/564040566.db2.gz	UIUWSOXKWUQZPL-LBPRGKRZSA-N	-1	0	343.345	3.731	50	0		EHAARM
Cc1nc(-c2cccc(NC(=O)[C@@H]3CC[C@H](C(=O)[O-])C3)c2)cs1	ZINC000261994999	564048155	/nfs/dbraw/zinc/04/81/55/564048155.db2.gz	PJDXMJDANURVCF-OLZOCXBDSA-N	-1	0	330.409	3.558	50	0		EHAARM
Cc1ccc(C(=O)COC(=O)c2cc(F)c([O-])c(Cl)c2)cc1C	ZINC000225664505	564049198	/nfs/dbraw/zinc/04/91/98/564049198.db2.gz	HKPBNYPTQNXXNI-UHFFFAOYSA-N	-1	0	336.746	3.841	50	0		EHAARM
C[C@]12CC(=O)[C@@H]3[C@H](CC[C@H]4C[C@H](O)CC[C@]34C)[C@@H]1CC=C2CC(=O)[O-]	ZINC000257358878	564056007	/nfs/dbraw/zinc/05/60/07/564056007.db2.gz	WXRCQADVBJRAON-HDGUCRAISA-N	-1	0	346.467	3.580	50	0		EHAARM
CC1(C)[C@H](C(F)(F)F)CCN1C(=O)CCc1ccc(C(=O)[O-])cc1	ZINC000263578889	564060609	/nfs/dbraw/zinc/06/06/09/564060609.db2.gz	TXZSAXWIKQQVBK-CYBMUJFWSA-N	-1	0	343.345	3.507	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3cc(F)ccc3n2)cc1OC	ZINC000001459161	564072963	/nfs/dbraw/zinc/07/29/63/564072963.db2.gz	FQCFUZZUOYLMNU-UHFFFAOYSA-N	-1	0	327.311	3.756	50	0		EHAARM
O=P([O-])([O-])[C@H]([NH2+]C[C@H]1CCCc2ccccc21)c1ccc(F)cc1	ZINC000012949508	564079772	/nfs/dbraw/zinc/07/97/72/564079772.db2.gz	IZVZWRXPGQHJMQ-QAPCUYQASA-N	-1	0	349.342	3.712	50	0		EHAARM
Cc1cc(F)ccc1S(=O)(=O)[N-]c1cc(-c2ccccc2)on1	ZINC000075093574	564080021	/nfs/dbraw/zinc/08/00/21/564080021.db2.gz	RHTUMZLQDRJUSL-UHFFFAOYSA-N	-1	0	332.356	3.590	50	0		EHAARM
CCCC[C@H](C(=O)[O-])[C@@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002226286	564124457	/nfs/dbraw/zinc/12/44/57/564124457.db2.gz	OUABTEZBKXLQFA-HOCLYGCPSA-N	-1	0	343.427	3.728	50	0		EHAARM
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N[C@@H](CC(=O)[O-])c1cccs1	ZINC000095989357	564144102	/nfs/dbraw/zinc/14/41/02/564144102.db2.gz	GFMAPRHJICAGKC-WOPDTQHZSA-N	-1	0	335.450	3.554	50	0		EHAARM
COC(=O)c1ccc(/C=C\c2cc(C(=O)[O-])c3ccc(F)cc3n2)o1	ZINC000096188183	564145930	/nfs/dbraw/zinc/14/59/30/564145930.db2.gz	AOFUWMFQAFCPJS-ARJAWSKDSA-N	-1	0	341.294	3.622	50	0		EHAARM
Cc1nn(C)c(Cl)c1/C=C\c1cc(C(=O)[O-])c2ccccc2n1	ZINC000096297759	564146606	/nfs/dbraw/zinc/14/66/06/564146606.db2.gz	FLXKTUFOFKVJQR-FPLPWBNLSA-N	-1	0	327.771	3.799	50	0		EHAARM
Cc1ccc(C[C@H](C(=O)Nc2ccc(F)cc2)[C@@H](C)C(=O)[O-])cc1	ZINC000002910433	564153055	/nfs/dbraw/zinc/15/30/55/564153055.db2.gz	BBRLINWIXHPXMR-DYVFJYSZSA-N	-1	0	329.371	3.652	50	0		EHAARM
O=C([O-])C1CCN(C(=O)N[C@H](c2cccc(F)c2)C2CCCC2)CC1	ZINC000263198531	564160449	/nfs/dbraw/zinc/16/04/49/564160449.db2.gz	HDTSUGQOPVLROU-KRWDZBQOSA-N	-1	0	348.418	3.563	50	0		EHAARM
Cc1ccc([C@@H]2[C@H](C(=O)[O-])CCC(=O)N2[C@@H](C)c2cc(C)oc2C)o1	ZINC000071857726	564176087	/nfs/dbraw/zinc/17/60/87/564176087.db2.gz	ZWQLKOMDUDWMDL-WRSAYESZSA-N	-1	0	345.395	3.923	50	0		EHAARM
Cc1cc(C)c(C(=O)[O-])cc1NC(=O)[C@H]1CCc2cc(F)ccc21	ZINC000566020710	974593822	/nfs/dbraw/zinc/59/38/22/974593822.db2.gz	AWTBNGMMDZBRFW-HNNXBMFYSA-N	-1	0	327.355	3.809	50	0		EHAARM
Cc1cccc(C(=O)N2C[C@H](C(=O)[O-])[C@H](c3ccccc3)C2)c1Cl	ZINC000262858889	1029646690	/nfs/dbraw/zinc/64/66/90/1029646690.db2.gz	IORORRBVCACOOV-HOTGVXAUSA-N	-1	0	343.810	3.589	50	0		EHAARM
COc1cc(/C=C\c2nc3c(cccc3C(=O)[O-])o2)cc(OC)c1	ZINC000439274381	1035600182	/nfs/dbraw/zinc/60/01/82/1035600182.db2.gz	MBFQGZFCYDYWCA-SREVYHEPSA-N	-1	0	325.320	3.714	50	0		EHAARM
CC[C@H](C)n1ncc2c1nc(/C=C/c1cncs1)cc2C(=O)[O-]	ZINC000566305721	1130804556	/nfs/dbraw/zinc/80/45/56/1130804556.db2.gz	ZJFVIMWTSNLBCX-YEZKRMTDSA-N	-1	0	328.397	3.727	50	0		EHAARM
O=C([O-])c1ccc2nc(/C=C\c3nccn3CC(F)(F)F)ccc2c1	ZINC000221850752	1138221025	/nfs/dbraw/zinc/22/10/25/1138221025.db2.gz	UXBOZTWYRTYRJV-XQRVVYSFSA-N	-1	0	347.296	3.862	50	0		EHAARM
Cc1ccc(C(C)C)cc1S(=O)(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000053944080	214205817	/nfs/dbraw/zinc/20/58/17/214205817.db2.gz	DQFVQRBTYKTPCC-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
C[C@H](NC(=O)c1ccccc1C(=O)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000004675976	210245257	/nfs/dbraw/zinc/24/52/57/210245257.db2.gz	UTKYOJIITUTECN-PGBBXINNSA-N	-1	0	327.424	3.720	50	0		EHAARM
C[C@H](Oc1cc2oc(=O)cc(-c3ccccc3)c2cc1Cl)C(=O)[O-]	ZINC000004652441	210237980	/nfs/dbraw/zinc/23/79/80/210237980.db2.gz	IHPVIWJZZRTWJJ-JTQLQIEISA-N	-1	0	344.750	3.965	50	0		EHAARM
O=C([O-])CCSc1nc(-c2ccc(F)cc2)cc(C(F)(F)F)n1	ZINC000002513420	209860375	/nfs/dbraw/zinc/86/03/75/209860375.db2.gz	DHRILOMJJCJGHF-UHFFFAOYSA-N	-1	0	346.305	3.868	50	0		EHAARM
CC(C)C[C@@H](C(=O)[O-])[C@@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002272712	209836722	/nfs/dbraw/zinc/83/67/22/209836722.db2.gz	DFNZDMUCEFEEPF-GOEBONIOSA-N	-1	0	343.427	3.584	50	0		EHAARM
CCC(=O)Nc1cccc(NC(=O)CC2(C(=O)[O-])CCCCC2)c1C	ZINC000040497390	213322165	/nfs/dbraw/zinc/32/21/65/213322165.db2.gz	OMYCMZKJRXUPCV-UHFFFAOYSA-N	-1	0	346.427	3.707	50	0		EHAARM
CCOc1ccc(NC(=O)C[C@H](Cc2ccc(C)cc2)C(=O)[O-])cc1	ZINC000035141840	213009756	/nfs/dbraw/zinc/00/97/56/213009756.db2.gz	DWDCNHAXXBTHKL-INIZCTEOSA-N	-1	0	341.407	3.666	50	0		EHAARM
Cc1cc(C)cc(C(=O)N2CC[C@@H](Cc3cccc(C(=O)[O-])c3)C2)c1	ZINC000072137345	216024934	/nfs/dbraw/zinc/02/49/34/216024934.db2.gz	NCMUNFYMKQWAKK-KRWDZBQOSA-N	-1	0	337.419	3.706	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2SCCN2C(=O)CCc2ccccc2)cc1	ZINC000206580026	241044837	/nfs/dbraw/zinc/04/48/37/241044837.db2.gz	HPUXTGZELVTEMB-SFHVURJKSA-N	-1	0	341.432	3.592	50	0		EHAARM
Cc1nc(-c2csc(S(=O)(=O)[N-]c3ccc(C)c(C)c3)c2)no1	ZINC000021701779	212240068	/nfs/dbraw/zinc/24/00/68/212240068.db2.gz	CGSQPJWHJRJPGI-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
C[C@H](CC(=O)N1CC[C@@](C)(C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237542071	242682415	/nfs/dbraw/zinc/68/24/15/242682415.db2.gz	ZZZMIGYLJPDDQB-BDJLRTHQSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)/C(Cl)=C/c1ccc(F)c(F)c1	ZINC000077024566	216834721	/nfs/dbraw/zinc/83/47/21/216834721.db2.gz	OAZNEFKJYXEBEO-XFFZJAGNSA-N	-1	0	337.709	3.881	50	0		EHAARM
Cc1cccc(OCC(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)c1C	ZINC000020144000	212105616	/nfs/dbraw/zinc/10/56/16/212105616.db2.gz	UGAVHIMHLZZIAB-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)c2ccccc12	ZINC000012291079	211332922	/nfs/dbraw/zinc/33/29/22/211332922.db2.gz	PFKZQVMKFNHIFB-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
O=C([O-])c1cccc(N2C(=O)/C(=C/c3ccsc3)SC2=S)c1	ZINC000096669495	218886558	/nfs/dbraw/zinc/88/65/58/218886558.db2.gz	IYPQFMGXRUVGIG-SDQBBNPISA-N	-1	0	347.442	3.852	50	0		EHAARM
CCOc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1ccncc1	ZINC000004913680	210321353	/nfs/dbraw/zinc/32/13/53/210321353.db2.gz	UDMBZCGQSVNJEB-UHFFFAOYSA-N	-1	0	334.441	3.579	50	0		EHAARM
Cc1ccc(OCC(=O)Nc2cc(Cl)ccc2C(=O)[O-])cc1C	ZINC000004825222	210289460	/nfs/dbraw/zinc/28/94/60/210289460.db2.gz	DABQRLIUIXPPIO-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
CCOc1ccc(CN=c2[n-]nc(-c3ccc(C)cc3C)o2)cc1F	ZINC000328590528	258044091	/nfs/dbraw/zinc/04/40/91/258044091.db2.gz	LJASUZSVPVTQDV-UHFFFAOYSA-N	-1	0	341.386	3.925	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cccc2cc(C)cnc21	ZINC000012536055	258054728	/nfs/dbraw/zinc/05/47/28/258054728.db2.gz	PAGORBIOBXUGPK-UHFFFAOYSA-N	-1	0	342.420	3.661	50	0		EHAARM
O=S(=O)([N-]c1nc2ccc(F)cc2s1)c1ccc(F)cc1F	ZINC000009468764	471717170	/nfs/dbraw/zinc/71/71/70/471717170.db2.gz	MNQJUIQNMOABIO-UHFFFAOYSA-N	-1	0	344.339	3.514	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(SC)c1	ZINC000006706899	563581105	/nfs/dbraw/zinc/58/11/05/563581105.db2.gz	AFPSFKPXAWYTAY-UHFFFAOYSA-N	-1	0	343.857	3.871	50	0		EHAARM
Cc1cc(C(=O)N2CCC[C@H](CCC(=O)[O-])C2)c(Cl)cc1F	ZINC000237694437	563993628	/nfs/dbraw/zinc/99/36/28/563993628.db2.gz	PMNFMTOSBJXWAS-LLVKDONJSA-N	-1	0	327.783	3.505	50	0		EHAARM
O=C([O-])c1nn2c(c1Cl)N[C@H](c1ccccc1)C[C@H]2C(F)(F)F	ZINC000000226825	563263106	/nfs/dbraw/zinc/26/31/06/563263106.db2.gz	RQMWBEVLHVOEIT-IUCAKERBSA-N	-1	0	345.708	3.895	50	0		EHAARM
O=Cc1ccc(OCc2ccc(C(=O)[O-])cc2)c(Br)c1	ZINC000000453560	563322257	/nfs/dbraw/zinc/32/22/57/563322257.db2.gz	CDUAXQNMFJFQAI-UHFFFAOYSA-N	-1	0	335.153	3.539	50	0		EHAARM
CC[C@H](C)Sc1nc2ccc(NC(=O)/C=C/C(=O)[O-])cc2s1	ZINC000001573710	563393217	/nfs/dbraw/zinc/39/32/17/563393217.db2.gz	ZYNLXGWOIYOXPN-UCUJLANTSA-N	-1	0	336.438	3.766	50	0		EHAARM
CCCCc1c([O-])n(-c2ccccc2)c(=O)n(-c2ccccc2)c1=O	ZINC000002031198	563418685	/nfs/dbraw/zinc/41/86/85/563418685.db2.gz	BDXKIVHGIVLZBS-UHFFFAOYSA-N	-1	0	336.391	3.993	50	0		EHAARM
Cc1ccc(CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)[O-])cc1	ZINC000002382541	563430932	/nfs/dbraw/zinc/43/09/32/563430932.db2.gz	LIUGCVMBJYHYNA-CQSZACIVSA-N	-1	0	339.457	3.596	50	0		EHAARM
CC(C)(C)c1ccc(Cn2c3ccccc3nc2S(=O)(=O)[O-])cc1	ZINC000006244591	563562345	/nfs/dbraw/zinc/56/23/45/563562345.db2.gz	JMFFDBMRYSEQSB-UHFFFAOYSA-N	-1	0	344.436	3.629	50	0		EHAARM
Cc1cc(C)cc(NC(=O)Cc2ccc(OC(C)(C)C(=O)[O-])cc2)c1	ZINC000001481819	563861070	/nfs/dbraw/zinc/86/10/70/563861070.db2.gz	BNFRJXLZYUTIII-UHFFFAOYSA-N	-1	0	341.407	3.727	50	0	investigational	EHAARM
CCOCc1ccccc1Cn1c(=O)c2ccccc2[n-]c1=S	ZINC000027223346	563895050	/nfs/dbraw/zinc/89/50/50/563895050.db2.gz	FNZRXVVJPHFXKM-UHFFFAOYSA-N	-1	0	326.421	3.644	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2Cl)C1	ZINC000043583356	563912985	/nfs/dbraw/zinc/91/29/85/563912985.db2.gz	WGIGCMSFORXDJA-JTQLQIEISA-N	-1	0	330.211	3.710	50	0		EHAARM
COc1ccc(-c2csc(NC(=O)c3ccco3)c2C(=O)[O-])cc1	ZINC000002552556	563917981	/nfs/dbraw/zinc/91/79/81/563917981.db2.gz	LUGAMWRCQRORSP-UHFFFAOYSA-N	-1	0	343.360	3.967	50	0		EHAARM
O=C([O-])C1(CC(=O)Nc2ccc3oc(C4CC4)nc3c2)CCCC1	ZINC000071804949	563922545	/nfs/dbraw/zinc/92/25/45/563922545.db2.gz	NKIPFIQULHFKGI-UHFFFAOYSA-N	-1	0	328.368	3.679	50	0		EHAARM
O=C([O-])c1ccc(O[C@H](O)Cn2c3ccccc3c3ccccc32)cc1	ZINC000000032696	563967773	/nfs/dbraw/zinc/96/77/73/563967773.db2.gz	PKMCFEARKYKHNA-FQEVSTJZSA-N	-1	0	347.370	3.890	50	0		EHAARM
COc1cc(C(=O)N2CCCC[C@@H]2c2ccc(F)cc2)ccc1O	ZINC000077504209	563970027	/nfs/dbraw/zinc/97/00/27/563970027.db2.gz	WMQHAONHVSCHDG-MRXNPFEDSA-N	-1	0	329.371	3.907	50	0		EHAARM
CCN(C(=O)Cc1c2ccccc2[nH]c1C(=O)[O-])c1ccccc1C	ZINC000000201595	563988381	/nfs/dbraw/zinc/98/83/81/563988381.db2.gz	JVRSWCDBGQUTGS-UHFFFAOYSA-N	-1	0	336.391	3.770	50	0		EHAARM
COc1ccc(C[C@H](CC(=O)[O-])C(=O)Nc2ccc(Cl)cc2)cc1	ZINC000005170681	563999881	/nfs/dbraw/zinc/99/98/81/563999881.db2.gz	RXTJZLAISJKFDV-CYBMUJFWSA-N	-1	0	347.798	3.621	50	0		EHAARM
Cc1ccc(-c2cc(=O)n(-c3cc(C)nc(-c4ccccc4)n3)[n-]2)cc1	ZINC000005363044	564003085	/nfs/dbraw/zinc/00/30/85/564003085.db2.gz	NORFLGQSEYFWFW-UHFFFAOYSA-N	-1	0	342.402	3.901	50	0		EHAARM
CC[C@@H](C)[C@@H](Nc1nc(C)nc2sc3c(c21)CCCC3)C(=O)[O-]	ZINC000005574917	564005749	/nfs/dbraw/zinc/00/57/49/564005749.db2.gz	VKNRJLBBRIYWOZ-YMTOWFKASA-N	-1	0	333.457	3.790	50	0		EHAARM
Cc1cc(C)cc(OCC(=O)Nc2ccc(Cl)cc2C(=O)[O-])c1	ZINC000002881591	564013492	/nfs/dbraw/zinc/01/34/92/564013492.db2.gz	BIUKFYYMNLKLGP-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cc1)c1cc(-c2ccno2)cs1	ZINC000044893508	564027520	/nfs/dbraw/zinc/02/75/20/564027520.db2.gz	OTLRRQHXIDZDFG-UHFFFAOYSA-N	-1	0	340.813	3.857	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CC2)[C@@H]1c1ccc(Cl)cc1	ZINC000045923060	564028902	/nfs/dbraw/zinc/02/89/02/564028902.db2.gz	PRNVLCNPBOLZHG-DLBZAZTESA-N	-1	0	341.794	3.868	50	0		EHAARM
Cc1ccc2c(CC(=O)N[C@H](C(=O)[O-])c3ccccc3)coc2c1C	ZINC000237876355	564051449	/nfs/dbraw/zinc/05/14/49/564051449.db2.gz	UDVYCIPMLOHBRP-SFHVURJKSA-N	-1	0	337.375	3.534	50	0		EHAARM
CCc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2N(C)C)s1	ZINC000083825527	564063496	/nfs/dbraw/zinc/06/34/96/564063496.db2.gz	JNMMRTMDKLLVMQ-UHFFFAOYSA-N	-1	0	344.889	3.831	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c(C)c1	ZINC000075351841	564082010	/nfs/dbraw/zinc/08/20/10/564082010.db2.gz	FYKLFAMGRJBWJD-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
O=c1c(-c2nc(-c3cccc(F)c3)no2)c[n-]c2ccc(F)cc21	ZINC000075441541	564084816	/nfs/dbraw/zinc/08/48/16/564084816.db2.gz	KWJRRUWTIPLQJY-UHFFFAOYSA-N	-1	0	325.274	3.523	50	0		EHAARM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3ccc(C)cc3C)c(C)o2)n[nH]1	ZINC000075519126	564087647	/nfs/dbraw/zinc/08/76/47/564087647.db2.gz	XDQFVFWJUULDNF-UHFFFAOYSA-N	-1	0	345.424	3.704	50	0		EHAARM
CCN(CC)c1ccc(C(=O)[O-])cc1NC(=O)c1ccc(C)cc1	ZINC000064820305	564096580	/nfs/dbraw/zinc/09/65/80/564096580.db2.gz	RPCYNAIYASPOLP-UHFFFAOYSA-N	-1	0	326.396	3.792	50	0		EHAARM
CC(C)(C)c1ccc(S(=O)(=O)[N-]c2noc3ccccc32)cc1	ZINC000006800803	564098227	/nfs/dbraw/zinc/09/82/27/564098227.db2.gz	KYSDPZQESWJPLY-UHFFFAOYSA-N	-1	0	330.409	3.926	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)o2)cc1Cl	ZINC000064958661	564098516	/nfs/dbraw/zinc/09/85/16/564098516.db2.gz	IIIGURMFUFWJDL-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
Cc1cc([N-]S(=O)(=O)c2cn(C(C)C)c3ncccc23)ccc1F	ZINC000065242220	564103385	/nfs/dbraw/zinc/10/33/85/564103385.db2.gz	CRRPVKKUEDUCGT-UHFFFAOYSA-N	-1	0	347.415	3.866	50	0		EHAARM
O=C(Nc1ccc(-c2nccs2)cc1)c1s[n-]c(=O)c1Cl	ZINC000252492035	564119576	/nfs/dbraw/zinc/11/95/76/564119576.db2.gz	MBELBEFFTKGYQX-UHFFFAOYSA-N	-1	0	337.813	3.878	50	0		EHAARM
COc1ccc(CCNC(=S)[N-]c2ccccc2SC)cc1	ZINC000007814618	564124000	/nfs/dbraw/zinc/12/40/00/564124000.db2.gz	QHSQCSHQNBLLQS-UHFFFAOYSA-N	-1	0	332.494	3.946	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1	ZINC000096479739	564148572	/nfs/dbraw/zinc/14/85/72/564148572.db2.gz	SMHBKWURIKRXSW-SFHVURJKSA-N	-1	0	341.382	3.820	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@H]2CCCC[C@@H]2C(F)(F)F)cc1	ZINC000096479744	564148584	/nfs/dbraw/zinc/14/85/84/564148584.db2.gz	SLGWRFLXCDWQDC-KBPBESRZSA-N	-1	0	343.345	3.555	50	0		EHAARM
Cc1cc(C)c(NC(=O)Nc2cccc(CCC(=O)[O-])c2)c(C)n1	ZINC000263110161	564159770	/nfs/dbraw/zinc/15/97/70/564159770.db2.gz	VQGXBKVDKJAZGS-UHFFFAOYSA-N	-1	0	327.384	3.668	50	0		EHAARM
O=C([O-])[C@@H]1CCN(C(=O)[C@@H]2CCCc3ccccc32)c2ccccc21	ZINC000327396515	971395661	/nfs/dbraw/zinc/39/56/61/971395661.db2.gz	STARTMRHHKVCMM-QZTJIDSGSA-N	-1	0	335.403	3.712	50	0		EHAARM
C[C@H](C(=O)[O-])c1cccc(NC(=O)[C@@H]2CCc3cc(F)ccc32)c1	ZINC000574651742	974786604	/nfs/dbraw/zinc/78/66/04/974786604.db2.gz	IQSQEEVGWQKKOO-APPDUMDISA-N	-1	0	327.355	3.682	50	0		EHAARM
Cc1c([N-]S(=O)(=O)c2ccc(Cl)s2)cnn1C1CCCC1	ZINC000194226412	1023910421	/nfs/dbraw/zinc/91/04/21/1023910421.db2.gz	DJMGGSAPNSPPCM-UHFFFAOYSA-N	-1	0	345.877	3.822	50	0		EHAARM
O=C([O-])Cc1ccc(-c2cc(F)ccc2OC[C@@H]2CCOC2)cc1F	ZINC000657204591	1024096215	/nfs/dbraw/zinc/09/62/15/1024096215.db2.gz	PVUKVUTVFWLFQJ-GFCCVEGCSA-N	-1	0	348.345	3.674	50	0		EHAARM
O=C([O-])c1ccc2[nH]c(-c3cccc(Oc4ncccn4)c3)nc2c1	ZINC000055369431	214312541	/nfs/dbraw/zinc/31/25/41/214312541.db2.gz	YHMFUHKPWUGSIO-UHFFFAOYSA-N	-1	0	332.319	3.510	50	0		EHAARM
CC[C@H](C)N(Cc1ccc(Cl)cc1)C(=O)CCc1cc(=O)[n-]o1	ZINC000055393477	214317846	/nfs/dbraw/zinc/31/78/46/214317846.db2.gz	USANBFHWJGJUHC-LBPRGKRZSA-N	-1	0	336.819	3.794	50	0		EHAARM
O=C([O-])C1(NC(=O)/C=C/c2ccc(Cl)cc2Cl)CCCC1	ZINC000037419944	213147491	/nfs/dbraw/zinc/14/74/91/213147491.db2.gz	LLYYNEASXMZKRA-GQCTYLIASA-N	-1	0	328.195	3.520	50	0		EHAARM
O=c1cc(C(F)(F)F)[n-]c2ccc(I)cc12	ZINC000036379873	213092172	/nfs/dbraw/zinc/09/21/72/213092172.db2.gz	MGVPAKBHXXRIEL-UHFFFAOYSA-N	-1	0	339.054	3.564	50	0		EHAARM
O=C([O-])c1cc2n(n1)[C@H](C(F)(F)F)C[C@@H](c1ccc(Cl)cc1)N2	ZINC000000226878	209496469	/nfs/dbraw/zinc/49/64/69/209496469.db2.gz	QJWIAWGYDPQGOS-ONGXEEELSA-N	-1	0	345.708	3.895	50	0		EHAARM
O=C([O-])COc1ccc2oc(-c3ccc(Cl)cc3)cc(=O)c2c1	ZINC000000151189	209454337	/nfs/dbraw/zinc/45/43/37/209454337.db2.gz	QRZKULJYERGMBQ-UHFFFAOYSA-N	-1	0	330.723	3.577	50	0		EHAARM
COc1cc(C)c(C)cc1S(=O)(=O)[N-]c1cnc2ccccc2c1	ZINC000072414261	216204707	/nfs/dbraw/zinc/20/47/07/216204707.db2.gz	INTPMFSTHZEBAO-UHFFFAOYSA-N	-1	0	342.420	3.661	50	0		EHAARM
Cc1cc(C)cc(Oc2coc3cc(OCC(=O)[O-])ccc3c2=O)c1	ZINC000000064973	209396907	/nfs/dbraw/zinc/39/69/07/209396907.db2.gz	RIHUCQNJALFVGU-UHFFFAOYSA-N	-1	0	340.331	3.666	50	0		EHAARM
CCOC(=O)c1c2cc(OCC(=O)[O-])ccc2oc1-c1ccccc1	ZINC000000044640	209386554	/nfs/dbraw/zinc/38/65/54/209386554.db2.gz	FKZWOGDCHZTJPO-UHFFFAOYSA-N	-1	0	340.331	3.740	50	0		EHAARM
CCOc1cccc2c1Oc1[n-]n(-c3ccc(CC)cc3)c(=O)c1C2	ZINC000021774770	212247949	/nfs/dbraw/zinc/24/79/49/212247949.db2.gz	CAAOZQQWEGFUDL-UHFFFAOYSA-N	-1	0	336.391	3.823	50	0		EHAARM
CSc1cccc(NC(=O)C[C@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000013253266	211537521	/nfs/dbraw/zinc/53/75/21/211537521.db2.gz	NSRDBPCWYWTKRJ-SFHVURJKSA-N	-1	0	329.421	3.780	50	0		EHAARM
CCC[C@]1(C(=O)[O-])CCCN(C(=O)c2cc(Cl)ccc2F)C1	ZINC000091807793	218069038	/nfs/dbraw/zinc/06/90/38/218069038.db2.gz	QWROYBORVSSVNO-INIZCTEOSA-N	-1	0	327.783	3.586	50	0		EHAARM
Cc1ccc2nc([N-]c3ncc4c(n3)C[C@@H](C)CC4=O)nc(C)c2c1	ZINC000010157461	211151724	/nfs/dbraw/zinc/15/17/24/211151724.db2.gz	XHMDFOFSMPUHGP-LLVKDONJSA-N	-1	0	333.395	3.545	50	0		EHAARM
CC(C)(C)OC(=O)Nc1ccc(Cc2nc(C(=O)[O-])cs2)cc1	ZINC000095348145	218282819	/nfs/dbraw/zinc/28/28/19/218282819.db2.gz	GLVXYQYIKYHKHG-UHFFFAOYSA-N	-1	0	334.397	3.779	50	0		EHAARM
O=C([O-])c1cc(-c2cccs2)nc2nc(N3CCCC3)sc21	ZINC000005937334	210562105	/nfs/dbraw/zinc/56/21/05/210562105.db2.gz	HNQVBHDLRDEJCP-UHFFFAOYSA-N	-1	0	331.422	3.718	50	0		EHAARM
Cc1c2ccc(O[C@@H](C)C(=O)[O-])cc2oc(=O)c1Cc1ccccc1	ZINC000005548142	210486506	/nfs/dbraw/zinc/48/65/06/210486506.db2.gz	SBSLUCQDRXEBCP-ZDUSSCGKSA-N	-1	0	338.359	3.544	50	0		EHAARM
Cc1cc(C)cc(C[C@@H](C(=O)Nc2ccccc2)[C@@H](C)C(=O)[O-])c1	ZINC000000037847	208554694	/nfs/dbraw/zinc/55/46/94/208554694.db2.gz	DDUJKVMTEJMQQH-CRAIPNDOSA-N	-1	0	325.408	3.822	50	0		EHAARM
O=C([O-])c1cc(Cl)ccc1NC(=O)c1ccc(Br)o1	ZINC000004842517	210295814	/nfs/dbraw/zinc/29/58/14/210295814.db2.gz	VMFMRNJFFCQIOQ-UHFFFAOYSA-N	-1	0	344.548	3.646	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1	ZINC000004748878	210269213	/nfs/dbraw/zinc/26/92/13/210269213.db2.gz	XLCGWOVMXCXCHL-CQSZACIVSA-N	-1	0	338.190	3.939	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)C2(Cc3ccccc3)CCC2)C1	ZINC000097045127	258068037	/nfs/dbraw/zinc/06/80/37/258068037.db2.gz	RQSBBTQXDYZMKI-QGZVFWFLSA-N	-1	0	329.440	3.503	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(C)c1	ZINC000005508699	563535698	/nfs/dbraw/zinc/53/56/98/563535698.db2.gz	TUNOIFFFKWCNBE-UHFFFAOYSA-N	-1	0	325.817	3.848	50	0		EHAARM
O=S(=O)([N-]c1ccccn1)c1ccc(C(F)(F)F)cc1Cl	ZINC000000107023	471324388	/nfs/dbraw/zinc/32/43/88/471324388.db2.gz	SIVSDSCNQXXWEB-UHFFFAOYSA-N	-1	0	336.722	3.555	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)c2cccc3c2C(=O)c2ccccc2-3)c1	ZINC000000075209	563216850	/nfs/dbraw/zinc/21/68/50/563216850.db2.gz	ASDYJRQOOWNXSU-UHFFFAOYSA-N	-1	0	343.338	3.849	50	0		EHAARM
COc1cc(Cl)c(C)cc1[N-]S(=O)(=O)c1ccc(C)cc1	ZINC000000145434	563244154	/nfs/dbraw/zinc/24/41/54/563244154.db2.gz	RDAXQBQFUSAXPR-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
O=C([O-])CCC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000000150859	563246098	/nfs/dbraw/zinc/24/60/98/563246098.db2.gz	GJVICDICBOISAR-UHFFFAOYSA-N	-1	0	329.196	3.528	50	0		EHAARM
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000000196904	563257952	/nfs/dbraw/zinc/25/79/52/563257952.db2.gz	ZKZWYIXNSUJZGP-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)[C@@H]2CC[C@](C)(C(=O)[O-])C2(C)C)cc1	ZINC000000223913	563262632	/nfs/dbraw/zinc/26/26/32/563262632.db2.gz	DUOIEPVTIVMMNP-OXJNMPFZSA-N	-1	0	346.471	3.998	50	0		EHAARM
Cc1nc2cc(C(=O)[O-])ccc2n1-c1ccc(Br)cc1	ZINC000000266816	563268725	/nfs/dbraw/zinc/26/87/25/563268725.db2.gz	KYXHXVCKYFDHMK-UHFFFAOYSA-N	-1	0	331.169	3.795	50	0		EHAARM
CC(=O)Oc1cccc(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)c1	ZINC000000313496	563281717	/nfs/dbraw/zinc/28/17/17/563281717.db2.gz	SBHQCVVFIQJANM-UHFFFAOYSA-N	-1	0	340.162	3.877	50	0		EHAARM
CC(C)(C)OC(=O)N1[C@H](C(=O)[O-])CS[C@@H]1c1ccc(Cl)cc1	ZINC000001406904	563388156	/nfs/dbraw/zinc/38/81/56/563388156.db2.gz	MCVPXTHCXZFQMW-NWDGAFQWSA-N	-1	0	343.832	3.776	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])c1cccc(C(F)(F)F)c1	ZINC000002505696	563434915	/nfs/dbraw/zinc/43/49/15/563434915.db2.gz	UPKLBXIBSSZUID-NSHDSACASA-N	-1	0	333.306	3.746	50	0		EHAARM
Cc1ccc(CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)[O-])cc1	ZINC000002571896	563442593	/nfs/dbraw/zinc/44/25/93/563442593.db2.gz	LIUGCVMBJYHYNA-AWEZNQCLSA-N	-1	0	339.457	3.596	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1ccc(Cl)c(Cl)c1	ZINC000002575636	563442606	/nfs/dbraw/zinc/44/26/06/563442606.db2.gz	WJEUUKADFJNOHW-JTQLQIEISA-N	-1	0	348.226	3.904	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])c1ccc(C(F)(F)F)cc1	ZINC000002585859	563443597	/nfs/dbraw/zinc/44/35/97/563443597.db2.gz	WJMVMQYNFZQHGW-LLVKDONJSA-N	-1	0	333.306	3.746	50	0		EHAARM
O=S(=O)(Cc1ccc(Cl)cc1)[N-]c1nc2ccccc2s1	ZINC000002877142	563460189	/nfs/dbraw/zinc/46/01/89/563460189.db2.gz	CMRQWUAUYLSYTJ-UHFFFAOYSA-N	-1	0	338.841	3.892	50	0		EHAARM
O=C([O-])COc1ccc2cc(-c3ccc(Cl)cc3)c(=O)oc2c1	ZINC000005234672	563523754	/nfs/dbraw/zinc/52/37/54/563523754.db2.gz	VGGNXQBIPPKTJU-UHFFFAOYSA-N	-1	0	330.723	3.577	50	0		EHAARM
Cc1ccc(F)cc1[N-]S(=O)(=O)c1ccccc1OC(F)(F)F	ZINC000012985571	563682040	/nfs/dbraw/zinc/68/20/40/563682040.db2.gz	NTPUJUSYCUSBDV-UHFFFAOYSA-N	-1	0	349.305	3.834	50	0		EHAARM
COc1ccc(Cc2nnc(Nc3ccc(Cl)cc3)[n-]c2=O)cc1	ZINC000013139103	563690865	/nfs/dbraw/zinc/69/08/65/563690865.db2.gz	RTESBNOPOFGRAQ-UHFFFAOYSA-N	-1	0	342.786	3.574	50	0		EHAARM
CCCOc1cc(Br)c(/C=C/C(=O)[O-])cc1OCC	ZINC000013747608	563720816	/nfs/dbraw/zinc/72/08/16/563720816.db2.gz	DMZNZLJRORDAHA-AATRIKPKSA-N	-1	0	329.190	3.734	50	0		EHAARM
O=c1nc(Nc2ccc(Cl)c(Cl)c2)[n-]nc1Cc1ccccc1	ZINC000016777424	563823313	/nfs/dbraw/zinc/82/33/13/563823313.db2.gz	CVICZJLNLXXWCY-UHFFFAOYSA-N	-1	0	347.205	3.806	50	0		EHAARM
O=C(N[C@@H](c1ccccc1)c1ccccn1)c1ccc([O-])c(Cl)c1	ZINC000029711731	563907993	/nfs/dbraw/zinc/90/79/93/563907993.db2.gz	QTFKAJYHJNLMPJ-SFHVURJKSA-N	-1	0	338.794	3.960	50	0		EHAARM
CC(C)(C)OC(=O)Nc1ccc(Oc2ccc(C(=O)[O-])cn2)cc1	ZINC000045796203	563929416	/nfs/dbraw/zinc/92/94/16/563929416.db2.gz	BULXBWQFRPBRFP-UHFFFAOYSA-N	-1	0	330.340	3.919	50	0		EHAARM
[O-]c1cc(Cc2ccccc2)c(Br)nc1Br	ZINC000000506887	564001797	/nfs/dbraw/zinc/00/17/97/564001797.db2.gz	CIUSVVJJYMAHGT-UHFFFAOYSA-N	-1	0	343.018	3.903	50	0		EHAARM
O=S(=O)([N-]c1ccccc1OCc1cscn1)c1ccccc1	ZINC000058342212	563942982	/nfs/dbraw/zinc/94/29/82/563942982.db2.gz	MQEBREPHQIXROG-UHFFFAOYSA-N	-1	0	346.433	3.523	50	0		EHAARM
CN(Cc1csc(-c2cccs2)n1)Cc1ncccc1C(=O)[O-]	ZINC000065461865	563961128	/nfs/dbraw/zinc/96/11/28/563961128.db2.gz	IEDLLFPZDNQYFH-UHFFFAOYSA-N	-1	0	345.449	3.597	50	0		EHAARM
Cc1ccc2nc(C)cc(C(=O)NCc3ccc(C(=O)[O-])s3)c2c1	ZINC000095519443	563977372	/nfs/dbraw/zinc/97/73/72/563977372.db2.gz	WDTZUVQSHZXOJT-UHFFFAOYSA-N	-1	0	340.404	3.541	50	0		EHAARM
CC[C@](C)(CC(=O)[O-])NC(=O)c1sc2nc(C)cc(C)c2c1C	ZINC000119562689	563982793	/nfs/dbraw/zinc/98/27/93/563982793.db2.gz	AIFHUMQBIUIPNX-QGZVFWFLSA-N	-1	0	334.441	3.595	50	0		EHAARM
Cc1c(C)c2ccc(OCc3ccc(C(=O)[O-])o3)c(C)c2oc1=O	ZINC000000200931	563988330	/nfs/dbraw/zinc/98/83/30/563988330.db2.gz	GBLVKBRGKYZKBV-UHFFFAOYSA-N	-1	0	328.320	3.588	50	0		EHAARM
Cc1ccc2cc(C(=O)N3CCC[C@H](CCC(=O)[O-])C3)c(C)nc2c1	ZINC000237888379	563994132	/nfs/dbraw/zinc/99/41/32/563994132.db2.gz	IWOJFXYNLXJRIH-OAHLLOKOSA-N	-1	0	340.423	3.569	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc3ccc(Cl)cc3[nH]2)C1	ZINC000237969137	563994328	/nfs/dbraw/zinc/99/43/28/563994328.db2.gz	FAICWBVEFUUSEK-NSHDSACASA-N	-1	0	334.803	3.538	50	0		EHAARM
Cc1cc(C)cc(C[C@@H](CC(=O)Nc2ccc(F)cc2)C(=O)[O-])c1	ZINC000000350637	564000170	/nfs/dbraw/zinc/00/01/70/564000170.db2.gz	LGFYFEZOOUFXDL-HNNXBMFYSA-N	-1	0	329.371	3.715	50	0		EHAARM
Cc1nc2c3ccccc3oc2c(N[C@H](C(=O)[O-])c2ccccc2)n1	ZINC000005215508	564001113	/nfs/dbraw/zinc/00/11/13/564001113.db2.gz	ZOPMELGXYYGHSX-HNNXBMFYSA-N	-1	0	333.347	3.922	50	0		EHAARM
COc1ccc(-c2noc(CSc3ccccc3C(=O)[O-])n2)cc1	ZINC000012978296	564019335	/nfs/dbraw/zinc/01/93/35/564019335.db2.gz	FRZHLQXVNVUSKF-UHFFFAOYSA-N	-1	0	342.376	3.736	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2cccc(C(C)C)c2)cc1C(=O)[O-]	ZINC000013265589	564019626	/nfs/dbraw/zinc/01/96/26/564019626.db2.gz	HWNHSLHWWAZSLR-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)COc1ccccc1C(C)C	ZINC000013169988	564019661	/nfs/dbraw/zinc/01/96/61/564019661.db2.gz	KZXZLWHOGMIZAW-UHFFFAOYSA-N	-1	0	327.380	3.834	50	0		EHAARM
CCC[C@H](CC(=O)[O-])NC(=O)c1cc(C(F)(F)F)ccc1Cl	ZINC000220523519	564035945	/nfs/dbraw/zinc/03/59/45/564035945.db2.gz	UMTHGHNSKRZIDV-SECBINFHSA-N	-1	0	337.725	3.732	50	0		EHAARM
O=S(=O)([N-]c1cccc2c[nH]nc21)c1cc(Cl)ccc1Cl	ZINC000001427078	564066808	/nfs/dbraw/zinc/06/68/08/564066808.db2.gz	PEEUUEJUZITNPC-UHFFFAOYSA-N	-1	0	342.207	3.671	50	0		EHAARM
CCn1cc(C(=O)[O-])c(=O)c2cc(F)c(NC3CCCCC3)cc21	ZINC000001430500	564066949	/nfs/dbraw/zinc/06/69/49/564066949.db2.gz	ZTJMOXLHGBTJME-UHFFFAOYSA-N	-1	0	332.375	3.603	50	0		EHAARM
Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(-c2cc[nH]n2)s1	ZINC000075351824	564082021	/nfs/dbraw/zinc/08/20/21/564082021.db2.gz	GOISLAWJHYGBHS-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
CCCCc1ccc([N-]S(=O)(=O)c2cc(OC)ccc2OC)cc1	ZINC000006361909	564085360	/nfs/dbraw/zinc/08/53/60/564085360.db2.gz	LKLGSAQSLXMUKB-UHFFFAOYSA-N	-1	0	349.452	3.847	50	0		EHAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2ccc(Cl)cc2)c1=O	ZINC000065215387	564102854	/nfs/dbraw/zinc/10/28/54/564102854.db2.gz	UFSRJSJQYPKOOA-UHFFFAOYSA-N	-1	0	348.811	3.694	50	0		EHAARM
CC1(C)CN(C(=O)c2cccc(C(=O)[O-])c2)c2cccc(Cl)c21	ZINC000236752818	564117697	/nfs/dbraw/zinc/11/76/97/564117697.db2.gz	IHFNROXQABMWED-UHFFFAOYSA-N	-1	0	329.783	3.976	50	0		EHAARM
CC(=NNc1ccc(Cl)c(C(=O)[O-])c1)c1ccc2c(c1)OCCO2	ZINC000252474933	564118957	/nfs/dbraw/zinc/11/89/57/564118957.db2.gz	OXNKDQPLUVELKT-UHFFFAOYSA-N	-1	0	346.770	3.646	50	0		EHAARM
Cc1nc(-c2ccc([N-]S(=O)(=O)c3cccs3)cc2)cs1	ZINC000007726290	564122304	/nfs/dbraw/zinc/12/23/04/564122304.db2.gz	VAUKSGCOUWPHCU-UHFFFAOYSA-N	-1	0	336.463	3.981	50	0		EHAARM
Cc1noc(Cl)c1CC(=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000095943481	564142094	/nfs/dbraw/zinc/14/20/94/564142094.db2.gz	FWOMAXCCUOHWAS-UHFFFAOYSA-N	-1	0	335.574	3.830	50	0		EHAARM
CC(C)(CC(=O)[O-])CC(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000096405653	564147310	/nfs/dbraw/zinc/14/73/10/564147310.db2.gz	RJRDEHYHZIPBCB-UHFFFAOYSA-N	-1	0	328.368	3.703	50	0		EHAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)c1ccc(-c2ccccc2)[nH]1	ZINC000262191843	564152794	/nfs/dbraw/zinc/15/27/94/564152794.db2.gz	IAWNHGKKYHPIHB-OAHLLOKOSA-N	-1	0	326.396	3.541	50	0		EHAARM
CCC(=O)N1[C@H](CC(C)C)c2[nH]c3ccccc3c2C[C@H]1C(=O)[O-]	ZINC000003147370	564155446	/nfs/dbraw/zinc/15/54/46/564155446.db2.gz	FVEKIDYDEYCOKO-CVEARBPZSA-N	-1	0	328.412	3.503	50	0		EHAARM
C[C@H]1CCCN(c2ccc(NC(=O)c3cccs3)cc2C(=O)[O-])C1	ZINC000058064946	564157407	/nfs/dbraw/zinc/15/74/07/564157407.db2.gz	DXBGEWAWFHDSKF-LBPRGKRZSA-N	-1	0	344.436	3.935	50	0		EHAARM
C[C@@H](Oc1ccccc1)c1nc(C2CC2)nn1-c1ccccc1C(=O)[O-]	ZINC000670473800	564167128	/nfs/dbraw/zinc/16/71/28/564167128.db2.gz	JZIHBVXIYLXCBX-CYBMUJFWSA-N	-1	0	349.390	3.983	50	0		EHAARM
O=C([O-])CCC(=O)N1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1	ZINC000566755576	601739326	/nfs/dbraw/zinc/73/93/26/601739326.db2.gz	QOTXRYOMJJWRLZ-KRWDZBQOSA-N	-1	0	343.810	3.831	50	0		EHAARM
O=C([O-])[C@@H]1C[C@@H](NC(=O)C[C@@H]2CCc3ccccc32)c2ccccc21	ZINC000653330306	954160121	/nfs/dbraw/zinc/16/01/21/954160121.db2.gz	CRNFRWADMYJIOW-GDIGMMSISA-N	-1	0	335.403	3.536	50	0		EHAARM
O=C([O-])c1ccc2c(=O)[nH]c(C(Cl)=Cc3cccc(F)c3)nc2c1	ZINC000033490514	957187006	/nfs/dbraw/zinc/18/70/06/957187006.db2.gz	ABISWCQHPPLUCM-NTUHNPAUSA-N	-1	0	344.729	3.910	50	0		EHAARM
Cc1cc(C(=O)Nc2ccc(O[C@@H](C)C(=O)[O-])c(F)c2)c(C)s1	ZINC000630258551	975201795	/nfs/dbraw/zinc/20/17/95/975201795.db2.gz	PRXUAFQDFMHDDQ-VIFPVBQESA-N	-1	0	337.372	3.608	50	0		EHAARM
CC(C)c1nc(/C=C\c2cnn(Cc3ccccc3)c2)ncc1C(=O)[O-]	ZINC000255563331	1028568128	/nfs/dbraw/zinc/56/81/28/1028568128.db2.gz	HJSFUBVNSAEZIA-HJWRWDBZSA-N	-1	0	348.406	3.713	50	0		EHAARM
CC(C)c1cc([N-]S(=O)(=O)/C=C/c2ccc(Cl)cc2)no1	ZINC000170651095	1033403080	/nfs/dbraw/zinc/40/30/80/1033403080.db2.gz	BEJVEDYBVDTADE-BQYQJAHWSA-N	-1	0	326.805	3.864	50	0		EHAARM
CC(C)c1nc(/C=C\c2ncc(C(F)(F)F)s2)ncc1C(=O)[O-]	ZINC000432703127	1033744416	/nfs/dbraw/zinc/74/44/16/1033744416.db2.gz	KGTSPPMBRYBORF-ARJAWSKDSA-N	-1	0	343.330	3.944	50	0		EHAARM
O=C([O-])c1ccc(/C=C/C(=O)c2cccc([N+](=O)[O-])c2)c(Cl)c1	ZINC000096009371	1043502492	/nfs/dbraw/zinc/50/24/92/1043502492.db2.gz	WDPMRBRAHGMABJ-VOTSOKGWSA-N	-1	0	331.711	3.843	50	0		EHAARM
O=C([O-])[C@@H]1CCCCN1C(=O)c1ccc(-c2cccc(F)c2)cc1	ZINC000952969733	1137483922	/nfs/dbraw/zinc/48/39/22/1137483922.db2.gz	MXZJXCXHFIBTQF-KRWDZBQOSA-N	-1	0	327.355	3.572	50	0		EHAARM
CCC(CC)(CC(=O)Nc1ccc(OC(C)C)cc1F)C(=O)[O-]	ZINC000052118335	214118378	/nfs/dbraw/zinc/11/83/78/214118378.db2.gz	AYRMPSHFRHPJIM-UHFFFAOYSA-N	-1	0	325.380	3.833	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)c1ccco1)c1ccc(Cl)cc1Cl	ZINC000004717971	210258065	/nfs/dbraw/zinc/25/80/65/210258065.db2.gz	RHNOVJWZGQVWNX-LLVKDONJSA-N	-1	0	328.151	3.532	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)c1ccco1)c1ccc(Cl)cc1Cl	ZINC000004717970	210257924	/nfs/dbraw/zinc/25/79/24/210257924.db2.gz	RHNOVJWZGQVWNX-NSHDSACASA-N	-1	0	328.151	3.532	50	0		EHAARM
CC(C)Oc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(F)cc2)cc1	ZINC000004581138	210226421	/nfs/dbraw/zinc/22/64/21/210226421.db2.gz	SOFQXERJWDXQTP-KRWDZBQOSA-N	-1	0	345.370	3.559	50	0		EHAARM
Cc1cccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c1C	ZINC000100326513	219097045	/nfs/dbraw/zinc/09/70/45/219097045.db2.gz	DHTWTPYFEAWZTN-UHFFFAOYSA-N	-1	0	348.402	3.522	50	0		EHAARM
O=C([O-])[C@@H](NC(=O)c1ccc(Cl)cc1)C12CC3CC(CC(C3)C1)C2	ZINC000004376097	210183761	/nfs/dbraw/zinc/18/37/61/210183761.db2.gz	ZGVVRGAJVBTNPC-FVTZREDMSA-N	-1	0	347.842	3.739	50	0		EHAARM
O=S(=O)(C=C([O-])c1ccc(Cl)cc1Cl)c1ccccc1	ZINC000003125520	209966103	/nfs/dbraw/zinc/96/61/03/209966103.db2.gz	SBUYRKXLMNCGLI-UHFFFAOYSA-N	-1	0	329.204	3.650	50	0		EHAARM
O=C([O-])c1cc(-c2ccccc2)nc2cc(-c3ccc(F)cc3)nn21	ZINC000036615759	213102477	/nfs/dbraw/zinc/10/24/77/213102477.db2.gz	WWHAGALIPNSIFY-UHFFFAOYSA-N	-1	0	333.322	3.901	50	0		EHAARM
CSc1ncc(C(=O)[O-])c(Nc2ccc(C(F)(F)F)cc2)n1	ZINC000035287584	213017779	/nfs/dbraw/zinc/01/77/79/213017779.db2.gz	OPYHQOTZSQNMFL-UHFFFAOYSA-N	-1	0	329.303	3.659	50	0		EHAARM
O=C([O-])C1(Cc2ccc(Cl)cc2)CCN(c2ncccc2F)CC1	ZINC000071749879	215805600	/nfs/dbraw/zinc/80/56/00/215805600.db2.gz	ZMTSKJUVUBRNMS-UHFFFAOYSA-N	-1	0	348.805	3.788	50	0		EHAARM
CCOc1cc(C)c(S(=O)(=O)[N-]c2ccc(Cl)cn2)cc1C	ZINC000000384699	209563256	/nfs/dbraw/zinc/56/32/56/209563256.db2.gz	SRRAUJLURFUOQT-UHFFFAOYSA-N	-1	0	340.832	3.551	50	0		EHAARM
Cc1cc(/C=C2/NC(=O)[N-]C2=O)c(-c2ccccc2)n1-c1ccccc1	ZINC000022215388	212282488	/nfs/dbraw/zinc/28/24/88/212282488.db2.gz	NKIUFXBQQSIINP-QGOAFFKASA-N	-1	0	343.386	3.633	50	0		EHAARM
Cc1oc([C@H](CC(C)C)NC(=O)OCc2ccccc2)nc1C(=O)[O-]	ZINC000218912184	241350807	/nfs/dbraw/zinc/35/08/07/241350807.db2.gz	MULLZAJRBDDYAA-AWEZNQCLSA-N	-1	0	346.383	3.695	50	0		EHAARM
CC(C)Cc1nnc([N-]C(=O)c2cc(-c3cccs3)on2)s1	ZINC000021747335	212246966	/nfs/dbraw/zinc/24/69/66/212246966.db2.gz	PNSSCMHCDWCPNN-UHFFFAOYSA-N	-1	0	334.426	3.705	50	0		EHAARM
O=C([O-])c1ccc(C(=O)NC(c2cccs2)c2cccs2)o1	ZINC000238003417	242891284	/nfs/dbraw/zinc/89/12/84/242891284.db2.gz	XYFAUZXLQAXUOO-UHFFFAOYSA-N	-1	0	333.390	3.620	50	0		EHAARM
O=C([O-])c1cnn2c1N[C@H](c1ccc(Cl)cc1)C[C@@H]2C(F)(F)F	ZINC000020616578	212156239	/nfs/dbraw/zinc/15/62/39/212156239.db2.gz	ITJQPWGJQGPSCV-WDEREUQCSA-N	-1	0	345.708	3.895	50	0		EHAARM
COc1cccc(Nc2nnc(Cc3ccc(Cl)cc3)c(=O)[n-]2)c1	ZINC000016777450	211933880	/nfs/dbraw/zinc/93/38/80/211933880.db2.gz	OSRVBCGKXIMSHV-UHFFFAOYSA-N	-1	0	342.786	3.574	50	0		EHAARM
Cc1nn(Cc2ccc(C)cc2)c2nc(C)c(Cl)c(C(=O)[O-])c12	ZINC000012396176	211368128	/nfs/dbraw/zinc/36/81/28/211368128.db2.gz	LSBJILAYPMVZMC-UHFFFAOYSA-N	-1	0	329.787	3.756	50	0		EHAARM
Cc1cc(NCc2cncn2CC(C)C)nc(-c2ccccc2[O-])n1	ZINC000091915352	218088040	/nfs/dbraw/zinc/08/80/40/218088040.db2.gz	OWZKHQGWYZXTLI-UHFFFAOYSA-N	-1	0	337.427	3.622	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3)s2)n[nH]1	ZINC000009686598	211113194	/nfs/dbraw/zinc/11/31/94/211113194.db2.gz	SHLYMSMBSYPEJK-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
O=C(c1ccccc1)c1cc(C(=O)c2ccccc2[O-])cn2ccnc12	ZINC000009114662	211041760	/nfs/dbraw/zinc/04/17/60/211041760.db2.gz	QCZKFLPHRDSUNV-UHFFFAOYSA-N	-1	0	342.354	3.502	50	0		EHAARM
Cc1c(C(=O)Nc2ccc(C(=O)[O-])cc2)oc2c1[C@H](O)CC(C)(C)C2	ZINC000008992395	211027917	/nfs/dbraw/zinc/02/79/17/211027917.db2.gz	LYZPUTREXWENRJ-CYBMUJFWSA-N	-1	0	343.379	3.544	50	0		EHAARM
Cc1c2ccc(O[C@H](C)C(=O)[O-])cc2oc(=O)c1Cc1ccccc1	ZINC000005548143	210485831	/nfs/dbraw/zinc/48/58/31/210485831.db2.gz	SBSLUCQDRXEBCP-CYBMUJFWSA-N	-1	0	338.359	3.544	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@H]2c2cccs2)cc1	ZINC000299748296	258008049	/nfs/dbraw/zinc/00/80/49/258008049.db2.gz	GTQAYYPGBAJOEK-HNNXBMFYSA-N	-1	0	329.421	3.743	50	0		EHAARM
O=C([O-])c1cccc(CS[C@H](C(=O)NC2CC2)c2ccccc2)c1	ZINC000032885590	258058814	/nfs/dbraw/zinc/05/88/14/258058814.db2.gz	JRAACMHMXIAANZ-KRWDZBQOSA-N	-1	0	341.432	3.638	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000252486995	527597515	/nfs/dbraw/zinc/59/75/15/527597515.db2.gz	RCKGLMJLSQQWLG-AEGPPILISA-N	-1	0	335.831	3.547	50	0		EHAARM
O=C([O-])C[C@H](CC(=O)Nc1ccc2ccccc2n1)c1ccccc1	ZINC000000152822	563246699	/nfs/dbraw/zinc/24/66/99/563246699.db2.gz	PLRALSVBRIVBCP-INIZCTEOSA-N	-1	0	334.375	3.822	50	0		EHAARM
O=C([O-])CCn1c2ccccc2nc1SCCc1ccccc1	ZINC000000193448	563257294	/nfs/dbraw/zinc/25/72/94/563257294.db2.gz	LMLHJSMLPNSPCL-UHFFFAOYSA-N	-1	0	326.421	3.846	50	0		EHAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)c1	ZINC000000270128	563269492	/nfs/dbraw/zinc/26/94/92/563269492.db2.gz	HBWUCVKLKHTIOL-UHFFFAOYSA-N	-1	0	349.452	3.703	50	0		EHAARM
O=S(=O)([N-]c1nc2ccccc2s1)c1cccc2cccnc21	ZINC000000271820	563270075	/nfs/dbraw/zinc/27/00/75/563270075.db2.gz	JFRWRNHOJWVDLQ-UHFFFAOYSA-N	-1	0	341.417	3.645	50	0		EHAARM
O=C([O-])CCSc1nc2ccccc2n1CCOc1ccccc1	ZINC000000297610	563274892	/nfs/dbraw/zinc/27/48/92/563274892.db2.gz	UPRAXQDJCBOLJY-UHFFFAOYSA-N	-1	0	342.420	3.682	50	0		EHAARM
COc1ccc(NC(=O)C[C@H](Cc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000000351309	563289421	/nfs/dbraw/zinc/28/94/21/563289421.db2.gz	PKHGRYMSMWUGKW-ZDUSSCGKSA-N	-1	0	347.798	3.621	50	0		EHAARM
O=C([O-])c1ccc(C2CCN(C(=O)OCc3ccccc3)CC2)cc1	ZINC000002527191	563439176	/nfs/dbraw/zinc/43/91/76/563439176.db2.gz	XAOKKIBZXDQKGS-UHFFFAOYSA-N	-1	0	339.391	3.901	50	0		EHAARM
O=C([O-])c1cccc(CSc2nnc(COc3ccccc3)o2)c1	ZINC000002868824	563458809	/nfs/dbraw/zinc/45/88/09/563458809.db2.gz	BLLJEUIVRRMEGN-UHFFFAOYSA-N	-1	0	342.376	3.639	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)[C@@H]1CC(C)=C(C)C[C@@H]1C(=O)[O-]	ZINC000006731393	563583864	/nfs/dbraw/zinc/58/38/64/563583864.db2.gz	GARMDYLWECVQLZ-OLZOCXBDSA-N	-1	0	337.803	3.734	50	0		EHAARM
Cc1ccc(C[C@@]2(C(=O)[O-])CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000006845291	563588614	/nfs/dbraw/zinc/58/86/14/563588614.db2.gz	OROZSQNPVNQUHJ-IBGZPJMESA-N	-1	0	333.428	3.639	50	0		EHAARM
CCOc1cccc(=O)c2c(C)n(-c3cccc(C(=O)[O-])c3)c(C)c21	ZINC000013684684	563710779	/nfs/dbraw/zinc/71/07/79/563710779.db2.gz	AXFPYPDTEASIRH-UHFFFAOYSA-N	-1	0	337.375	3.704	50	0		EHAARM
Cc1cc([C@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])ccc1F	ZINC000221040268	563920104	/nfs/dbraw/zinc/92/01/04/563920104.db2.gz	VVAKZLAABFIUDS-UKRRQHHQSA-N	-1	0	337.391	3.702	50	0		EHAARM
CCc1nc2sc(C)cc2c(N[C@H](Cc2ccccc2)C(=O)[O-])n1	ZINC000041090723	563924185	/nfs/dbraw/zinc/92/41/85/563924185.db2.gz	YCEUCEHRLIUUQN-CQSZACIVSA-N	-1	0	341.436	3.670	50	0		EHAARM
Fc1ccc(F)c(-c2csc([N-]c3ncnc4nccnc34)n2)c1	ZINC000097229572	563970651	/nfs/dbraw/zinc/97/06/51/563970651.db2.gz	XSLNFZVAFZYZDM-UHFFFAOYSA-N	-1	0	342.334	3.565	50	0		EHAARM
O=c1c2cccc(F)c2[n-]cc1S(=O)(=O)c1cccc(Cl)c1	ZINC000096511490	563980833	/nfs/dbraw/zinc/98/08/33/563980833.db2.gz	WDZHOTRHJLPROK-UHFFFAOYSA-N	-1	0	337.759	3.566	50	0		EHAARM
Cc1cc(C)cc(C[C@H](CC(=O)Nc2ccc(F)cc2)C(=O)[O-])c1	ZINC000000350638	563991529	/nfs/dbraw/zinc/99/15/29/563991529.db2.gz	LGFYFEZOOUFXDL-OAHLLOKOSA-N	-1	0	329.371	3.715	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@@H]1CCCC[C@H]1C)c2=O	ZINC000000425244	563998934	/nfs/dbraw/zinc/99/89/34/563998934.db2.gz	ISKIQBBLHZBAII-QMTHXVAHSA-N	-1	0	332.425	3.597	50	0		EHAARM
O=C([O-])c1ccccc1-c1nc(-c2ccccc2Br)no1	ZINC000034797603	564001223	/nfs/dbraw/zinc/00/12/23/564001223.db2.gz	WZMHCDXFUUVKOP-UHFFFAOYSA-N	-1	0	345.152	3.864	50	0		EHAARM
C[C@H](CC(=O)N1CCC[C@@H](C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000136151113	564001266	/nfs/dbraw/zinc/00/12/66/564001266.db2.gz	GOUMWXQOENSYKM-VXGBXAGGSA-N	-1	0	343.345	3.522	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000005392652	564003546	/nfs/dbraw/zinc/00/35/46/564003546.db2.gz	UKNCGUATWKBCJQ-UHFFFAOYSA-N	-1	0	345.342	3.905	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000000483959	564016886	/nfs/dbraw/zinc/01/68/86/564016886.db2.gz	JZOCQCSMIMMERG-QWHCGFSZSA-N	-1	0	330.409	3.640	50	0		EHAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccccc1O	ZINC000170623995	564017307	/nfs/dbraw/zinc/01/73/07/564017307.db2.gz	MXKZNIXTGNGSKT-UHFFFAOYSA-N	-1	0	341.816	3.554	50	0		EHAARM
COc1cc(C)c(C(C)C)cc1S(=O)(=O)[N-]c1ccccc1O	ZINC000170623992	564017314	/nfs/dbraw/zinc/01/73/14/564017314.db2.gz	KHGSAPGZRRBSCR-UHFFFAOYSA-N	-1	0	335.425	3.633	50	0		EHAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)c2ccc(Cl)s2)CC1	ZINC000013185686	564019616	/nfs/dbraw/zinc/01/96/16/564019616.db2.gz	CTKJWAQIMRJHSL-UHFFFAOYSA-N	-1	0	349.839	3.660	50	0		EHAARM
CSc1nc2ccc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])cc2s1	ZINC000013249564	564019634	/nfs/dbraw/zinc/01/96/34/564019634.db2.gz	DBLDZZWBSRXRGV-GHMZBOCLSA-N	-1	0	348.449	3.624	50	0		EHAARM
O=C(N[C@@H](c1ccco1)c1ccccc1)c1c([O-])cc(F)cc1F	ZINC000084525054	564068539	/nfs/dbraw/zinc/06/85/39/564068539.db2.gz	LTSJRRIREHGFOT-QGZVFWFLSA-N	-1	0	329.302	3.783	50	0		EHAARM
CCOc1ccccc1-c1noc(-c2c[n-]c3ccccc3c2=O)n1	ZINC000075352723	564082017	/nfs/dbraw/zinc/08/20/17/564082017.db2.gz	BIAPYGJJZHFKBA-UHFFFAOYSA-N	-1	0	333.347	3.644	50	0		EHAARM
C[C@@H](Oc1c(=O)c2ccccc2oc1-c1ccc(Cl)cc1)C(=O)[O-]	ZINC000001791346	564087707	/nfs/dbraw/zinc/08/77/07/564087707.db2.gz	VFOMTFVUBBNBBK-SNVBAGLBSA-N	-1	0	344.750	3.965	50	0		EHAARM
CC(C)=CCOc1cc2oc(=O)c(CC(=O)[O-])c(C)c2cc1Cl	ZINC000006645690	564095036	/nfs/dbraw/zinc/09/50/36/564095036.db2.gz	MWIYUXNKQVCQIW-UHFFFAOYSA-N	-1	0	336.771	3.727	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)OCc1ccccc1)c1ccc(Cl)cc1	ZINC000002511979	564100488	/nfs/dbraw/zinc/10/04/88/564100488.db2.gz	DHXHWTXUFRFSIW-HNNXBMFYSA-N	-1	0	333.771	3.782	50	0		EHAARM
Cc1ccc(Cl)cc1NC(=O)c1c([O-])c2sccc2n(C)c1=O	ZINC000065215351	564102831	/nfs/dbraw/zinc/10/28/31/564102831.db2.gz	ITLWZFXMKFKWLV-UHFFFAOYSA-N	-1	0	348.811	3.520	50	0		EHAARM
Cc1cc(Cl)ccc1NC(=O)c1c([O-])c2sccc2[nH]c1=O	ZINC000065215275	564102857	/nfs/dbraw/zinc/10/28/57/564102857.db2.gz	VWTGXKQORHBYRW-UHFFFAOYSA-N	-1	0	334.784	3.509	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2ccc(C)cc2)c2cccnc21	ZINC000065242233	564103375	/nfs/dbraw/zinc/10/33/75/564103375.db2.gz	VLFBRYSTKRATHF-UHFFFAOYSA-N	-1	0	329.425	3.556	50	0		EHAARM
O=S(=O)([N-]c1ccc(Br)cc1)c1ccccc1Cl	ZINC000007052573	564103875	/nfs/dbraw/zinc/10/38/75/564103875.db2.gz	FXKFNTBHTGOYGJ-UHFFFAOYSA-N	-1	0	346.633	3.903	50	0		EHAARM
CCOc1ccc([N-]S(=O)(=O)c2ccc(Cl)s2)cc1OC	ZINC000007109357	564104976	/nfs/dbraw/zinc/10/49/76/564104976.db2.gz	VKBGDNSTFIYJRU-UHFFFAOYSA-N	-1	0	347.845	3.610	50	0		EHAARM
Cc1ccc([C@H](C)C(=O)Nc2ccc(C)c(O[C@H](C)C(=O)[O-])c2)cc1	ZINC000170067799	564105183	/nfs/dbraw/zinc/10/51/83/564105183.db2.gz	IOUHBHZLGHKSOZ-LSDHHAIUSA-N	-1	0	341.407	3.898	50	0		EHAARM
O=S(=O)([N-]c1ccccc1OC(F)F)c1ccc(Cl)cc1	ZINC000007409122	564108103	/nfs/dbraw/zinc/10/81/03/564108103.db2.gz	PVLHNYALNAMYKG-UHFFFAOYSA-N	-1	0	333.743	3.742	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000225457444	564134913	/nfs/dbraw/zinc/13/49/13/564134913.db2.gz	ICILTTWIPMCECT-KGLIPLIRSA-N	-1	0	343.345	3.555	50	0		EHAARM
O=S(=O)(N[C@H](c1ccsc1)c1cccs1)c1cccs1	ZINC000390826683	564138468	/nfs/dbraw/zinc/13/84/68/564138468.db2.gz	OOFUQJSBFACAGI-CYBMUJFWSA-N	-1	0	341.504	3.939	50	0		EHAARM
CCc1ccc2c(Cl)c(C(=O)N3CCC[C@H]3C(=O)[O-])sc2c1	ZINC000095971437	564143434	/nfs/dbraw/zinc/14/34/34/564143434.db2.gz	YRQOUOTWRUPQBR-NSHDSACASA-N	-1	0	337.828	3.806	50	0		EHAARM
Cc1cc2cc([N-]S(=O)(=O)c3ccc(F)c(F)c3F)ccc2[nH]1	ZINC000031721920	564159774	/nfs/dbraw/zinc/15/97/74/564159774.db2.gz	ZVFFQZVNQYBPOX-UHFFFAOYSA-N	-1	0	340.326	3.694	50	0		EHAARM
Cc1cc2oc(-c3ccc(C(=O)[O-])cc3)c(O)c(=O)c2cc1Cl	ZINC000031773450	564159810	/nfs/dbraw/zinc/15/98/10/564159810.db2.gz	OAESWBMHXBTDFL-UHFFFAOYSA-N	-1	0	330.723	3.826	50	0		EHAARM
Cc1nc(C(=O)N(Cc2ccoc2)C2CCCCC2)ccc1C(=O)[O-]	ZINC000263338617	564161382	/nfs/dbraw/zinc/16/13/82/564161382.db2.gz	OHLXYTJCKNOZAZ-UHFFFAOYSA-N	-1	0	342.395	3.656	50	0		EHAARM
COc1ccccc1-c1cc(C(=O)[O-])c2c(n1)onc2-c1ccco1	ZINC000008391784	564164989	/nfs/dbraw/zinc/16/49/89/564164989.db2.gz	JTSCILIMOGRFIJ-UHFFFAOYSA-N	-1	0	336.303	3.857	50	0		EHAARM
C[C@H]1CCC[C@H](OCc2cccc(NC(=O)C3(C(=O)[O-])CC3)c2)C1	ZINC000154836296	959039622	/nfs/dbraw/zinc/03/96/22/959039622.db2.gz	CBECHBJZNDQVJE-BBRMVZONSA-N	-1	0	331.412	3.585	50	0		EHAARM
O=C([O-])[C@@H]1CCN(C(=O)C[C@H]2CCc3ccccc32)c2ccccc21	ZINC000669435063	976001338	/nfs/dbraw/zinc/00/13/38/976001338.db2.gz	SDMIKRKJWMDCKR-CRAIPNDOSA-N	-1	0	335.403	3.712	50	0		EHAARM
CCc1sc(C(=O)[O-])cc1-c1cccc(CN2CCOCC2)c1	ZINC000032573479	1015423059	/nfs/dbraw/zinc/42/30/59/1015423059.db2.gz	IJJPKKRZSYWGGS-UHFFFAOYSA-N	-1	0	331.437	3.508	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)Nc1nc(-c2cccs2)cs1	ZINC000000816579	1033807464	/nfs/dbraw/zinc/80/74/64/1033807464.db2.gz	VCETXPQBXFFOCP-ZJUUUORDSA-N	-1	0	336.438	3.701	50	0	aggregator	EHAARM
Cc1c([O-])c(-c2ccn(C)n2)cc2c(-c3ccccc3)cc(=O)oc12	ZINC000828407779	1131434519	/nfs/dbraw/zinc/43/45/19/1131434519.db2.gz	PCXLXYGOZVZHNE-UHFFFAOYSA-N	-1	0	332.359	3.875	50	0		EHAARM
O=C([O-])c1ccc(CNC(=O)c2ccccc2Cc2ccccc2)cc1	ZINC000013166254	1137054683	/nfs/dbraw/zinc/05/46/83/1137054683.db2.gz	OTRLPBDXGUJAPN-UHFFFAOYSA-N	-1	0	345.398	3.906	50	0		EHAARM
C[C@H](c1cc(F)ccc1F)N(C)Cc1nc(=O)c2sccc2[n-]1	ZINC000053125899	214164557	/nfs/dbraw/zinc/16/45/57/214164557.db2.gz	SQHSNBORJZEJHD-SECBINFHSA-N	-1	0	335.379	3.868	50	0		EHAARM
CCN(Cc1ccc(F)c(F)c1)Cc1nc(=O)c2sccc2[n-]1	ZINC000053209882	214169873	/nfs/dbraw/zinc/16/98/73/214169873.db2.gz	VHRLNBJITQFADQ-UHFFFAOYSA-N	-1	0	335.379	3.697	50	0		EHAARM
O=c1nc(CN2CCC[C@@H]2c2cccc(F)c2)[n-]c2ccsc21	ZINC000053717989	214194915	/nfs/dbraw/zinc/19/49/15/214194915.db2.gz	YWXOHHRQNPWWHT-CQSZACIVSA-N	-1	0	329.400	3.873	50	0		EHAARM
Cc1ccc(-c2csc3[n-]c(-c4ncccn4)nc(=O)c23)cc1C	ZINC000054753380	214253989	/nfs/dbraw/zinc/25/39/89/214253989.db2.gz	AGWYKKUYMKYQDZ-UHFFFAOYSA-N	-1	0	334.404	3.725	50	0		EHAARM
CCOc1cc(C=O)cc(Cl)c1OCc1ccc(C(=O)[O-])cc1	ZINC000004656025	210238286	/nfs/dbraw/zinc/23/82/86/210238286.db2.gz	YLRVVDDTTKHJTF-UHFFFAOYSA-N	-1	0	334.755	3.828	50	0		EHAARM
CCCn1c(=O)c(C(=O)Nc2ccccc2F)c([O-])c2ccccc21	ZINC000100536973	219101492	/nfs/dbraw/zinc/10/14/92/219101492.db2.gz	DSIKQSYZUOSHNZ-UHFFFAOYSA-N	-1	0	340.354	3.509	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3sccc3[nH]c2=O)c(Cl)c1	ZINC000065215239	214844755	/nfs/dbraw/zinc/84/47/55/214844755.db2.gz	GBOZEVUGTPLXRE-UHFFFAOYSA-N	-1	0	334.784	3.509	50	0		EHAARM
Cc1ccc(NC(=O)c2cccc(Br)c2)c(C(=O)[O-])c1	ZINC000004105132	210120724	/nfs/dbraw/zinc/12/07/24/210120724.db2.gz	SETRMSCIBXZXTP-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccccc2F)cc1	ZINC000003623684	210068739	/nfs/dbraw/zinc/06/87/39/210068739.db2.gz	UDEISEXEGWSXKW-KRWDZBQOSA-N	-1	0	345.370	3.560	50	0		EHAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1ccccc1Oc1ccccc1	ZINC000003566279	210055865	/nfs/dbraw/zinc/05/58/65/210055865.db2.gz	ATXRUBBOGSGABU-UHFFFAOYSA-N	-1	0	343.408	3.620	50	0		EHAARM
CCOC(=O)c1sc2ncc(C(=O)c3ccccc3[O-])cc2c1C	ZINC000003339735	210011747	/nfs/dbraw/zinc/01/17/47/210011747.db2.gz	SJODOZIEEQIKDQ-UHFFFAOYSA-N	-1	0	341.388	3.718	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1CC(=O)c1ccccc1Br	ZINC000043879327	213601118	/nfs/dbraw/zinc/60/11/18/213601118.db2.gz	GBKPVVHPQQKNTI-GHMZBOCLSA-N	-1	0	325.202	3.913	50	0		EHAARM
CCCc1[nH]nc2c1[C@@H](c1cc(Cl)cc(Cl)c1[O-])CC(=O)N2	ZINC000067696141	215188934	/nfs/dbraw/zinc/18/89/34/215188934.db2.gz	CXMZPFXZLXVLGL-MRVPVSSYSA-N	-1	0	340.210	3.849	50	0		EHAARM
Cc1cc2sc([N-]S(=O)(=O)C=Cc3ccccc3)nc2c(C)c1	ZINC000037492447	213149206	/nfs/dbraw/zinc/14/92/06/213149206.db2.gz	WAXVBIVKIMADOH-HJWRWDBZSA-N	-1	0	344.461	3.748	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC2(C[C@@H](C(=O)[O-])c3ccccc32)CC1	ZINC000035571216	213039433	/nfs/dbraw/zinc/03/94/33/213039433.db2.gz	CLQYVKLGGAFNEB-CQSZACIVSA-N	-1	0	331.412	3.527	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000368924	209554772	/nfs/dbraw/zinc/55/47/72/209554772.db2.gz	UFJUJIGDWOIYFD-UWVGGRQHSA-N	-1	0	336.800	3.555	50	0		EHAARM
O=C([O-])c1ccc(Cl)cc1NC(=O)CSCc1ccccc1	ZINC000000053047	209391538	/nfs/dbraw/zinc/39/15/38/209391538.db2.gz	JHKXBFYVBYLHAW-UHFFFAOYSA-N	-1	0	335.812	3.910	50	0		EHAARM
Cc1nc(-c2cc(C(=O)N3CCCC[C@@H]3CCC(=O)[O-])co2)cs1	ZINC000237788703	242794417	/nfs/dbraw/zinc/79/44/17/242794417.db2.gz	GBQUCSOLVOSZIM-CYBMUJFWSA-N	-1	0	348.424	3.571	50	0		EHAARM
COC(=O)[C@@H]1[C@H](c2ccccc2)C=C[C@H](c2ccccc2)[C@H]1C(=O)[O-]	ZINC000245242313	243100221	/nfs/dbraw/zinc/10/02/21/243100221.db2.gz	ZXGPHADSLBDYNB-FCGDIQPGSA-N	-1	0	336.387	3.614	50	0		EHAARM
C[C@H](O)[C@@H]1CC[C@@H]2[C@@H]3CCC(=O)[C@](C)(CCC(=O)[O-])[C@@H]3CC[C@@]12C	ZINC000248378467	243562820	/nfs/dbraw/zinc/56/28/20/243562820.db2.gz	JPPQYWISPXWYPP-ALHYADCGSA-N	-1	0	336.472	3.660	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC000253370688	243881230	/nfs/dbraw/zinc/88/12/30/243881230.db2.gz	UYFZCNMOEGGLPX-VBNZEHGJSA-N	-1	0	335.831	3.547	50	0		EHAARM
Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(CC(=O)[O-])cc1	ZINC000018194231	211989049	/nfs/dbraw/zinc/98/90/49/211989049.db2.gz	DEKNKSJWYCOAQS-UHFFFAOYSA-N	-1	0	336.347	3.529	50	0		EHAARM
CC(C)(C)C(=O)Nc1cccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])c1	ZINC000012381328	211361469	/nfs/dbraw/zinc/36/14/69/211361469.db2.gz	UJJJUWGCLMWZPE-LSDHHAIUSA-N	-1	0	346.427	3.501	50	0		EHAARM
Cc1cc(C)nc([N-]c2n[nH]c(COc3cccc4ccccc43)n2)n1	ZINC000009329491	211069493	/nfs/dbraw/zinc/06/94/93/211069493.db2.gz	WBQCCPNJZHQJPQ-UHFFFAOYSA-N	-1	0	346.394	3.687	50	0		EHAARM
CCOc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(F)cc1	ZINC000009227734	211054297	/nfs/dbraw/zinc/05/42/97/211054297.db2.gz	DGEIPIGSCLCCEG-UHFFFAOYSA-N	-1	0	329.780	3.679	50	0		EHAARM
COc1ccc(-c2noc([N-]c3cccc(C(C)=O)c3)n2)cc1OC	ZINC000009152971	211044545	/nfs/dbraw/zinc/04/45/45/211044545.db2.gz	NUMIXVJDNIKIPB-UHFFFAOYSA-N	-1	0	339.351	3.700	50	0		EHAARM
Cc1c(NC(=O)Cc2ccccc2OC(C)C)cccc1C(=O)[O-]	ZINC000095424395	218367043	/nfs/dbraw/zinc/36/70/43/218367043.db2.gz	BKVXSAIWMCCONN-UHFFFAOYSA-N	-1	0	327.380	3.662	50	0		EHAARM
Cc1ccc2nc(-c3ccc(Nc4nncc(=O)[n-]4)cc3)sc2c1	ZINC000005009203	210360157	/nfs/dbraw/zinc/36/01/57/210360157.db2.gz	XPVNPVCDMQVPKP-UHFFFAOYSA-N	-1	0	335.392	3.906	50	0		EHAARM
CCC(=O)Nc1ccc(C(=O)Nc2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000004824765	210289736	/nfs/dbraw/zinc/28/97/36/210289736.db2.gz	SCEGODWYAUFWNA-UHFFFAOYSA-N	-1	0	346.770	3.639	50	0		EHAARM
CCOc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccccc1C	ZINC000004809487	210282010	/nfs/dbraw/zinc/28/20/10/210282010.db2.gz	OXBPTBGOGKGCMX-UHFFFAOYSA-N	-1	0	325.817	3.848	50	0		EHAARM
CCCOc1ccc(S(=O)(=O)[N-]c2ccccn2)cc1C(C)C	ZINC000011565836	258054350	/nfs/dbraw/zinc/05/43/50/258054350.db2.gz	CNUFNRWAHYDOSS-UHFFFAOYSA-N	-1	0	334.441	3.795	50	0		EHAARM
Cc1ccc2c(c1)CCCN2C(=O)[C@H]1CC(C)=C(C)C[C@@H]1C(=O)[O-]	ZINC000017067056	135711183	/nfs/dbraw/zinc/71/11/83/135711183.db2.gz	XEDQTOBUZGSKLA-IRXDYDNUSA-N	-1	0	327.424	3.721	50	0		EHAARM
COc1cc(C(=O)[O-])cc(Cl)c1OC(=O)c1ccccc1Cl	ZINC000227145864	536542700	/nfs/dbraw/zinc/54/27/00/536542700.db2.gz	WRISXHAPXILMII-UHFFFAOYSA-N	-1	0	341.146	3.919	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)Nc1nc(-c2cccs2)cs1	ZINC000000238691	563264454	/nfs/dbraw/zinc/26/44/54/563264454.db2.gz	OHMMCOAMMMUDIC-UHFFFAOYSA-N	-1	0	330.390	3.822	50	0		EHAARM
COc1ccc(-c2cc(=O)c3cc(CC(=O)[O-])cc(Cl)c3o2)cc1	ZINC000000395711	563304489	/nfs/dbraw/zinc/30/44/89/563304489.db2.gz	YUJQXQYBIAFAGW-UHFFFAOYSA-N	-1	0	344.750	3.749	50	0		EHAARM
Cc1cc(C)nc([N-]c2n[nH]c(-c3ccc(Cl)cc3Cl)n2)n1	ZINC000001278825	563382436	/nfs/dbraw/zinc/38/24/36/563382436.db2.gz	XJRFJVUAQPYETR-UHFFFAOYSA-N	-1	0	335.198	3.929	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1cccc2ccccc21	ZINC000002572729	563442534	/nfs/dbraw/zinc/44/25/34/563442534.db2.gz	JXDXPRAUFACOHG-HNNXBMFYSA-N	-1	0	329.396	3.750	50	0		EHAARM
CCOc1cc([N-]S(=O)(=O)c2cccs2)ccc1OC(F)F	ZINC000002789719	563613469	/nfs/dbraw/zinc/61/34/69/563613469.db2.gz	SBSPGUPJARBRTD-UHFFFAOYSA-N	-1	0	349.380	3.549	50	0		EHAARM
O=C([O-])C1CCN(C(=O)c2ccc(-c3ccc(Cl)cc3)o2)CC1	ZINC000013167507	563691733	/nfs/dbraw/zinc/69/17/33/563691733.db2.gz	RTHAJGRHZQXXPJ-UHFFFAOYSA-N	-1	0	333.771	3.537	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccccc2Br)cc1	ZINC000016130202	563804337	/nfs/dbraw/zinc/80/43/37/563804337.db2.gz	AYQWRXDIFYSADB-UHFFFAOYSA-N	-1	0	340.242	3.812	50	0		EHAARM
CCc1cccc([N-]S(=O)(=O)c2ccccc2Br)c1	ZINC000016147691	563804760	/nfs/dbraw/zinc/80/47/60/563804760.db2.gz	NGWDENBMRQUBSC-UHFFFAOYSA-N	-1	0	340.242	3.812	50	0		EHAARM
CCCOc1ccc2cc(S(=O)(=O)[N-]c3ccccn3)ccc2c1	ZINC000016652509	563819371	/nfs/dbraw/zinc/81/93/71/563819371.db2.gz	OSDRMMHSAAVONQ-UHFFFAOYSA-N	-1	0	342.420	3.824	50	0		EHAARM
Cc1[n-]n(-c2nc(C)cc(C)n2)c(=O)c1Cc1ccc(C(C)C)cc1	ZINC000018222483	563851372	/nfs/dbraw/zinc/85/13/72/563851372.db2.gz	QMSXFYRNHDFMQC-SFHVURJKSA-N	-1	0	336.439	3.798	50	0		EHAARM
CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1ccc([O-])c(Cl)c1	ZINC000024190406	563869666	/nfs/dbraw/zinc/86/96/66/563869666.db2.gz	FBDUTIWKVVJAEG-UHFFFAOYSA-N	-1	0	341.798	3.504	50	0		EHAARM
C[C@@H](Sc1ccccc1C(=O)[O-])C(=O)Nc1ccc(N(C)C)cc1	ZINC000025054552	563880605	/nfs/dbraw/zinc/88/06/05/563880605.db2.gz	MXTYCHDTSJTHHM-GFCCVEGCSA-N	-1	0	344.436	3.570	50	0		EHAARM
CSc1nnc([N-]C(=O)c2cc(-c3ccc(C)c(C)c3)on2)s1	ZINC000027795624	563899686	/nfs/dbraw/zinc/89/96/86/563899686.db2.gz	MNTGGZYUHGHMGN-UHFFFAOYSA-N	-1	0	346.437	3.784	50	0		EHAARM
Cc1oc(CN(C)C(=O)C2(c3cccc(Cl)c3)CC2)cc1C(=O)[O-]	ZINC000268938189	563908511	/nfs/dbraw/zinc/90/85/11/563908511.db2.gz	PWKSGGBKZDXZLR-UHFFFAOYSA-N	-1	0	347.798	3.630	50	0		EHAARM
Cc1cnc([C@@H](C2CC2)n2c(=O)c3ccccc3[n-]c2=S)s1	ZINC000096427378	563952197	/nfs/dbraw/zinc/95/21/97/563952197.db2.gz	BDYAIJJFYINKSH-CYBMUJFWSA-N	-1	0	329.450	3.823	50	0		EHAARM
CC(C)(C)OC(=O)N1C[C@H](C(=O)[O-])[C@@H](c2cccc3ccccc32)C1	ZINC000074937985	563967086	/nfs/dbraw/zinc/96/70/86/563967086.db2.gz	XFLHWJLBGXTNJN-SJORKVTESA-N	-1	0	341.407	3.875	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(Br)cc2F)cc1	ZINC000096171003	563980011	/nfs/dbraw/zinc/98/00/11/563980011.db2.gz	QFKLPLKSHQIDPM-UHFFFAOYSA-N	-1	0	344.205	3.697	50	0		EHAARM
Cc1cccc(OCCn2c3ccccc3nc2SCC(=O)[O-])c1	ZINC000000122640	563986859	/nfs/dbraw/zinc/98/68/59/563986859.db2.gz	IRMKBFVKYQUHAR-UHFFFAOYSA-N	-1	0	342.420	3.600	50	0		EHAARM
CC(C)[C@H]1CN(C(=O)c2cc(=O)c3ccccc3[n-]2)c2ccccc21	ZINC000408514954	563992975	/nfs/dbraw/zinc/99/29/75/563992975.db2.gz	IQTWSWYYZFUOPS-MRXNPFEDSA-N	-1	0	332.403	3.928	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)C[C@H]2CCCc3ccccc32)C1	ZINC000237959134	563994306	/nfs/dbraw/zinc/99/43/06/563994306.db2.gz	CBKLKLLLLIEKNL-DOTOQJQBSA-N	-1	0	329.440	3.600	50	0		EHAARM
COc1ccc(C[C@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000005199522	564000352	/nfs/dbraw/zinc/00/03/52/564000352.db2.gz	MLIWZQVEMIEICL-CYBMUJFWSA-N	-1	0	347.798	3.621	50	0		EHAARM
Cc1cc(C)c2oc(-c3ccco3)c(O[C@@H](C)C(=O)[O-])c(=O)c2c1	ZINC000005556479	564005299	/nfs/dbraw/zinc/00/52/99/564005299.db2.gz	VSWLSLBZCRISTF-NSHDSACASA-N	-1	0	328.320	3.522	50	0		EHAARM
CCOc1ccc(NC[C@@H](CC(=O)[O-])c2nc3ccccc3[nH]2)cc1	ZINC000017307991	564011591	/nfs/dbraw/zinc/01/15/91/564011591.db2.gz	IJXCDDGLIQWDKI-CYBMUJFWSA-N	-1	0	339.395	3.632	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1C	ZINC000000347136	564012406	/nfs/dbraw/zinc/01/24/06/564012406.db2.gz	GMVVAAWSKCJHMG-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2c(C)cccc2C)c1=O	ZINC000005686891	564018728	/nfs/dbraw/zinc/01/87/28/564018728.db2.gz	WUVFEBIFORYHOW-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
Cc1ccc(C)c(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)c1	ZINC000013185370	564019622	/nfs/dbraw/zinc/01/96/22/564019622.db2.gz	UUTXAJONMSTYEV-UHFFFAOYSA-N	-1	0	337.419	3.562	50	0		EHAARM
COC(=O)c1ccc(C)c(NC(=O)CC2(C(=O)[O-])CCCCCC2)c1	ZINC000013251490	564019668	/nfs/dbraw/zinc/01/96/68/564019668.db2.gz	CJPJBIFVTJTUTH-UHFFFAOYSA-N	-1	0	347.411	3.535	50	0		EHAARM
Cc1cccc(C(=O)[O-])c1NS(=O)(=O)c1ccc(C(C)C)cc1	ZINC000013464589	564020019	/nfs/dbraw/zinc/02/00/19/564020019.db2.gz	RHMGXGCWHQAJGC-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
O=c1[nH]c2ccccc2c([O-])c1-c1cc2cc(Cl)ccc2oc1=O	ZINC000107918140	564027128	/nfs/dbraw/zinc/02/71/28/564027128.db2.gz	XUAVGHPAIXVYCG-UHFFFAOYSA-N	-1	0	339.734	3.661	50	0		EHAARM
O=C([N-]c1nnc(-c2ccsc2)o1)c1cc(-c2ccccc2)on1	ZINC000049029144	564032422	/nfs/dbraw/zinc/03/24/22/564032422.db2.gz	OFZWYSVPRLHIGH-UHFFFAOYSA-N	-1	0	338.348	3.705	50	0		EHAARM
Cc1ccccc1-c1cc2ncc(C(=O)c3ccccc3[O-])cn2n1	ZINC000043573931	564076195	/nfs/dbraw/zinc/07/61/95/564076195.db2.gz	XEMPCALIVJAIIT-UHFFFAOYSA-N	-1	0	329.359	3.641	50	0		EHAARM
O=C([O-])c1cccc(Nc2ncc(-c3nc4ccccc4o3)cn2)c1	ZINC000075272947	564081395	/nfs/dbraw/zinc/08/13/95/564081395.db2.gz	MTZURAQVAMFEPX-UHFFFAOYSA-N	-1	0	332.319	3.727	50	0		EHAARM
CCCOc1ccc([C@H](Nc2ccc(F)cc2)[P@@](=O)([O-])O)cc1	ZINC000012998743	564086216	/nfs/dbraw/zinc/08/62/16/564086216.db2.gz	BVDFKGZAZOPFGX-MRXNPFEDSA-N	-1	0	339.303	3.903	50	0		EHAARM
O=C(Nc1cccc(C(F)(F)F)c1)c1c(=O)[nH]c2ccccc2c1[O-]	ZINC000006494024	564090796	/nfs/dbraw/zinc/09/07/96/564090796.db2.gz	YKKFQSZQLFCFDP-UHFFFAOYSA-N	-1	0	348.280	3.505	50	0		EHAARM
C[C@@H]1CCCN(c2ccc(NC(=O)C3CCCC3)c(C(=O)[O-])c2)C1	ZINC000064589246	564092569	/nfs/dbraw/zinc/09/25/69/564092569.db2.gz	PMZAXQJBLXNOAJ-CYBMUJFWSA-N	-1	0	330.428	3.750	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2cc(C)no2)o1	ZINC000064958419	564098545	/nfs/dbraw/zinc/09/85/45/564098545.db2.gz	WPGDQJDKIWWKIL-UHFFFAOYSA-N	-1	0	332.381	3.606	50	0		EHAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2cc(-c3ccnn3C)cs2)c1	ZINC000065112360	564101304	/nfs/dbraw/zinc/10/13/04/564101304.db2.gz	WXILMQWKIWETRT-UHFFFAOYSA-N	-1	0	347.465	3.566	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccc(F)cc3)s2)on1	ZINC000007005517	564102988	/nfs/dbraw/zinc/10/29/88/564102988.db2.gz	KHLHZBXRLBLFKI-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
C[C@](CC(=O)[O-])(C(=O)Nc1cc(F)ccc1F)C1CCCCC1	ZINC000089894558	564114900	/nfs/dbraw/zinc/11/49/00/564114900.db2.gz	RVQVOBVGAPXJIX-QGZVFWFLSA-N	-1	0	325.355	3.965	50	0		EHAARM
Cc1cc(NC(=O)CCCC(=O)[O-])ccc1NC(=O)c1cccs1	ZINC000000475314	564116722	/nfs/dbraw/zinc/11/67/22/564116722.db2.gz	NPVYSFSMWQVZDL-UHFFFAOYSA-N	-1	0	346.408	3.502	50	0		EHAARM
O=C([O-])c1ccn(-c2ccc(NC(=O)CCCc3ccccc3)cc2)n1	ZINC000238234834	564117792	/nfs/dbraw/zinc/11/77/92/564117792.db2.gz	AYJWSEWODJSWMX-UHFFFAOYSA-N	-1	0	349.390	3.532	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000013021851	564135890	/nfs/dbraw/zinc/13/58/90/564135890.db2.gz	RXRPOEJOFUHQDK-OALUTQOASA-N	-1	0	333.387	3.863	50	0		EHAARM
CCCn1c2ccccc2nc1[N-]S(=O)(=O)c1cc(C)ccc1C	ZINC000028233033	564150766	/nfs/dbraw/zinc/15/07/66/564150766.db2.gz	WKRFQPYJIAXWPK-UHFFFAOYSA-N	-1	0	343.452	3.864	50	0		EHAARM
Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)c1cc(C(=O)[O-])ccn1	ZINC000263419298	564161579	/nfs/dbraw/zinc/16/15/79/564161579.db2.gz	OXUCKUAKGXVCCE-LLVKDONJSA-N	-1	0	347.440	3.501	50	0		EHAARM
Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)c1cc(C(=O)[O-])ccn1	ZINC000263419299	564161589	/nfs/dbraw/zinc/16/15/89/564161589.db2.gz	OXUCKUAKGXVCCE-NSHDSACASA-N	-1	0	347.440	3.501	50	0		EHAARM
CC(C)c1ccccc1NS(=O)(=O)c1ccc(CCC(=O)[O-])cc1	ZINC000008105369	564162708	/nfs/dbraw/zinc/16/27/08/564162708.db2.gz	VULJXYTWDAZWFB-UHFFFAOYSA-N	-1	0	347.436	3.628	50	0		EHAARM
Cc1ccc([C@H]2[C@@H](C(=O)[O-])CCC(=O)N2CCc2cccs2)s1	ZINC000069664820	564171394	/nfs/dbraw/zinc/17/13/94/564171394.db2.gz	OUKBJPIOKYHCDC-XJKSGUPXSA-N	-1	0	349.477	3.725	50	0		EHAARM
COc1ccc(F)cc1CSCc1nc(=O)c2sccc2[n-]1	ZINC000071862864	564176124	/nfs/dbraw/zinc/17/61/24/564176124.db2.gz	WSFFCZYKUGCXTF-UHFFFAOYSA-N	-1	0	336.413	3.566	50	0		EHAARM
O=C([O-])[C@@H]1CC[C@H](C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)C1	ZINC000263353738	962507402	/nfs/dbraw/zinc/50/74/02/962507402.db2.gz	WKDDYLNHPXSGPO-OTWHNJEPSA-N	-1	0	337.419	3.588	50	0		EHAARM
O=C([O-])c1nc(Cl)c(Cl)c(N=NCc2cccnc2)c1Cl	ZINC000254683512	1042613201	/nfs/dbraw/zinc/61/32/01/1042613201.db2.gz	UXWNUYLNNCZOPI-UHFFFAOYSA-N	-1	0	345.573	3.581	50	0		EHAARM
O=C([O-])[C@@H](CNC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)C1CCCCC1	ZINC000630266011	1137352786	/nfs/dbraw/zinc/35/27/86/1137352786.db2.gz	XLYCYYMGZBFDHN-RDBSUJKOSA-N	-1	0	349.393	3.752	50	0		EHAARM
CC[C@@H](C)C(=O)Nc1ccccc1NC(=O)c1cccc(C(=O)[O-])c1	ZINC000952981417	1137485308	/nfs/dbraw/zinc/48/53/08/1137485308.db2.gz	ZAVVCNDXNZOZNK-GFCCVEGCSA-N	-1	0	340.379	3.622	50	0		EHAARM
COc1ccc(-c2csc(-n3[n-]c(-c4ccccc4)cc3=O)n2)cc1	ZINC000004611500	210232051	/nfs/dbraw/zinc/23/20/51/210232051.db2.gz	VQHNRTPXTADKEI-UHFFFAOYSA-N	-1	0	349.415	3.960	50	0		EHAARM
CC(C)c1nn(C)c(Cl)c1/C=C\c1ncc(C(=O)[O-])c(C(C)C)n1	ZINC000098055975	219075450	/nfs/dbraw/zinc/07/54/50/219075450.db2.gz	DUKGXUQHCSKUMP-SREVYHEPSA-N	-1	0	348.834	3.979	50	0		EHAARM
O=C([O-])CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1	ZINC000100284156	219096034	/nfs/dbraw/zinc/09/60/34/219096034.db2.gz	QYYOBVKMZHKPNY-UHFFFAOYSA-N	-1	0	345.811	3.764	50	0		EHAARM
O=S(=O)([N-]c1ccc(Oc2ccccc2)nc1)c1cccs1	ZINC000047212136	213836889	/nfs/dbraw/zinc/83/68/89/213836889.db2.gz	VDCKMCAAWCNSGT-UHFFFAOYSA-N	-1	0	332.406	3.736	50	0		EHAARM
O=C([O-])c1cc(Cl)c(=O)n(Cc2ccc(Cl)c(Cl)c2)c1	ZINC000003884194	210083730	/nfs/dbraw/zinc/08/37/30/210083730.db2.gz	UNVCOKQZRGHXKJ-UHFFFAOYSA-N	-1	0	332.570	3.555	50	0		EHAARM
CCCOc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(F)cc2)cc1	ZINC000003623661	210068412	/nfs/dbraw/zinc/06/84/12/210068412.db2.gz	PSOTXTFICVPDQM-KRWDZBQOSA-N	-1	0	345.370	3.560	50	0		EHAARM
O=C([O-])C1=CCCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000002384269	209845295	/nfs/dbraw/zinc/84/52/95/209845295.db2.gz	BVZYISLKDUHKRZ-UHFFFAOYSA-N	-1	0	349.386	3.652	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)CCCOc2ccc(Cl)cc2)c1	ZINC000001773600	209790868	/nfs/dbraw/zinc/79/08/68/209790868.db2.gz	VLDGUYCBIKJYCT-UHFFFAOYSA-N	-1	0	333.771	3.836	50	0		EHAARM
COc1ccccc1NC(=O)[C@@H](CC(=O)[O-])Cc1ccc(Cl)cc1	ZINC000000524384	209645709	/nfs/dbraw/zinc/64/57/09/209645709.db2.gz	PJDWYOCFRPNMMK-CYBMUJFWSA-N	-1	0	347.798	3.621	50	0		EHAARM
Cc1ccc(C2=CCN(Cc3nc(=O)c4sccc4[n-]3)CC2)cc1	ZINC000035269410	213016750	/nfs/dbraw/zinc/01/67/50/213016750.db2.gz	VYRQCBXSRMTILY-UHFFFAOYSA-N	-1	0	337.448	3.995	50	0		EHAARM
Cc1cc(C)cc(C[C@H](C(=O)[O-])[C@@H](C)C(=O)Nc2ccccc2)c1	ZINC000071405947	215770626	/nfs/dbraw/zinc/77/06/26/215770626.db2.gz	ANBMXTJXOBLPPU-QAPCUYQASA-N	-1	0	325.408	3.822	50	0		EHAARM
COc1ccc(NC(=O)[C@@H](C)[C@H](Cc2ccc(C)cc2)C(=O)[O-])cc1	ZINC000035142041	213009886	/nfs/dbraw/zinc/00/98/86/213009886.db2.gz	UVUBRMPGPVRXGS-KSSFIOAISA-N	-1	0	341.407	3.522	50	0		EHAARM
O=S(=O)([N-]c1ccncc1)c1cc(Cl)c(Cl)cc1Cl	ZINC000000367696	209554474	/nfs/dbraw/zinc/55/44/74/209554474.db2.gz	OJJDBZBPNHRSRN-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
COc1ccccc1[N-]S(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000000243054	209500701	/nfs/dbraw/zinc/50/07/01/209500701.db2.gz	YEZNWJXSLILKQG-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
Cc1nc2ccc(NC(=O)c3s[n-]c(=O)c3Cl)cc2s1	ZINC000253405540	243910924	/nfs/dbraw/zinc/91/09/24/243910924.db2.gz	NYAODXCPZHEKLP-UHFFFAOYSA-N	-1	0	325.802	3.673	50	0		EHAARM
C[C@H](Sc1ccccc1C(=O)[O-])C(=O)Nc1cccnc1Cl	ZINC000012940572	211490083	/nfs/dbraw/zinc/49/00/83/211490083.db2.gz	FXCHSXDYXZXYRB-VIFPVBQESA-N	-1	0	336.800	3.553	50	0		EHAARM
CC(C)(C)C(=O)Nc1cccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])c1	ZINC000012381325	211361449	/nfs/dbraw/zinc/36/14/49/211361449.db2.gz	UJJJUWGCLMWZPE-CABCVRRESA-N	-1	0	346.427	3.501	50	0		EHAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1cccc(C(F)(F)F)c1	ZINC000010301972	211161364	/nfs/dbraw/zinc/16/13/64/211161364.db2.gz	ISZVCWFCRPPHSR-UHFFFAOYSA-N	-1	0	349.305	3.654	50	0		EHAARM
CCc1[n-]n2c(nc(-c3ccccc3OC)cc2=O)c1-c1ccccc1	ZINC000009935421	211135057	/nfs/dbraw/zinc/13/50/57/211135057.db2.gz	SXLBJDPWCQQJTE-UHFFFAOYSA-N	-1	0	345.402	3.928	50	0		EHAARM
Cc1c(C(=O)Nc2ccccc2C(=O)[O-])oc2c1[C@@H](O)CC(C)(C)C2	ZINC000009548013	211100793	/nfs/dbraw/zinc/10/07/93/211100793.db2.gz	HAPAVTRQHOXCFX-ZDUSSCGKSA-N	-1	0	343.379	3.544	50	0		EHAARM
Cc1ccc(-c2cc(C(=O)N3CC[C@@H]3C(=O)[O-])c3ccccc3n2)cc1	ZINC000095359507	218293181	/nfs/dbraw/zinc/29/31/81/218293181.db2.gz	AEYKHSDIPYULRZ-LJQANCHMSA-N	-1	0	346.386	3.509	50	0		EHAARM
CC[C@H](C)[C@@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)c1ccccc1	ZINC000095361113	218294052	/nfs/dbraw/zinc/29/40/52/218294052.db2.gz	IORYCVSFYDWOFH-YVEFUNNKSA-N	-1	0	329.396	3.732	50	0		EHAARM
C[C@@H](CC(=O)N1CCC[C@@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000096479548	218856250	/nfs/dbraw/zinc/85/62/50/218856250.db2.gz	DKGQWQJBIAJJCW-WCQYABFASA-N	-1	0	343.345	3.522	50	0		EHAARM
CC(C)OC(=O)[C@H]1C2c3ccccc3C(c3ccccc32)[C@H]1C(=O)[O-]	ZINC000005002940	210357532	/nfs/dbraw/zinc/35/75/32/210357532.db2.gz	OSMMTMKDUSZPCL-GMNCBBECSA-N	-1	0	336.387	3.546	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)N[C@@H](C)CCc2ccccc2)[C@@H](C(=O)[O-])C1	ZINC000004902224	210317132	/nfs/dbraw/zinc/31/71/32/210317132.db2.gz	JAECESZJDZEUAG-SZMVWBNQSA-N	-1	0	329.440	3.571	50	0		EHAARM
CC1=C(C)C[C@@H](C(=O)NCc2c(F)cccc2Cl)[C@H](C(=O)[O-])C1	ZINC000000119094	258047354	/nfs/dbraw/zinc/04/73/54/258047354.db2.gz	GMZWWZZYRIUHQM-VXGBXAGGSA-N	-1	0	339.794	3.543	50	0		EHAARM
O=C([O-])C1(NC(=O)C[C@@H](Cc2ccccc2)c2ccco2)CCCC1	ZINC000299800073	258103851	/nfs/dbraw/zinc/10/38/51/258103851.db2.gz	ZPRYBRDVFUHLDW-MRXNPFEDSA-N	-1	0	341.407	3.510	50	0		EHAARM
CC1CCN(c2ccc(NC(=O)c3cccs3)cc2C(=O)[O-])CC1	ZINC000046053349	132421471	/nfs/dbraw/zinc/42/14/71/132421471.db2.gz	TUFQSPXFHYJRKD-UHFFFAOYSA-N	-1	0	344.436	3.935	50	0		EHAARM
Cc1ccc(C2=NN(C(=O)CCCC(=O)[O-])[C@H](c3ccco3)C2)cc1	ZINC000000376071	563299107	/nfs/dbraw/zinc/29/91/07/563299107.db2.gz	JRWDDCGBZKBHNN-INIZCTEOSA-N	-1	0	340.379	3.521	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccc(Br)s1	ZINC000000479290	563335766	/nfs/dbraw/zinc/33/57/66/563335766.db2.gz	VPFPHHWZJNBWBM-UHFFFAOYSA-N	-1	0	346.271	3.874	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(SC)cc1	ZINC000001061639	563372133	/nfs/dbraw/zinc/37/21/33/563372133.db2.gz	LAGVSAPZDICNOY-UHFFFAOYSA-N	-1	0	343.857	3.871	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1ccc(Cl)cc1Cl	ZINC000002575633	563442520	/nfs/dbraw/zinc/44/25/20/563442520.db2.gz	HGGWEUIYPYFHNX-NSHDSACASA-N	-1	0	348.226	3.904	50	0		EHAARM
CCOc1cc(/C=C/C(=O)[O-])ccc1OCCOc1ccccc1	ZINC000003249573	563478051	/nfs/dbraw/zinc/47/80/51/563478051.db2.gz	SFOZXAJMWIBUNF-PKNBQFBNSA-N	-1	0	328.364	3.641	50	0		EHAARM
Cc1nc(-c2ccc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])cc2)cs1	ZINC000006668239	563577484	/nfs/dbraw/zinc/57/74/84/563577484.db2.gz	PYYXNAANQQHGKL-CABCVRRESA-N	-1	0	342.420	3.724	50	0		EHAARM
CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)[N-]c1ccccn1	ZINC000012560783	563663181	/nfs/dbraw/zinc/66/31/81/563663181.db2.gz	PWOYBQQSCJYGTJ-UHFFFAOYSA-N	-1	0	334.441	3.713	50	0		EHAARM
O=C(c1cnn(-c2ccc(F)cc2F)c1)c1cc(Cl)ccc1[O-]	ZINC000015232225	563780390	/nfs/dbraw/zinc/78/03/90/563780390.db2.gz	KLOIRBLVUHVSBC-UHFFFAOYSA-N	-1	0	334.709	3.741	50	0		EHAARM
COc1ccc(-n2nc(-c3ccc(Cl)cc3)cc2C(=O)[O-])cc1	ZINC000025762059	563888046	/nfs/dbraw/zinc/88/80/46/563888046.db2.gz	UAIOEVXISNTUHQ-UHFFFAOYSA-N	-1	0	328.755	3.900	50	0		EHAARM
CC[C@@H](C(=O)[O-])N(C)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000070915572	563929832	/nfs/dbraw/zinc/92/98/32/563929832.db2.gz	WBNLTUKBCCEZSD-SFHVURJKSA-N	-1	0	339.391	3.731	50	0	in-vitro	EHAARM
O=C([O-])C1(CCCc2ccccc2)CCN(C(=O)C2CCC2)CC1	ZINC000071748469	563965071	/nfs/dbraw/zinc/96/50/71/563965071.db2.gz	CMIWSZQPWSEPCC-UHFFFAOYSA-N	-1	0	329.440	3.503	50	0		EHAARM
Cc1cc2cc(C(=O)N3CCc4ccccc4[C@H]3CC(=O)[O-])ccc2o1	ZINC000095505429	563977127	/nfs/dbraw/zinc/97/71/27/563977127.db2.gz	WUKGQPVZWZSNCB-GOSISDBHSA-N	-1	0	349.386	3.956	50	0		EHAARM
CC(C)COc1ccc(C(=O)N[C@H](CC(=O)[O-])c2ccccc2)cc1	ZINC000000206846	563988554	/nfs/dbraw/zinc/98/85/54/563988554.db2.gz	ITLLSEZJXZVABX-GOSISDBHSA-N	-1	0	341.407	3.667	50	0		EHAARM
Cc1nc(-n2cccc2)sc1C(=O)Nc1nnc(CC(C)C)s1	ZINC000061719164	564000427	/nfs/dbraw/zinc/00/04/27/564000427.db2.gz	BOFYUTBZFQZBCU-UHFFFAOYSA-N	-1	0	347.469	3.545	50	0		EHAARM
CC(C)(C)c1nc2cc(NC(=O)CC(C)(C)CC(=O)[O-])ccc2[nH]1	ZINC000012627314	564018761	/nfs/dbraw/zinc/01/87/61/564018761.db2.gz	DGKIXDHTSZGRSW-UHFFFAOYSA-N	-1	0	331.416	3.690	50	0		EHAARM
C[C@H](NC(=O)[C@H]1CC=CC[C@@H]1C(=O)[O-])c1ccc(Cl)cc1Cl	ZINC000013000391	564019351	/nfs/dbraw/zinc/01/93/51/564019351.db2.gz	UJTNSTILXGVWSW-XDTLVQLUSA-N	-1	0	342.222	3.838	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)c1cc(F)c(F)cc1Cl)c1ccccc1	ZINC000013224117	564019625	/nfs/dbraw/zinc/01/96/25/564019625.db2.gz	VGVMDVGXXIYEJD-AWEZNQCLSA-N	-1	0	339.725	3.564	50	0		EHAARM
Cc1ccccc1CN(C)C(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000047932258	564029827	/nfs/dbraw/zinc/02/98/27/564029827.db2.gz	ZHRJZINUOYIRPM-UHFFFAOYSA-N	-1	0	339.420	3.579	50	0		EHAARM
O=S(=O)(C=C([O-])c1ccccc1)c1ccc(Cl)c(Cl)c1	ZINC000001001658	564053986	/nfs/dbraw/zinc/05/39/86/564053986.db2.gz	FVUJULWAPKHQSU-UHFFFAOYSA-N	-1	0	329.204	3.650	50	0		EHAARM
O=S(=O)([N-]c1ccc(F)c(Cl)c1)c1cccc2cccnc21	ZINC000001100861	564054384	/nfs/dbraw/zinc/05/43/84/564054384.db2.gz	FVZSXWRBTGUZEN-UHFFFAOYSA-N	-1	0	336.775	3.828	50	0		EHAARM
C[C@]12CC(=O)[C@@H]3[C@H](CC[C@H]4C[C@H](O)CC[C@]34C)[C@H]1CC=C2CC(=O)[O-]	ZINC000257358877	564055998	/nfs/dbraw/zinc/05/59/98/564055998.db2.gz	WXRCQADVBJRAON-AWNCOGSJSA-N	-1	0	346.467	3.580	50	0		EHAARM
O=C([O-])c1ccc(CN2CCO[C@H](c3ccc(Cl)cc3)C2)cc1	ZINC000263398823	564056328	/nfs/dbraw/zinc/05/63/28/564056328.db2.gz	HLFCZXQMONPIEM-KRWDZBQOSA-N	-1	0	331.799	3.612	50	0		EHAARM
O=C([O-])c1ccc(CN2CCO[C@H](c3ccc(F)c(Cl)c3)C2)cc1	ZINC000263565239	564058154	/nfs/dbraw/zinc/05/81/54/564058154.db2.gz	FJLVCLLRILIBDX-KRWDZBQOSA-N	-1	0	349.789	3.751	50	0		EHAARM
Cc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1ccc2ccccc2c1	ZINC000012535915	564058379	/nfs/dbraw/zinc/05/83/79/564058379.db2.gz	VISJYRGCCMEIAZ-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
O=S(=O)([N-]c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1F	ZINC000012536218	564058387	/nfs/dbraw/zinc/05/83/87/564058387.db2.gz	RKIHJNBNCGRYPK-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
O=C(Nc1cccc2cccnc21)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000063809188	564077244	/nfs/dbraw/zinc/07/72/44/564077244.db2.gz	ZEVVRNSZOJMFLX-UHFFFAOYSA-N	-1	0	348.387	3.798	50	0		EHAARM
O=C(Nc1nc2c(s1)CCC2)c1cc(Cl)c([O-])c(Cl)c1	ZINC000012950117	564079874	/nfs/dbraw/zinc/07/98/74/564079874.db2.gz	RRHDTIINVUUPNB-UHFFFAOYSA-N	-1	0	329.208	3.897	50	0		EHAARM
Cc1cccc2sc(NC(=O)[C@H]3CC(C)=CC[C@H]3C(=O)[O-])nc21	ZINC000006217826	564082989	/nfs/dbraw/zinc/08/29/89/564082989.db2.gz	GJCVSXKJGOPOAN-NEPJUHHUSA-N	-1	0	330.409	3.600	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2Cl)cc1	ZINC000006316842	564084548	/nfs/dbraw/zinc/08/45/48/564084548.db2.gz	RXTYJECMPUFDKJ-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2ccc(-c3nnc(C)o3)cc2)sc1C	ZINC000091017891	564087145	/nfs/dbraw/zinc/08/71/45/564087145.db2.gz	VSBDXAXQRGWPNR-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3cccc(C)c3C)c(C)o2)n[nH]1	ZINC000075519096	564087635	/nfs/dbraw/zinc/08/76/35/564087635.db2.gz	KELHBYIRNMLRDO-UHFFFAOYSA-N	-1	0	345.424	3.704	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cc(C)cc(C)c2)c2cccnc21	ZINC000065242229	564103425	/nfs/dbraw/zinc/10/34/25/564103425.db2.gz	LLPRLEJWPJVEGL-UHFFFAOYSA-N	-1	0	343.452	3.864	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1ccccc1	ZINC000238128176	564117791	/nfs/dbraw/zinc/11/77/91/564117791.db2.gz	MDCJHWGHEMBBKT-PKOBYXMFSA-N	-1	0	337.419	3.829	50	0		EHAARM
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N[C@H](CC(=O)[O-])c1cccs1	ZINC000252486169	564119335	/nfs/dbraw/zinc/11/93/35/564119335.db2.gz	GFMAPRHJICAGKC-GRYCIOLGSA-N	-1	0	335.450	3.554	50	0		EHAARM
C[C@H](NC(=O)c1cccc(C(=O)[O-])c1)c1ncc(-c2ccccc2)o1	ZINC000225482913	564135207	/nfs/dbraw/zinc/13/52/07/564135207.db2.gz	BSENIATVURRQNQ-LBPRGKRZSA-N	-1	0	336.347	3.531	50	0		EHAARM
O=S(=O)([N-]Cc1ccc(-c2ccoc2)cc1)c1c(F)cccc1F	ZINC000390830276	564138642	/nfs/dbraw/zinc/13/86/42/564138642.db2.gz	JXJPEOMUOHKITD-UHFFFAOYSA-N	-1	0	349.358	3.703	50	0		EHAARM
O=C(Nc1ccc(Oc2ncccn2)cc1)c1ccc([O-])c(Cl)c1	ZINC000080404402	564139626	/nfs/dbraw/zinc/13/96/26/564139626.db2.gz	FZOJOWSKXHBQAL-UHFFFAOYSA-N	-1	0	341.754	3.880	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)c2cccc3c2-c2ccccc2C3=O)c1	ZINC000096191925	564145956	/nfs/dbraw/zinc/14/59/56/564145956.db2.gz	LRFLGOLSSWDOGK-UHFFFAOYSA-N	-1	0	343.338	3.849	50	0		EHAARM
C[C@@H](Cc1ccc(NC(=O)[C@H]2CCc3cc(F)ccc32)cc1)C(=O)[O-]	ZINC000563451653	974533228	/nfs/dbraw/zinc/53/32/28/974533228.db2.gz	ZZOYREMPIFTHOO-SGTLLEGYSA-N	-1	0	341.382	3.757	50	0		EHAARM
Cc1cc([O-])c(C2=NCCS[C@H](c3ccc(Cl)cc3)C2)c(=O)o1	ZINC000005730253	1137359370	/nfs/dbraw/zinc/35/93/70/1137359370.db2.gz	JBKBAKSDOZAJSE-HNNXBMFYSA-N	-1	0	349.839	3.975	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000004612055	210231888	/nfs/dbraw/zinc/23/18/88/210231888.db2.gz	STMFJDTXVZATRV-STQMWFEESA-N	-1	0	348.399	3.779	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c(C)c1	ZINC000100662851	219104447	/nfs/dbraw/zinc/10/44/47/219104447.db2.gz	OLHPZSBYPKOUOW-UHFFFAOYSA-N	-1	0	348.402	3.522	50	0		EHAARM
O=c1c2[nH]c3ccc(F)cc3c2[n-]c(=S)n1Cc1ccccc1	ZINC000100880104	219110093	/nfs/dbraw/zinc/11/00/93/219110093.db2.gz	FMBJWBDHQCRPDV-UHFFFAOYSA-N	-1	0	325.368	3.728	50	0		EHAARM
CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccccc1C(=O)[O-]	ZINC000000470691	209622600	/nfs/dbraw/zinc/62/26/00/209622600.db2.gz	DMEWCKZDQSPRHP-CYBMUJFWSA-N	-1	0	327.380	3.916	50	0		EHAARM
CC[C@H](C)c1ccccc1OCC(=O)Nc1ccccc1C(=O)[O-]	ZINC000000470692	209622414	/nfs/dbraw/zinc/62/24/14/209622414.db2.gz	DMEWCKZDQSPRHP-ZDUSSCGKSA-N	-1	0	327.380	3.916	50	0		EHAARM
COc1cc(OC)c(C(=O)CCC(=O)[O-])cc1CC1CCCCC1	ZINC000071770720	215822625	/nfs/dbraw/zinc/82/26/25/215822625.db2.gz	BEZLYMAYYWEURA-UHFFFAOYSA-N	-1	0	334.412	3.874	50	0		EHAARM
CCCN(CCOc1c(Cl)cc(Cl)c([O-])c1Cl)C(N)=O	ZINC000072115173	216011170	/nfs/dbraw/zinc/01/11/70/216011170.db2.gz	XPDKDQRDRFEEFU-UHFFFAOYSA-N	-1	0	341.622	3.522	50	0	in-vitro	EHAARM
O=C([O-])c1ccccc1[C@@H]1CCN(C(=O)c2cccc3ncccc32)C1	ZINC000072157923	216048216	/nfs/dbraw/zinc/04/82/16/216048216.db2.gz	VAMGGSVYNUZFHJ-CQSZACIVSA-N	-1	0	346.386	3.563	50	0		EHAARM
COc1ccc(/C=C/C(=O)Nc2sc3c(c2C(=O)[O-])CCC3)cc1	ZINC000000349891	209546203	/nfs/dbraw/zinc/54/62/03/209546203.db2.gz	UGYVGIJEUITCSZ-JXMROGBWSA-N	-1	0	343.404	3.596	50	0		EHAARM
COc1cc(S(=O)(=O)[N-]c2cnc3ccccc3c2)c(C)cc1C	ZINC000072414260	216205420	/nfs/dbraw/zinc/20/54/20/216205420.db2.gz	OWDXQDHFUUDXOZ-UHFFFAOYSA-N	-1	0	342.420	3.661	50	0		EHAARM
Cn1cc(C(=O)[O-])c(C(=O)NC2CCCCCCCCCCC2)n1	ZINC000020616098	212155773	/nfs/dbraw/zinc/15/57/73/212155773.db2.gz	GBCMJNCUSJNBNZ-UHFFFAOYSA-N	-1	0	335.448	3.521	50	0		EHAARM
Cc1sc(N)nc1-c1ccc(OCc2ccc(C(=O)[O-])cc2)cc1	ZINC000020330432	212119543	/nfs/dbraw/zinc/11/95/43/212119543.db2.gz	ZNXTWVCFPZKLML-UHFFFAOYSA-N	-1	0	340.404	3.978	50	0		EHAARM
O=[P@@]([O-])(O)C1(Nc2ccc(OC(F)(F)F)cc2)CCCCC1	ZINC000012527135	211399517	/nfs/dbraw/zinc/39/95/17/211399517.db2.gz	CHMWXBUYPYCODQ-UHFFFAOYSA-N	-1	0	339.250	3.835	50	0		EHAARM
C[C@@](CC(=O)[O-])(C(=O)Nc1cc(F)ccc1F)C1CCCCC1	ZINC000089894559	217874877	/nfs/dbraw/zinc/87/48/77/217874877.db2.gz	RVQVOBVGAPXJIX-KRWDZBQOSA-N	-1	0	325.355	3.965	50	0		EHAARM
COC(=O)c1c(SCc2cccc(C)c2)[n-]c2ccccc2c1=O	ZINC000009300299	211063991	/nfs/dbraw/zinc/06/39/91/211063991.db2.gz	XJAIMBWUCDLGNB-UHFFFAOYSA-N	-1	0	339.416	3.915	50	0		EHAARM
CC(C)CC(=O)Nc1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])cc1	ZINC000009259199	211059153	/nfs/dbraw/zinc/05/91/53/211059153.db2.gz	XXBHSYDLVRHPPG-HOTGVXAUSA-N	-1	0	346.427	3.501	50	0		EHAARM
CC[C@@H](C)[C@H](Nc1nc(C)nc2sc3c(c21)CCCC3)C(=O)[O-]	ZINC000005574911	210492858	/nfs/dbraw/zinc/49/28/58/210492858.db2.gz	VKNRJLBBRIYWOZ-OTYXRUKQSA-N	-1	0	333.457	3.790	50	0		EHAARM
CCOc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1ncccc1C	ZINC000004970509	210343784	/nfs/dbraw/zinc/34/37/84/210343784.db2.gz	UVEBPRSVWPOVQM-UHFFFAOYSA-N	-1	0	334.441	3.713	50	0		EHAARM
O=C1OC2(CCCCC2)OC([O-])=C1c1c(F)c(F)nc(F)c1Cl	ZINC000328579005	258017629	/nfs/dbraw/zinc/01/76/29/258017629.db2.gz	HEXSKYSWPWIPAZ-UHFFFAOYSA-N	-1	0	349.692	3.613	50	0		EHAARM
O=C([O-])C1(NC(=O)C[C@H](Cc2ccccc2)c2ccco2)CCCC1	ZINC000299800071	258103638	/nfs/dbraw/zinc/10/36/38/258103638.db2.gz	ZPRYBRDVFUHLDW-INIZCTEOSA-N	-1	0	341.407	3.510	50	0		EHAARM
CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc1cccc(C(=O)[O-])c1	ZINC000000041898	563212903	/nfs/dbraw/zinc/21/29/03/563212903.db2.gz	LVQFPCUAPXISCX-ZYHUDNBSSA-N	-1	0	328.195	3.915	50	0		EHAARM
CC(C)OC(=O)C1[C@H](c2ccccc2)C(C(=O)[O-])[C@H]1c1ccccc1	ZINC000000083590	563219295	/nfs/dbraw/zinc/21/92/95/563219295.db2.gz	JPDDMZAETFWSGR-YYZRRKBYSA-N	-1	0	338.403	3.836	50	0		EHAARM
Cc1c(C(=O)[O-])cc(-c2ccccc2)n1CCNC(=O)OC(C)(C)C	ZINC000000113823	563230614	/nfs/dbraw/zinc/23/06/14/563230614.db2.gz	RUFAECVCTWTIRV-UHFFFAOYSA-N	-1	0	344.411	3.686	50	0		EHAARM
COc1ccc(-n2c(=S)[n-]nc2-c2ccc(OC)c(OC)c2)cc1	ZINC000000309625	563279860	/nfs/dbraw/zinc/27/98/60/563279860.db2.gz	CHMZOCNKAJPOCJ-UHFFFAOYSA-N	-1	0	343.408	3.623	50	0		EHAARM
O=S(=O)([N-]c1cccnc1)c1ccc(Cl)c(Cl)c1Cl	ZINC000000367682	563296810	/nfs/dbraw/zinc/29/68/10/563296810.db2.gz	SPXRBVPGWYCXII-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
O=C([O-])c1ccc(CSc2nnc(COc3ccccc3)o2)cc1	ZINC000001059212	563371804	/nfs/dbraw/zinc/37/18/04/563371804.db2.gz	ARDMORFJUCWPAL-UHFFFAOYSA-N	-1	0	342.376	3.639	50	0		EHAARM
C[C@H]1CCc2c(sc3[n-]c(=S)n(Cc4ccco4)c(=O)c23)C1	ZINC000002657875	563445213	/nfs/dbraw/zinc/44/52/13/563445213.db2.gz	BJXCEZMOKJVGPI-VIFPVBQESA-N	-1	0	332.450	3.887	50	0		EHAARM
CCCCSc1nc2ccc(NC(=O)CCC(=O)[O-])cc2s1	ZINC000003106448	563472471	/nfs/dbraw/zinc/47/24/71/563472471.db2.gz	RADGTDHQVJHOCY-UHFFFAOYSA-N	-1	0	338.454	3.992	50	0		EHAARM
CCc1nc2sc3c([nH]c(=O)cc3[O-])c2c(C(F)(F)F)c1C	ZINC000006870856	563589721	/nfs/dbraw/zinc/58/97/21/563589721.db2.gz	KCXHOBSSMDJOOO-UHFFFAOYSA-N	-1	0	328.315	3.733	50	0		EHAARM
O=C([O-])c1ccc(OCc2ccc(F)cc2)c(Br)c1	ZINC000007603900	563607176	/nfs/dbraw/zinc/60/71/76/563607176.db2.gz	YZBDKZVRORHBNH-UHFFFAOYSA-N	-1	0	325.133	3.865	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2cccc(C)n2)cc1C(C)(C)C	ZINC000012560769	563663036	/nfs/dbraw/zinc/66/30/36/563663036.db2.gz	VQASHXLKSQKISA-UHFFFAOYSA-N	-1	0	348.468	3.887	50	0		EHAARM
O=C([O-])c1cc(-c2c(F)cccc2F)nc2cc3c(cc21)OCCO3	ZINC000012941588	563678235	/nfs/dbraw/zinc/67/82/35/563678235.db2.gz	NLSOGXJIDGRUCE-UHFFFAOYSA-N	-1	0	343.285	3.649	50	0		EHAARM
O=S(=O)([N-]c1cccc(F)c1)c1cc(Cl)sc1Cl	ZINC000014244780	563754794	/nfs/dbraw/zinc/75/47/94/563754794.db2.gz	MOVFWMDLGKSLCU-UHFFFAOYSA-N	-1	0	326.201	3.995	50	0		EHAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)c2ccc(C(C)C)cc2)c1	ZINC000024152994	563869258	/nfs/dbraw/zinc/86/92/58/563869258.db2.gz	NNWMEDBRLHEWBS-UHFFFAOYSA-N	-1	0	347.436	3.562	50	0		EHAARM
Cc1ccc(C)c(Sc2cc(N3CCC(C(=O)[O-])CC3)ncn2)c1	ZINC000033268049	563915419	/nfs/dbraw/zinc/91/54/19/563915419.db2.gz	JUFYOWUTSYUCPQ-UHFFFAOYSA-N	-1	0	343.452	3.546	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1cc(-c2ccno2)oc1C	ZINC000032971276	563920092	/nfs/dbraw/zinc/92/00/92/563920092.db2.gz	JTDPEKUSPIEAJF-UHFFFAOYSA-N	-1	0	332.381	3.606	50	0		EHAARM
CC(C)(C)OC(=O)N1C[C@H](C(=O)[O-])[C@@H](c2ccc3ccccc3c2)C1	ZINC000074937986	563967076	/nfs/dbraw/zinc/96/70/76/563967076.db2.gz	KIPDUNKQDUZDQD-SJORKVTESA-N	-1	0	341.407	3.875	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000000483962	564016880	/nfs/dbraw/zinc/01/68/80/564016880.db2.gz	JZOCQCSMIMMERG-STQMWFEESA-N	-1	0	330.409	3.640	50	0		EHAARM
CC(C)Cc1nc2sc3c([n-]cnc3=O)c2c2c1COC(C)(C)C2	ZINC000018144679	564018425	/nfs/dbraw/zinc/01/84/25/564018425.db2.gz	MECBSCGUSZQRLI-UHFFFAOYSA-N	-1	0	343.452	3.583	50	0		EHAARM
C[C@H](NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-])c1ccc(Cl)cc1Cl	ZINC000013000388	564019352	/nfs/dbraw/zinc/01/93/52/564019352.db2.gz	UJTNSTILXGVWSW-BIMULSAOSA-N	-1	0	342.222	3.838	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(C(C)C)cc1	ZINC000013027543	564019359	/nfs/dbraw/zinc/01/93/59/564019359.db2.gz	RIHUISYKFMYWPD-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000108492098	564028321	/nfs/dbraw/zinc/02/83/21/564028321.db2.gz	ZMKQHAOCSWUPGS-MAZHCROVSA-N	-1	0	335.831	3.547	50	0		EHAARM
Cc1ccccc1[C@@H](C)NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000047931913	564029830	/nfs/dbraw/zinc/02/98/30/564029830.db2.gz	RZTINOUUSCBECY-LLVKDONJSA-N	-1	0	339.420	3.797	50	0		EHAARM
O=C([O-])c1cccc(-c2nc(-c3ccc4c(c3)OCCO4)cs2)c1	ZINC000058356134	564050324	/nfs/dbraw/zinc/05/03/24/564050324.db2.gz	UYGUUAKWRABUEA-UHFFFAOYSA-N	-1	0	339.372	3.947	50	0		EHAARM
COC(=O)c1c(SCc2ccccc2C)[n-]c2ccccc2c1=O	ZINC000015731497	564072651	/nfs/dbraw/zinc/07/26/51/564072651.db2.gz	HWJGDQLKVFTSNJ-UHFFFAOYSA-N	-1	0	339.416	3.915	50	0		EHAARM
CCc1ccc(OCCCC(=O)Nc2ccccc2C(=O)[O-])cc1	ZINC000001773433	564087470	/nfs/dbraw/zinc/08/74/70/564087470.db2.gz	SEPUFZYBASAEBY-UHFFFAOYSA-N	-1	0	327.380	3.745	50	0		EHAARM
Cc1ccc(N=C2S[C@H](CC(=O)[O-])C(=O)N2C2CCCCC2)cc1	ZINC000252619825	564090730	/nfs/dbraw/zinc/09/07/30/564090730.db2.gz	LSOXDQJUHUWWCK-OAHLLOKOSA-N	-1	0	346.452	3.734	50	0		EHAARM
Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(-c2ccno2)s1	ZINC000065031172	564099782	/nfs/dbraw/zinc/09/97/82/564099782.db2.gz	SMMAUUFGZBHDCJ-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2cccc(C(C)C)c2)c1	ZINC000007055755	564103945	/nfs/dbraw/zinc/10/39/45/564103945.db2.gz	VMTRKXAPHPNSNF-UHFFFAOYSA-N	-1	0	335.425	3.628	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000007056424	564103963	/nfs/dbraw/zinc/10/39/63/564103963.db2.gz	SEKMXRVYEIJNSH-UHFFFAOYSA-N	-1	0	345.342	3.823	50	0		EHAARM
Cc1cccc([C@@H]2CC(c3ccsc3)=NN2C(=O)CCC(=O)[O-])c1	ZINC000170091747	564105469	/nfs/dbraw/zinc/10/54/69/564105469.db2.gz	LDLDMLNEJFWGQM-INIZCTEOSA-N	-1	0	342.420	3.599	50	0		EHAARM
CCOc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(Cl)cn1	ZINC000006706768	564117465	/nfs/dbraw/zinc/11/74/65/564117465.db2.gz	SJFDCLVBDJCYOR-UHFFFAOYSA-N	-1	0	347.223	3.588	50	0		EHAARM
CCCC[C@@H](C(=O)[O-])[C@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002226289	564124434	/nfs/dbraw/zinc/12/44/34/564124434.db2.gz	OUABTEZBKXLQFA-GDBMZVCRSA-N	-1	0	343.427	3.728	50	0		EHAARM
O=C([O-])Cc1csc(SCc2ccc(Br)cc2)n1	ZINC000013414368	564136356	/nfs/dbraw/zinc/13/63/56/564136356.db2.gz	HGDLXIGUFACJGT-UHFFFAOYSA-N	-1	0	344.255	3.825	50	0		EHAARM
CC1(C)[C@H](C(F)(F)F)CCN1C(=O)CCc1ccccc1C(=O)[O-]	ZINC000263565219	564164251	/nfs/dbraw/zinc/16/42/51/564164251.db2.gz	FIVOWTHNAITWGA-CYBMUJFWSA-N	-1	0	343.345	3.507	50	0		EHAARM
Cc1nn(C(C)C)c(C)c1S(=O)(=O)Nc1ccccc1Cl	ZINC000070014663	564173324	/nfs/dbraw/zinc/17/33/24/564173324.db2.gz	RXIQKYRHMVMDRD-UHFFFAOYSA-N	-1	0	327.837	3.535	50	0		EHAARM
O=C([O-])c1c2c(sc1NC(=O)c1ccc(Cl)cn1)CCCC2	ZINC000315655645	600583319	/nfs/dbraw/zinc/58/33/19/600583319.db2.gz	SKQZRIONWYJGRA-UHFFFAOYSA-N	-1	0	336.800	3.626	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC000261841412	967806690	/nfs/dbraw/zinc/80/66/90/967806690.db2.gz	ITKGYNWGAMAILF-AGIUHOORSA-N	-1	0	335.366	3.601	50	0		EHAARM
CC(C)c1nc(/C=C/c2ncc(C(F)(F)F)s2)ncc1C(=O)[O-]	ZINC000278713925	1032096664	/nfs/dbraw/zinc/09/66/64/1032096664.db2.gz	KGTSPPMBRYBORF-ONEGZZNKSA-N	-1	0	343.330	3.944	50	0		EHAARM
CC1(C)C[C@@]1(CNC(=O)Cc1ccc(O)c(F)c1)c1ccccc1	ZINC000827848536	1131409063	/nfs/dbraw/zinc/40/90/63/1131409063.db2.gz	SYWXMSRPAUQRGL-HXUWFJFHSA-N	-1	0	327.399	3.558	50	0		EHAARM
Cc1ccc([C@H]2CCN(C(=O)C[C@H](C(=O)[O-])c3ccccc3)C2)cc1	ZINC000634944181	1137480978	/nfs/dbraw/zinc/48/09/78/1137480978.db2.gz	QFRKYIIWAJWXRS-OALUTQOASA-N	-1	0	337.419	3.569	50	0		EHAARM
COC(=O)N=c1[n-]nc([C@@H](C)Oc2ccc(Cl)c(C)c2)s1	ZINC000004695006	210250181	/nfs/dbraw/zinc/25/01/81/210250181.db2.gz	DTSULULNXGMUFQ-MRVPVSSYSA-N	-1	0	327.793	3.818	50	0		EHAARM
Cc1ccc(-n2c([S-])nc3c(-c4ccccc4)c[nH]c3c2=O)cc1	ZINC000100071585	219089878	/nfs/dbraw/zinc/08/98/78/219089878.db2.gz	ROOOELOSXROGBG-UHFFFAOYSA-N	-1	0	333.416	3.978	50	0		EHAARM
COc1ccc(-c2cc(=O)n3[n-]c(-c4ccc(F)cc4)cc3n2)cc1	ZINC000100649976	219103783	/nfs/dbraw/zinc/10/37/83/219103783.db2.gz	YZUODYZDZQRDCQ-UHFFFAOYSA-N	-1	0	335.338	3.917	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3cc(C)ccc3C)o2)c1C	ZINC000064958553	214816047	/nfs/dbraw/zinc/81/60/47/214816047.db2.gz	GUYJWJUFEMZSLU-UHFFFAOYSA-N	-1	0	346.408	3.969	50	0		EHAARM
Cc1[n-]n(-c2nc(C)cc(C)n2)c(=O)c1Cc1ccccc1Cl	ZINC000101339183	219122277	/nfs/dbraw/zinc/12/22/77/219122277.db2.gz	DOTWWUXOTSXBHF-UHFFFAOYSA-N	-1	0	328.803	3.537	50	0		EHAARM
Cc1[n-]n(-c2nc(C)cc(C)n2)c(=O)c1Cc1ccc(C(C)C)cc1	ZINC000101380581	219125047	/nfs/dbraw/zinc/12/50/47/219125047.db2.gz	QMSXFYRNHDFMQC-GOSISDBHSA-N	-1	0	336.439	3.798	50	0		EHAARM
COC(=O)c1ccc(/C=C(/CC(=O)[O-])c2nc3ccccc3s2)o1	ZINC000065488393	214927769	/nfs/dbraw/zinc/92/77/69/214927769.db2.gz	QRZWFLLTSWNYTK-NTMALXAHSA-N	-1	0	343.360	3.691	50	0		EHAARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccccc2F)cc1	ZINC000003623682	210069266	/nfs/dbraw/zinc/06/92/66/210069266.db2.gz	UDEISEXEGWSXKW-QGZVFWFLSA-N	-1	0	345.370	3.560	50	0		EHAARM
COc1ccccc1S(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1	ZINC000003419354	210034902	/nfs/dbraw/zinc/03/49/02/210034902.db2.gz	XZPGIRSMEKIOCT-UHFFFAOYSA-N	-1	0	331.315	3.515	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])n(-c3ccc(F)cc3F)n2)cc1	ZINC000044672172	213640520	/nfs/dbraw/zinc/64/05/20/213640520.db2.gz	HDDFGSWPNRENMI-UHFFFAOYSA-N	-1	0	330.290	3.524	50	0		EHAARM
O=C([O-])[C@@H]1C=CCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000042784413	213533846	/nfs/dbraw/zinc/53/38/46/213533846.db2.gz	YSQFCCXPDNQENP-CQSZACIVSA-N	-1	0	349.386	3.508	50	0		EHAARM
Cc1cc(C)cc(Oc2ccc(N3C[C@H](C(=O)[O-])CC3=O)cc2)c1	ZINC000040451246	213304941	/nfs/dbraw/zinc/30/49/41/213304941.db2.gz	HRMHHNNXVGSQJJ-CQSZACIVSA-N	-1	0	325.364	3.533	50	0		EHAARM
O=C([O-])C1CCC(NC(=O)c2cc(F)c(Cl)cc2Cl)CC1	ZINC000037561524	213156370	/nfs/dbraw/zinc/15/63/70/213156370.db2.gz	KNXYNNPSQZQMSV-UHFFFAOYSA-N	-1	0	334.174	3.506	50	0		EHAARM
Cc1cc2c(nc(Cl)nc2NCc2ccc(C(=O)[O-])cc2)s1	ZINC000036277639	213081400	/nfs/dbraw/zinc/08/14/00/213081400.db2.gz	FYDYCIYRVRVTKT-UHFFFAOYSA-N	-1	0	333.800	3.963	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC2(C[C@H](C(=O)[O-])c3ccccc32)CC1	ZINC000035571214	213038572	/nfs/dbraw/zinc/03/85/72/213038572.db2.gz	CLQYVKLGGAFNEB-AWEZNQCLSA-N	-1	0	331.412	3.527	50	0		EHAARM
Cc1ccc(-c2cc3ncc(C(=O)c4cc(F)ccc4[O-])cn3n2)cc1	ZINC000021729223	212246366	/nfs/dbraw/zinc/24/63/66/212246366.db2.gz	OFEFCPFZDUTQQS-UHFFFAOYSA-N	-1	0	347.349	3.780	50	0		EHAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)c1	ZINC000021707341	212241594	/nfs/dbraw/zinc/24/15/94/212241594.db2.gz	HICGVISOKMTPKF-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
O=C([O-])c1cnn2c1N[C@@H](c1ccc(Cl)cc1)C[C@H]2C(F)(F)F	ZINC000020616581	212156005	/nfs/dbraw/zinc/15/60/05/212156005.db2.gz	ITJQPWGJQGPSCV-MNOVXSKESA-N	-1	0	345.708	3.895	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2ccc(Br)cc2)s1	ZINC000020255899	212114782	/nfs/dbraw/zinc/11/47/82/212114782.db2.gz	DAFLKSSPBUZLCH-UHFFFAOYSA-N	-1	0	332.244	3.620	50	0		EHAARM
Cc1noc(C)c1C[C@H](C)NC(=O)c1c([O-])cc(Cl)cc1Cl	ZINC000080029446	217273065	/nfs/dbraw/zinc/27/30/65/217273065.db2.gz	HIBXYNNIVNIULL-ZETCQYMHSA-N	-1	0	343.210	3.665	50	0		EHAARM
CCc1cc(C(=O)[O-])c2c(C3CC3)nn(-c3ccc(F)cc3)c2n1	ZINC000012399141	211368213	/nfs/dbraw/zinc/36/82/13/211368213.db2.gz	GDSRPIVEVCYPMG-UHFFFAOYSA-N	-1	0	325.343	3.698	50	0		EHAARM
Cc1ccc2nc(-c3ccc(Nc4nnc(C)c(=O)[n-]4)cc3)sc2c1	ZINC000011990577	211276026	/nfs/dbraw/zinc/27/60/26/211276026.db2.gz	YZKWLOCNJJRVKZ-UHFFFAOYSA-N	-1	0	349.419	3.802	50	0		EHAARM
Cc1ccc(N2CCN([C@@H](C(=O)[O-])c3ccc(Cl)cc3)CC2)cc1	ZINC000091690226	218047521	/nfs/dbraw/zinc/04/75/21/218047521.db2.gz	HYRZKSBDSAVAIS-GOSISDBHSA-N	-1	0	344.842	3.596	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)CCc3cccs3)C2)cc1	ZINC000095366318	218298933	/nfs/dbraw/zinc/29/89/33/218298933.db2.gz	VSOGPQQPXQOXBP-INIZCTEOSA-N	-1	0	343.448	3.785	50	0		EHAARM
O=C([O-])c1cccc([C@@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)c1	ZINC000095360980	218294069	/nfs/dbraw/zinc/29/40/69/218294069.db2.gz	AXTSTQCDROVGKR-GOSISDBHSA-N	-1	0	348.402	3.886	50	0		EHAARM
O=C([O-])c1cccc([C@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)c1	ZINC000095360982	218294300	/nfs/dbraw/zinc/29/43/00/218294300.db2.gz	AXTSTQCDROVGKR-SFHVURJKSA-N	-1	0	348.402	3.886	50	0		EHAARM
CC[C@@H](c1nc(C)c(C)s1)n1cc(-c2ccccc2C(=O)[O-])nn1	ZINC000095364404	218296540	/nfs/dbraw/zinc/29/65/40/218296540.db2.gz	NMUSUBANXDTNSB-HNNXBMFYSA-N	-1	0	342.424	3.716	50	0		EHAARM
Cc1csc([C@@H](C2CC2)n2c(=O)c3ccccc3[n-]c2=S)n1	ZINC000095402817	218337007	/nfs/dbraw/zinc/33/70/07/218337007.db2.gz	UREOHHUVMNYKKP-CYBMUJFWSA-N	-1	0	329.450	3.823	50	0		EHAARM
Cc1ccc(OCC(=O)Nc2cc(Cl)ccc2C(=O)[O-])c(C)c1	ZINC000004952932	210337639	/nfs/dbraw/zinc/33/76/39/210337639.db2.gz	XYEZJOOOQLJHFH-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
C[C@H](NC(=O)c1ccc(C(=O)[O-])o1)c1nc(-c2ccccc2)cs1	ZINC000097231575	219000001	/nfs/dbraw/zinc/00/00/01/219000001.db2.gz	AMQDGCZXAVIJLW-JTQLQIEISA-N	-1	0	342.376	3.592	50	0		EHAARM
C[C@@H](NC(=O)c1ccc(C(=O)[O-])o1)c1nc(-c2ccccc2)cs1	ZINC000097231576	219000554	/nfs/dbraw/zinc/00/05/54/219000554.db2.gz	AMQDGCZXAVIJLW-SNVBAGLBSA-N	-1	0	342.376	3.592	50	0		EHAARM
COc1c(Cl)cc(C(=O)Nc2ccccc2C(=O)[O-])cc1Cl	ZINC000004832516	210290455	/nfs/dbraw/zinc/29/04/55/210290455.db2.gz	XSHNMHNNUOPXLB-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)Oc1cccc(Cl)c1	ZINC000004813751	210284573	/nfs/dbraw/zinc/28/45/73/210284573.db2.gz	JRVWZUMLZDHWDG-LLVKDONJSA-N	-1	0	333.771	3.753	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(C)c1C	ZINC000004809455	210282226	/nfs/dbraw/zinc/28/22/26/210282226.db2.gz	NRBZHRBSSSWXDL-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
Cc1cnc(-n2ncc(C(=O)[O-])c2C(C)C)nc1-c1ccc(F)cc1	ZINC000299802185	258105079	/nfs/dbraw/zinc/10/50/79/258105079.db2.gz	XXPCMVMZJMSFEG-UHFFFAOYSA-N	-1	0	340.358	3.598	50	0		EHAARM
CC[C@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002540510	258049931	/nfs/dbraw/zinc/04/99/31/258049931.db2.gz	UIMPTCRXHVBHOO-CYBMUJFWSA-N	-1	0	339.391	3.636	50	0		EHAARM
O=C([O-])C1CCN(c2nc3ccc(-c4cccs4)nc3s2)CC1	ZINC000169676732	226554549	/nfs/dbraw/zinc/55/45/49/226554549.db2.gz	UUFYNJPJHRHNKH-UHFFFAOYSA-N	-1	0	345.449	3.721	50	0		EHAARM
CCOc1ccc([C@H]2[C@@H](C(=O)[O-])CCC(=O)N2C2CCCCC2)cc1	ZINC000001394556	563386432	/nfs/dbraw/zinc/38/64/32/563386432.db2.gz	IGAXLNWFPCVKLI-HKUYNNGSSA-N	-1	0	345.439	3.782	50	0		EHAARM
C[C@H](Oc1ccc(Oc2cnc3ccc(Cl)cc3n2)cc1)C(=O)[O-]	ZINC000001539117	563391823	/nfs/dbraw/zinc/39/18/23/563391823.db2.gz	NUQZXROIVGBRGR-JTQLQIEISA-N	-1	0	344.754	3.927	50	0	in-vitro	EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1csc2ccccc12	ZINC000002385850	563430915	/nfs/dbraw/zinc/43/09/15/563430915.db2.gz	VRUFHPBCNHYEPJ-GFCCVEGCSA-N	-1	0	335.425	3.812	50	0		EHAARM
Cc1nc2c3ccccc3oc2c(N[C@@H](Cc2ccccc2)C(=O)[O-])n1	ZINC000005158467	563521707	/nfs/dbraw/zinc/52/17/07/563521707.db2.gz	RXYAOWWCBNEJFM-HNNXBMFYSA-N	-1	0	347.374	3.792	50	0		EHAARM
CCC(=O)N1[C@@H](C(=O)[O-])Cc2c3ccccc3[nH]c2[C@H]1CC(C)C	ZINC000005296786	563525679	/nfs/dbraw/zinc/52/56/79/563525679.db2.gz	FVEKIDYDEYCOKO-HZPDHXFCSA-N	-1	0	328.412	3.503	50	0		EHAARM
COc1ccc(-c2n[n-]c(=S)n2-c2ccc(C)cc2)cc1OC	ZINC000005687772	563545974	/nfs/dbraw/zinc/54/59/74/563545974.db2.gz	ZPDHCCBLCVTLJR-UHFFFAOYSA-N	-1	0	327.409	3.923	50	0		EHAARM
Cc1nc(-c2ccc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])cc2)cs1	ZINC000006668242	563577443	/nfs/dbraw/zinc/57/74/43/563577443.db2.gz	PYYXNAANQQHGKL-LSDHHAIUSA-N	-1	0	342.420	3.724	50	0		EHAARM
CCOc1cc(S(=O)(=O)[N-]c2ccc(Cl)cn2)c(C)cc1C	ZINC000006706819	563581260	/nfs/dbraw/zinc/58/12/60/563581260.db2.gz	GEIXNZXCMQTVKP-UHFFFAOYSA-N	-1	0	340.832	3.551	50	0		EHAARM
CC[C@H](C)c1ccc(OCC(=O)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000006954502	563592332	/nfs/dbraw/zinc/59/23/32/563592332.db2.gz	OLKMCIFUOSDSLI-ZDUSSCGKSA-N	-1	0	327.380	3.916	50	0		EHAARM
CCOc1ccc(Cl)cc1C(=O)Nc1ccc(CC(=O)[O-])cc1	ZINC000007043403	563593889	/nfs/dbraw/zinc/59/38/89/563593889.db2.gz	XPJDIUFXJXPQHH-UHFFFAOYSA-N	-1	0	333.771	3.618	50	0		EHAARM
CCCOc1ccc(S(=O)(=O)[N-]c2cccnc2)c2ccccc12	ZINC000007348632	563600143	/nfs/dbraw/zinc/60/01/43/563600143.db2.gz	GQKZKEQBASLQKC-UHFFFAOYSA-N	-1	0	342.420	3.824	50	0		EHAARM
Cc1ccc([C@H](CC(=O)[O-])NC(=O)c2c(F)cccc2Cl)cc1	ZINC000013178513	563692001	/nfs/dbraw/zinc/69/20/01/563692001.db2.gz	VQGVFHGRWCXPHJ-AWEZNQCLSA-N	-1	0	335.762	3.733	50	0		EHAARM
COc1ccc([C@@H](NC(=O)CC2(C(=O)[O-])CCCCC2)C(C)C)cc1	ZINC000013468896	563699133	/nfs/dbraw/zinc/69/91/33/563699133.db2.gz	CWJDIQZREARDCV-SFHVURJKSA-N	-1	0	347.455	3.934	50	0		EHAARM
COc1ccc(Cc2[n-]n3c(nc(C)cc3=O)c2-c2ccccc2)cc1	ZINC000013520522	563885802	/nfs/dbraw/zinc/88/58/02/563885802.db2.gz	VHVXLXRQYLPCIY-UHFFFAOYSA-N	-1	0	345.402	3.597	50	0		EHAARM
CCc1cccc(C)c1[N-]S(=O)(=O)c1cc(-c2ccno2)oc1C	ZINC000032971332	563920102	/nfs/dbraw/zinc/92/01/02/563920102.db2.gz	OMDJKGBLFWUAJH-UHFFFAOYSA-N	-1	0	346.408	3.915	50	0		EHAARM
Cc1noc(C)c1[C@@H](C)CNC(=O)c1c([O-])cc(Cl)cc1Cl	ZINC000096483793	563955371	/nfs/dbraw/zinc/95/53/71/563955371.db2.gz	AIHCLRRWOSIAED-ZETCQYMHSA-N	-1	0	343.210	3.837	50	0		EHAARM
C[C@@H](Oc1ccc(CCC(=O)[O-])cc1)c1nc(-c2ccccc2)no1	ZINC000097166003	563968526	/nfs/dbraw/zinc/96/85/26/563968526.db2.gz	GKFZNERTDDLVDF-CYBMUJFWSA-N	-1	0	338.363	3.894	50	0		EHAARM
CCOc1cccc([C@@H]2CCCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])c1	ZINC000072233798	563986113	/nfs/dbraw/zinc/98/61/13/563986113.db2.gz	DKAUKPNHISACCN-JKSUJKDBSA-N	-1	0	349.427	3.653	50	0		EHAARM
CCOc1ccc([C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])cc1	ZINC000221039640	563989643	/nfs/dbraw/zinc/98/96/43/563989643.db2.gz	USZJCPNSXWNJIA-HOTGVXAUSA-N	-1	0	349.427	3.653	50	0		EHAARM
CCOC(=O)c1nc(-c2cccs2)[n-]c1NC(=O)c1ccccc1	ZINC000033435929	563992082	/nfs/dbraw/zinc/99/20/82/563992082.db2.gz	MHYIPYSSWGBFGS-UHFFFAOYSA-N	-1	0	341.392	3.567	50	0		EHAARM
C[C@@H](Oc1ccc2cc(-c3ccc(Cl)cc3)c(=O)oc2c1)C(=O)[O-]	ZINC000005234674	564001388	/nfs/dbraw/zinc/00/13/88/564001388.db2.gz	HPODAEPKTVPRNM-SNVBAGLBSA-N	-1	0	344.750	3.965	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)c2ccc(COc3ccccc3)o2)cc1	ZINC000005429025	564003907	/nfs/dbraw/zinc/00/39/07/564003907.db2.gz	NXNRWOKJAWLVGJ-UHFFFAOYSA-N	-1	0	337.331	3.809	50	0		EHAARM
O=c1cc(-c2ccc3ccccc3c2)nc2[n-]c(C(F)(F)F)nn21	ZINC000018240799	564018924	/nfs/dbraw/zinc/01/89/24/564018924.db2.gz	OHRSWHLSDUFAKC-UHFFFAOYSA-N	-1	0	330.269	3.669	50	0		EHAARM
O=C([O-])CCC(=O)Nc1nc(-c2cc(Cl)ccc2Cl)cs1	ZINC000006742001	564033510	/nfs/dbraw/zinc/03/35/10/564033510.db2.gz	IFNOHDLDUMTHKU-UHFFFAOYSA-N	-1	0	345.207	3.920	50	0		EHAARM
COc1cc(/C=C\c2nc3ccccc3s2)ccc1OCC(=O)[O-]	ZINC000033530722	564036860	/nfs/dbraw/zinc/03/68/60/564036860.db2.gz	KEEVXVBVNZTLGM-CLFYSBASSA-N	-1	0	341.388	3.939	50	0		EHAARM
O=C([O-])CCCC(=O)Nc1cc(Cl)ccc1C(=O)c1ccccc1	ZINC000241590476	564052041	/nfs/dbraw/zinc/05/20/41/564052041.db2.gz	PFEQDIUGNSLGBF-UHFFFAOYSA-N	-1	0	345.782	3.764	50	0		EHAARM
CCOc1ccc(NC(=O)NC2CCC(C(=O)[O-])CC2)cc1Cl	ZINC000263463929	564056339	/nfs/dbraw/zinc/05/63/39/564056339.db2.gz	FOANRURDOZKCBQ-UHFFFAOYSA-N	-1	0	340.807	3.504	50	0		EHAARM
O=C(Cc1csc([N-]c2ncccn2)n1)Nc1cccc(Cl)c1	ZINC000044227681	564059809	/nfs/dbraw/zinc/05/98/09/564059809.db2.gz	GURDWFNFTNTAPT-UHFFFAOYSA-N	-1	0	345.815	3.511	50	0		EHAARM
CC(C)c1ccc([C@H](NCc2ccccc2F)[P@@](=O)([O-])O)cc1	ZINC000012949564	564079840	/nfs/dbraw/zinc/07/98/40/564079840.db2.gz	UTYWMIQLAYGQBT-QGZVFWFLSA-N	-1	0	337.331	3.915	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc(Oc2ccccc2)cc1	ZINC000007054001	564103924	/nfs/dbraw/zinc/10/39/24/564103924.db2.gz	SEOMMIHWSVNHPZ-UHFFFAOYSA-N	-1	0	344.392	3.885	50	0		EHAARM
COc1ccc([C@@H](C)n2c(=O)c3ccccc3[n-]c2=S)cc1OC	ZINC000007277204	564106188	/nfs/dbraw/zinc/10/61/88/564106188.db2.gz	GVPUVVKEOLFUIC-LLVKDONJSA-N	-1	0	342.420	3.686	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1cc(C)ccc1C	ZINC000007402535	564107918	/nfs/dbraw/zinc/10/79/18/564107918.db2.gz	GVLJRODIKLQHOM-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CC1CCC(N(C)C(=O)c2cc(F)cc(Br)c2[O-])CC1	ZINC000170610221	564109766	/nfs/dbraw/zinc/10/97/66/564109766.db2.gz	FPRLPYGCQIOXBC-UHFFFAOYSA-N	-1	0	344.224	3.945	50	0		EHAARM
CCOc1cc(C(=O)CCC(=O)NC2CCCCCC2)ccc1O	ZINC000007787354	564123345	/nfs/dbraw/zinc/12/33/45/564123345.db2.gz	QCSKUDHICAILFO-UHFFFAOYSA-N	-1	0	333.428	3.593	50	0		EHAARM
COc1ccccc1CN[C@@H](c1ccc(C(C)C)cc1)[P@@](=O)([O-])O	ZINC000012997561	564135875	/nfs/dbraw/zinc/13/58/75/564135875.db2.gz	FXCYMDVIPQCQCE-GOSISDBHSA-N	-1	0	349.367	3.785	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000003128518	564155325	/nfs/dbraw/zinc/15/53/25/564155325.db2.gz	SSUYVXACYZZFHA-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
CC(C)n1ncc2cc(/C=C\c3ncc(C(=O)[O-])s3)c(Cl)nc21	ZINC000222217628	599907222	/nfs/dbraw/zinc/90/72/22/599907222.db2.gz	QFSZGLLFCLPDOR-ARJAWSKDSA-N	-1	0	348.815	3.991	50	0		EHAARM
O=C([O-])COc1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1	ZINC000001234721	956862699	/nfs/dbraw/zinc/86/26/99/956862699.db2.gz	PDWXZSPQBZUPNB-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC000261841416	967806468	/nfs/dbraw/zinc/80/64/68/967806468.db2.gz	ITKGYNWGAMAILF-AVGNSLFASA-N	-1	0	335.366	3.601	50	0		EHAARM
CCOc1ccc(-c2nc(C(F)(F)F)c(C(=O)[O-])o2)cc1OCC	ZINC000326355766	1022086733	/nfs/dbraw/zinc/08/67/33/1022086733.db2.gz	FOZUEXZLVXQZLS-UHFFFAOYSA-N	-1	0	345.273	3.856	50	0		EHAARM
COc1ccc(-c2cc(=N[C@@H](C)C(=O)[O-])c3cc(C)ccc3o2)cc1	ZINC000254879303	1035598671	/nfs/dbraw/zinc/59/86/71/1035598671.db2.gz	JTCQPNGSBPKRHT-ZDUSSCGKSA-N	-1	0	337.375	3.791	50	0		EHAARM
Cc1nn(C)c(Cl)c1/C=C\c1cc(C(=O)[O-])c2ccc(F)cc2n1	ZINC000097040503	1039733182	/nfs/dbraw/zinc/73/31/82/1039733182.db2.gz	KFCRFCMHYKTZSR-XQRVVYSFSA-N	-1	0	345.761	3.938	50	0		EHAARM
Cc1c(S(=O)(=O)[N-]c2cc(C(C)(C)C)no2)c2ccccc2n1C	ZINC000331720934	1041109868	/nfs/dbraw/zinc/10/98/68/1041109868.db2.gz	KHXPDDZCQXBXIK-UHFFFAOYSA-N	-1	0	347.440	3.573	50	0		EHAARM
Cc1cnc(/C=C\c2cc(C(=O)[O-])c3cnn(C(C)C)c3n2)s1	ZINC000576826853	1131689005	/nfs/dbraw/zinc/68/90/05/1131689005.db2.gz	NSLZIBSPHBPBDL-PLNGDYQASA-N	-1	0	328.397	3.646	50	0		EHAARM
O=C([O-])C/C(=C/c1ccnn1CC1CCC1)c1nc2ccccc2o1	ZINC000630951919	1137425285	/nfs/dbraw/zinc/42/52/85/1137425285.db2.gz	QSJGDSZSFDWGOY-UVTDQMKNSA-N	-1	0	337.379	3.840	50	0		EHAARM
CN(Cc1ccccc1N1CCCC1)C(=O)c1ccc([O-])c(Cl)c1	ZINC000052398372	214126874	/nfs/dbraw/zinc/12/68/74/214126874.db2.gz	XHAWUTYOYNXFHY-UHFFFAOYSA-N	-1	0	344.842	3.918	50	0		EHAARM
O=c1nc(Cc2ncc(C(F)(F)F)cc2Cl)[n-]c2ccsc21	ZINC000053847516	214202664	/nfs/dbraw/zinc/20/26/64/214202664.db2.gz	CDSIBGONPPUWDX-UHFFFAOYSA-N	-1	0	345.733	3.643	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)cc1O	ZINC000004618400	210231487	/nfs/dbraw/zinc/23/14/87/210231487.db2.gz	BLYOOWUUCLQDEH-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
Cc1cccc(C(=O)N2NC3=C(CCCCC3)[C@@]2(O)C(F)(F)F)c1	ZINC000004524740	210214107	/nfs/dbraw/zinc/21/41/07/210214107.db2.gz	MXYFQCPBKRXFOP-CZUORRHYSA-N	-1	0	340.345	3.638	50	0		EHAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(Br)s2)c1	ZINC000004674036	210243201	/nfs/dbraw/zinc/24/32/01/210243201.db2.gz	SGTRLBBNTAISRW-UHFFFAOYSA-N	-1	0	346.271	3.928	50	0		EHAARM
CCN(CC)c1ccc(C(=O)[O-])cc1NC(=O)c1cccc(C)c1	ZINC000064820527	214807953	/nfs/dbraw/zinc/80/79/53/214807953.db2.gz	LSDQZHURKBYDPJ-UHFFFAOYSA-N	-1	0	326.396	3.792	50	0		EHAARM
COc1ccc(NC(=O)[C@@H](CC(=O)[O-])Cc2ccc(Cl)cc2)cc1	ZINC000004164060	210137315	/nfs/dbraw/zinc/13/73/15/210137315.db2.gz	OKUYZTFCXVVBKQ-CYBMUJFWSA-N	-1	0	347.798	3.621	50	0		EHAARM
Cc1c(C)c2ccc(O[C@@H](C(=O)[O-])c3ccccc3)c(C)c2oc1=O	ZINC000004039263	210106322	/nfs/dbraw/zinc/10/63/22/210106322.db2.gz	KQIOIIZICLVPHO-GOSISDBHSA-N	-1	0	338.359	3.923	50	0	biogenic	EHAARM
Cc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(OC(F)F)cc2)cc1	ZINC000003399303	210028334	/nfs/dbraw/zinc/02/83/34/210028334.db2.gz	OPRUGNWYAZDJSK-HNNXBMFYSA-N	-1	0	349.333	3.542	50	0		EHAARM
O=C([O-])c1cc2nc(-c3ccc(Cl)s3)cc(C(F)(F)F)n2n1	ZINC000002770813	209908487	/nfs/dbraw/zinc/90/84/87/209908487.db2.gz	SWWLTWBWFAYFLF-UHFFFAOYSA-N	-1	0	347.705	3.828	50	0		EHAARM
Cc1ccc(-c2cc(C(F)(F)F)nc(SCC(=O)[O-])n2)s1	ZINC000002554329	209867096	/nfs/dbraw/zinc/86/70/96/209867096.db2.gz	OJQJEONPJXRPDD-UHFFFAOYSA-N	-1	0	334.344	3.709	50	0		EHAARM
CCSC(=S)N1[C@@H](c2ccc(C)cc2)SC[C@@H]1C(=O)[O-]	ZINC000002336934	209841921	/nfs/dbraw/zinc/84/19/21/209841921.db2.gz	RJKSJDQJAMUIJW-VXGBXAGGSA-N	-1	0	327.496	3.534	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)c1ccc(Br)cc1	ZINC000000435124	209599054	/nfs/dbraw/zinc/59/90/54/209599054.db2.gz	QTRSMHUVAPFRDQ-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
Cc1nn(C)c(Cl)c1/C=C/c1cc(C(=O)[O-])c2ccc(F)cc2n1	ZINC000031855779	212752541	/nfs/dbraw/zinc/75/25/41/212752541.db2.gz	KFCRFCMHYKTZSR-GQCTYLIASA-N	-1	0	345.761	3.938	50	0		EHAARM
COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)[O-])c(OC)c1	ZINC000021948598	212266532	/nfs/dbraw/zinc/26/65/32/212266532.db2.gz	WEVWBIJISCZDAJ-UHFFFAOYSA-N	-1	0	325.364	3.869	50	0		EHAARM
Cc1c(C(=O)[O-])sc2ncnc(NCc3ccc(Cl)cc3)c12	ZINC000021715886	212243164	/nfs/dbraw/zinc/24/31/64/212243164.db2.gz	HIBLQKVRFSDPLB-UHFFFAOYSA-N	-1	0	333.800	3.963	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)CCCc2ccc(Cl)cc2)C1	ZINC000237947540	242867350	/nfs/dbraw/zinc/86/73/50/242867350.db2.gz	FMRHZPNSVKHMPY-HNNXBMFYSA-N	-1	0	337.847	3.766	50	0		EHAARM
CCOc1ccccc1Nc1ncnc2sc(C(=O)[O-])c(C)c21	ZINC000020328394	212119908	/nfs/dbraw/zinc/11/99/08/212119908.db2.gz	KMBBDJRHJMELRC-UHFFFAOYSA-N	-1	0	329.381	3.840	50	0		EHAARM
COc1cc(C(=O)[O-])ccc1OCc1cccc(Br)c1	ZINC000013420095	211555466	/nfs/dbraw/zinc/55/54/66/211555466.db2.gz	GCENFXPJMGKQFH-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
CC[C@]1(C(=O)[O-])CCCN(C(=O)c2c(F)ccc(C)c2Cl)C1	ZINC000091548708	218020641	/nfs/dbraw/zinc/02/06/41/218020641.db2.gz	FBJDNVWUNVZBGE-INIZCTEOSA-N	-1	0	327.783	3.505	50	0		EHAARM
CCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2cc(Cl)ccc2F)C1	ZINC000091807796	218068438	/nfs/dbraw/zinc/06/84/38/218068438.db2.gz	QWROYBORVSSVNO-MRXNPFEDSA-N	-1	0	327.783	3.586	50	0		EHAARM
CSc1n[n-]c2nc3c(c(=O)n12)C1(CCCC1)Cc1ccccc1-3	ZINC000009350887	211072378	/nfs/dbraw/zinc/07/23/78/211072378.db2.gz	LYEWQLPZVGDZSK-UHFFFAOYSA-N	-1	0	338.436	3.587	50	0		EHAARM
COc1ccc(-c2c[n-]n3c2nc(C)c(Cc2ccccc2)c3=O)cc1	ZINC000009261219	211059526	/nfs/dbraw/zinc/05/95/26/211059526.db2.gz	HBFRPEJLHJTVLJ-UHFFFAOYSA-N	-1	0	345.402	3.597	50	0		EHAARM
CCOCCCn1c(CCCCC(=O)[O-])nc2cc(Cl)ccc21	ZINC000095095658	218280898	/nfs/dbraw/zinc/28/08/98/218280898.db2.gz	YEECMIOTLZFKAF-UHFFFAOYSA-N	-1	0	338.835	3.914	50	0		EHAARM
O=C([O-])C1(CC(=O)Nc2ccccc2Br)CCCCC1	ZINC000008987269	211026587	/nfs/dbraw/zinc/02/65/87/211026587.db2.gz	RQPHOBCQDOIQOP-UHFFFAOYSA-N	-1	0	340.217	3.813	50	0		EHAARM
Cc1ccc(C)c([C@H](C)NC(=O)C[C@@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000008388752	210944181	/nfs/dbraw/zinc/94/41/81/210944181.db2.gz	FEUVPANUXSVSBS-HRAATJIYSA-N	-1	0	339.435	3.913	50	0		EHAARM
Cc1cc2cc(C(=O)N[C@H](C(=O)[O-])c3ccc(F)cc3F)ccc2o1	ZINC000095520573	218426468	/nfs/dbraw/zinc/42/64/68/218426468.db2.gz	IDBJFALVVWQCNJ-INIZCTEOSA-N	-1	0	345.301	3.575	50	0		EHAARM
Cc1cc2oc(-c3ccco3)c(O[C@H](C)C(=O)[O-])c(=O)c2cc1C	ZINC000005580604	210494451	/nfs/dbraw/zinc/49/44/51/210494451.db2.gz	MIEKWPKQWRAHON-LLVKDONJSA-N	-1	0	328.320	3.522	50	0		EHAARM
COc1ccc(Nc2nccc(Nc3ccccc3C(=O)[O-])n2)cc1	ZINC000096693972	218887338	/nfs/dbraw/zinc/88/73/38/218887338.db2.gz	XTUYEDFQXBYWPD-UHFFFAOYSA-N	-1	0	336.351	3.671	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc2oc3c(c2c1)CCCC3	ZINC000004788694	210278442	/nfs/dbraw/zinc/27/84/42/210278442.db2.gz	VLLLKBSANCJDDA-GJZGRUSLSA-N	-1	0	339.391	3.917	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccccc1	ZINC000238129392	257944245	/nfs/dbraw/zinc/94/42/45/257944245.db2.gz	MDCJHWGHEMBBKT-IEBWSBKVSA-N	-1	0	337.419	3.829	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000006402441	258052040	/nfs/dbraw/zinc/05/20/40/258052040.db2.gz	HGVAJYUWPFBDPF-MSOLQXFVSA-N	-1	0	338.407	3.502	50	0		EHAARM
CCOc1ccc2nc(Sc3ncccc3C(=O)[O-])sc2c1	ZINC000017118015	258056810	/nfs/dbraw/zinc/05/68/10/258056810.db2.gz	AHIJZERZZWMUQC-UHFFFAOYSA-N	-1	0	332.406	3.939	50	0		EHAARM
COCc1nc(C)c(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)s1	ZINC000159246888	533278004	/nfs/dbraw/zinc/27/80/04/533278004.db2.gz	LNUOJBWVMRWUTF-UHFFFAOYSA-N	-1	0	347.223	3.863	50	0		EHAARM
C[C@@H](CC(=O)N1CCC[C@@H](C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000136151075	533413572	/nfs/dbraw/zinc/41/35/72/533413572.db2.gz	GOUMWXQOENSYKM-NWDGAFQWSA-N	-1	0	343.345	3.522	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccccc2Br)cc1	ZINC000007053423	563594228	/nfs/dbraw/zinc/59/42/28/563594228.db2.gz	COAHKPPDLKCWMI-UHFFFAOYSA-N	-1	0	326.215	3.558	50	0		EHAARM
COc1ccc(S(=O)(=O)[N-]c2cccc3c(C)c(C)[nH]c32)cc1	ZINC000000003606	563211502	/nfs/dbraw/zinc/21/15/02/563211502.db2.gz	SYJJOYBZDOCMLT-UHFFFAOYSA-N	-1	0	330.409	3.594	50	0		EHAARM
COc1ccc(CCCC(=O)Nc2cccc(C(=O)[O-])c2)cc1C	ZINC000000616813	563358773	/nfs/dbraw/zinc/35/87/73/563358773.db2.gz	RTIIKUSDUZZCIB-UHFFFAOYSA-N	-1	0	327.380	3.663	50	0		EHAARM
CC[C@@H](C)c1ccc(OCC(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000001164986	563376963	/nfs/dbraw/zinc/37/69/63/563376963.db2.gz	OJEGCQLBJSIRGZ-CYBMUJFWSA-N	-1	0	327.380	3.916	50	0		EHAARM
O=C([O-])c1ccccc1-c1nnc2c(Cl)cc(C(F)(F)F)cn21	ZINC000002243925	563427744	/nfs/dbraw/zinc/42/77/44/563427744.db2.gz	KMMWGFVFICSUDA-UHFFFAOYSA-N	-1	0	341.676	3.767	50	0		EHAARM
CCN(CC)c1ccc([N-]S(=O)(=O)c2ccc(F)cc2F)cc1	ZINC000006350146	563565668	/nfs/dbraw/zinc/56/56/68/563565668.db2.gz	GJCVQXMMBVRJAZ-UHFFFAOYSA-N	-1	0	340.395	3.612	50	0		EHAARM
Cc1cc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])ccc1Br	ZINC000000402026	563594941	/nfs/dbraw/zinc/59/49/41/563594941.db2.gz	GBXVFMOXCSZQBR-NWDGAFQWSA-N	-1	0	340.217	3.587	50	0		EHAARM
Cc1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])c(Br)c1	ZINC000002744409	563611181	/nfs/dbraw/zinc/61/11/81/563611181.db2.gz	OQGQWGTZRYVECK-QWRGUYRKSA-N	-1	0	340.217	3.587	50	0		EHAARM
CCCOc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cn2)cc1C	ZINC000008714629	563636342	/nfs/dbraw/zinc/63/63/42/563636342.db2.gz	OVUOTIIFZJYNEP-UHFFFAOYSA-N	-1	0	340.832	3.633	50	0		EHAARM
O=C([O-])c1cccc2c1CCCN2C(=O)Cc1ccc2c(c1)CCCC2	ZINC000012794337	563672273	/nfs/dbraw/zinc/67/22/73/563672273.db2.gz	UDFUTEFHKPFUQZ-UHFFFAOYSA-N	-1	0	349.430	3.786	50	0		EHAARM
O=c1c2ccccc2[n-]c(=S)n1CCCCOc1ccccc1	ZINC000032778500	563734283	/nfs/dbraw/zinc/73/42/83/563734283.db2.gz	STXXJUBIJUDUCQ-UHFFFAOYSA-N	-1	0	326.421	3.918	50	0		EHAARM
CC[C@H](C)N(CC(=O)[O-])C(=O)c1sc2nc(C)cc(C)c2c1C	ZINC000119104590	563868678	/nfs/dbraw/zinc/86/86/78/563868678.db2.gz	OBILBIZQXWHCQF-NSHDSACASA-N	-1	0	334.441	3.547	50	0		EHAARM
COc1ccc2cc(S(=O)(=O)[N-]c3ccc(Cl)cn3)ccc2c1	ZINC000027587914	563897589	/nfs/dbraw/zinc/89/75/89/563897589.db2.gz	VTTQFGGVHVLRIS-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
CCN(c1ccccc1C(=O)[O-])S(=O)(=O)c1ccc(C(C)C)cc1	ZINC000028580180	563903316	/nfs/dbraw/zinc/90/33/16/563903316.db2.gz	DUVDUBGRZKNFEV-UHFFFAOYSA-N	-1	0	347.436	3.723	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1CC(=O)c1ccccc1Br	ZINC000043879397	563925974	/nfs/dbraw/zinc/92/59/74/563925974.db2.gz	GBKPVVHPQQKNTI-WDEREUQCSA-N	-1	0	325.202	3.913	50	0		EHAARM
CCOCCn1cnc(-c2ccccc2)c1-c1ccccc1C(=O)[O-]	ZINC000065492381	563961559	/nfs/dbraw/zinc/96/15/59/563961559.db2.gz	WGCKHIQXKMTNOC-UHFFFAOYSA-N	-1	0	336.391	3.952	50	0		EHAARM
C[C@@H](C(=O)[O-])[C@H](NC(=O)c1ccc(F)cc1Cl)c1ccccc1	ZINC000097018282	563966782	/nfs/dbraw/zinc/96/67/82/563966782.db2.gz	HOMZQDZQJYQNIA-BMIGLBTASA-N	-1	0	335.762	3.671	50	0		EHAARM
COc1cc(C)c(C)cc1S(=O)(=O)[N-]c1cccc2cccnc21	ZINC000074826891	563967047	/nfs/dbraw/zinc/96/70/47/563967047.db2.gz	RLEHVEZDLWRZSU-UHFFFAOYSA-N	-1	0	342.420	3.661	50	0		EHAARM
O=C(NCc1ccc(Cl)cn1)c1cc(Cl)c([O-])c(Cl)c1	ZINC000408513812	563992764	/nfs/dbraw/zinc/99/27/64/563992764.db2.gz	FHXGUZYGBVHRQY-UHFFFAOYSA-N	-1	0	331.586	3.677	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)CCc1ccc(Cl)s1	ZINC000237924121	563994218	/nfs/dbraw/zinc/99/42/18/563994218.db2.gz	BVYLPXDBZWIORN-NSHDSACASA-N	-1	0	329.849	3.580	50	0		EHAARM
Cc1ccc([C@H]2CCCN2C(=O)CCc2ccccc2C(=O)[O-])o1	ZINC000262233399	563994975	/nfs/dbraw/zinc/99/49/75/563994975.db2.gz	XAGTYMIBGJOMTC-MRXNPFEDSA-N	-1	0	327.380	3.583	50	0		EHAARM
COc1ccc(C[C@@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000005199518	564000353	/nfs/dbraw/zinc/00/03/53/564000353.db2.gz	MLIWZQVEMIEICL-ZDUSSCGKSA-N	-1	0	347.798	3.621	50	0		EHAARM
Cc1ccc(NC(=O)c2ccccc2C(=O)[O-])cc1Br	ZINC000000038666	564042066	/nfs/dbraw/zinc/04/20/66/564042066.db2.gz	MWGBUTLXYHMWDR-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
O=C(Nc1ccc(F)c(Cl)c1)c1nn(-c2ccccc2)cc1[O-]	ZINC000084572839	564068736	/nfs/dbraw/zinc/06/87/36/564068736.db2.gz	PLKBMUOBWIHUBM-UHFFFAOYSA-N	-1	0	331.734	3.623	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)cc1C	ZINC000075351843	564082029	/nfs/dbraw/zinc/08/20/29/564082029.db2.gz	NXMYQKBMUSVKTJ-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
CC(=O)c1ccc([N-]S(=O)(=O)c2cccc(Cl)c2Cl)cc1	ZINC000006456727	564087863	/nfs/dbraw/zinc/08/78/63/564087863.db2.gz	QBEPIRVLNDUBFX-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
Cn1nc(C2CCCCC2)c2ncc(C(=O)c3ccccc3[O-])cc21	ZINC000521396862	564090913	/nfs/dbraw/zinc/09/09/13/564090913.db2.gz	WIUZUQHQXSSMHV-UHFFFAOYSA-N	-1	0	335.407	3.953	50	0		EHAARM
Cc1nnc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3C)s2)o1	ZINC000064920012	564097672	/nfs/dbraw/zinc/09/76/72/564097672.db2.gz	XOBINCRKXFCQQB-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2cnc3ccccc3c2)n[nH]1	ZINC000170617506	564110162	/nfs/dbraw/zinc/11/01/62/564110162.db2.gz	JXDQWAMWAVUQKB-GFCCVEGCSA-N	-1	0	344.440	3.662	50	0		EHAARM
O=C([O-])CCCNC(=O)c1sc2cc(Cl)ccc2c1Cl	ZINC000037409933	564121428	/nfs/dbraw/zinc/12/14/28/564121428.db2.gz	HFOWVOLZBAOLTI-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@H](c2ccc(Cl)cc2)[C@@H]1C(=O)[O-]	ZINC000139784229	564133627	/nfs/dbraw/zinc/13/36/27/564133627.db2.gz	WOCFNKDQXQVEJM-ZIAGYGMSSA-N	-1	0	339.819	3.908	50	0		EHAARM
C[C@@H](NC(=O)c1cccc(C(=O)[O-])c1)c1ncc(-c2ccccc2)o1	ZINC000225482941	564135203	/nfs/dbraw/zinc/13/52/03/564135203.db2.gz	BSENIATVURRQNQ-GFCCVEGCSA-N	-1	0	336.347	3.531	50	0		EHAARM
CCCCC[C@@H]1c2[nH]c3ccccc3c2C[C@@H](C(=O)[O-])N1C(C)=O	ZINC000003024598	564154465	/nfs/dbraw/zinc/15/44/65/564154465.db2.gz	LKEGYTFONVXESR-SJORKVTESA-N	-1	0	328.412	3.647	50	0		EHAARM
CC[C@@H]1c2[nH]c3ccccc3c2C[C@@H](C(=O)[O-])N1C(=O)c1ccccc1	ZINC000003173965	564155667	/nfs/dbraw/zinc/15/56/67/564155667.db2.gz	VANZQNXBIFPECN-MSOLQXFVSA-N	-1	0	348.402	3.771	50	0		EHAARM
O=C(CCc1nc(-c2cccs2)no1)Nc1cccc(Cl)c1[O-]	ZINC000069738187	564171840	/nfs/dbraw/zinc/17/18/40/564171840.db2.gz	WIWQJAYXOSEIJQ-UHFFFAOYSA-N	-1	0	349.799	3.728	50	0		EHAARM
O=C([O-])C1(NC(=O)CCCc2nc3ccccc3s2)CCCCC1	ZINC000071802829	564175501	/nfs/dbraw/zinc/17/55/01/564175501.db2.gz	PBWRYLYDIGVRGB-UHFFFAOYSA-N	-1	0	346.452	3.523	50	0		EHAARM
C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)C3(C(=O)[O-])CC3)c2)C1	ZINC000154836178	959038504	/nfs/dbraw/zinc/03/85/04/959038504.db2.gz	CBECHBJZNDQVJE-CJNGLKHVSA-N	-1	0	331.412	3.585	50	0		EHAARM
O=C([O-])[C@@H]1CCN(C(=O)Nc2ccc(OCC3CCCCC3)cc2)C1	ZINC000263494444	962677731	/nfs/dbraw/zinc/67/77/31/962677731.db2.gz	QEQNOJXNHKCGFR-OAHLLOKOSA-N	-1	0	346.427	3.584	50	0		EHAARM
COc1cc(C)c(NC(=O)CCc2ccccc2C(=O)[O-])c(C)c1C	ZINC000263527252	962708368	/nfs/dbraw/zinc/70/83/68/962708368.db2.gz	KMUREUJOISRFFR-UHFFFAOYSA-N	-1	0	341.407	3.890	50	0		EHAARM
C[C@H](Cc1ccc(NC(=O)[C@@H]2CCc3cc(F)ccc32)cc1)C(=O)[O-]	ZINC000563451652	974533291	/nfs/dbraw/zinc/53/32/91/974533291.db2.gz	ZZOYREMPIFTHOO-KZULUSFZSA-N	-1	0	341.382	3.757	50	0		EHAARM
O=C([O-])[C@H]1CCN(C(=O)C[C@@H]2CCc3ccccc32)c2ccccc21	ZINC000669435066	976001987	/nfs/dbraw/zinc/00/19/87/976001987.db2.gz	SDMIKRKJWMDCKR-YJBOKZPZSA-N	-1	0	335.403	3.712	50	0		EHAARM
O=C(Nc1ccccc1OCC(F)(F)C(F)F)c1ccccc1O	ZINC000022309242	1019876080	/nfs/dbraw/zinc/87/60/80/1019876080.db2.gz	CQMQMTNTSQFJDC-UHFFFAOYSA-N	-1	0	343.276	3.924	50	0		EHAARM
O=C([O-])/C=C/c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1	ZINC000095970403	1031163494	/nfs/dbraw/zinc/16/34/94/1031163494.db2.gz	XDWOFOARYLYJLD-DHZHZOJOSA-N	-1	0	348.358	3.621	50	0		EHAARM
COc1cc(C=NNc2cccc(C)c2)cc(Br)c1O	ZINC000254478177	1039910874	/nfs/dbraw/zinc/91/08/74/1039910874.db2.gz	POJOLOHJNYACKJ-UHFFFAOYSA-N	-1	0	335.201	3.918	50	0		EHAARM
O=C([O-])/C=C\c1ccc(NC(=O)CCc2cc(F)ccc2F)cc1	ZINC000221915564	1138223861	/nfs/dbraw/zinc/22/38/61/1138223861.db2.gz	BXZYDHTUQIBLAK-KMKOMSMNSA-N	-1	0	331.318	3.634	50	0		EHAARM
CC(C)=C1[C@@H]2C=C[C@H]1[C@H](C(=O)[O-])[C@@H]2C(=O)Nc1cc(C)ccc1C	ZINC000004380629	210183892	/nfs/dbraw/zinc/18/38/92/210183892.db2.gz	WXJDHIUYCWULNV-JFTQMJAMSA-N	-1	0	325.408	3.711	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)NCC[C@H](c1ccco1)c1ccccc1	ZINC000004029068	210103110	/nfs/dbraw/zinc/10/31/10/210103110.db2.gz	OXOZTHCAZFOPJR-INIZCTEOSA-N	-1	0	349.386	3.930	50	0	biogenic	EHAARM
O=C([O-])c1ccccc1C(=O)NCC[C@@H](c1ccco1)c1ccccc1	ZINC000004029067	210102887	/nfs/dbraw/zinc/10/28/87/210102887.db2.gz	OXOZTHCAZFOPJR-MRXNPFEDSA-N	-1	0	349.386	3.930	50	0	biogenic	EHAARM
C=Cc1ccc(Cn2c3cc(OC)ccc3c(C=O)c2C(=O)[O-])cc1	ZINC000045795946	213756477	/nfs/dbraw/zinc/75/64/77/213756477.db2.gz	BJWMSRQNFCTDIN-UHFFFAOYSA-N	-1	0	335.359	3.852	50	0		EHAARM
O=C(NCc1cc(=O)n(-c2ccccc2)[n-]1)c1ccc2ccccc2c1	ZINC000102715524	219224435	/nfs/dbraw/zinc/22/44/35/219224435.db2.gz	NQGBKXNAWNHLDW-UHFFFAOYSA-N	-1	0	343.386	3.661	50	0		EHAARM
CCOc1cc(C(=O)[O-])ccc1OCCOc1ccccc1Cl	ZINC000003331278	210009633	/nfs/dbraw/zinc/00/96/33/210009633.db2.gz	FKFDWCUWJCMCJB-UHFFFAOYSA-N	-1	0	336.771	3.895	50	0		EHAARM
Cc1cc2oc(-c3ccccc3)c(O[C@H](C)C(=O)[O-])c(=O)c2cc1C	ZINC000001923686	209805166	/nfs/dbraw/zinc/80/51/66/209805166.db2.gz	XOXQOCNIUVJITQ-CYBMUJFWSA-N	-1	0	338.359	3.929	50	0		EHAARM
Cc1ccc(C2=NN(C(=O)CCC(=O)[O-])[C@H](c3cccs3)C2)cc1	ZINC000000554146	209662078	/nfs/dbraw/zinc/66/20/78/209662078.db2.gz	OLDALRBCNWTBHP-HNNXBMFYSA-N	-1	0	342.420	3.599	50	0		EHAARM
Cc1cc(Cl)cc([N-]S(=O)(=O)c2cccc3cccnc32)c1O	ZINC000072301046	216139974	/nfs/dbraw/zinc/13/99/74/216139974.db2.gz	UGWUOZOTTFZRAM-UHFFFAOYSA-N	-1	0	348.811	3.703	50	0		EHAARM
COc1ccc(/C=C/C(=O)Nc2sc(C)c(C)c2C(=O)[O-])cc1	ZINC000000227498	209496871	/nfs/dbraw/zinc/49/68/71/209496871.db2.gz	FURBUDYMZDPVNI-RMKNXTFCSA-N	-1	0	331.393	3.724	50	0		EHAARM
O=C([O-])c1ccc(-c2ccc(I)cc2Cl)o1	ZINC000000172811	209462753	/nfs/dbraw/zinc/46/27/53/209462753.db2.gz	KBZBIGOWLGUDIU-UHFFFAOYSA-N	-1	0	348.523	3.903	50	0		EHAARM
Cc1ccc(-c2n[nH]cc2-c2nc3cc(C(=O)[O-])ccc3[nH]2)cc1C	ZINC000072410280	216202885	/nfs/dbraw/zinc/20/28/85/216202885.db2.gz	RRKHIGBNLCXZGI-UHFFFAOYSA-N	-1	0	332.363	3.935	50	0		EHAARM
CCn1nccc1[N-]S(=O)(=O)c1ccc(C2CCCCC2)cc1	ZINC000028249370	212610893	/nfs/dbraw/zinc/61/08/93/212610893.db2.gz	UYMSHUDUMINKAP-UHFFFAOYSA-N	-1	0	333.457	3.752	50	0		EHAARM
CC[C@@H](C(=O)[O-])n1cnc2scc(-c3ccc(Cl)cc3)c2c1=O	ZINC000000065089	209396536	/nfs/dbraw/zinc/39/65/36/209396536.db2.gz	RJKZODONBJBONO-LBPRGKRZSA-N	-1	0	348.811	3.814	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccccc2Cl)C1	ZINC000108462636	219889373	/nfs/dbraw/zinc/88/93/73/219889373.db2.gz	RCKGLMJLSQQWLG-CFVMTHIKSA-N	-1	0	335.831	3.547	50	0		EHAARM
COc1ccc(NC(=O)C[C@@H](CC(=O)[O-])c2ccccc2)c(C)c1	ZINC000226750174	242112535	/nfs/dbraw/zinc/11/25/35/242112535.db2.gz	INIHMCCVSZARTM-HNNXBMFYSA-N	-1	0	327.380	3.591	50	0		EHAARM
CCOC(=O)c1cccc([N-]c2nc(-c3ccc(OC)cc3)no2)c1	ZINC000021158317	212212853	/nfs/dbraw/zinc/21/28/53/212212853.db2.gz	LZOYDFBBNPPNPX-UHFFFAOYSA-N	-1	0	339.351	3.666	50	0		EHAARM
O=C([O-])C[C@H]1CCCCN1C(=O)c1ccc(-c2cccc(F)c2)cc1	ZINC000244884022	243097037	/nfs/dbraw/zinc/09/70/37/243097037.db2.gz	YDTQPSKGUMLSED-GOSISDBHSA-N	-1	0	341.382	3.962	50	0		EHAARM
Cc1ccc([C@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1C	ZINC000020616885	212156180	/nfs/dbraw/zinc/15/61/80/212156180.db2.gz	OGLOQIHCRMSYSJ-OLZOCXBDSA-N	-1	0	339.317	3.858	50	0		EHAARM
CC(C)(C)c1ccc(-c2n[n-]c(NCCc3ccccc3)nc2=O)cc1	ZINC000016777483	211934376	/nfs/dbraw/zinc/93/43/76/211934376.db2.gz	LDAAUXBFPMCIHI-UHFFFAOYSA-N	-1	0	348.450	3.784	50	0		EHAARM
C[C@@H](Sc1ccccc1C(=O)[O-])C(=O)Nc1cccnc1Cl	ZINC000012940563	211489806	/nfs/dbraw/zinc/48/98/06/211489806.db2.gz	FXCHSXDYXZXYRB-SECBINFHSA-N	-1	0	336.800	3.553	50	0		EHAARM
O=C(Cc1cccc2c1cccc2[S@](=O)[O-])Nc1ccc(F)cc1	ZINC000012428610	211377791	/nfs/dbraw/zinc/37/77/91/211377791.db2.gz	HSBHXBUFUADIFN-UHFFFAOYSA-N	-1	0	343.379	3.741	50	0		EHAARM
Cc1cc(C(=O)[N-]c2nnc(-c3cc(Cl)ccc3Cl)o2)on1	ZINC000012422420	211375733	/nfs/dbraw/zinc/37/57/33/211375733.db2.gz	DDCJXMYIPITDNK-UHFFFAOYSA-N	-1	0	339.138	3.592	50	0		EHAARM
COc1ccccc1-c1cc(C(=O)[O-])c2nc(-c3ccccc3)[nH]c2n1	ZINC000011694695	211237058	/nfs/dbraw/zinc/23/70/58/211237058.db2.gz	QHEQARLUEAQDND-UHFFFAOYSA-N	-1	0	345.358	3.999	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3c(C)cccc3C)s2)n[nH]1	ZINC000009686420	211113940	/nfs/dbraw/zinc/11/39/40/211113940.db2.gz	YTZOWJCSQNDDPK-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
COc1ccccc1-c1c(C)[n-]n2c1nc(Cc1ccccc1)cc2=O	ZINC000009045301	211032478	/nfs/dbraw/zinc/03/24/78/211032478.db2.gz	HHFCZECCAVOXDX-UHFFFAOYSA-N	-1	0	345.402	3.597	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)NCc3cccs3)C2)cc1	ZINC000095376203	218308802	/nfs/dbraw/zinc/30/88/02/218308802.db2.gz	NGSCENYEJRXABB-OAHLLOKOSA-N	-1	0	344.436	3.536	50	0		EHAARM
O=S(=O)([N-]c1nc2ccc(Cl)cc2s1)c1cccs1	ZINC000008864722	211013503	/nfs/dbraw/zinc/01/35/03/211013503.db2.gz	RVILMXPQIYAOED-UHFFFAOYSA-N	-1	0	330.843	3.812	50	0		EHAARM
CCCC[C@@H](CC(=O)[O-])NC(=O)c1oc2cc(OC)ccc2c1C	ZINC000095523985	218427873	/nfs/dbraw/zinc/42/78/73/218427873.db2.gz	RTLYCXRKJKONQV-LBPRGKRZSA-N	-1	0	333.384	3.513	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)N(Cc1ccccc1)Cc1ccccc1	ZINC000005773225	210533092	/nfs/dbraw/zinc/53/30/92/210533092.db2.gz	UNSMZYSBHPOFFL-PMACEKPBSA-N	-1	0	349.430	3.882	50	0		EHAARM
C[C@@H](Oc1c(=O)c2cc(Cl)ccc2oc1-c1ccccc1)C(=O)[O-]	ZINC000005606313	210499601	/nfs/dbraw/zinc/49/96/01/210499601.db2.gz	CGMDAXOVIJRHDM-SNVBAGLBSA-N	-1	0	344.750	3.965	50	0		EHAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ncccc1C	ZINC000004970494	210343340	/nfs/dbraw/zinc/34/33/40/210343340.db2.gz	IHTPMPJFVSXCTB-UHFFFAOYSA-N	-1	0	340.832	3.551	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)cc1C(=O)[O-]	ZINC000299753329	258006489	/nfs/dbraw/zinc/00/64/89/258006489.db2.gz	XVGNTKKUDHZOOB-HUUCEWRRSA-N	-1	0	347.798	3.702	50	0		EHAARM
Cc1cc(C)n(-c2ccc(Oc3ccccc3)c(S(=O)(=O)[O-])c2)n1	ZINC000169293535	534099614	/nfs/dbraw/zinc/09/96/14/534099614.db2.gz	KOTWEQVEQLAXFH-UHFFFAOYSA-N	-1	0	344.392	3.528	50	0		EHAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc3ccccc3c2)c1	ZINC000000341222	563286198	/nfs/dbraw/zinc/28/61/98/563286198.db2.gz	CENXJRMWUXFKEH-UHFFFAOYSA-N	-1	0	343.404	3.658	50	0		EHAARM
Cc1noc(C2CC2)c1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000126823408	563364507	/nfs/dbraw/zinc/36/45/07/563364507.db2.gz	OZCVJTHIUNWCBX-UHFFFAOYSA-N	-1	0	346.330	3.680	50	0		EHAARM
O=C([O-])[C@H](Cc1cccc2ccccc21)NC(=O)OCc1ccccc1	ZINC000002561176	563441572	/nfs/dbraw/zinc/44/15/72/563441572.db2.gz	HNYQEAGTPQSPLT-IBGZPJMESA-N	-1	0	349.386	3.762	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1cc(Cl)ccc1OC	ZINC000005598735	563541817	/nfs/dbraw/zinc/54/18/17/563541817.db2.gz	PCXFOSGQMVSWMU-UHFFFAOYSA-N	-1	0	325.817	3.712	50	0		EHAARM
CCCc1cc2c(cc1[O-])occ(-c1ccc(C(=O)OCC)o1)c2=O	ZINC000005686282	563545526	/nfs/dbraw/zinc/54/55/26/563545526.db2.gz	INYUCQJYWDBHML-UHFFFAOYSA-N	-1	0	342.347	3.888	50	0	biogenic	EHAARM
Cc1c([O-])c2c(cc(-c3ccccc3)n(-c3ccccc3)c2=O)oc1=O	ZINC000006556301	563571948	/nfs/dbraw/zinc/57/19/48/563571948.db2.gz	AGHSEVIEGLASEL-UHFFFAOYSA-N	-1	0	345.354	3.625	50	0	aggregator	EHAARM
CCOc1ccc(/C=C(/NC(=O)c2ccccc2Cl)C(=O)[O-])cc1	ZINC000013111209	563688211	/nfs/dbraw/zinc/68/82/11/563688211.db2.gz	WJNJXYXQWSRWHN-LFIBNONCSA-N	-1	0	345.782	3.594	50	0		EHAARM
Cc1ccc(NC(=O)CSc2nc(=O)c3sccc3[n-]2)c(C)c1	ZINC000032765486	563729612	/nfs/dbraw/zinc/72/96/12/563729612.db2.gz	GSRIYPZATHHTSZ-UHFFFAOYSA-N	-1	0	345.449	3.745	50	0		EHAARM
Cc1ccc(CSc2ncc(Br)c(C(=O)[O-])n2)cc1	ZINC000028291919	563902211	/nfs/dbraw/zinc/90/22/11/563902211.db2.gz	KETCAXMAVPASFH-UHFFFAOYSA-N	-1	0	339.214	3.538	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cccc(Cl)c2Cl)C1	ZINC000043589654	563913577	/nfs/dbraw/zinc/91/35/77/563913577.db2.gz	PJJYNDYSLYBCOG-SNVBAGLBSA-N	-1	0	330.211	3.710	50	0		EHAARM
O=C([O-])c1nsc2c1NC(=O)C[C@@H]2c1ccc(F)cc1Cl	ZINC000071284437	563915725	/nfs/dbraw/zinc/91/57/25/563915725.db2.gz	URPMIQFFZUAXIA-SSDOTTSWSA-N	-1	0	326.736	3.757	50	0		EHAARM
CC[C@H](C)[C@@H](Nc1nc(C(F)(F)F)nc2ccccc21)C(=O)[O-]	ZINC000062742119	563954574	/nfs/dbraw/zinc/95/45/74/563954574.db2.gz	UOAPBVAOUIPKES-GZMMTYOYSA-N	-1	0	327.306	3.560	50	0		EHAARM
CCc1cccc([N-]S(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)c1	ZINC000033262037	563966305	/nfs/dbraw/zinc/96/63/05/563966305.db2.gz	VQBLRCKMYHNHCU-UHFFFAOYSA-N	-1	0	345.424	3.650	50	0		EHAARM
O=C([O-])COc1ccc2c(=O)c(-c3ccc(Cl)cc3)coc2c1	ZINC000000118160	563986735	/nfs/dbraw/zinc/98/67/35/563986735.db2.gz	IHJLLWWPIVQSNY-UHFFFAOYSA-N	-1	0	330.723	3.577	50	0		EHAARM
O=C([O-])CSc1nnc(-c2ccccc2)n1-c1cccc(Cl)c1	ZINC000000421297	563998254	/nfs/dbraw/zinc/99/82/54/563998254.db2.gz	RDRAWMRXSXPVIF-UHFFFAOYSA-N	-1	0	345.811	3.764	50	0		EHAARM
C[C@H](Oc1c(=O)c2cc(Cl)ccc2oc1-c1ccccc1)C(=O)[O-]	ZINC000005606311	564006323	/nfs/dbraw/zinc/00/63/23/564006323.db2.gz	CGMDAXOVIJRHDM-JTQLQIEISA-N	-1	0	344.750	3.965	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CSc2nccc3ccccc32)cc1	ZINC000000529615	564021416	/nfs/dbraw/zinc/02/14/16/564021416.db2.gz	DGVJPERBJITBGZ-UHFFFAOYSA-N	-1	0	338.388	3.664	50	0		EHAARM
Cc1cc(NC(=O)[C@@H]2CC[C@H](C(=O)[O-])C2)ccc1Oc1cccnc1	ZINC000263182530	564053179	/nfs/dbraw/zinc/05/31/79/564053179.db2.gz	HKYZORDLHWXOCX-KGLIPLIRSA-N	-1	0	340.379	3.622	50	0		EHAARM
Cc1nn(-c2ccccc2)c2ncc(C(=O)c3ccccc3[O-])cc12	ZINC000000984704	564053858	/nfs/dbraw/zinc/05/38/58/564053858.db2.gz	HAKMOWZBKMIOJH-UHFFFAOYSA-N	-1	0	329.359	3.666	50	0		EHAARM
O=C([O-])CCN1c2ccccc2S[C@H](c2ccccc2)CC1=O	ZINC000075249349	564081159	/nfs/dbraw/zinc/08/11/59/564081159.db2.gz	AAISIVGGBORMIZ-INIZCTEOSA-N	-1	0	327.405	3.731	50	0		EHAARM
Cc1cc(C)c([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c(C)c1	ZINC000075351844	564082007	/nfs/dbraw/zinc/08/20/07/564082007.db2.gz	BOEDHEHZUFOTJG-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
O=C([O-])c1ccccc1-c1cc2cc(Br)ccc2oc1=O	ZINC000006222505	564083072	/nfs/dbraw/zinc/08/30/72/564083072.db2.gz	MKERZCJQVNXSBY-UHFFFAOYSA-N	-1	0	345.148	3.921	50	0		EHAARM
Cc1ccc2[nH]c(=O)c(-c3nc(-c4ccccc4C)no3)c([O-])c2c1	ZINC000075536684	564087938	/nfs/dbraw/zinc/08/79/38/564087938.db2.gz	WQNSJCXCVGQEIV-UHFFFAOYSA-N	-1	0	333.347	3.568	50	0		EHAARM
CCCOc1ccccc1[C@@H](C)NC(=O)c1ccccc1C(=O)[O-]	ZINC000426493024	564093881	/nfs/dbraw/zinc/09/38/81/564093881.db2.gz	SRRZPPIPLGZGLS-CYBMUJFWSA-N	-1	0	327.380	3.665	50	0		EHAARM
O=C([O-])c1cnc(/C=C/c2ccc(OCc3ccccn3)cc2)s1	ZINC000065566775	564107045	/nfs/dbraw/zinc/10/70/45/564107045.db2.gz	WZSGGPQOVCOOEJ-RMKNXTFCSA-N	-1	0	338.388	3.986	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccccc1C(C)C	ZINC000007708375	564122128	/nfs/dbraw/zinc/12/21/28/564122128.db2.gz	CWFDBVQPZSJEBR-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)OC)cc1	ZINC000012536248	564135288	/nfs/dbraw/zinc/13/52/88/564135288.db2.gz	VCMCLWXCKDGLFX-ZDUSSCGKSA-N	-1	0	347.436	3.788	50	0		EHAARM
Cc1c(C(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)oc2c1C(=O)CCC2	ZINC000095969677	564143435	/nfs/dbraw/zinc/14/34/35/564143435.db2.gz	OKICJDUTPPRUCL-UHFFFAOYSA-N	-1	0	347.754	3.711	50	0		EHAARM
Cc1ccc(-n2[n-]c(C(=O)Nc3ccc(C)cc3Cl)cc2=O)cc1	ZINC000174371236	564174356	/nfs/dbraw/zinc/17/43/56/564174356.db2.gz	UOMBTQGDHGLICW-UHFFFAOYSA-N	-1	0	341.798	3.688	50	0		EHAARM
C[S@](=O)Cc1cccc(NC(=O)c2ccc3[n-]c(=S)oc3c2)c1	ZINC000073731721	564176390	/nfs/dbraw/zinc/17/63/90/564176390.db2.gz	AGOXAMCYYPSRHX-HSZRJFAPSA-N	-1	0	346.433	3.621	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(Cc2c(F)cccc2F)C2CC2)s1	ZINC000263572026	962737216	/nfs/dbraw/zinc/73/72/16/962737216.db2.gz	KHNMJXWYDXIKHN-UHFFFAOYSA-N	-1	0	337.347	3.529	50	0		EHAARM
O=C([O-])C1CCC(NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)CC1	ZINC000263041900	1032417398	/nfs/dbraw/zinc/41/73/98/1032417398.db2.gz	DRHJWUWZTKDFOL-UHFFFAOYSA-N	-1	0	349.736	3.732	50	0		EHAARM
Cc1c(Cl)cccc1C(=O)N1C[C@H](C(=O)[O-])[C@H](c2ccccc2)C1	ZINC000263054149	1032422953	/nfs/dbraw/zinc/42/29/53/1032422953.db2.gz	ARTIIQRIXSEBNG-HOTGVXAUSA-N	-1	0	343.810	3.589	50	0		EHAARM
O=C([O-])[C@@H](CNC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)C1CCCCC1	ZINC000630266008	1137352767	/nfs/dbraw/zinc/35/27/67/1137352767.db2.gz	XLYCYYMGZBFDHN-IHRRRGAJSA-N	-1	0	349.393	3.752	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)CSCc1ccc(Cl)cc1	ZINC000004695761	210250323	/nfs/dbraw/zinc/25/03/23/210250323.db2.gz	VDGMSERFQZCSSU-UHFFFAOYSA-N	-1	0	335.812	3.910	50	0		EHAARM
O=c1c2ccccc2[n-]c(=S)n1CCOc1ccc2c(c1)CCC2	ZINC000055180418	214283958	/nfs/dbraw/zinc/28/39/58/214283958.db2.gz	CTPWZXVDYZKSKU-UHFFFAOYSA-N	-1	0	338.432	3.627	50	0		EHAARM
C[C@@H](CC(=O)[O-])CC(=O)Nc1ccc(OCCc2ccccc2)cc1	ZINC000004690996	210249479	/nfs/dbraw/zinc/24/94/79/210249479.db2.gz	VAPZLYLULJYPNS-OAHLLOKOSA-N	-1	0	341.407	3.748	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000004600163	210230071	/nfs/dbraw/zinc/23/00/71/210230071.db2.gz	PXDLPTSECRXUQH-QWHCGFSZSA-N	-1	0	327.302	3.701	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)CSc1nc2ccccc2o1	ZINC000004502740	210207061	/nfs/dbraw/zinc/20/70/61/210207061.db2.gz	JBJBNWKKKANVKH-UHFFFAOYSA-N	-1	0	342.376	3.565	50	0		EHAARM
O=C1[N-]C(=O)/C(=C\c2ccc(Sc3ccc(Cl)cc3)cc2)N1	ZINC000003652523	210071986	/nfs/dbraw/zinc/07/19/86/210071986.db2.gz	PXPAVXJKNHQRQC-NTEUORMPSA-N	-1	0	330.796	3.672	50	0		EHAARM
CCCCC[C@@H]1c2[nH]c3ccccc3c2C[C@H](C(=O)[O-])N1C(C)=O	ZINC000003024602	209953858	/nfs/dbraw/zinc/95/38/58/209953858.db2.gz	LKEGYTFONVXESR-IAGOWNOFSA-N	-1	0	328.412	3.647	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)n1c2ccccc2nc1-c1ccco1	ZINC000001926931	209806603	/nfs/dbraw/zinc/80/66/03/209806603.db2.gz	BATIMPKLZQDCEB-UHFFFAOYSA-N	-1	0	332.315	3.683	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccccc1SC	ZINC000038556540	213214532	/nfs/dbraw/zinc/21/45/32/213214532.db2.gz	NSNAQPAFTVDCPF-UHFFFAOYSA-N	-1	0	343.857	3.871	50	0		EHAARM
O=c1c2c3c(sc2[n-]c(=S)n1CCc1ccccc1)CCC3	ZINC000000503360	209638265	/nfs/dbraw/zinc/63/82/65/209638265.db2.gz	VULGALACVZUJNW-UHFFFAOYSA-N	-1	0	328.462	3.852	50	0		EHAARM
CCOc1ccc2nc([N-]S(=O)(=O)c3ccc(C)cc3)sc2c1	ZINC000000461418	209615469	/nfs/dbraw/zinc/61/54/69/209615469.db2.gz	YQGOZXKEYZZVKC-UHFFFAOYSA-N	-1	0	348.449	3.804	50	0		EHAARM
C[C@H](CC(=O)N1CC[C@](C)(C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237543590	242685190	/nfs/dbraw/zinc/68/51/90/242685190.db2.gz	ZZZMIGYLJPDDQB-BZNIZROVSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])CCc1ccc(NC(=O)c2ccccc2Br)cc1	ZINC000021002957	212199238	/nfs/dbraw/zinc/19/92/38/212199238.db2.gz	SRHOOPMXJQBSBE-UHFFFAOYSA-N	-1	0	348.196	3.719	50	0		EHAARM
O=C([O-])CSc1csc(-c2ccc(Br)cc2)n1	ZINC000047843802	213870635	/nfs/dbraw/zinc/87/06/35/213870635.db2.gz	USGLBUWNEBSWPP-UHFFFAOYSA-N	-1	0	330.228	3.749	50	0		EHAARM
CC(C)c1cccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)c1	ZINC000014632481	211748820	/nfs/dbraw/zinc/74/88/20/211748820.db2.gz	RTRZAJQHHHAPSI-HOTGVXAUSA-N	-1	0	349.427	3.651	50	0		EHAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2ccc3occc3c2)C[C@H]1C(=O)[O-]	ZINC000091829457	218071633	/nfs/dbraw/zinc/07/16/33/218071633.db2.gz	ZBTUDWCECDQGMW-ZWKOTPCHSA-N	-1	0	349.386	3.682	50	0		EHAARM
CC(C)CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])cc1	ZINC000009259198	211060459	/nfs/dbraw/zinc/06/04/59/211060459.db2.gz	XXBHSYDLVRHPPG-CVEARBPZSA-N	-1	0	346.427	3.501	50	0		EHAARM
O=C([O-])c1ccc(C(=O)Nc2ccccc2NCC(F)(F)F)s1	ZINC000095989927	218496939	/nfs/dbraw/zinc/49/69/39/218496939.db2.gz	INMAWWDQSRTIPF-UHFFFAOYSA-N	-1	0	344.314	3.673	50	0		EHAARM
Cc1ccsc1[C@@H]1C[C@H]1C(=O)N(C)Cc1ccc(C(=O)[O-])cc1	ZINC000097035893	218923754	/nfs/dbraw/zinc/92/37/54/218923754.db2.gz	OQSQRTSEELCGLT-HUUCEWRRSA-N	-1	0	329.421	3.517	50	0		EHAARM
COc1cc(C)c(S(=O)(=O)[N-]c2cc(C)ccn2)cc1C(C)C	ZINC000004970555	210343852	/nfs/dbraw/zinc/34/38/52/210343852.db2.gz	DYGKTUBXXWRCOC-UHFFFAOYSA-N	-1	0	334.441	3.631	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000006402443	258051950	/nfs/dbraw/zinc/05/19/50/258051950.db2.gz	HGVAJYUWPFBDPF-QZTJIDSGSA-N	-1	0	338.407	3.502	50	0		EHAARM
CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc1ccccc1C(=O)[O-]	ZINC000000041902	563212917	/nfs/dbraw/zinc/21/29/17/563212917.db2.gz	BRFXGVVYPHCOTN-BXKDBHETSA-N	-1	0	328.195	3.915	50	0		EHAARM
O=C([O-])c1cc(Cl)cn(Cc2c(Cl)cccc2Cl)c1=O	ZINC000000169895	563250810	/nfs/dbraw/zinc/25/08/10/563250810.db2.gz	VGKXLEJSDBNNBG-UHFFFAOYSA-N	-1	0	332.570	3.555	50	0		EHAARM
O=C([O-])[C@@H]1C=C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000002243686	563427584	/nfs/dbraw/zinc/42/75/84/563427584.db2.gz	IWMUNNGMJRKNSV-KGLIPLIRSA-N	-1	0	349.386	3.554	50	0		EHAARM
O=C([O-])C1=CCN(C(=O)OCC2c3ccccc3-c3ccccc32)CC1	ZINC000002583138	563443167	/nfs/dbraw/zinc/44/31/67/563443167.db2.gz	PSVIYSJIJLCHPY-UHFFFAOYSA-N	-1	0	349.386	3.652	50	0		EHAARM
CCCCc1ccc(NS(=O)(=O)c2cccc(C(=O)[O-])c2)cc1	ZINC000002859163	563456769	/nfs/dbraw/zinc/45/67/69/563456769.db2.gz	VCKYVPWUFMIGPP-UHFFFAOYSA-N	-1	0	333.409	3.528	50	0		EHAARM
CCCCCOc1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])cc1	ZINC000003017293	563469903	/nfs/dbraw/zinc/46/99/03/563469903.db2.gz	FRQAZRBRWXLBLT-IRXDYDNUSA-N	-1	0	331.412	3.861	50	0		EHAARM
CCOc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1ncccc1C	ZINC000008714963	563636756	/nfs/dbraw/zinc/63/67/56/563636756.db2.gz	MSLKSBSKUGPURD-UHFFFAOYSA-N	-1	0	348.468	3.887	50	0		EHAARM
O=C([O-])c1ccc(O[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1	ZINC000013413607	563698121	/nfs/dbraw/zinc/69/81/21/563698121.db2.gz	NBDPIWAZBUDGRK-SFHVURJKSA-N	-1	0	339.391	3.517	50	0		EHAARM
O=c1c2c3c(sc2[n-]c(=S)n1Cc1ccncc1)CCCCC3	ZINC000017071730	563834943	/nfs/dbraw/zinc/83/49/43/563834943.db2.gz	XIIBBUYEQHJNHF-UHFFFAOYSA-N	-1	0	343.477	3.833	50	0		EHAARM
CC[C@@H](c1ccc2cc(OC)ccc2c1)[C@H](CC(=O)[O-])C(=O)OC	ZINC000000393192	563842314	/nfs/dbraw/zinc/84/23/14/563842314.db2.gz	UCKVSTWLDCKQLF-IRXDYDNUSA-N	-1	0	330.380	3.606	50	0		EHAARM
CC[C@H](c1ccc2cc(OC)ccc2c1)[C@H](CC(=O)[O-])C(=O)OC	ZINC000000393193	563842379	/nfs/dbraw/zinc/84/23/79/563842379.db2.gz	UCKVSTWLDCKQLF-SJORKVTESA-N	-1	0	330.380	3.606	50	0		EHAARM
Cc1c(Cl)ccc(S(=O)(=O)[N-]c2cccc(O)c2)c1Cl	ZINC000032601910	563914101	/nfs/dbraw/zinc/91/41/01/563914101.db2.gz	MSOHYBSHVBHXEZ-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
COC(=O)c1ccccc1Nc1cc(C)nc(-c2ccccc2[O-])n1	ZINC000015835907	563917820	/nfs/dbraw/zinc/91/78/20/563917820.db2.gz	INNMGNGWRQCJKU-UHFFFAOYSA-N	-1	0	335.363	3.688	50	0		EHAARM
O=C([O-])CCC/C(=C\c1csnn1)c1nc2ccccc2s1	ZINC000044026044	563980803	/nfs/dbraw/zinc/98/08/03/563980803.db2.gz	UEFRMKRCLFUEDZ-CSKARUKUSA-N	-1	0	331.422	3.943	50	0		EHAARM
CC(C)Oc1ccc([C@@H](CC(=O)[O-])NC(=O)C2CCCCC2)cc1	ZINC000000104986	563986461	/nfs/dbraw/zinc/98/64/61/563986461.db2.gz	VFCHVBHBDLYYGY-QGZVFWFLSA-N	-1	0	333.428	3.686	50	0		EHAARM
Cc1cc([C@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])ccc1F	ZINC000221040212	563989710	/nfs/dbraw/zinc/98/97/10/563989710.db2.gz	VVAKZLAABFIUDS-HIFRSBDPSA-N	-1	0	337.391	3.702	50	0		EHAARM
Cc1ccccc1N1C(=O)[C@H](CC(=O)[O-])S/C1=N/C1CCCCC1	ZINC000100507704	563992647	/nfs/dbraw/zinc/99/26/47/563992647.db2.gz	DFYMSSYLAPFLCW-MJWGMMHASA-N	-1	0	346.452	3.607	50	0		EHAARM
Cn1c2ccccc2c(Cl)c1C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000237712120	563993717	/nfs/dbraw/zinc/99/37/17/563993717.db2.gz	IEOVTFMDKGKKCB-LBPRGKRZSA-N	-1	0	348.830	3.549	50	0		EHAARM
O=C([O-])C1CCN(C(=O)c2ccc(-c3ccc(F)cc3)cc2F)CC1	ZINC000238041464	563994470	/nfs/dbraw/zinc/99/44/70/563994470.db2.gz	RTQBRRGSJPWZKB-UHFFFAOYSA-N	-1	0	345.345	3.569	50	0		EHAARM
Cc1ccc(-c2nnc(SCC(=O)[O-])n2-c2ccc(C)cc2)cc1	ZINC000000421207	563998249	/nfs/dbraw/zinc/99/82/49/563998249.db2.gz	WJVYLAQNXZFNMS-UHFFFAOYSA-N	-1	0	339.420	3.728	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000484063	564012467	/nfs/dbraw/zinc/01/24/67/564012467.db2.gz	QWHZBNHBBJIOFC-ZJUUUORDSA-N	-1	0	338.816	3.779	50	0		EHAARM
CC(C)c1cc(=O)n2nc(SCc3ccc(Cl)cc3)[n-]c2n1	ZINC000018240918	564018965	/nfs/dbraw/zinc/01/89/65/564018965.db2.gz	SAKNFGVWKNUXFO-UHFFFAOYSA-N	-1	0	334.832	3.899	50	0		EHAARM
CCCc1cc(=O)[nH]c(SCC(=O)c2c(C)cc(C)cc2C)n1	ZINC000015879415	564024404	/nfs/dbraw/zinc/02/44/04/564024404.db2.gz	PRYYIEVDKABBIE-UHFFFAOYSA-N	-1	0	330.453	3.623	50	0		EHAARM
CO[C@@]1(C)C[C@@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C1(C)C	ZINC000081485063	564032344	/nfs/dbraw/zinc/03/23/44/564032344.db2.gz	WIOMVHIALISFIU-DYVFJYSZSA-N	-1	0	334.441	3.766	50	0		EHAARM
O=C([O-])C1=CC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000685944989	564051408	/nfs/dbraw/zinc/05/14/08/564051408.db2.gz	NCPGXDCNFMQHSH-AWEZNQCLSA-N	-1	0	349.386	3.699	50	0		EHAARM
O=S(=O)([N-]c1ccccc1OC(F)(F)F)c1cccc(F)c1	ZINC000012536244	564058377	/nfs/dbraw/zinc/05/83/77/564058377.db2.gz	GENMMOVGALBPSI-UHFFFAOYSA-N	-1	0	335.278	3.525	50	0		EHAARM
CCOc1cc2c(cc1[N-]S(=O)(=O)c1ccc(C)cc1)O[C@H](C)C2	ZINC000012560895	564059576	/nfs/dbraw/zinc/05/95/76/564059576.db2.gz	UMPCYDIVLARGCE-CYBMUJFWSA-N	-1	0	347.436	3.518	50	0		EHAARM
O=C(NCCCOC1CCCCC1)c1ccc2[n-]c(=S)oc2c1	ZINC000118760877	564084371	/nfs/dbraw/zinc/08/43/71/564084371.db2.gz	AAOGDPVQTCEUST-UHFFFAOYSA-N	-1	0	334.441	3.586	50	0		EHAARM
CCc1ccc(-c2noc(-c3c([O-])c4ccccc4[nH]c3=O)n2)cc1	ZINC000075536603	564087939	/nfs/dbraw/zinc/08/79/39/564087939.db2.gz	CDTJZRBSXVOIJH-UHFFFAOYSA-N	-1	0	333.347	3.513	50	0		EHAARM
O=C([O-])CCn1c2ccccc2nc1SCCOc1ccccc1	ZINC000169336660	564092485	/nfs/dbraw/zinc/09/24/85/564092485.db2.gz	PHAJRNLHWLJQLC-UHFFFAOYSA-N	-1	0	342.420	3.682	50	0		EHAARM
CCCCn1cc(S(=O)(=O)[N-]c2ccc(F)cc2)c2cccnc21	ZINC000065242333	564103442	/nfs/dbraw/zinc/10/34/42/564103442.db2.gz	VIPJIRYEAPZURU-UHFFFAOYSA-N	-1	0	347.415	3.776	50	0		EHAARM
O=C(COc1ccc(Cl)cc1Cl)[N-]OCc1ccccc1	ZINC000007791446	564123429	/nfs/dbraw/zinc/12/34/29/564123429.db2.gz	JOOOPHMORPBWDJ-UHFFFAOYSA-N	-1	0	326.179	3.620	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000225457411	564134938	/nfs/dbraw/zinc/13/49/38/564134938.db2.gz	ICILTTWIPMCECT-ZIAGYGMSSA-N	-1	0	343.345	3.555	50	0		EHAARM
COC(=O)Nc1ccccc1C(=O)Nc1ccc2[n-]c(=S)oc2c1	ZINC000079112044	564137928	/nfs/dbraw/zinc/13/79/28/564137928.db2.gz	FZSOKQJKDAUTNF-UHFFFAOYSA-N	-1	0	343.364	3.921	50	0		EHAARM
O=S(=O)([N-]c1ccc2c(c1)OCO2)c1cccc(Cl)c1Cl	ZINC000002627539	564151353	/nfs/dbraw/zinc/15/13/53/564151353.db2.gz	MCMCZOAIHULYRH-UHFFFAOYSA-N	-1	0	346.191	3.523	50	0		EHAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)CCc1ccc(Cl)s1	ZINC000237025131	960839697	/nfs/dbraw/zinc/83/96/97/960839697.db2.gz	XUMYBBRGFXNUAO-UHFFFAOYSA-N	-1	0	337.828	3.691	50	0		EHAARM
Cc1cccc(C(C)C)c1NC(=O)c1cccc(OCC(=O)[O-])c1	ZINC000262224557	961568987	/nfs/dbraw/zinc/56/89/87/961568987.db2.gz	XMSHQGAQVOVBOQ-UHFFFAOYSA-N	-1	0	327.380	3.834	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccccc1	ZINC000327294066	1028454309	/nfs/dbraw/zinc/45/43/09/1028454309.db2.gz	NUFXOAUAQCJNRU-CARYKQCGSA-N	-1	0	341.451	3.925	50	0		EHAARM
CC(C)c1nc(/C=C\c2ccnn2-c2ccccc2)ncc1C(=O)[O-]	ZINC000574996295	1131512866	/nfs/dbraw/zinc/51/28/66/1131512866.db2.gz	JZJOJSXZPDRUJS-HJWRWDBZSA-N	-1	0	334.379	3.654	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cnn([C@H](C)C3CC3)c2)cc1Cl	ZINC000187740829	1131950168	/nfs/dbraw/zinc/95/01/68/1131950168.db2.gz	LYZBHUWCWVYDSG-LLVKDONJSA-N	-1	0	339.848	3.617	50	0		EHAARM
Cc1ccc([C@H]2CCN(C(=O)C[C@@H](C(=O)[O-])c3ccccc3)C2)cc1	ZINC000634944182	1137481050	/nfs/dbraw/zinc/48/10/50/1137481050.db2.gz	QFRKYIIWAJWXRS-RBUKOAKNSA-N	-1	0	337.419	3.569	50	0		EHAARM
O=c1nc(-c2cnccn2)[n-]c2cc(-c3cccc(Cl)c3)sc21	ZINC000054757198	214254248	/nfs/dbraw/zinc/25/42/48/214254248.db2.gz	GYMCHRLEENQBKO-UHFFFAOYSA-N	-1	0	340.795	3.762	50	0		EHAARM
O=C([O-])c1cc(Br)ccc1NC(=O)c1ccccc1F	ZINC000004695631	210250232	/nfs/dbraw/zinc/25/02/32/210250232.db2.gz	ROVWUHSULNIYRR-UHFFFAOYSA-N	-1	0	338.132	3.539	50	0		EHAARM
Cc1ccccc1-n1c([S-])nc2c(-c3ccccc3)c[nH]c2c1=O	ZINC000100071569	219090073	/nfs/dbraw/zinc/09/00/73/219090073.db2.gz	BPEULQDHHORMKC-UHFFFAOYSA-N	-1	0	333.416	3.978	50	0		EHAARM
CCCCn1c2ccccc2c([O-])c(C(=O)Nc2ccccc2)c1=O	ZINC000100485709	219100504	/nfs/dbraw/zinc/10/05/04/219100504.db2.gz	OSTYNJWCELHMRP-UHFFFAOYSA-N	-1	0	336.391	3.760	50	0	biogenic,in-vitro	EHAARM
O=c1c2sc3ncccc3c2[n-]c(=S)n1Cc1ccc(F)cc1	ZINC000101275622	219120903	/nfs/dbraw/zinc/12/09/03/219120903.db2.gz	LEJZPFMRRFDXMO-UHFFFAOYSA-N	-1	0	343.408	3.856	50	0		EHAARM
CC(C)(C)c1nc2cc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])ccc2o1	ZINC000046834808	213811255	/nfs/dbraw/zinc/81/12/55/213811255.db2.gz	SHVUYRASNIKGOH-QWHCGFSZSA-N	-1	0	342.395	3.731	50	0		EHAARM
Cc1ccccc1COc1ccc2c(C)c(CC(=O)[O-])c(=O)oc2c1	ZINC000004046364	210107626	/nfs/dbraw/zinc/10/76/26/210107626.db2.gz	YHDQWYVHWWBGRA-UHFFFAOYSA-N	-1	0	338.359	3.616	50	0	biogenic	EHAARM
O=C([O-])c1cc(Cl)c(=O)n(Cc2ccc(Cl)cc2Cl)c1	ZINC000003883116	210083807	/nfs/dbraw/zinc/08/38/07/210083807.db2.gz	DYYRSIHGNPWBMC-UHFFFAOYSA-N	-1	0	332.570	3.555	50	0		EHAARM
COc1cc(Cl)c(C)cc1[N-]S(=O)(=O)c1ccccc1F	ZINC000003371232	210019393	/nfs/dbraw/zinc/01/93/93/210019393.db2.gz	QBSNSZUVPCTLFG-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
COc1cccc(-c2nccn2C2CCCC2)c1O[C@H](C)C(=O)[O-]	ZINC000067588760	215166185	/nfs/dbraw/zinc/16/61/85/215166185.db2.gz	KHLFKRIYDCJWAT-GFCCVEGCSA-N	-1	0	330.384	3.526	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)OCc1ccccc1)c1ccccc1Cl	ZINC000002511980	209860627	/nfs/dbraw/zinc/86/06/27/209860627.db2.gz	HJNVDNSNHGNSSS-HNNXBMFYSA-N	-1	0	333.771	3.782	50	0		EHAARM
CC(C)(CC(=O)[O-])CC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1	ZINC000040025638	213253311	/nfs/dbraw/zinc/25/33/11/213253311.db2.gz	LZSQZQYWLLBWJA-QGZVFWFLSA-N	-1	0	349.427	3.984	50	0		EHAARM
O=C([O-])c1ccc([C@H]2SCCN2C(=O)Nc2ccccc2)cc1	ZINC000036138753	213072629	/nfs/dbraw/zinc/07/26/29/213072629.db2.gz	GKZPEUHFIHNYTK-OAHLLOKOSA-N	-1	0	328.393	3.664	50	0		EHAARM
O=C([O-])c1cc(-c2cccnc2)nc2ccc(Br)cc21	ZINC000000068136	209397950	/nfs/dbraw/zinc/39/79/50/209397950.db2.gz	AVLAIBAXSCQGEN-UHFFFAOYSA-N	-1	0	329.153	3.758	50	0		EHAARM
O=C([O-])c1ccc(C[C@H]2CCN(C(=O)c3ccccc3Cl)C2)cc1	ZINC000072448220	216238897	/nfs/dbraw/zinc/23/88/97/216238897.db2.gz	WNCSQVCHYAIYJX-CQSZACIVSA-N	-1	0	343.810	3.743	50	0		EHAARM
CCC[C@@H](CC(=O)[O-])NC(=O)c1cc(C(F)(F)F)ccc1Cl	ZINC000220523438	241446902	/nfs/dbraw/zinc/44/69/02/241446902.db2.gz	UMTHGHNSKRZIDV-VIFPVBQESA-N	-1	0	337.725	3.732	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2ncccc2C)c(Cl)cc1Cl	ZINC000019943271	212088138	/nfs/dbraw/zinc/08/81/38/212088138.db2.gz	VUTBQVNMXXYEMM-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CC(C)n1ncc2c1NC(=O)CS[C@@H]2c1ccc(C(=O)[O-])cc1	ZINC000079494822	217234370	/nfs/dbraw/zinc/23/43/70/217234370.db2.gz	UZCXEYKUSMVIDE-CQSZACIVSA-N	-1	0	331.397	3.586	50	0		EHAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccc(F)cc1	ZINC000011613854	211226841	/nfs/dbraw/zinc/22/68/41/211226841.db2.gz	XNJPWBQEYXKWDB-UHFFFAOYSA-N	-1	0	343.807	3.987	50	0		EHAARM
Cc1cccc(OCCSCc2nc(=O)c3sccc3[n-]2)c1	ZINC000009603706	211107665	/nfs/dbraw/zinc/10/76/65/211107665.db2.gz	VDXSEMHEHFJLCN-UHFFFAOYSA-N	-1	0	332.450	3.605	50	0		EHAARM
O=C([O-])c1cc(-c2ccccc2)nc2c1cnn2Cc1ccccc1	ZINC000008939971	211021478	/nfs/dbraw/zinc/02/14/78/211021478.db2.gz	QZVIHAPHTFLCEK-UHFFFAOYSA-N	-1	0	329.359	3.845	50	0		EHAARM
Cc1ccc2nc(NC(=O)[C@@H]3CC(C)=CC[C@H]3C(=O)[O-])sc2c1	ZINC000004976940	210347168	/nfs/dbraw/zinc/34/71/68/210347168.db2.gz	IVCSMRNUYHKNBU-VXGBXAGGSA-N	-1	0	330.409	3.600	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000004898194	210315933	/nfs/dbraw/zinc/31/59/33/210315933.db2.gz	MMLMUEBHVMHOEP-MSOLQXFVSA-N	-1	0	337.419	3.783	50	0		EHAARM
O=C([O-])c1cc(NC(=O)CSc2ccc(F)cc2)ccc1Cl	ZINC000004842719	210296692	/nfs/dbraw/zinc/29/66/92/210296692.db2.gz	CDSLCVMWQZRKRT-UHFFFAOYSA-N	-1	0	339.775	3.908	50	0		EHAARM
O=C(Nc1ccc(NC2CCOCC2)cc1)c1cc(F)c([O-])c(F)c1	ZINC000097377437	219019399	/nfs/dbraw/zinc/01/93/99/219019399.db2.gz	KNXICDLVCKNPRT-UHFFFAOYSA-N	-1	0	348.349	3.514	50	0		EHAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1cc(Cl)ccc1C	ZINC000000384613	563301260	/nfs/dbraw/zinc/30/12/60/563301260.db2.gz	FLRXODWJBIBZFZ-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)Nc1cccc(C(=O)[O-])c1	ZINC000000041895	563212870	/nfs/dbraw/zinc/21/28/70/563212870.db2.gz	LVQFPCUAPXISCX-JQWIXIFHSA-N	-1	0	328.195	3.915	50	0		EHAARM
O=C([O-])c1cc(Br)ccc1NC(=O)C1CCCCC1	ZINC000000138840	563241524	/nfs/dbraw/zinc/24/15/24/563241524.db2.gz	ZLAFDAGXBATNNP-UHFFFAOYSA-N	-1	0	326.190	3.666	50	0		EHAARM
O=C(NC(=S)Nc1cc(Cl)c([O-])c(Cl)c1)c1cccs1	ZINC000000471140	563331519	/nfs/dbraw/zinc/33/15/19/563331519.db2.gz	NVAZLYXYMBEFKK-UHFFFAOYSA-N	-1	0	347.248	3.887	50	0		EHAARM
Cc1cc([C@H]2CC[C@H](C(=O)[O-])CN2C(=O)C2CCCC2)ccc1F	ZINC000034714559	563463890	/nfs/dbraw/zinc/46/38/90/563463890.db2.gz	UYHGDIJJRBCYTQ-DOTOQJQBSA-N	-1	0	333.403	3.689	50	0		EHAARM
Cc1cc([C@@H]2CC[C@@H](C(=O)[O-])CN2C(=O)C2CCCC2)ccc1F	ZINC000034714561	563463896	/nfs/dbraw/zinc/46/38/96/563463896.db2.gz	UYHGDIJJRBCYTQ-WBVHZDCISA-N	-1	0	333.403	3.689	50	0		EHAARM
CCCCSc1nc2ccc(NC(=O)/C=C/C(=O)[O-])cc2s1	ZINC000003106449	563472578	/nfs/dbraw/zinc/47/25/78/563472578.db2.gz	ZAGAZAIWNSMKPN-VOTSOKGWSA-N	-1	0	336.438	3.768	50	0		EHAARM
COc1ccccc1[C@@H]1[C@@H](C(=O)[O-])CCC(=O)N1c1ccc(C)cc1	ZINC000004200325	563497674	/nfs/dbraw/zinc/49/76/74/563497674.db2.gz	MSAZOYMMVYAYHB-QFBILLFUSA-N	-1	0	339.391	3.573	50	0		EHAARM
CCOc1ccc([N-]S(=O)(=O)c2cc(C)ccc2OCC)cc1	ZINC000006702220	563580469	/nfs/dbraw/zinc/58/04/69/563580469.db2.gz	ACZWGWQOQPVNFA-UHFFFAOYSA-N	-1	0	335.425	3.593	50	0		EHAARM
Cn1c2ccccc2nc1[N-]S(=O)(=O)c1ccc2ccccc2c1	ZINC000013163074	563691669	/nfs/dbraw/zinc/69/16/69/563691669.db2.gz	OMUDOTYQCFSELD-UHFFFAOYSA-N	-1	0	337.404	3.527	50	0		EHAARM
CCOc1cc2cc(C(=O)c3ccccc3[O-])cnc2cc1OCC	ZINC000014120390	563742773	/nfs/dbraw/zinc/74/27/73/563742773.db2.gz	TXMBMXJWDREION-UHFFFAOYSA-N	-1	0	337.375	3.969	50	0		EHAARM
C[C@@H]1CCc2nc(NC(=O)CC3(CC(=O)[O-])CCCC3)sc2C1	ZINC000017070749	563833286	/nfs/dbraw/zinc/83/32/86/563833286.db2.gz	LJMMYNNLJHYRCE-LLVKDONJSA-N	-1	0	336.457	3.632	50	0		EHAARM
O=C([O-])c1cn(-c2ncc(Cl)cc2Cl)cc1C(F)(F)F	ZINC000043299493	563862154	/nfs/dbraw/zinc/86/21/54/563862154.db2.gz	ABLMMGMUQYIKSI-UHFFFAOYSA-N	-1	0	325.073	3.896	50	0		EHAARM
Cc1cccc2c1OC/C(=C\c1ccc(OCCC(=O)[O-])cc1)C2=O	ZINC000066407997	563886446	/nfs/dbraw/zinc/88/64/46/563886446.db2.gz	CFRDHLINFTYGEE-RVDMUPIBSA-N	-1	0	338.359	3.507	50	0		EHAARM
CC[C@H](CC(=O)[O-])NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000032099057	563913324	/nfs/dbraw/zinc/91/33/24/563913324.db2.gz	RUDHGDWNJABZLC-CYBMUJFWSA-N	-1	0	339.391	3.778	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1	ZINC000032971260	563920112	/nfs/dbraw/zinc/92/01/12/563920112.db2.gz	UWQSIHDCLGQCLF-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
O=C([O-])C1(CCCc2ccccc2)CCN(c2nccs2)CC1	ZINC000071415756	563964361	/nfs/dbraw/zinc/96/43/61/563964361.db2.gz	PSJSAVNQKJTZJY-UHFFFAOYSA-N	-1	0	330.453	3.837	50	0		EHAARM
O=C([O-])C1(Cc2ccccc2)CCN(c2nccc3occc32)CC1	ZINC000071768057	563965565	/nfs/dbraw/zinc/96/55/65/563965565.db2.gz	JMACXNJKVIZFAX-UHFFFAOYSA-N	-1	0	336.391	3.742	50	0		EHAARM
O=C([O-])[C@]1(C/C=C/c2ccccc2)CCCN(C(=O)C2CCC2)C1	ZINC000071767642	563965593	/nfs/dbraw/zinc/96/55/93/563965593.db2.gz	IMTBWCJAICSPFM-MVHVFESUSA-N	-1	0	327.424	3.583	50	0		EHAARM
CC(C)Nc1cccc(CNC(=O)c2cc(F)c(F)c([O-])c2F)c1	ZINC000097112866	563967868	/nfs/dbraw/zinc/96/78/68/563967868.db2.gz	VQHYIZOJPSLAKH-UHFFFAOYSA-N	-1	0	338.329	3.560	50	0		EHAARM
CCc1cc(C(=O)N=c2[n-]nc(C)s2)sc1-c1ccccc1	ZINC000585152352	563974322	/nfs/dbraw/zinc/97/43/22/563974322.db2.gz	SGCMXKZUOOYFNH-UHFFFAOYSA-N	-1	0	329.450	3.812	50	0		EHAARM
Cc1nc(C(C)C)sc1C(=O)N(C)[C@H](C(=O)[O-])c1cccs1	ZINC000095528237	563977488	/nfs/dbraw/zinc/97/74/88/563977488.db2.gz	RKEFUMJDLDJWBV-NSHDSACASA-N	-1	0	338.454	3.534	50	0		EHAARM
O=C([O-])c1ccc(N2C(=S)N=NC2[C@@H]2C[C@H]2c2ccccc2)cc1	ZINC000006276951	563981558	/nfs/dbraw/zinc/98/15/58/563981558.db2.gz	RQYKSGHOCVZJHV-LSDHHAIUSA-N	-1	0	337.404	3.525	50	0		EHAARM
CC(C)[C@@H](NC(=O)CC1(C(=O)[O-])CCCCCC1)c1ccncc1	ZINC000072998265	563982208	/nfs/dbraw/zinc/98/22/08/563982208.db2.gz	BWMVMVRZBRHKBU-QGZVFWFLSA-N	-1	0	332.444	3.710	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@H](Cc2ccc(Cl)cc2)[C@@H]1C(=O)[O-]	ZINC000221038450	563989605	/nfs/dbraw/zinc/98/96/05/563989605.db2.gz	WGOZBWNNXCXPKD-TZMCWYRMSA-N	-1	0	339.819	3.593	50	0		EHAARM
C[C@H](NC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-])c1ccc(Cl)cc1Cl	ZINC000248268120	563995647	/nfs/dbraw/zinc/99/56/47/563995647.db2.gz	UJTNSTILXGVWSW-TVYUQYBPSA-N	-1	0	342.222	3.838	50	0		EHAARM
O=C([O-])C1CCN(C(=O)Nc2ccc(Oc3ccccc3)cc2)CC1	ZINC000243071501	563996129	/nfs/dbraw/zinc/99/61/29/563996129.db2.gz	ILKJHNXIZDGDII-UHFFFAOYSA-N	-1	0	340.379	3.807	50	0		EHAARM
O=c1c2cc(F)ccc2[n-]c(=S)n1CCc1c[nH]c2ccccc12	ZINC000000425301	563998971	/nfs/dbraw/zinc/99/89/71/563998971.db2.gz	OHEIIAUZYWWUDJ-UHFFFAOYSA-N	-1	0	339.395	3.548	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)N[C@H](C)CCc2ccccc2)[C@H](C(=O)[O-])C1	ZINC000005563838	564005635	/nfs/dbraw/zinc/00/56/35/564005635.db2.gz	JAECESZJDZEUAG-BPQIPLTHSA-N	-1	0	329.440	3.571	50	0		EHAARM
O=C([O-])COc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1	ZINC000008189171	564016107	/nfs/dbraw/zinc/01/61/07/564016107.db2.gz	XHKWCSGYPGURBA-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
Cc1cc([N-]S(=O)(=O)c2ccc(C)cc2)n(-c2ccccc2C)n1	ZINC000018194742	564018689	/nfs/dbraw/zinc/01/86/89/564018689.db2.gz	QCICRUYYMIUCSC-UHFFFAOYSA-N	-1	0	341.436	3.598	50	0		EHAARM
CC(C)c1nc2cc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])ccc2o1	ZINC000046834811	564025399	/nfs/dbraw/zinc/02/53/99/564025399.db2.gz	JLBYQXXZLIBVSW-STQMWFEESA-N	-1	0	328.368	3.557	50	0		EHAARM
Cc1[nH]nc(-c2ccc(S(=O)(=O)[N-]c3ccccc3)s2)c1C	ZINC000006914049	564033842	/nfs/dbraw/zinc/03/38/42/564033842.db2.gz	IQBGYNMJUOGCAN-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
CCc1ccc(/C=C/c2nc3cc(C(=O)[O-])ccc3n(CC)c2=O)cc1	ZINC000007916495	564034555	/nfs/dbraw/zinc/03/45/55/564034555.db2.gz	QENXJDAXHPGLIN-PKNBQFBNSA-N	-1	0	348.402	3.847	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc3cc(F)ccc3s2)C1	ZINC000261846396	564045708	/nfs/dbraw/zinc/04/57/08/564045708.db2.gz	ZIWCBFYRNUUUMY-LLVKDONJSA-N	-1	0	335.400	3.757	50	0		EHAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2ccccc2Br)c1	ZINC000005884125	564056781	/nfs/dbraw/zinc/05/67/81/564056781.db2.gz	PPESHNKFMQWRMM-UHFFFAOYSA-N	-1	0	340.242	3.867	50	0		EHAARM
O=C([O-])c1cccc(NC(=O)CSc2ccc3ccccc3n2)c1	ZINC000011907375	564072943	/nfs/dbraw/zinc/07/29/43/564072943.db2.gz	PCGRJKKBNUSIDZ-UHFFFAOYSA-N	-1	0	338.388	3.664	50	0		EHAARM
COc1cc(C(C)=NNc2ccc(C(=O)[O-])cc2)ccc1SC	ZINC000252474370	564090192	/nfs/dbraw/zinc/09/01/92/564090192.db2.gz	BYKYWUHXURIQQS-UHFFFAOYSA-N	-1	0	330.409	3.951	50	0		EHAARM
Cc1ccc(-c2oc3ccc(C)cc3c(=O)c2O[C@@H](C)C(=O)[O-])cc1	ZINC000001941794	564090328	/nfs/dbraw/zinc/09/03/28/564090328.db2.gz	ZLGKDTAOASUYFH-ZDUSSCGKSA-N	-1	0	338.359	3.929	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2ccc(C)c(C)c2)c2cccnc21	ZINC000065242245	564103370	/nfs/dbraw/zinc/10/33/70/564103370.db2.gz	RZDBTIPUEDFELC-UHFFFAOYSA-N	-1	0	343.452	3.864	50	0		EHAARM
CCCCn1cc(S(=O)(=O)[N-]c2ccccc2)c2cccnc21	ZINC000065242363	564103436	/nfs/dbraw/zinc/10/34/36/564103436.db2.gz	WBIHZDGOLLLWOY-UHFFFAOYSA-N	-1	0	329.425	3.637	50	0		EHAARM
CCCOc1ccc(C(F)(F)F)cc1[N-]S(=O)(=O)c1ccco1	ZINC000170602983	564109428	/nfs/dbraw/zinc/10/94/28/564109428.db2.gz	CQMLBVLZPFAKKF-UHFFFAOYSA-N	-1	0	349.330	3.888	50	0		EHAARM
Cc1cc([N-]S(=O)(=O)c2ccc(Oc3ccccc3)cc2)no1	ZINC000000806121	564116801	/nfs/dbraw/zinc/11/68/01/564116801.db2.gz	RMYDGGWNVYNADF-UHFFFAOYSA-N	-1	0	330.365	3.576	50	0		EHAARM
O=C([O-])[C@@H](NC(=O)c1cc(Cl)sc1Cl)c1ccccc1	ZINC000219665898	564117670	/nfs/dbraw/zinc/11/76/70/564117670.db2.gz	JZLZCUCWLIADGN-JTQLQIEISA-N	-1	0	330.192	3.611	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(C2CC2)[C@@H]2CCc3ccccc32)s1	ZINC000238011768	961075003	/nfs/dbraw/zinc/07/50/03/961075003.db2.gz	ZPVWWFVPESIIRT-CQSZACIVSA-N	-1	0	327.405	3.738	50	0		EHAARM
Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C1(C(=O)[O-])CC1	ZINC000118963622	1018110869	/nfs/dbraw/zinc/11/08/69/1018110869.db2.gz	VMOOGFWDBNWUKU-AWEZNQCLSA-N	-1	0	339.391	3.938	50	0		EHAARM
Cc1cn2c(/C=C/c3ncc(/C=C/C(=O)[O-])s3)c(C)nc2s1	ZINC000170651769	1033405712	/nfs/dbraw/zinc/40/57/12/1033405712.db2.gz	CUXKNOICCDETOG-UTTVJGTNSA-N	-1	0	331.422	3.737	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2cccs2)cs1	ZINC000000816575	1033808145	/nfs/dbraw/zinc/80/81/45/1033808145.db2.gz	VCETXPQBXFFOCP-VHSXEESVSA-N	-1	0	336.438	3.701	50	0	aggregator	EHAARM
Cc1cc(Br)ccc1N(CC(=O)[O-])C(=O)OC(C)(C)C	ZINC000725376345	1034440696	/nfs/dbraw/zinc/44/06/96/1034440696.db2.gz	UVTDRELRNBOOFN-UHFFFAOYSA-N	-1	0	344.205	3.584	50	0		EHAARM
O=C(c1cnn(-c2nccc3sccc32)c1)c1cc(F)ccc1[O-]	ZINC000048362991	1042320149	/nfs/dbraw/zinc/32/01/49/1042320149.db2.gz	HOUDLAGQYNIIPU-UHFFFAOYSA-N	-1	0	339.351	3.558	50	0		EHAARM
Cc1ccccc1S(=O)([O-])=NC(=O)Nc1c(C)cccc1Cl	ZINC000034132907	1128995683	/nfs/dbraw/zinc/99/56/83/1128995683.db2.gz	MJBBKDRZGWVKMY-UHFFFAOYSA-N	-1	0	338.816	3.672	50	0		EHAARM
C[C@@H]1CCCN(c2ccc(Cl)cc2NC(=O)CCCC(=O)[O-])C1	ZINC000952967398	1137484986	/nfs/dbraw/zinc/48/49/86/1137484986.db2.gz	ZTUNFGTURQOMPG-GFCCVEGCSA-N	-1	0	338.835	3.770	50	0		EHAARM
O=c1nc(CN2CCC[C@H]2c2cccc(F)c2)[n-]c2ccsc21	ZINC000053717987	214194842	/nfs/dbraw/zinc/19/48/42/214194842.db2.gz	YWXOHHRQNPWWHT-AWEZNQCLSA-N	-1	0	329.400	3.873	50	0		EHAARM
Cn1cc(-c2nc(=O)c3sc(-c4ccccc4Cl)cc3[n-]2)cn1	ZINC000054757253	214253827	/nfs/dbraw/zinc/25/38/27/214253827.db2.gz	BXXYCYYICJCITM-UHFFFAOYSA-N	-1	0	342.811	3.706	50	0		EHAARM
CC(C)COC(=O)N=c1[n-]nc(Cc2ccc(Cl)cc2)s1	ZINC000004695002	210250907	/nfs/dbraw/zinc/25/09/07/210250907.db2.gz	LYSXYRICJLCORP-UHFFFAOYSA-N	-1	0	325.821	3.987	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@@H](C(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000004600165	210230424	/nfs/dbraw/zinc/23/04/24/210230424.db2.gz	PXDLPTSECRXUQH-STQMWFEESA-N	-1	0	327.302	3.701	50	0		EHAARM
CC1(C)CC(=O)C(Sc2ccc(Br)cc2)=C([O-])C1	ZINC000101156650	219118235	/nfs/dbraw/zinc/11/82/35/219118235.db2.gz	NYIVFEZIZAEDTK-UHFFFAOYSA-N	-1	0	327.243	3.868	50	0		EHAARM
O=c1c2sc3ncccc3c2[n-]c(=S)n1Cc1ccccc1	ZINC000101275613	219120914	/nfs/dbraw/zinc/12/09/14/219120914.db2.gz	XARPNRSJWYLOAW-UHFFFAOYSA-N	-1	0	325.418	3.717	50	0		EHAARM
CCCCN(C)c1ccc(NC(=O)c2ccccc2)cc1C(=O)[O-]	ZINC000046053313	213777788	/nfs/dbraw/zinc/77/77/88/213777788.db2.gz	JXTGPBXDZRKAQB-UHFFFAOYSA-N	-1	0	326.396	3.873	50	0		EHAARM
O=C([O-])CSc1nnc(-c2ccccc2)n1-c1ccc(Cl)cc1	ZINC000003369510	210020122	/nfs/dbraw/zinc/02/01/22/210020122.db2.gz	JCPATHOSANGUEU-UHFFFAOYSA-N	-1	0	345.811	3.764	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc2ccccc2c1	ZINC000003335555	210010598	/nfs/dbraw/zinc/01/05/98/210010598.db2.gz	UWOKQUAPGOAGJO-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
Cc1ccc(CSC(=O)N[C@H](Cc2ccccc2)C(=O)[O-])cc1	ZINC000038607474	213215840	/nfs/dbraw/zinc/21/58/40/213215840.db2.gz	VZGFBWQZOIKMRJ-MRXNPFEDSA-N	-1	0	329.421	3.634	50	0		EHAARM
CC[C@](C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000035813219	213050327	/nfs/dbraw/zinc/05/03/27/213050327.db2.gz	DZSLHAJXIQCMLR-FQEVSTJZSA-N	-1	0	339.391	3.778	50	0		EHAARM
Cc1cccc(C(=O)Nc2ccc(Br)cc2C(=O)[O-])c1	ZINC000000312683	209529934	/nfs/dbraw/zinc/52/99/34/209529934.db2.gz	RATILUUXTZRZDZ-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
CCc1cccc(CC)c1NC(=O)c1ccc(OCC(=O)[O-])cc1	ZINC000000065153	209397550	/nfs/dbraw/zinc/39/75/50/209397550.db2.gz	JSMHWFKRAOWKIX-UHFFFAOYSA-N	-1	0	327.380	3.527	50	0		EHAARM
Cc1cc(OCC(=O)Nc2ccc(C(=O)[O-])cc2)cc(C)c1Cl	ZINC000000065022	209397212	/nfs/dbraw/zinc/39/72/12/209397212.db2.gz	NCZRQRXVQPTFBA-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
O=C([O-])CCCCN1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1	ZINC000195559399	241009876	/nfs/dbraw/zinc/00/98/76/241009876.db2.gz	PCQBPESYGIEBNB-CQSZACIVSA-N	-1	0	332.227	3.622	50	0		EHAARM
CCOC(=O)C=C([O-])c1cc2ccc(Br)cc2s1	ZINC000216699124	241204320	/nfs/dbraw/zinc/20/43/20/241204320.db2.gz	RCZDNEMJJZVWJS-UHFFFAOYSA-N	-1	0	327.199	3.800	50	0		EHAARM
C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@H](OCC(=O)[O-])CC[C@@]43C)[C@H]1CCC2=O	ZINC000257356407	244584592	/nfs/dbraw/zinc/58/45/92/244584592.db2.gz	HVGDJTBADGQHHZ-YLMHJTNXSA-N	-1	0	346.467	3.988	50	0		EHAARM
Cc1nn(-c2ccc(C(=O)[O-])cc2)c2c1[C@@H](C(C)C)SCC(=O)N2	ZINC000079491779	217232534	/nfs/dbraw/zinc/23/25/34/217232534.db2.gz	KYJQJHNJHZMHEP-OAHLLOKOSA-N	-1	0	345.424	3.911	50	0		EHAARM
O=C([O-])c1cccnc1SCC(=O)c1ccc2c(c1)CCCC2	ZINC000012428606	211378401	/nfs/dbraw/zinc/37/84/01/211378401.db2.gz	QKEVGKSBQCDTNL-UHFFFAOYSA-N	-1	0	327.405	3.634	50	0		EHAARM
O=C([O-])c1cccc(Cn2cnc(-c3ccccc3)c2[C@H]2CCOC2)c1	ZINC000091694515	218049023	/nfs/dbraw/zinc/04/90/23/218049023.db2.gz	CZRLQKIFAQRGRD-SFHVURJKSA-N	-1	0	348.402	3.801	50	0		EHAARM
O=C([O-])C1(CC(=O)Nc2cccc3c(O)cccc23)CCCCC1	ZINC000008922374	211018945	/nfs/dbraw/zinc/01/89/45/211018945.db2.gz	MENJAVPMPWKZQN-UHFFFAOYSA-N	-1	0	327.380	3.909	50	0		EHAARM
CN(C[C@@H]1CCOC1)C(=O)c1cc(-c2ccccc2)cc(Cl)c1[O-]	ZINC000096481545	218857018	/nfs/dbraw/zinc/85/70/18/218857018.db2.gz	ZDYZPCJNDMGREW-ZDUSSCGKSA-N	-1	0	345.826	3.821	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2cccnc2)cc1C(C)(C)C	ZINC000004970458	210343390	/nfs/dbraw/zinc/34/33/90/210343390.db2.gz	GSOJSOSWEZSWIP-UHFFFAOYSA-N	-1	0	334.441	3.579	50	0		EHAARM
Cc1cc(C)cc(OCC(=O)Nc2cc(Cl)ccc2C(=O)[O-])c1	ZINC000004832163	210291342	/nfs/dbraw/zinc/29/13/42/210291342.db2.gz	YJIVYETYWNAOJA-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
Cc1cccnc1[N-]S(=O)(=O)c1ccc(Cl)c(C)c1Cl	ZINC000011565931	258054319	/nfs/dbraw/zinc/05/43/19/258054319.db2.gz	UXAZTPHRVQYNMC-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CC(C)CCC[C@H](C)NC(=O)CSCc1cccc(C(=O)[O-])c1	ZINC000032885595	258059031	/nfs/dbraw/zinc/05/90/31/258059031.db2.gz	QVHSUDYRBYOTQI-AWEZNQCLSA-N	-1	0	337.485	3.949	50	0		EHAARM
COc1ccc([C@H]2[C@H](C(=O)[O-])CCC(=O)N2c2ccc(C)cc2)cc1	ZINC000003888158	536947649	/nfs/dbraw/zinc/94/76/49/536947649.db2.gz	WUXFDDOWIRXNME-MJGOQNOKSA-N	-1	0	339.391	3.573	50	0		EHAARM
CCc1ccc(CC)c(S(=O)(=O)[N-]c2cc(OC)ccc2OC)c1	ZINC000000081715	563218521	/nfs/dbraw/zinc/21/85/21/563218521.db2.gz	BFEAEDNWZJZCJQ-UHFFFAOYSA-N	-1	0	349.452	3.629	50	0		EHAARM
Cc1ccc([C@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1	ZINC000000226865	563263015	/nfs/dbraw/zinc/26/30/15/563263015.db2.gz	BRZQPRHKSQMCSZ-VXGBXAGGSA-N	-1	0	325.290	3.550	50	0		EHAARM
Cc1ccc(C[C@@H](C(=O)[O-])[C@@H](C)C(=O)Nc2ccc(F)cc2)cc1	ZINC000000350633	563289394	/nfs/dbraw/zinc/28/93/94/563289394.db2.gz	VZVZQCSDNMAZDA-CXAGYDPISA-N	-1	0	329.371	3.652	50	0		EHAARM
O=S(=O)([N-]c1ccccn1)c1ccc(Cl)c(Cl)c1Cl	ZINC000000452090	563320713	/nfs/dbraw/zinc/32/07/13/563320713.db2.gz	PIWBJNJGBLRETH-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
CCc1cc2c(nc(C)nc2N[C@H](Cc2ccccc2)C(=O)[O-])s1	ZINC000000572983	563350276	/nfs/dbraw/zinc/35/02/76/563350276.db2.gz	VXRLJDNQIOOMIC-OAHLLOKOSA-N	-1	0	341.436	3.670	50	0		EHAARM
O=C([O-])/C=C/C(=O)Nc1nc(-c2ccc(Cl)c(Cl)c2)cs1	ZINC000002114742	563423128	/nfs/dbraw/zinc/42/31/28/563423128.db2.gz	UAULQPZMFYZMKH-ONEGZZNKSA-N	-1	0	343.191	3.696	50	0		EHAARM
Nc1cccc(-c2cc(C(=O)[O-])c3cc(Br)ccc3n2)c1	ZINC000002503212	563434629	/nfs/dbraw/zinc/43/46/29/563434629.db2.gz	GYFAFNQNGQBBHE-UHFFFAOYSA-N	-1	0	343.180	3.945	50	0		EHAARM
C[C@@H]1CCc2c(sc3[n-]c(=S)n(Cc4ccco4)c(=O)c23)C1	ZINC000002657876	563445175	/nfs/dbraw/zinc/44/51/75/563445175.db2.gz	BJXCEZMOKJVGPI-SECBINFHSA-N	-1	0	332.450	3.887	50	0		EHAARM
O=C([O-])CCNc1nc(-c2ccccc2)nc2c3ccccc3oc21	ZINC000005215281	563523263	/nfs/dbraw/zinc/52/32/63/563523263.db2.gz	ZPSRTOZGNXZWSB-UHFFFAOYSA-N	-1	0	333.347	3.930	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2ncccc2C)cc1C(C)(C)C	ZINC000008714965	563636686	/nfs/dbraw/zinc/63/66/86/563636686.db2.gz	SXPNUNLRKBWLSZ-UHFFFAOYSA-N	-1	0	348.468	3.887	50	0		EHAARM
CSc1cccc(NC(=O)CSc2ccccc2C(=O)[O-])c1	ZINC000012983521	563681969	/nfs/dbraw/zinc/68/19/69/563681969.db2.gz	ILOXZLABCJHTLJ-UHFFFAOYSA-N	-1	0	333.434	3.838	50	0		EHAARM
CC1CCC([NH2+]C[C@H]2CCCc3ccccc32)(P(=O)([O-])[O-])CC1	ZINC000012997520	563683830	/nfs/dbraw/zinc/68/38/30/563683830.db2.gz	LHAYQZYNMMRRSK-BFHRDPOASA-N	-1	0	337.400	3.780	50	0		EHAARM
CC(C)c1nnc([N-]C(=O)c2cc(-c3cccc(F)c3)no2)s1	ZINC000032833425	563759665	/nfs/dbraw/zinc/75/96/65/563759665.db2.gz	AIRLREYRIMEUFS-UHFFFAOYSA-N	-1	0	332.360	3.708	50	0		EHAARM
CCCCOc1ccc(S(=O)(=O)[N-]c2cccc(C)n2)cc1C	ZINC000016651404	563819320	/nfs/dbraw/zinc/81/93/20/563819320.db2.gz	NQJVMWNUPHJBCK-UHFFFAOYSA-N	-1	0	334.441	3.678	50	0		EHAARM
Cc1cnc([C@H](C2CC2)n2c(=O)c3ccccc3[n-]c2=S)s1	ZINC000096427379	563952169	/nfs/dbraw/zinc/95/21/69/563952169.db2.gz	BDYAIJJFYINKSH-ZDUSSCGKSA-N	-1	0	329.450	3.823	50	0		EHAARM
CN(Cc1csc(-c2ccccc2)n1)Cc1ncccc1C(=O)[O-]	ZINC000065420307	563960568	/nfs/dbraw/zinc/96/05/68/563960568.db2.gz	CTBJTHNZWPOPAW-UHFFFAOYSA-N	-1	0	339.420	3.535	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CC(=O)Nc3c2cnn3C2CCCC2)cc1	ZINC000071283731	563964127	/nfs/dbraw/zinc/96/41/27/563964127.db2.gz	ARJSCAVEUJGGSR-AWEZNQCLSA-N	-1	0	325.368	3.820	50	0		EHAARM
CC(C)(C)c1ccc([C@H](CC(=O)[O-])NC(=O)c2ccccc2)cc1	ZINC000000118173	563986707	/nfs/dbraw/zinc/98/67/07/563986707.db2.gz	PYCQHVKJSXVXFP-KRWDZBQOSA-N	-1	0	325.408	3.930	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)c1c(F)cccc1F)c1ccc(Cl)cc1	ZINC000000116177	563986765	/nfs/dbraw/zinc/98/67/65/563986765.db2.gz	AXALGCTWBQNCAR-ZDUSSCGKSA-N	-1	0	339.725	3.564	50	0		EHAARM
O=C([O-])c1ccc2[nH]c(Cc3ccc(Br)cc3)nc2c1	ZINC000033559704	563992712	/nfs/dbraw/zinc/99/27/12/563992712.db2.gz	PZESDKHCVXIRAK-UHFFFAOYSA-N	-1	0	331.169	3.614	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n(C1CCCCCC1)c2=O	ZINC000000425242	563998911	/nfs/dbraw/zinc/99/89/11/563998911.db2.gz	VSKKAANAFFCBSC-UHFFFAOYSA-N	-1	0	332.425	3.741	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@H]1CCCC[C@@H]1C)c2=O	ZINC000000425245	563998915	/nfs/dbraw/zinc/99/89/15/563998915.db2.gz	ISKIQBBLHZBAII-HZMBPMFUSA-N	-1	0	332.425	3.597	50	0		EHAARM
Cc1ccc2cc(S(=O)(=O)Nc3cccc(C(=O)[O-])c3)ccc2c1	ZINC000005234535	564001381	/nfs/dbraw/zinc/00/13/81/564001381.db2.gz	WFNQBWVEIPZAOP-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000005602594	564006303	/nfs/dbraw/zinc/00/63/03/564006303.db2.gz	QJYKGMLSOSOTOL-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000000483961	564016885	/nfs/dbraw/zinc/01/68/85/564016885.db2.gz	JZOCQCSMIMMERG-CHWSQXEVSA-N	-1	0	330.409	3.640	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CC2)[C@@H]1c1ccccc1Cl	ZINC000045923089	564028919	/nfs/dbraw/zinc/02/89/19/564028919.db2.gz	KQJTWDKMBAIVCP-DLBZAZTESA-N	-1	0	341.794	3.868	50	0		EHAARM
COC(=O)Nc1cccc(NC(=O)CC2(CC(=O)[O-])CCCCC2)c1	ZINC000048382375	564031672	/nfs/dbraw/zinc/03/16/72/564031672.db2.gz	GKEAQXLBXYWAAM-UHFFFAOYSA-N	-1	0	348.399	3.619	50	0		EHAARM
CC(C)(CCCc1ccccc1)C(=O)[N-]S(=O)(=O)c1ccccc1	ZINC000112758361	564032360	/nfs/dbraw/zinc/03/23/60/564032360.db2.gz	SGHWONWETOHIHS-UHFFFAOYSA-N	-1	0	345.464	3.541	50	0		EHAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)Nc1cc(Cl)ccc1C	ZINC000064983804	564099093	/nfs/dbraw/zinc/09/90/93/564099093.db2.gz	FQDUPKXSJILABB-UHFFFAOYSA-N	-1	0	334.803	3.658	50	0		EHAARM
Cc1cc2nc3c(nc2cc1C)N(C)c1c(=O)c(Cl)n[n-]c1S3	ZINC000007036860	564103523	/nfs/dbraw/zinc/10/35/23/564103523.db2.gz	VWVQNEOMWPWTEO-UHFFFAOYSA-N	-1	0	345.815	3.628	50	0		EHAARM
CC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2C(F)(F)F)cc1	ZINC000007052373	564103871	/nfs/dbraw/zinc/10/38/71/564103871.db2.gz	SYVODXDZZCDAKA-UHFFFAOYSA-N	-1	0	343.326	3.709	50	0		EHAARM
O=C([O-])c1ccccc1CC(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000071284391	564110844	/nfs/dbraw/zinc/11/08/44/564110844.db2.gz	FZDLOFMDUGITDI-UHFFFAOYSA-N	-1	0	346.386	3.552	50	0		EHAARM
Cc1nn(C)c(Cl)c1/C=C/c1cc(C(=O)[O-])c2ccccc2n1	ZINC000013459934	564111708	/nfs/dbraw/zinc/11/17/08/564111708.db2.gz	FLXKTUFOFKVJQR-BQYQJAHWSA-N	-1	0	327.771	3.799	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1cccc2ccccc21	ZINC000000528295	564116747	/nfs/dbraw/zinc/11/67/47/564116747.db2.gz	CWQJYGAVNZAHEO-UHFFFAOYSA-N	-1	0	327.405	3.958	50	0		EHAARM
C[C@H](Nc1nc(-c2ccccc2)nc2c3ccccc3oc21)C(=O)[O-]	ZINC000006850628	564117490	/nfs/dbraw/zinc/11/74/90/564117490.db2.gz	VPVMZMQLIYHSQH-NSHDSACASA-N	-1	0	333.347	3.928	50	0		EHAARM
CN(C(=O)OC(C)(C)C)[C@H](C(=O)[O-])c1cccc(Cl)c1Cl	ZINC000069550571	564118266	/nfs/dbraw/zinc/11/82/66/564118266.db2.gz	ZTCFCPXMNLBKKH-NSHDSACASA-N	-1	0	334.199	3.986	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2nnc(-c3ccccc3C)o2)c(C)s1	ZINC000194775591	564122104	/nfs/dbraw/zinc/12/21/04/564122104.db2.gz	SMCQAUROJQKWEN-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1cccc([C@H]2CC(c3ccco3)=NN2C(=O)CCCC(=O)[O-])c1	ZINC000095946186	564142225	/nfs/dbraw/zinc/14/22/25/564142225.db2.gz	ACOMTAAAVYEXTI-MRXNPFEDSA-N	-1	0	340.379	3.521	50	0		EHAARM
C[C@H](CC(=O)N1CCC(C(=O)[O-])CC1)c1ccccc1C(F)(F)F	ZINC000096479446	564148563	/nfs/dbraw/zinc/14/85/63/564148563.db2.gz	ZMKSVEFJTRHNPP-LLVKDONJSA-N	-1	0	343.345	3.522	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)c2ccc(F)cc2)cc1C(=O)[O-]	ZINC000058065125	564157398	/nfs/dbraw/zinc/15/73/98/564157398.db2.gz	REIWWNURRLRXME-UHFFFAOYSA-N	-1	0	330.359	3.622	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3c(n2)onc3C(C)C)c(OC)c1	ZINC000008395186	564165100	/nfs/dbraw/zinc/16/51/00/564165100.db2.gz	CUYVDDFUTOXMON-UHFFFAOYSA-N	-1	0	342.351	3.729	50	0		EHAARM
O=C(Nc1cccc(Cl)c1[O-])c1cccc(NC(=O)C2CC2)c1	ZINC000069841255	564172451	/nfs/dbraw/zinc/17/24/51/564172451.db2.gz	YDOANDOIMZTRLP-UHFFFAOYSA-N	-1	0	330.771	3.646	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)C(c1ccccc1)c1ccccc1)c1ccco1	ZINC000002882801	1026760910	/nfs/dbraw/zinc/76/09/10/1026760910.db2.gz	JKXCYTYNXQEUPJ-KRWDZBQOSA-N	-1	0	349.386	3.744	50	0		EHAARM
CC(=NNc1ccc(Cl)c(C(=O)[O-])c1)c1ccc([N+](=O)[O-])cc1	ZINC000254790680	1042618636	/nfs/dbraw/zinc/61/86/36/1042618636.db2.gz	HXPNKJHMEJFPSX-UHFFFAOYSA-N	-1	0	333.731	3.783	50	0		EHAARM
CC(C)(CC(=O)[O-])CC(=O)N[C@H](CC(F)(F)F)c1ccccc1	ZINC000055151169	214279365	/nfs/dbraw/zinc/27/93/65/214279365.db2.gz	WVUMZXVKIZFWPC-GFCCVEGCSA-N	-1	0	331.334	3.687	50	0		EHAARM
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1	ZINC000004569149	210223175	/nfs/dbraw/zinc/22/31/75/210223175.db2.gz	ZPUSHAMABMIDFZ-UHFFFAOYSA-N	-1	0	330.384	3.792	50	0		EHAARM
CCCn1c2ccccc2c([O-])c(C(=O)Nc2cccc(C)c2)c1=O	ZINC000100452257	219099626	/nfs/dbraw/zinc/09/96/26/219099626.db2.gz	OIAYVLYJTBBCQJ-UHFFFAOYSA-N	-1	0	336.391	3.678	50	0		EHAARM
O=C([O-])c1cc(NC(=O)C(c2ccccc2)c2ccccc2)ccc1O	ZINC000003194854	209976168	/nfs/dbraw/zinc/97/61/68/209976168.db2.gz	PZSSCILPUFAAMQ-UHFFFAOYSA-N	-1	0	347.370	3.861	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1CC(=O)c1cccc(Br)c1	ZINC000002574557	209870087	/nfs/dbraw/zinc/87/00/87/209870087.db2.gz	HXMGBTCEMUDHJI-GWCFXTLKSA-N	-1	0	325.202	3.913	50	0		EHAARM
O=S(=O)([N-]c1cccc(F)c1)c1ccc(Br)cc1F	ZINC000068741082	215330190	/nfs/dbraw/zinc/33/01/90/215330190.db2.gz	JBGCYOBWPUHJDN-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
Cc1ccc(-c2csc([N-]S(=O)(=O)c3ccc(C)cc3)n2)cc1	ZINC000000475636	209625165	/nfs/dbraw/zinc/62/51/65/209625165.db2.gz	HCFSSMPIXTYGLE-UHFFFAOYSA-N	-1	0	344.461	3.650	50	0		EHAARM
Cc1ccc([C@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000000226868	209497009	/nfs/dbraw/zinc/49/70/09/209497009.db2.gz	QAMKCWLSDIAWSU-PWSUYJOCSA-N	-1	0	325.290	3.550	50	0		EHAARM
COc1ccc([C@H]2S[C@H](C)C(=O)N2c2cccc(C(=O)[O-])c2)cc1	ZINC000000191265	209476185	/nfs/dbraw/zinc/47/61/85/209476185.db2.gz	CDAPDEHTTWYUPC-PIGZYNQJSA-N	-1	0	343.404	3.561	50	0		EHAARM
O=C([O-])C[C@@H](CC(=O)Nc1ccc2ccccc2n1)c1ccccc1	ZINC000000152826	209456712	/nfs/dbraw/zinc/45/67/12/209456712.db2.gz	PLRALSVBRIVBCP-MRXNPFEDSA-N	-1	0	334.375	3.822	50	0		EHAARM
CC(C)Oc1ccc([C@H](CC(=O)[O-])NC(=O)C2CCCCC2)cc1	ZINC000000104989	209422935	/nfs/dbraw/zinc/42/29/35/209422935.db2.gz	VFCHVBHBDLYYGY-KRWDZBQOSA-N	-1	0	333.428	3.686	50	0		EHAARM
O=C(c1cnc2cc(-c3ccccc3)nn2c1)c1cc(Cl)ccc1[O-]	ZINC000021729201	212246064	/nfs/dbraw/zinc/24/60/64/212246064.db2.gz	ALSJUDNOOFWCDN-UHFFFAOYSA-N	-1	0	349.777	3.986	50	0		EHAARM
COc1ccc(-c2cc3[n-]c(-c4nccs4)nc(=O)c3s2)cc1	ZINC000225746504	242013665	/nfs/dbraw/zinc/01/36/65/242013665.db2.gz	UJTPJCHFZXXYSM-UHFFFAOYSA-N	-1	0	341.417	3.784	50	0		EHAARM
O=C([O-])CCc1ccc(NC(=O)COc2ccc3ccccc3c2)cc1	ZINC000020103055	212100588	/nfs/dbraw/zinc/10/05/88/212100588.db2.gz	WWPJDSCFHMRRCD-UHFFFAOYSA-N	-1	0	349.386	3.875	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc2sccc2c1	ZINC000013454054	211558862	/nfs/dbraw/zinc/55/88/62/211558862.db2.gz	NMMFXVOGDMHQMS-UHFFFAOYSA-N	-1	0	347.417	3.709	50	0		EHAARM
O=S(=O)([N-]c1cnc(-c2ccccc2)nc1)c1cccc(Cl)c1	ZINC000012507886	211394509	/nfs/dbraw/zinc/39/45/09/211394509.db2.gz	QSOYVBCQFFYWLK-UHFFFAOYSA-N	-1	0	345.811	3.598	50	0		EHAARM
CCc1ccccc1NC(=O)c1c([O-])c2ccccc2n(CC)c1=O	ZINC000012414619	211373499	/nfs/dbraw/zinc/37/34/99/211373499.db2.gz	WVBJTPDCAMJEPZ-UHFFFAOYSA-N	-1	0	336.391	3.542	50	0		EHAARM
O=C([O-])c1ccc(OCc2ccccc2F)c(Br)c1	ZINC000007603999	210819237	/nfs/dbraw/zinc/81/92/37/210819237.db2.gz	RVIGRHJARSPRQZ-UHFFFAOYSA-N	-1	0	325.133	3.865	50	0		EHAARM
Cc1nc(-c2cc(C(=O)Nc3cc(C(=O)[O-])ccc3C)co2)cs1	ZINC000097228668	218999670	/nfs/dbraw/zinc/99/96/70/218999670.db2.gz	ADPWDSLGFBKTGK-UHFFFAOYSA-N	-1	0	342.376	3.970	50	0		EHAARM
CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000007053774	208578345	/nfs/dbraw/zinc/57/83/45/208578345.db2.gz	FQDDFIUXSSIXOR-LBPRGKRZSA-N	-1	0	333.409	3.699	50	0		EHAARM
O=C(N=C([O-])C(F)(F)F)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000004840491	210294719	/nfs/dbraw/zinc/29/47/19/210294719.db2.gz	IPKODTIBWSXTIE-UHFFFAOYSA-N	-1	0	334.603	3.569	50	0		EHAARM
COc1c(Cl)cc(C(=O)Nc2cccc(C(=O)[O-])c2)cc1Cl	ZINC000004833154	210291567	/nfs/dbraw/zinc/29/15/67/210291567.db2.gz	JOOUAWNLHLCOQL-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
Cc1oc(CN(C)C(=O)C2(c3cccc(F)c3)CCC2)cc1C(=O)[O-]	ZINC000299747807	258008474	/nfs/dbraw/zinc/00/84/74/258008474.db2.gz	FDORBVKGTYZXTM-UHFFFAOYSA-N	-1	0	345.370	3.506	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2nn(-c3ccccc3)cc2C)c(C)s1	ZINC000299743601	258009035	/nfs/dbraw/zinc/00/90/35/258009035.db2.gz	LOAZEIHQMTVIGM-UHFFFAOYSA-N	-1	0	347.465	3.660	50	0		EHAARM
Cc1ccc(C(=O)Nc2ccc(N3CCCCC3)cc2C(=O)[O-])cc1	ZINC000064588716	132806638	/nfs/dbraw/zinc/80/66/38/132806638.db2.gz	BBIHSLJDHNLKRC-UHFFFAOYSA-N	-1	0	338.407	3.936	50	0		EHAARM
Cc1cc2nc([N-]S(=O)(=O)c3ccc(Cl)cc3)[nH]c2cc1C	ZINC000000347284	563288019	/nfs/dbraw/zinc/28/80/19/563288019.db2.gz	LJNUNJCOSPOPFP-UHFFFAOYSA-N	-1	0	335.816	3.634	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)[O-])n2)cc1	ZINC000000483891	563337743	/nfs/dbraw/zinc/33/77/43/563337743.db2.gz	MSWQGSUCTSKSLI-KBPBESRZSA-N	-1	0	344.436	3.948	50	0		EHAARM
O=C([O-])CS[C@H](C(=O)Nc1ccc(Cl)cc1)c1ccccc1	ZINC000001397038	563386725	/nfs/dbraw/zinc/38/67/25/563386725.db2.gz	QEYOHPDHFPXPHI-HNNXBMFYSA-N	-1	0	335.812	3.838	50	0		EHAARM
O=S(=O)(C=C([O-])c1ccc(Cl)c(Cl)c1)c1ccccc1	ZINC000001396961	563386769	/nfs/dbraw/zinc/38/67/69/563386769.db2.gz	LZBIUNZNOUZDPA-UHFFFAOYSA-N	-1	0	329.204	3.650	50	0	in-vivo	EHAARM
CC1(COc2ccc(C[C@H]3SC(=O)[N-]C3=O)cc2)CCCCC1	ZINC000001854671	563414453	/nfs/dbraw/zinc/41/44/53/563414453.db2.gz	YZFWTZACSRHJQD-OAHLLOKOSA-N	-1	0	333.453	3.930	50	0	in-man	EHAARM
O=C([O-])[C@H]1CS[C@H](c2ccc(OCc3ccccc3Cl)cc2)N1	ZINC000002472421	563433255	/nfs/dbraw/zinc/43/32/55/563433255.db2.gz	CYMVBODYZNMIRO-HZPDHXFCSA-N	-1	0	349.839	3.707	50	0		EHAARM
CCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002530814	563439698	/nfs/dbraw/zinc/43/96/98/563439698.db2.gz	JBIJSEUVWWLFGV-SFHVURJKSA-N	-1	0	339.391	3.778	50	0		EHAARM
Cc1ccc(CSC[C@H](NC(=O)OC(C)(C)C)C(=O)[O-])cc1C	ZINC000002528220	563439708	/nfs/dbraw/zinc/43/97/08/563439708.db2.gz	AYUOVKILVZAKFO-AWEZNQCLSA-N	-1	0	339.457	3.515	50	0		EHAARM
CC(C)=C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002559990	563441603	/nfs/dbraw/zinc/44/16/03/563441603.db2.gz	IYVIIHAWJFLOAR-UHFFFAOYSA-N	-1	0	337.375	3.904	50	0		EHAARM
COc1cc(C(=O)[O-])ccc1OCc1ccc(Br)cc1	ZINC000007603938	563607532	/nfs/dbraw/zinc/60/75/32/563607532.db2.gz	GATMQUPWPCOCMJ-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2ncccc2C(=O)[O-])c1	ZINC000013310043	563694622	/nfs/dbraw/zinc/69/46/22/563694622.db2.gz	HCZYQVLCBKLHTR-GFCCVEGCSA-N	-1	0	330.409	3.516	50	0		EHAARM
CCOc1ccc2[nH]c(=NC(=O)c3ccc([O-])c(Cl)c3)sc2c1	ZINC000032721313	563703218	/nfs/dbraw/zinc/70/32/18/563703218.db2.gz	UROMKHSMSNROIG-UHFFFAOYSA-N	-1	0	348.811	3.728	50	0		EHAARM
O=S(=O)([N-]c1ccccc1C(F)(F)F)c1ccc(F)c(F)c1	ZINC000014256069	563756382	/nfs/dbraw/zinc/75/63/82/563756382.db2.gz	BCXZEJPHSKFQOJ-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
CCCCc1nc2sc3c([n-]cnc3=O)c2c2c1COC(C)(C)C2	ZINC000017044817	563830265	/nfs/dbraw/zinc/83/02/65/563830265.db2.gz	HUIDKVHCYGASHI-UHFFFAOYSA-N	-1	0	343.452	3.727	50	0		EHAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1cccc(O)c1	ZINC000032601882	563914120	/nfs/dbraw/zinc/91/41/20/563914120.db2.gz	MUWFSXZCNCLWEM-UHFFFAOYSA-N	-1	0	341.816	3.554	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(-c3n[nH]c(C)c3C)o2)cc1	ZINC000033262017	563966346	/nfs/dbraw/zinc/96/63/46/563966346.db2.gz	DFJOMHXYPOHKLV-UHFFFAOYSA-N	-1	0	345.424	3.650	50	0		EHAARM
Cc1nc(CCCn2ccnc2-c2ccccc2C(=O)[O-])sc1C	ZINC000077354722	563969123	/nfs/dbraw/zinc/96/91/23/563969123.db2.gz	FVRDOBGFLJGSBK-UHFFFAOYSA-N	-1	0	341.436	3.954	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(Br)cc2F)c1	ZINC000096170873	563979994	/nfs/dbraw/zinc/97/99/94/563979994.db2.gz	RHTLPPIQVBZVCJ-UHFFFAOYSA-N	-1	0	344.205	3.697	50	0		EHAARM
O=C([O-])C[C@H](/N=C\c1cc(Br)ccc1O)c1ccccc1	ZINC000230138601	563983209	/nfs/dbraw/zinc/98/32/09/563983209.db2.gz	CUSYDOOHCWEMBN-KPYNCUPYSA-N	-1	0	348.196	3.790	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)c1c(F)cccc1F)c1ccc(Cl)cc1	ZINC000000116182	563986750	/nfs/dbraw/zinc/98/67/50/563986750.db2.gz	AXALGCTWBQNCAR-CYBMUJFWSA-N	-1	0	339.725	3.564	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cccc2ccccc21	ZINC000000477212	564012471	/nfs/dbraw/zinc/01/24/71/564012471.db2.gz	SDFDNBCYVHOOAL-UHFFFAOYSA-N	-1	0	327.405	3.958	50	0		EHAARM
O=C(c1cccc(Cl)c1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000000507219	564019651	/nfs/dbraw/zinc/01/96/51/564019651.db2.gz	MCLJEEJRFVQVLS-FZMZJTMJSA-N	-1	0	346.736	3.593	50	0		EHAARM
O=C([N-]n1c(=O)c2ccccc2nc1-c1ccccc1)c1cccs1	ZINC000000508189	564019843	/nfs/dbraw/zinc/01/98/43/564019843.db2.gz	JZOWBXPOIZLFTM-UHFFFAOYSA-N	-1	0	347.399	3.509	50	0		EHAARM
C[C@@H]1CN(c2nc(-c3ccccc3[O-])nc3ccccc32)C[C@@H](C)O1	ZINC000000554185	564023068	/nfs/dbraw/zinc/02/30/68/564023068.db2.gz	SSGBQDDFWFXNHS-ZIAGYGMSSA-N	-1	0	335.407	3.616	50	0		EHAARM
CCC(Cc1ccccc1)=NNC(=S)Nc1cccc(C(=O)[O-])c1	ZINC000245238295	564024787	/nfs/dbraw/zinc/02/47/87/564024787.db2.gz	IWDSGKULODCZGW-UHFFFAOYSA-N	-1	0	341.436	3.680	50	0		EHAARM
O=C(Nc1cccc(Cl)c1Cl)c1c(=O)[nH]c2ccccc2c1[O-]	ZINC000006494025	564025220	/nfs/dbraw/zinc/02/52/20/564025220.db2.gz	XHJPBUJCVRLEOK-UHFFFAOYSA-N	-1	0	349.173	3.793	50	0	biogenic,in-vitro	EHAARM
CC(C)N(C(=O)c1ccccc1-c1ncccc1C(=O)[O-])C(C)C	ZINC000534640165	564061410	/nfs/dbraw/zinc/06/14/10/564061410.db2.gz	GQTZGZNKDKDVIU-UHFFFAOYSA-N	-1	0	326.396	3.706	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)N(Cc1ccccc1)Cc1ccccc1	ZINC000005773221	564070645	/nfs/dbraw/zinc/07/06/45/564070645.db2.gz	UNSMZYSBHPOFFL-UXHICEINSA-N	-1	0	349.430	3.882	50	0		EHAARM
O=S(=O)([N-]c1ncccc1OCc1ccccc1)c1cccs1	ZINC000006057220	564070689	/nfs/dbraw/zinc/07/06/89/564070689.db2.gz	BKDCWASVJSRCED-UHFFFAOYSA-N	-1	0	346.433	3.523	50	0		EHAARM
Cc1cc(CCCC(=O)N2CCC[C@H](CCC(=O)[O-])C2)c(C)s1	ZINC000237604623	564083609	/nfs/dbraw/zinc/08/36/09/564083609.db2.gz	QJHRRNHSPKUUPS-OAHLLOKOSA-N	-1	0	337.485	3.791	50	0		EHAARM
O=C([O-])c1c(F)cc(-c2ccccc2OC[C@@H]2CCOC2)cc1F	ZINC000569139356	564086394	/nfs/dbraw/zinc/08/63/94/564086394.db2.gz	BTXUTZIPUYWTRZ-LLVKDONJSA-N	-1	0	334.318	3.745	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)c1ccc(OC2CCCC2)cc1	ZINC000521394003	564090884	/nfs/dbraw/zinc/09/08/84/564090884.db2.gz	ZABLYANEOWKWOM-UHFFFAOYSA-N	-1	0	325.364	3.959	50	0		EHAARM
Cc1nc(-c2cccc([N-]S(=O)(=O)c3c(C)noc3C)c2)cs1	ZINC000006587093	564092282	/nfs/dbraw/zinc/09/22/82/564092282.db2.gz	CNIAGMBETKTGAH-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1ccc(-c2ccncc2)cc1[N-]S(=O)(=O)c1cccs1	ZINC000065552016	564107433	/nfs/dbraw/zinc/10/74/33/564107433.db2.gz	ATSKVGZYEKXGJK-UHFFFAOYSA-N	-1	0	330.434	3.919	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2ccccc2O)c(Cl)cc1Cl	ZINC000107319743	564129526	/nfs/dbraw/zinc/12/95/26/564129526.db2.gz	PCWLGUBFWDIHOZ-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
COc1cc(/C=C\c2ncc(C(=O)[O-])s2)cc(Cl)c1OC	ZINC000096402121	564147096	/nfs/dbraw/zinc/14/70/96/564147096.db2.gz	STXMCXMZAGDHQM-ARJAWSKDSA-N	-1	0	325.773	3.682	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)c2cccc(C)c2)cc1C(=O)[O-]	ZINC000058065137	564157401	/nfs/dbraw/zinc/15/74/01/564157401.db2.gz	WUKHRDPSBCNPBZ-UHFFFAOYSA-N	-1	0	326.396	3.792	50	0		EHAARM
O=C([O-])C[C@H]1Sc2nc(-c3ccccc3)cn2N=C1c1ccccc1	ZINC000008394170	564165072	/nfs/dbraw/zinc/16/50/72/564165072.db2.gz	RHPJOPMMLAQVQH-MRXNPFEDSA-N	-1	0	349.415	3.752	50	0		EHAARM
CCSC1=NC(=O)C(C(c2ccccc2)c2ccccc2)C([O-])=N1	ZINC000009339766	564172806	/nfs/dbraw/zinc/17/28/06/564172806.db2.gz	MHIGJEVWUODWMY-UHFFFAOYSA-N	-1	0	338.432	3.768	50	0		EHAARM
CCCOc1ccc(S(=O)(=O)[N-]c2cncs2)c2ccccc12	ZINC000041096419	564173145	/nfs/dbraw/zinc/17/31/45/564173145.db2.gz	IUJIWWDPDCKQRI-UHFFFAOYSA-N	-1	0	348.449	3.886	50	0		EHAARM
CN(Cc1ccc(Cl)s1)C(=O)CCc1ccc(C(=O)[O-])cc1	ZINC000262612531	600034738	/nfs/dbraw/zinc/03/47/38/600034738.db2.gz	LJPDLUSTSVLLQG-UHFFFAOYSA-N	-1	0	337.828	3.691	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)c1ccco1	ZINC000002882802	1026761100	/nfs/dbraw/zinc/76/11/00/1026761100.db2.gz	JKXCYTYNXQEUPJ-QGZVFWFLSA-N	-1	0	349.386	3.744	50	0		EHAARM
CC[C@@](CNC(=O)c1ccc(Cl)s1)(C(=O)[O-])c1ccccc1	ZINC000263139848	1029669162	/nfs/dbraw/zinc/66/91/62/1029669162.db2.gz	ZRFRFPFNFMIMQF-INIZCTEOSA-N	-1	0	337.828	3.564	50	0		EHAARM
CC(C)c1nc(/C=C/c2ccc(F)c([N+](=O)[O-])c2)ncc1C(=O)[O-]	ZINC000170618331	1033338671	/nfs/dbraw/zinc/33/86/71/1033338671.db2.gz	QVPLEZOWYHTKEM-GQCTYLIASA-N	-1	0	331.303	3.516	50	0		EHAARM
O=Cc1c2ccccc2n(Cc2ccc(F)cc2Cl)c1C(=O)[O-]	ZINC000004636236	210235526	/nfs/dbraw/zinc/23/55/26/210235526.db2.gz	QRWUUOQSJVTTHH-UHFFFAOYSA-N	-1	0	331.730	3.993	50	0		EHAARM
CCOc1cc(C=O)cc(Cl)c1OCc1cccc(C(=O)[O-])c1	ZINC000004526037	210215493	/nfs/dbraw/zinc/21/54/93/210215493.db2.gz	OITIIZACYUXYBV-UHFFFAOYSA-N	-1	0	334.755	3.828	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CC2)[C@H]1c1ccc(Cl)cc1	ZINC000045923052	213766227	/nfs/dbraw/zinc/76/62/27/213766227.db2.gz	PRNVLCNPBOLZHG-IRXDYDNUSA-N	-1	0	341.794	3.868	50	0		EHAARM
Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)c(C)c1C	ZINC000003395038	210027204	/nfs/dbraw/zinc/02/72/04/210027204.db2.gz	HZSWWPADEATJSB-UHFFFAOYSA-N	-1	0	347.436	3.728	50	0		EHAARM
COc1cc(CC(=O)[O-])ccc1OCc1ccc(OC(C)C)cc1	ZINC000043191120	213567558	/nfs/dbraw/zinc/56/75/58/213567558.db2.gz	HVNVAADMWBVQHA-UHFFFAOYSA-N	-1	0	330.380	3.689	50	0		EHAARM
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000003260429	209992312	/nfs/dbraw/zinc/99/23/12/209992312.db2.gz	ILODIABXYXEPMB-UHFFFAOYSA-N	-1	0	347.436	3.792	50	0		EHAARM
COc1ccc(/C=C(/CC(=O)Nc2ccccc2Cl)C(=O)[O-])cc1	ZINC000002546430	209865526	/nfs/dbraw/zinc/86/55/26/209865526.db2.gz	JOEXUIUBXLLUDG-RAXLEYEMSA-N	-1	0	345.782	3.845	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)CCCOc1ccc(Cl)cc1	ZINC000001773601	209791925	/nfs/dbraw/zinc/79/19/25/209791925.db2.gz	PHWCYYWGHSSNPS-UHFFFAOYSA-N	-1	0	333.771	3.836	50	0		EHAARM
CC(C)(CC(=O)[O-])NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000039778405	213242970	/nfs/dbraw/zinc/24/29/70/213242970.db2.gz	PLCQKKONXZEZCF-UHFFFAOYSA-N	-1	0	339.391	3.778	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1cc(Cl)ccc1O	ZINC000035592597	213040371	/nfs/dbraw/zinc/04/03/71/213040371.db2.gz	GPRUVNBBDBNFJU-UHFFFAOYSA-N	-1	0	348.207	3.508	50	0		EHAARM
O=C([O-])c1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(F)c(F)c2)C1	ZINC000072156765	216045727	/nfs/dbraw/zinc/04/57/27/216045727.db2.gz	IUVOADUYMRCRLL-LLVKDONJSA-N	-1	0	346.333	3.684	50	0		EHAARM
CCc1cccc([N-]S(=O)(=O)c2ccccc2OC(F)(F)F)c1	ZINC000023391333	212374230	/nfs/dbraw/zinc/37/42/30/212374230.db2.gz	IYSCWSLBULFSPK-UHFFFAOYSA-N	-1	0	345.342	3.948	50	0		EHAARM
O=C([O-])C1(NC(=O)c2ccccc2-c2ccc(F)cc2)CCCC1	ZINC000244723608	243070277	/nfs/dbraw/zinc/07/02/77/243070277.db2.gz	MEKUKKFPSQPJMJ-UHFFFAOYSA-N	-1	0	327.355	3.620	50	0		EHAARM
O=C([O-])/C=C/c1ccc(NC(=O)Cc2c(F)cccc2Cl)cc1	ZINC000012992829	211503257	/nfs/dbraw/zinc/50/32/57/211503257.db2.gz	XMBWIXSCPITMRJ-RMKNXTFCSA-N	-1	0	333.746	3.758	50	0		EHAARM
Cc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000012526047	211399142	/nfs/dbraw/zinc/39/91/42/211399142.db2.gz	JIZSNUKSXIJDQP-UHFFFAOYSA-N	-1	0	347.436	3.792	50	0		EHAARM
COCc1cc(C)nc2sc3c([n-]c(-c4ccccc4)nc3=O)c21	ZINC000012445626	211384426	/nfs/dbraw/zinc/38/44/26/211384426.db2.gz	NAPOEODCJQLHRT-UHFFFAOYSA-N	-1	0	337.404	3.655	50	0		EHAARM
CCc1ccc(NC(=O)c2c([O-])c3ccccc3n(CC)c2=O)cc1	ZINC000012414623	211373372	/nfs/dbraw/zinc/37/33/72/211373372.db2.gz	PFYRXSCZICTLGU-UHFFFAOYSA-N	-1	0	336.391	3.542	50	0		EHAARM
O=C([O-])c1cc(-c2ccccc2)nc2c1cnn2-c1ccccc1F	ZINC000012396025	211368387	/nfs/dbraw/zinc/36/83/87/211368387.db2.gz	PEJHLFPSRYAOOZ-UHFFFAOYSA-N	-1	0	333.322	3.925	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CCc1ccc(C(F)(F)F)cc1)C(=O)[O-]	ZINC000091690168	218047453	/nfs/dbraw/zinc/04/74/53/218047453.db2.gz	UIQDQODDDQSNKX-GFCCVEGCSA-N	-1	0	347.333	3.616	50	0		EHAARM
Cc1ccc([C@@H](C(=O)[O-])N2CCN(c3ccc(C)c(C)c3)CC2)cc1	ZINC000091690104	218047598	/nfs/dbraw/zinc/04/75/98/218047598.db2.gz	DUKSJSLNWPJDIV-FQEVSTJZSA-N	-1	0	338.451	3.560	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)s2)n[nH]1	ZINC000009686506	211113173	/nfs/dbraw/zinc/11/31/73/211113173.db2.gz	AVDNETGPPNMUHT-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
Cc1ccccc1OCCSCc1nc(=O)c2sccc2[n-]1	ZINC000009603709	211106927	/nfs/dbraw/zinc/10/69/27/211106927.db2.gz	KRFGYVKEEXLTOE-UHFFFAOYSA-N	-1	0	332.450	3.605	50	0		EHAARM
CCc1cc(=O)n2[n-]c(Cc3ccccc3)c(-c3ccccc3)c2n1	ZINC000009137413	211044586	/nfs/dbraw/zinc/04/45/86/211044586.db2.gz	ASADSMMAFRFGRJ-UHFFFAOYSA-N	-1	0	329.403	3.843	50	0		EHAARM
CC(C)n1cccc1C(=O)N1CCC[C@@H](c2cccc(C(=O)[O-])c2)C1	ZINC000095355002	218288689	/nfs/dbraw/zinc/28/86/89/218288689.db2.gz	VUVGKAXOOQDNGR-QGZVFWFLSA-N	-1	0	340.423	3.787	50	0		EHAARM
CCOC(=O)c1c(C)nc([N-]c2nc3ccccc3s2)nc1C	ZINC000009014130	211031465	/nfs/dbraw/zinc/03/14/65/211031465.db2.gz	CAEFBUAHXSCCGU-UHFFFAOYSA-N	-1	0	328.397	3.623	50	0		EHAARM
O=C(Cc1coc2ccc3ccccc3c12)[N-]O[C@@H]1CCCCO1	ZINC000095393491	218325138	/nfs/dbraw/zinc/32/51/38/218325138.db2.gz	LGDWDPQQICIZJW-GOSISDBHSA-N	-1	0	325.364	3.703	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)Nc2ccc(F)c(Cl)c2)[C@H](C(=O)[O-])C1	ZINC000004892883	210314716	/nfs/dbraw/zinc/31/47/16/210314716.db2.gz	ZSCYJINYFFACSA-NWDGAFQWSA-N	-1	0	325.767	3.865	50	0		EHAARM
C[C@H](CCC(=O)[O-])NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000069837677	257690735	/nfs/dbraw/zinc/69/07/35/257690735.db2.gz	ASUWOMDZJCFFDR-CYBMUJFWSA-N	-1	0	339.391	3.778	50	0		EHAARM
COc1cc(/C=C/c2nc3c(cccc3C(=O)[O-])o2)cc(OC)c1	ZINC000328598376	258041702	/nfs/dbraw/zinc/04/17/02/258041702.db2.gz	MBFQGZFCYDYWCA-VOTSOKGWSA-N	-1	0	325.320	3.714	50	0		EHAARM
CC1(C)C[C@@]1(C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1)c1ccc(F)cc1	ZINC000248338849	520545246	/nfs/dbraw/zinc/54/52/46/520545246.db2.gz	SABJWVUWHRAAIN-YRVVQQKDSA-N	-1	0	347.430	3.501	50	0		EHAARM
COc1cc(Br)c(C(=O)[O-])cc1OCc1ccccc1	ZINC000002509489	563434902	/nfs/dbraw/zinc/43/49/02/563434902.db2.gz	FBTDEMXQQIWHKX-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
COc1cc(-c2cc(C(=O)[O-])c3ccccc3n2)cc(OC)c1OC	ZINC000000118196	563233294	/nfs/dbraw/zinc/23/32/94/563233294.db2.gz	HSUYVVQQTJCCFA-UHFFFAOYSA-N	-1	0	339.347	3.626	50	0		EHAARM
Cc1cc(OCC(=O)Nc2ccccc2C(=O)[O-])ccc1C(C)C	ZINC000000142344	563242514	/nfs/dbraw/zinc/24/25/14/563242514.db2.gz	BKFROLRADGPPHE-UHFFFAOYSA-N	-1	0	327.380	3.834	50	0		EHAARM
Cc1cc(C)cc(NC(=O)N(CCC(=O)[O-])Cc2ccccc2)c1	ZINC000000152589	563246664	/nfs/dbraw/zinc/24/66/64/563246664.db2.gz	GMXJXVXIBCKKHE-UHFFFAOYSA-N	-1	0	326.396	3.812	50	0		EHAARM
Cc1nc(=O)c(-c2ccccc2)c(C)n1-c1cccc(/C=C/C(=O)[O-])c1	ZINC000000267429	563269307	/nfs/dbraw/zinc/26/93/07/563269307.db2.gz	LANYIAFGUJOXJZ-VAWYXSNFSA-N	-1	0	346.386	3.614	50	0		EHAARM
COc1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c1	ZINC000000272937	563270117	/nfs/dbraw/zinc/27/01/17/563270117.db2.gz	XHKCNRXXGCNBHZ-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
CC[C@H](C)c1ccccc1OCC(=O)Nc1cccc(C(=O)[O-])c1	ZINC000000469709	563330149	/nfs/dbraw/zinc/33/01/49/563330149.db2.gz	LMBXEPRXLSRWDK-ZDUSSCGKSA-N	-1	0	327.380	3.916	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1C	ZINC000000479887	563336113	/nfs/dbraw/zinc/33/61/13/563336113.db2.gz	VVQRWBIEPWFNRQ-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CCc1cc(=O)oc2c(C)c(O[C@H](C(=O)[O-])c3ccccc3)ccc12	ZINC000000487403	563338373	/nfs/dbraw/zinc/33/83/73/563338373.db2.gz	IPGYKOREVNTCHE-IBGZPJMESA-N	-1	0	338.359	3.869	50	0	biogenic	EHAARM
O=c1cc([O-])c2sc3nc(C4CC4)cc(C(F)(F)F)c3c2[nH]1	ZINC000001275840	563382037	/nfs/dbraw/zinc/38/20/37/563382037.db2.gz	NWGYIIHUWDPLQR-UHFFFAOYSA-N	-1	0	326.299	3.740	50	0		EHAARM
C[C@@H](Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(=O)[O-]	ZINC000001484896	563391048	/nfs/dbraw/zinc/39/10/48/563391048.db2.gz	ABOOPXYCKNFDNJ-SNVBAGLBSA-N	-1	0	344.754	3.927	50	0	in-vivo	EHAARM
C[C@H](c1ccc2ccccc2c1)[C@H](NC(=O)OC(C)(C)C)C(=O)[O-]	ZINC000005723125	563547430	/nfs/dbraw/zinc/54/74/30/563547430.db2.gz	WUVVJXQHWJQEQZ-WBMJQRKESA-N	-1	0	329.396	3.921	50	0		EHAARM
Cc1cc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])ccc1Br	ZINC000000402027	563594961	/nfs/dbraw/zinc/59/49/61/563594961.db2.gz	GBXVFMOXCSZQBR-VXGBXAGGSA-N	-1	0	340.217	3.587	50	0		EHAARM
Cc1cc(C)cc(Nc2nnc(Cc3ccccc3Cl)c(=O)[n-]2)c1	ZINC000008555763	563632349	/nfs/dbraw/zinc/63/23/49/563632349.db2.gz	HFNUCBIZFOUSPS-UHFFFAOYSA-N	-1	0	340.814	3.770	50	0		EHAARM
CCCCOC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(C)cc1	ZINC000008705773	563636094	/nfs/dbraw/zinc/63/60/94/563636094.db2.gz	SZUDECAGGQEEDG-UHFFFAOYSA-N	-1	0	347.436	3.753	50	0		EHAARM
Cc1ccccc1CCN[C@@H](c1ccccc1Cl)[P@@](=O)([O-])O	ZINC000012997440	563683843	/nfs/dbraw/zinc/68/38/43/563683843.db2.gz	RMHZHKACKWDSFJ-MRXNPFEDSA-N	-1	0	339.759	3.657	50	0		EHAARM
COc1ccccc1-c1c(Cc2ccccc2)[n-]n2c1nc(C)cc2=O	ZINC000015658987	563789558	/nfs/dbraw/zinc/78/95/58/563789558.db2.gz	AVWRDOBTYUPSBK-UHFFFAOYSA-N	-1	0	345.402	3.597	50	0		EHAARM
Cc1cc(C)c(S(=O)(=O)[N-]c2ccnn2C2CCCC2)cc1C	ZINC000028047658	563901250	/nfs/dbraw/zinc/90/12/50/563901250.db2.gz	CAIDPSNTDSOJAG-UHFFFAOYSA-N	-1	0	333.457	3.724	50	0		EHAARM
O=C(N[C@H](c1ccccc1)c1ccccn1)c1ccc([O-])c(Cl)c1	ZINC000029711734	563908042	/nfs/dbraw/zinc/90/80/42/563908042.db2.gz	QTFKAJYHJNLMPJ-GOSISDBHSA-N	-1	0	338.794	3.960	50	0		EHAARM
COc1ccccc1C[C@H]1CCCN1C(=O)c1c([O-])cc(F)cc1F	ZINC000060472175	563963715	/nfs/dbraw/zinc/96/37/15/563963715.db2.gz	FLBUBPHCFKEWOL-CQSZACIVSA-N	-1	0	347.361	3.526	50	0		EHAARM
O=C([O-])[C@@]1(C/C=C/c2ccccc2)CCCN(c2ncccc2F)C1	ZINC000071403947	563964249	/nfs/dbraw/zinc/96/42/49/563964249.db2.gz	QRESSYFZCAOLTK-ZTJJKMQJSA-N	-1	0	340.398	3.995	50	0		EHAARM
O=C([O-])[C@]1(Cc2cccc(Cl)c2)CCCN(c2nccs2)C1	ZINC000071439624	563964399	/nfs/dbraw/zinc/96/43/99/563964399.db2.gz	RZWONPLADZLIAJ-INIZCTEOSA-N	-1	0	336.844	3.710	50	0		EHAARM
CCCN(CC(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000082425412	563973007	/nfs/dbraw/zinc/97/30/07/563973007.db2.gz	VSSPPCXYCLZPJC-UHFFFAOYSA-N	-1	0	339.391	3.732	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@H](C(=O)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000000106220	563986477	/nfs/dbraw/zinc/98/64/77/563986477.db2.gz	XBNFYFUGSSJTKU-CHWSQXEVSA-N	-1	0	343.301	3.581	50	0		EHAARM
CC(C)COc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)[O-])cc1	ZINC000000290156	563990302	/nfs/dbraw/zinc/99/03/02/563990302.db2.gz	KESLWDFINRKHSD-LDADJPATSA-N	-1	0	339.391	3.577	50	0		EHAARM
COc1ccc(NC(=O)[C@H](Cc2ccc(C)cc2)[C@@H](C)C(=O)[O-])cc1	ZINC000005414074	564003718	/nfs/dbraw/zinc/00/37/18/564003718.db2.gz	ZRKOPNCQBPMWIZ-RDTXWAMCSA-N	-1	0	341.407	3.522	50	0		EHAARM
O=C([O-])c1cc(Cl)ccc1NC(=O)COc1ccc(Cl)cc1	ZINC000000545080	564012564	/nfs/dbraw/zinc/01/25/64/564012564.db2.gz	BSJXKZQIJXOVGQ-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
CC[C@@H](C)c1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000007053735	564015361	/nfs/dbraw/zinc/01/53/61/564015361.db2.gz	GHEZAYNWZVGJCG-GFCCVEGCSA-N	-1	0	333.409	3.699	50	0		EHAARM
Cc1ccccc1NC(=O)c1nc[n-]c1C(=O)Nc1ccccc1C	ZINC000000492563	564017634	/nfs/dbraw/zinc/01/76/34/564017634.db2.gz	GHNHUEZGSXJACD-UHFFFAOYSA-N	-1	0	334.379	3.531	50	0		EHAARM
O=C([O-])c1cnn(-c2nc3ccccc3s2)c1C(F)(F)C(F)F	ZINC000025184265	564026406	/nfs/dbraw/zinc/02/64/06/564026406.db2.gz	NALYEPGFZYOXKK-UHFFFAOYSA-N	-1	0	345.277	3.537	50	0		EHAARM
CO[C@]1(C)C[C@@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C1(C)C	ZINC000081485061	564032352	/nfs/dbraw/zinc/03/23/52/564032352.db2.gz	WIOMVHIALISFIU-CXAGYDPISA-N	-1	0	334.441	3.766	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c(OC)c1	ZINC000005884216	564056778	/nfs/dbraw/zinc/05/67/78/564056778.db2.gz	WMHZCMWKZJRMJE-UHFFFAOYSA-N	-1	0	349.452	3.738	50	0		EHAARM
C[C@@H](CC(=O)N1CCC(C(=O)[O-])CC1)c1cccc(C(F)(F)F)c1	ZINC000237314516	564073284	/nfs/dbraw/zinc/07/32/84/564073284.db2.gz	HFHGFWWUMKEJLZ-NSHDSACASA-N	-1	0	343.345	3.522	50	0		EHAARM
Cn1cc([N-]S(=O)(=O)c2ccc(Cl)cc2)c(-c2ccccc2)n1	ZINC000091055917	564087200	/nfs/dbraw/zinc/08/72/00/564087200.db2.gz	HGZHRQDBTFWRHR-UHFFFAOYSA-N	-1	0	347.827	3.541	50	0		EHAARM
COc1ccc([C@H](CC(C)=O)c2c([O-])c3ccccc3oc2=O)cc1	ZINC000006614264	564094515	/nfs/dbraw/zinc/09/45/15/564094515.db2.gz	XWWHEKHACHXGCR-INIZCTEOSA-N	-1	0	338.359	3.618	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cccc(CC)c2)c2cccnc21	ZINC000065242231	564103397	/nfs/dbraw/zinc/10/33/97/564103397.db2.gz	JSVABWHIANLCCQ-UHFFFAOYSA-N	-1	0	343.452	3.810	50	0		EHAARM
CCOC(=O)c1cnc2ccccc2c1Nc1ccc(C(=O)[O-])cc1	ZINC000000090648	564124896	/nfs/dbraw/zinc/12/48/96/564124896.db2.gz	JUKFJGNPLQFZAG-UHFFFAOYSA-N	-1	0	336.347	3.853	50	0	biogenic	EHAARM
CSc1ccc([C@H](NCc2ccc(C)cc2)[P@@](=O)([O-])O)cc1	ZINC000012997516	564135836	/nfs/dbraw/zinc/13/58/36/564135836.db2.gz	GDOQVOLONZBMDA-MRXNPFEDSA-N	-1	0	337.381	3.683	50	0		EHAARM
O=C(NC1=NCCS1)c1cc(-c2ccccc2)cc(Cl)c1[O-]	ZINC000078995456	564137562	/nfs/dbraw/zinc/13/75/62/564137562.db2.gz	FUONUBNEVBQMPG-UHFFFAOYSA-N	-1	0	332.812	3.545	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@@H]1CCC[C@H](C)[C@@H]1C)c2=O	ZINC000020645202	564141709	/nfs/dbraw/zinc/14/17/09/564141709.db2.gz	VBIHYWPJMKUNNZ-ZIBATOQPSA-N	-1	0	346.452	3.843	50	0		EHAARM
COc1cc2c(=O)c(-c3ccc(Br)cc3)coc2cc1[O-]	ZINC000096102782	564145229	/nfs/dbraw/zinc/14/52/29/564145229.db2.gz	NDVVPGGVNZEFIN-UHFFFAOYSA-N	-1	0	347.164	3.937	50	0		EHAARM
O=C([O-])C[C@@H]1CCC[N@H+](Cc2ccc(Cl)c3cccnc23)CC1	ZINC000299743339	564150519	/nfs/dbraw/zinc/15/05/19/564150519.db2.gz	KIZLRAVSJTUTQO-CYBMUJFWSA-N	-1	0	332.831	3.965	50	0		EHAARM
Cc1ccc2nc(NC(=O)CC3(CC(=O)[O-])CCCC3)sc2c1	ZINC000003230495	564156326	/nfs/dbraw/zinc/15/63/26/564156326.db2.gz	NGQYRKHKFBYIOV-UHFFFAOYSA-N	-1	0	332.425	3.968	50	0		EHAARM
O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1cc(F)ccc1F	ZINC000008105035	564162744	/nfs/dbraw/zinc/16/27/44/564162744.db2.gz	MOTCFHQFXXJUOR-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
O=C([O-])C[C@@H]1Sc2nc(-c3ccccc3)cn2N=C1c1ccccc1	ZINC000008394171	564165053	/nfs/dbraw/zinc/16/50/53/564165053.db2.gz	RHPJOPMMLAQVQH-INIZCTEOSA-N	-1	0	349.415	3.752	50	0		EHAARM
Cc1cc(F)ccc1[C@H]1[C@@H](C(=O)[O-])CCC(=O)N1Cc1ccsc1	ZINC000069919900	564172819	/nfs/dbraw/zinc/17/28/19/564172819.db2.gz	QGKAVKUDQRSEQY-RDJZCZTQSA-N	-1	0	347.411	3.760	50	0		EHAARM
C[C@H](C(=O)NC1CCC(C(=O)[O-])CC1)c1ccc(Cl)c(Cl)c1	ZINC000261960200	601058368	/nfs/dbraw/zinc/05/83/68/601058368.db2.gz	ANAOCCIPYXJLQC-BMQDGWLCSA-N	-1	0	344.238	3.857	50	0		EHAARM
O=C([O-])[C@H]1CC[C@H](C(=O)N2CCC[C@H]2/C=C\c2ccccc2)CC1	ZINC000606441924	975016007	/nfs/dbraw/zinc/01/60/07/975016007.db2.gz	CCVYJVPFPYGVPC-RGDCUFLXSA-N	-1	0	327.424	3.582	50	0		EHAARM
C[C@]12CC3CC(C(=O)Nc4nc(CC(=O)[O-])cs4)(C1)C[C@@](C)(C3)C2	ZINC000170025695	1031266934	/nfs/dbraw/zinc/26/69/34/1031266934.db2.gz	MQRQGOMSYJEUQI-YVBDQSFBSA-N	-1	0	348.468	3.705	50	0		EHAARM
O=[N+]([O-])c1cc(Cl)cc(C=NNc2ccc(F)cc2F)c1[O-]	ZINC000254631200	1042612940	/nfs/dbraw/zinc/61/29/40/1042612940.db2.gz	JCBWIWDWEKSBAZ-UHFFFAOYSA-N	-1	0	327.674	3.678	50	0		EHAARM
O=C([O-])[C@H](CC(=O)N1CCC[C@@]2(CC=CCC2)C1)c1ccccc1	ZINC000634885239	1137481203	/nfs/dbraw/zinc/48/12/03/1137481203.db2.gz	CNYXSCSNAOMZGA-XLIONFOSSA-N	-1	0	327.424	3.594	50	0		EHAARM
CC(C)c1cccc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)c1	ZINC000049409493	214005912	/nfs/dbraw/zinc/00/59/12/214005912.db2.gz	WHWLLYBNPZLBKF-UHFFFAOYSA-N	-1	0	342.420	3.681	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2cc(C)ccc2C)c1=O	ZINC000100602501	219102961	/nfs/dbraw/zinc/10/29/61/219102961.db2.gz	DVRIVOAWKFAQGD-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
CCOc1cc(C)c(S(=O)(=O)[N-]c2ccccn2)cc1C(C)C	ZINC000004411685	210189426	/nfs/dbraw/zinc/18/94/26/210189426.db2.gz	YJAIUKZRFNRUTI-UHFFFAOYSA-N	-1	0	334.441	3.713	50	0		EHAARM
CC(C)c1cccc(NC(=O)c2c([O-])c3sccc3[nH]c2=O)c1	ZINC000065215272	214844739	/nfs/dbraw/zinc/84/47/39/214844739.db2.gz	VTNLSDSOWKRGLG-UHFFFAOYSA-N	-1	0	328.393	3.671	50	0		EHAARM
CSc1ccc([C@H]2[C@H](C(=O)[O-])CC(=O)N2Cc2ccccc2)cc1	ZINC000004237886	210148465	/nfs/dbraw/zinc/14/84/65/210148465.db2.gz	UJHRKLBHWDTEQV-AEFFLSMTSA-N	-1	0	341.432	3.583	50	0		EHAARM
O=C1CCCC2=Nc3nonc3N[C@@H](c3ccc4ncccc4c3)C12	ZINC000102736687	219226775	/nfs/dbraw/zinc/22/67/75/219226775.db2.gz	BJCXGJAZAAMXJP-INIZCTEOSA-N	-1	0	333.351	3.853	50	0		EHAARM
O=C([O-])c1cn(-c2ccccc2)c2c1NC(=O)C[C@H]2c1cccnc1	ZINC000040313099	213291068	/nfs/dbraw/zinc/29/10/68/213291068.db2.gz	YYYTVANVCLRRKW-AWEZNQCLSA-N	-1	0	333.347	3.694	50	0	biogenic	EHAARM
COc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2O)ccc1Cl	ZINC000035592607	213040196	/nfs/dbraw/zinc/04/01/96/213040196.db2.gz	OOPHMFBLNJTQKR-UHFFFAOYSA-N	-1	0	348.207	3.508	50	0		EHAARM
CCOc1ccc(NC(=O)C[C@H](C(=O)[O-])[C@H](C)c2ccccc2)cc1	ZINC000035142203	213009404	/nfs/dbraw/zinc/00/94/04/213009404.db2.gz	BALWTZPZJNFWNG-KDOFPFPSSA-N	-1	0	341.407	3.918	50	0		EHAARM
O=C([O-])c1ccccc1[C@@H]1CCN(C(=O)c2ccc(F)cc2Cl)C1	ZINC000072174286	216064914	/nfs/dbraw/zinc/06/49/14/216064914.db2.gz	ISJCMXZGZZPRHB-LLVKDONJSA-N	-1	0	347.773	3.807	50	0		EHAARM
CC[C@H](c1ccc2cc(OC)ccc2c1)[C@@H](CC(=O)[O-])C(=O)OC	ZINC000000393191	209567073	/nfs/dbraw/zinc/56/70/73/209567073.db2.gz	UCKVSTWLDCKQLF-IAGOWNOFSA-N	-1	0	330.380	3.606	50	0		EHAARM
Cc1cnc2c(cccc2S(=O)(=O)[N-]c2ccc3c(c2)CCC3)c1	ZINC000023371553	212372057	/nfs/dbraw/zinc/37/20/57/212372057.db2.gz	DPAQUGWXDKQVMP-UHFFFAOYSA-N	-1	0	338.432	3.833	50	0		EHAARM
CN(Cc1ccc(Cl)s1)Cc1nc(=O)c2sccc2[n-]1	ZINC000022130671	212277956	/nfs/dbraw/zinc/27/79/56/212277956.db2.gz	ZBYQCYMRDUDKRH-UHFFFAOYSA-N	-1	0	325.846	3.744	50	0		EHAARM
Cc1cc(F)cc([N-]S(=O)(=O)c2ccccc2Br)c1	ZINC000084848674	217650163	/nfs/dbraw/zinc/65/01/63/217650163.db2.gz	BUYYUUGIACXBDH-UHFFFAOYSA-N	-1	0	344.205	3.697	50	0		EHAARM
O=C([O-])C[C@H]1CCCN(C(=O)CCc2ccc(-c3ccccc3)o2)C1	ZINC000089851194	217861400	/nfs/dbraw/zinc/86/14/00/217861400.db2.gz	OKGAJTYOQRZQLN-OAHLLOKOSA-N	-1	0	341.407	3.593	50	0		EHAARM
O=C([O-])c1cc(-c2ccc(O)cc2)nc2[nH]c(-c3ccccc3)nc21	ZINC000011694702	211237454	/nfs/dbraw/zinc/23/74/54/211237454.db2.gz	XDZXWYAVEVKZPS-UHFFFAOYSA-N	-1	0	331.331	3.696	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1-c1cccs1	ZINC000010512327	211179022	/nfs/dbraw/zinc/17/90/22/211179022.db2.gz	PGVRNYPFNVQVTR-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
COc1ccc(-c2nnc(SCC(=O)[O-])n2C2CCCCC2)cc1	ZINC000006507232	210643169	/nfs/dbraw/zinc/64/31/69/210643169.db2.gz	HCRXFCCXRPPBRV-UHFFFAOYSA-N	-1	0	347.440	3.636	50	0		EHAARM
CCC(=O)Oc1ccc(C(=O)Nc2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000004977868	210346064	/nfs/dbraw/zinc/34/60/64/210346064.db2.gz	NNZOKPWXTLCHPG-UHFFFAOYSA-N	-1	0	347.754	3.606	50	0		EHAARM
CCOc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1cccnc1	ZINC000004970391	210344062	/nfs/dbraw/zinc/34/40/62/210344062.db2.gz	UYYBNLSDRJMEAP-UHFFFAOYSA-N	-1	0	334.441	3.579	50	0		EHAARM
CN1Cc2c(nc3ccccc3c2C(=O)[O-])/C(=C\c2cccs2)C1	ZINC000004949164	210338096	/nfs/dbraw/zinc/33/80/96/210338096.db2.gz	XBFZKVYBAXNXDS-XFXZXTDPSA-N	-1	0	336.416	3.981	50	0		EHAARM
Cc1ccc(-c2ccc(NC(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@@H]3C(=O)[O-])cc2)o1	ZINC000004852771	210300539	/nfs/dbraw/zinc/30/05/39/210300539.db2.gz	FKSLNBYCLBTOCK-DACLVMHWSA-N	-1	0	337.375	3.716	50	0		EHAARM
Cc1ccc(C[C@@H](C(=O)Nc2ccc(F)cc2)[C@@H](C)C(=O)[O-])cc1	ZINC000004801826	210280356	/nfs/dbraw/zinc/28/03/56/210280356.db2.gz	BBRLINWIXHPXMR-CXAGYDPISA-N	-1	0	329.371	3.652	50	0		EHAARM
O=C(NOCc1cccnc1)c1c([O-])c(Cl)cc(Cl)c1Cl	ZINC000154109415	224204746	/nfs/dbraw/zinc/20/47/46/224204746.db2.gz	UCCLVVNINFRQBY-UHFFFAOYSA-N	-1	0	347.585	3.609	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@H]2C[C@@H]2c2ccccc2Cl)cc1C(=O)[O-]	ZINC000299753327	258006808	/nfs/dbraw/zinc/00/68/08/258006808.db2.gz	XVGNTKKUDHZOOB-CABCVRRESA-N	-1	0	347.798	3.702	50	0		EHAARM
Cc1nn(-c2ccc(C)cc2)c(C)c1[N-]S(=O)(=O)c1ccccc1	ZINC000012536295	258054587	/nfs/dbraw/zinc/05/45/87/258054587.db2.gz	KJPRGUNOVIBELD-UHFFFAOYSA-N	-1	0	341.436	3.598	50	0		EHAARM
Cc1nc(CN2CCCC[C@H]2C(=O)[O-])oc1-c1ccc(Cl)cc1	ZINC000158507929	225032392	/nfs/dbraw/zinc/03/23/92/225032392.db2.gz	KJNPHWZCEVGGGS-AWEZNQCLSA-N	-1	0	334.803	3.743	50	0		EHAARM
Cc1sc2ncn([C@@H](C)C(=O)[O-])c(=O)c2c1-c1ccc(C)c(C)c1	ZINC000000148662	563245156	/nfs/dbraw/zinc/24/51/56/563245156.db2.gz	SYZWKYNOJNGYEK-NSHDSACASA-N	-1	0	342.420	3.696	50	0		EHAARM
O=C([O-])CC1C(=O)C(=O)N(c2ccccc2)[C@@H]1c1ccc(Cl)cc1	ZINC000000548215	563344420	/nfs/dbraw/zinc/34/44/20/563344420.db2.gz	NIDKBNQBLXAVOC-MRXNPFEDSA-N	-1	0	343.766	3.715	50	0		EHAARM
O=C([O-])CCCCNC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002560009	563441601	/nfs/dbraw/zinc/44/16/01/563441601.db2.gz	ULLSWWGYZWBPHK-UHFFFAOYSA-N	-1	0	339.391	3.780	50	0		EHAARM
O=c1[n-]c(Nc2ccc(Cl)cc2)nnc1Cc1ccccc1Cl	ZINC000002718978	563446646	/nfs/dbraw/zinc/44/66/46/563446646.db2.gz	XAQOVOAENDCYTH-UHFFFAOYSA-N	-1	0	347.205	3.806	50	0		EHAARM
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1ccccc1C(=O)[O-]	ZINC000003243185	563478083	/nfs/dbraw/zinc/47/80/83/563478083.db2.gz	FUWMRGQUYIVRDW-UHFFFAOYSA-N	-1	0	347.436	3.792	50	0		EHAARM
Cc1ccc(C)c(/C=C2\CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)c1	ZINC000006281673	563564201	/nfs/dbraw/zinc/56/42/01/563564201.db2.gz	FLRWNGYXUQWIPL-GXDHUFHOSA-N	-1	0	346.386	3.656	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)[C@H]1CC(C)=C(C)C[C@H]1C(=O)[O-]	ZINC000006731396	563583908	/nfs/dbraw/zinc/58/39/08/563583908.db2.gz	GARMDYLWECVQLZ-QWHCGFSZSA-N	-1	0	337.803	3.734	50	0		EHAARM
O=S(=O)([N-]c1noc2ccccc21)c1c(Cl)cccc1Cl	ZINC000007363538	563600084	/nfs/dbraw/zinc/60/00/84/563600084.db2.gz	DAJBXJLVXXOPKI-UHFFFAOYSA-N	-1	0	343.191	3.935	50	0		EHAARM
CCOc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1cccc(O)c1	ZINC000008132512	563622082	/nfs/dbraw/zinc/62/20/82/563622082.db2.gz	KQOAYCKXLHDMGD-UHFFFAOYSA-N	-1	0	335.425	3.715	50	0		EHAARM
Cc1cc(=O)oc2c(C)c([O-])c(-c3ccn(-c4ccccc4)n3)cc12	ZINC000013691757	563712508	/nfs/dbraw/zinc/71/25/08/563712508.db2.gz	QJAHEEFIAPDOBV-UHFFFAOYSA-N	-1	0	332.359	3.968	50	0		EHAARM
O=c1nc(Nc2cc(Cl)ccc2Cl)[n-]nc1-c1ccccc1	ZINC000016806939	563824478	/nfs/dbraw/zinc/82/44/78/563824478.db2.gz	SBSADZXYELHFCO-UHFFFAOYSA-N	-1	0	333.178	3.882	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CCCC2)C12CCCCC2	ZINC000030822675	563910834	/nfs/dbraw/zinc/91/08/34/563910834.db2.gz	ANKIAATVFMALOB-QGZVFWFLSA-N	-1	0	327.424	3.956	50	0	biogenic	EHAARM
CCc1cccc([N-]S(=O)(=O)c2cc(-c3ccno3)oc2C)c1	ZINC000032971339	563920163	/nfs/dbraw/zinc/92/01/63/563920163.db2.gz	FURACZAKVXMKNL-UHFFFAOYSA-N	-1	0	332.381	3.606	50	0		EHAARM
Cc1cc(Br)c([O-])c(Br)c1Br	ZINC000087612806	563974413	/nfs/dbraw/zinc/97/44/13/563974413.db2.gz	FTGDPJRWRYCBFF-UHFFFAOYSA-N	-1	0	344.828	3.988	50	0		EHAARM
Cc1cccc(SC2CCN(c3cccc(C(=O)[O-])n3)CC2)c1	ZINC000095504695	563977115	/nfs/dbraw/zinc/97/71/15/563977115.db2.gz	RUPRUMHQSREPSP-UHFFFAOYSA-N	-1	0	328.437	3.849	50	0		EHAARM
COc1cc(-c2n[n-]c(=S)n2-c2ccc(Cl)cc2)ccc1O	ZINC000095929454	563977789	/nfs/dbraw/zinc/97/77/89/563977789.db2.gz	SWEZMAJDSNBZMT-UHFFFAOYSA-N	-1	0	333.800	3.964	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@@H](CCc2ccccc2)[C@@H]1C(=O)[O-]	ZINC000072233759	563986055	/nfs/dbraw/zinc/98/60/55/563986055.db2.gz	PRZZNHCYHUYMIC-JKSUJKDBSA-N	-1	0	333.428	3.720	50	0		EHAARM
COc1ccc(Cc2nnc(Nc3cc(C)ccc3C)[n-]c2=O)cc1	ZINC000005154398	563994755	/nfs/dbraw/zinc/99/47/55/563994755.db2.gz	ASKLCBPCOBXOGW-UHFFFAOYSA-N	-1	0	336.395	3.537	50	0		EHAARM
Cc1c2ccc(OCc3ccccc3)cc2oc(=O)c1CCC(=O)[O-]	ZINC000005390017	564003499	/nfs/dbraw/zinc/00/34/99/564003499.db2.gz	YFKGZIWFNKVSCL-UHFFFAOYSA-N	-1	0	338.359	3.698	50	0		EHAARM
COc1ccc(NC(=O)[C@@H](Cc2ccc(C)cc2)[C@H](C)C(=O)[O-])cc1	ZINC000005413984	564003739	/nfs/dbraw/zinc/00/37/39/564003739.db2.gz	ZRKOPNCQBPMWIZ-KSSFIOAISA-N	-1	0	341.407	3.522	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000000483963	564016865	/nfs/dbraw/zinc/01/68/65/564016865.db2.gz	JZOCQCSMIMMERG-OLZOCXBDSA-N	-1	0	330.409	3.640	50	0		EHAARM
CCN(c1ccc(C(=O)Nc2ccccc2C(=O)[O-])cc1)C(C)C	ZINC000583651284	564018322	/nfs/dbraw/zinc/01/83/22/564018322.db2.gz	ILGPNQSEEPRCKM-UHFFFAOYSA-N	-1	0	326.396	3.872	50	0		EHAARM
Nc1c(N2CCCC2)s[n-]c1=NOc1cccc(C(F)(F)F)c1	ZINC000005750021	564025080	/nfs/dbraw/zinc/02/50/80/564025080.db2.gz	IOIZUOCOCIEQTA-UHFFFAOYSA-N	-1	0	344.362	3.750	50	0		EHAARM
Cc1ccc([C@@H]2[C@H](C(=O)[O-])CCC(=O)N2[C@H](C)c2cc(C)oc2C)o1	ZINC000106839529	564026666	/nfs/dbraw/zinc/02/66/66/564026666.db2.gz	ZWQLKOMDUDWMDL-DFHBCGBQSA-N	-1	0	345.395	3.923	50	0		EHAARM
C[C@H]1CCCN(c2ccc(NC(=O)c3ccccc3)cc2C(=O)[O-])C1	ZINC000046053446	564029354	/nfs/dbraw/zinc/02/93/54/564029354.db2.gz	QHUFSVMYDAZKQG-AWEZNQCLSA-N	-1	0	338.407	3.873	50	0		EHAARM
CCOC(=O)Nc1ccc(NC(=O)CC2(C(=O)[O-])CCCCC2)cc1	ZINC000048383491	564031716	/nfs/dbraw/zinc/03/17/16/564031716.db2.gz	QRCRGHUVIPVIMY-UHFFFAOYSA-N	-1	0	348.399	3.619	50	0		EHAARM
CCSc1cccc(NC(=O)CSc2n[n-]c(=S)s2)c1	ZINC000081746828	564051206	/nfs/dbraw/zinc/05/12/06/564051206.db2.gz	YROPYRVITOHWME-UHFFFAOYSA-N	-1	0	343.524	3.670	50	0		EHAARM
Cc1ccc2c(CC(=O)N[C@@H](C(=O)[O-])c3ccccc3)coc2c1C	ZINC000237874561	564051456	/nfs/dbraw/zinc/05/14/56/564051456.db2.gz	UDVYCIPMLOHBRP-GOSISDBHSA-N	-1	0	337.375	3.534	50	0		EHAARM
CN1CCc2c(sc3[n-]c(=S)n(C4CCCCC4)c(=O)c23)C1	ZINC000019074599	564053270	/nfs/dbraw/zinc/05/32/70/564053270.db2.gz	URZQTONFVHKNSO-UHFFFAOYSA-N	-1	0	335.498	3.614	50	0		EHAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCC(C(F)(F)F)CC1	ZINC000074155983	564070258	/nfs/dbraw/zinc/07/02/58/564070258.db2.gz	HKGHRKNOLYBJIC-UHFFFAOYSA-N	-1	0	330.331	3.905	50	0		EHAARM
C[C@H]1CCCN(c2ccc(NC(=O)c3ccccc3)c(C(=O)[O-])c2)C1	ZINC000064589023	564092545	/nfs/dbraw/zinc/09/25/45/564092545.db2.gz	CFSSKRKXULZXPN-AWEZNQCLSA-N	-1	0	338.407	3.873	50	0		EHAARM
O=S(=O)([N-]c1ccc2n[nH]cc2c1)c1cc(Cl)ccc1Cl	ZINC000006657442	564095493	/nfs/dbraw/zinc/09/54/93/564095493.db2.gz	JYBXVNUZAHFKQJ-UHFFFAOYSA-N	-1	0	342.207	3.671	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cccnc2Nc2ccccc2)cc1	ZINC000064757486	564096043	/nfs/dbraw/zinc/09/60/43/564096043.db2.gz	OEAGDBUBQOYBJN-UHFFFAOYSA-N	-1	0	339.420	3.934	50	0		EHAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)Nc1ccc(Cl)cc1C	ZINC000064983794	564099094	/nfs/dbraw/zinc/09/90/94/564099094.db2.gz	NZLHILVXOWRJSI-UHFFFAOYSA-N	-1	0	334.803	3.658	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccccc3C)s2)on1	ZINC000006887777	564100724	/nfs/dbraw/zinc/10/07/24/564100724.db2.gz	LSMPOCRLRYNESD-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c2ncccc12	ZINC000170597932	564109176	/nfs/dbraw/zinc/10/91/76/564109176.db2.gz	HZYMAHMTGHRBFN-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
Cc1nc2ccc([N-]S(=O)(=O)c3c(F)cccc3F)cc2s1	ZINC000007505265	564109410	/nfs/dbraw/zinc/10/94/10/564109410.db2.gz	ZLFPLYKOVQHWGF-UHFFFAOYSA-N	-1	0	340.376	3.684	50	0		EHAARM
O=C([O-])c1nsc2c1NC(=O)C[C@H]2c1ccc(F)cc1Cl	ZINC000071284436	564110857	/nfs/dbraw/zinc/11/08/57/564110857.db2.gz	URPMIQFFZUAXIA-ZETCQYMHSA-N	-1	0	326.736	3.757	50	0		EHAARM
Cc1[nH]c2c(cccc2C(=O)N2CCC[C@H](CCC(=O)[O-])C2)c1C	ZINC000237724229	564117769	/nfs/dbraw/zinc/11/77/69/564117769.db2.gz	MERUNZJNXFVLAM-CQSZACIVSA-N	-1	0	328.412	3.502	50	0		EHAARM
CC(=NNc1cccc(C(=O)[O-])c1)c1cc(Br)ccc1O	ZINC000252474375	564118947	/nfs/dbraw/zinc/11/89/47/564118947.db2.gz	CCQYQQOUBIZBIP-UHFFFAOYSA-N	-1	0	349.184	3.689	50	0		EHAARM
O=S(=O)([N-]c1cccc2cccnc21)c1ccc2c(c1)CCCC2	ZINC000007709486	564122139	/nfs/dbraw/zinc/12/21/39/564122139.db2.gz	KLFPDRAQWQPJNV-UHFFFAOYSA-N	-1	0	338.432	3.914	50	0		EHAARM
O=C(Nc1ccccc1)n1cc(C(=O)c2cc(Cl)ccc2[O-])cn1	ZINC000008391732	564164986	/nfs/dbraw/zinc/16/49/86/564164986.db2.gz	QWDAPEQNZKZGEW-UHFFFAOYSA-N	-1	0	341.754	3.553	50	0		EHAARM
Cc1ccc([C@@H](c2sc3nc(C)nn3c2[O-])N2CCCCCC2)o1	ZINC000041637142	564174209	/nfs/dbraw/zinc/17/42/09/564174209.db2.gz	VXPMXAJUPSOCOU-AWEZNQCLSA-N	-1	0	346.456	3.672	50	0		EHAARM
Cc1c2cc(F)ccc2oc1C(=O)N1CCCC[C@H]1CCC(=O)[O-]	ZINC000261777576	950049914	/nfs/dbraw/zinc/04/99/14/950049914.db2.gz	XMZOLLCUEIXIAM-ZDUSSCGKSA-N	-1	0	333.359	3.740	50	0		EHAARM
Cc1ccc(-c2[n-][nH]c(=NC(=O)[C@@H]3CCCc4ccccc43)c2C)o1	ZINC000568353748	1130969253	/nfs/dbraw/zinc/96/92/53/1130969253.db2.gz	YYHIWWYGBVWLBT-MRXNPFEDSA-N	-1	0	335.407	3.767	50	0		EHAARM
CCCOc1cc(C)c(C)cc1S(=O)(=O)[N-]c1ccccc1OC	ZINC000031903987	1138009544	/nfs/dbraw/zinc/00/95/44/1138009544.db2.gz	WSDPQFKTTUGYLU-UHFFFAOYSA-N	-1	0	349.452	3.902	50	0		EHAARM
Cc1ccc2nc(C)c(C(=O)N3CCCC[C@@H]3CCC(=O)[O-])cc2c1	ZINC000055392897	214316807	/nfs/dbraw/zinc/31/68/07/214316807.db2.gz	MFWHADRGQPSTOV-MRXNPFEDSA-N	-1	0	340.423	3.711	50	0		EHAARM
Cc1ccc(C)c(/C=C2/CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)c1	ZINC000097993529	219066765	/nfs/dbraw/zinc/06/67/65/219066765.db2.gz	FLRWNGYXUQWIPL-UVTDQMKNSA-N	-1	0	346.386	3.656	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000004612056	210231643	/nfs/dbraw/zinc/23/16/43/210231643.db2.gz	STMFJDTXVZATRV-CHWSQXEVSA-N	-1	0	348.399	3.779	50	0		EHAARM
O=c1c2sc3ncccc3c2[n-]c(=S)n1CCc1ccccc1	ZINC000100028555	219089210	/nfs/dbraw/zinc/08/92/10/219089210.db2.gz	PXEVPVWKRCVKKM-UHFFFAOYSA-N	-1	0	339.445	3.911	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(Cc2ccco2)C12CCCCC2	ZINC000049466993	214010302	/nfs/dbraw/zinc/01/03/02/214010302.db2.gz	ZIYUSOBSWLSTQF-QGZVFWFLSA-N	-1	0	339.391	3.807	50	0		EHAARM
CCc1cc2c(cc1O[C@@H](C)C(=O)[O-])oc(=O)cc2-c1ccccc1	ZINC000004387703	210186707	/nfs/dbraw/zinc/18/67/07/210186707.db2.gz	HIQCVTLJKKHOBY-LBPRGKRZSA-N	-1	0	338.359	3.874	50	0		EHAARM
Cc1[n-]n2c(nc(C)c(C)c2=O)c1-c1ccc(Br)cc1	ZINC000101083929	219116334	/nfs/dbraw/zinc/11/63/34/219116334.db2.gz	HDNTVGAXHMRXLJ-UHFFFAOYSA-N	-1	0	332.201	3.790	50	0		EHAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)Nc1ccc(C)cc1Cl	ZINC000064980711	214818871	/nfs/dbraw/zinc/81/88/71/214818871.db2.gz	IYRWWOVBLISPLW-UHFFFAOYSA-N	-1	0	334.803	3.658	50	0		EHAARM
O=C([O-])c1cccc(Nc2c(-c3ccc(O)cc3)nc3cnccn32)c1	ZINC000065322787	214871228	/nfs/dbraw/zinc/87/12/28/214871228.db2.gz	NEBDPDZUBKYUEE-UHFFFAOYSA-N	-1	0	346.346	3.544	50	0		EHAARM
O=C([O-])CCCC(=O)Nc1nc(C23CC4CC(CC(C4)C2)C3)cs1	ZINC000004124252	210126018	/nfs/dbraw/zinc/12/60/18/210126018.db2.gz	CXPZESZARNVNEF-UHFFFAOYSA-N	-1	0	348.468	3.804	50	0		EHAARM
CC(C)(C)c1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccccc2)cc1	ZINC000003629104	210068492	/nfs/dbraw/zinc/06/84/92/210068492.db2.gz	PYCQHVKJSXVXFP-QGZVFWFLSA-N	-1	0	325.408	3.930	50	0		EHAARM
Cc1ccc(C(=O)N[C@H](CC(=O)[O-])c2ccc(Cl)cc2)cc1C	ZINC000003399309	210027968	/nfs/dbraw/zinc/02/79/68/210027968.db2.gz	PKGWONIMZIWQNJ-MRXNPFEDSA-N	-1	0	331.799	3.903	50	0		EHAARM
O=C([O-])[C@@H]1CCC[C@H](CC(=O)c2ccccc2Br)C1	ZINC000043879466	213600793	/nfs/dbraw/zinc/60/07/93/213600793.db2.gz	WWBDHSIOGABKMI-WDEREUQCSA-N	-1	0	325.202	3.913	50	0		EHAARM
Cc1cc(C)c(C)c(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2C)c1C	ZINC000003295748	210000990	/nfs/dbraw/zinc/00/09/90/210000990.db2.gz	GKEGGVAHMGAZEQ-UHFFFAOYSA-N	-1	0	347.436	3.728	50	0		EHAARM
CC(C)(CC(=O)[O-])CC(=O)N[C@H](c1cccs1)c1ccc(F)cc1	ZINC000040025636	213252734	/nfs/dbraw/zinc/25/27/34/213252734.db2.gz	LZSQZQYWLLBWJA-KRWDZBQOSA-N	-1	0	349.427	3.984	50	0		EHAARM
CC(C)(C)OC(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)[O-]	ZINC000039959771	213246213	/nfs/dbraw/zinc/24/62/13/213246213.db2.gz	BFBAJLQTONSFEB-MRXNPFEDSA-N	-1	0	329.396	3.608	50	0		EHAARM
CC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)cc1	ZINC000000476461	209625833	/nfs/dbraw/zinc/62/58/33/209625833.db2.gz	FLLJMPPTUWBBLN-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
O=C([O-])[C@H](Cc1ccco1)n1ccnc1-c1coc(-c2ccccc2)n1	ZINC000071754101	215811652	/nfs/dbraw/zinc/81/16/52/215811652.db2.gz	WJXYFUHSZPMWLT-INIZCTEOSA-N	-1	0	349.346	3.667	50	0		EHAARM
Cc1cc(C)cc(C(=O)N2CC[C@H](Cc3cccc(C(=O)[O-])c3)C2)c1	ZINC000072137344	216024965	/nfs/dbraw/zinc/02/49/65/216024965.db2.gz	NCMUNFYMKQWAKK-QGZVFWFLSA-N	-1	0	337.419	3.706	50	0		EHAARM
CC(=O)N(CC(=O)[O-])CC1(c2ccc(Cl)s2)CCCCC1	ZINC000000385876	209564046	/nfs/dbraw/zinc/56/40/46/209564046.db2.gz	HNMXEJSZKWLINC-UHFFFAOYSA-N	-1	0	329.849	3.537	50	0		EHAARM
O=C([O-])c1cc(Cl)cn(Cc2ccc(Cl)cc2Cl)c1=O	ZINC000000170489	209461731	/nfs/dbraw/zinc/46/17/31/209461731.db2.gz	KQPVAFFLHGYNMP-UHFFFAOYSA-N	-1	0	332.570	3.555	50	0		EHAARM
Cc1cccc(C(=O)N[C@H](CC(=O)[O-])c2ccc(OC(C)C)cc2)c1	ZINC000000106248	209424439	/nfs/dbraw/zinc/42/44/39/209424439.db2.gz	ZLFFJJNPPDYXLE-GOSISDBHSA-N	-1	0	341.407	3.728	50	0		EHAARM
CC[C@H](C(=O)[O-])n1cnc2scc(-c3ccc(Cl)cc3)c2c1=O	ZINC000000065091	209397217	/nfs/dbraw/zinc/39/72/17/209397217.db2.gz	RJKZODONBJBONO-GFCCVEGCSA-N	-1	0	348.811	3.814	50	0		EHAARM
COC(=O)[C@@H]1[C@H](c2ccccc2)C=C[C@@H](c2ccccc2)[C@H]1C(=O)[O-]	ZINC000245242314	243099553	/nfs/dbraw/zinc/09/95/53/243099553.db2.gz	ZXGPHADSLBDYNB-INDMIFKZSA-N	-1	0	336.387	3.614	50	0		EHAARM
Cc1noc(C)c1[C@H](C)NC(=O)c1c([O-])cc(Cl)cc1Cl	ZINC000080028099	217273401	/nfs/dbraw/zinc/27/34/01/217273401.db2.gz	ZARHJBBMKLEUBN-LURJTMIESA-N	-1	0	329.183	3.795	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])nn2-c2ccc(Cl)cc2)cc1	ZINC000011801842	211248882	/nfs/dbraw/zinc/24/88/82/211248882.db2.gz	KMMGLWQVCGJRTC-UHFFFAOYSA-N	-1	0	328.755	3.900	50	0		EHAARM
COc1ccccc1-c1cc(=O)n2[n-]c(C)c(-c3ccc(F)cc3)c2n1	ZINC000010338585	211165665	/nfs/dbraw/zinc/16/56/65/211165665.db2.gz	UAJURRVIQIKILZ-UHFFFAOYSA-N	-1	0	349.365	3.813	50	0		EHAARM
Cc1cc(C(=O)N2CCC[C@@H](c3ccc(C(=O)[O-])cc3)C2)c(C)o1	ZINC000095354480	218288358	/nfs/dbraw/zinc/28/83/58/218288358.db2.gz	XXXDQPYUFCZHJH-MRXNPFEDSA-N	-1	0	327.380	3.614	50	0		EHAARM
COc1ccc(OC)c([C@H](C(=O)[O-])N(C)Cc2ccccc2Cl)c1	ZINC000095386475	218318346	/nfs/dbraw/zinc/31/83/46/218318346.db2.gz	VPCNIPFOHYIGOH-QGZVFWFLSA-N	-1	0	349.814	3.615	50	0		EHAARM
COc1cc(C)c(S(=O)(=O)[N-]c2cccc(C)n2)cc1C(C)C	ZINC000004970554	210343270	/nfs/dbraw/zinc/34/32/70/210343270.db2.gz	ZKNFFPPNZIBUFJ-UHFFFAOYSA-N	-1	0	334.441	3.631	50	0		EHAARM
Cc1cc(C)cc(C[C@H](C(=O)Nc2ccccc2)[C@@H](C)C(=O)[O-])c1	ZINC000000037846	208554607	/nfs/dbraw/zinc/55/46/07/208554607.db2.gz	DDUJKVMTEJMQQH-QAPCUYQASA-N	-1	0	325.408	3.822	50	0		EHAARM
O=S(=O)([N-]c1ccc2c(c1)OC1(CCCC1)O2)c1cccs1	ZINC000007055642	208578569	/nfs/dbraw/zinc/57/85/69/208578569.db2.gz	RLPAJUHAQZDLFY-UHFFFAOYSA-N	-1	0	337.422	3.590	50	0		EHAARM
O=c1nc(CSc2nc3ccccc3s2)[n-]c2ccsc21	ZINC000004830219	210291288	/nfs/dbraw/zinc/29/12/88/210291288.db2.gz	JMYYRABYNCERBW-UHFFFAOYSA-N	-1	0	331.447	3.887	50	0		EHAARM
O=C(c1cc(F)c(F)c([O-])c1F)N1CC[C@H](c2ccc(F)cc2)C1	ZINC000328587480	258046025	/nfs/dbraw/zinc/04/60/25/258046025.db2.gz	ZRAIZOSYAYOPJW-JTQLQIEISA-N	-1	0	339.288	3.578	50	0		EHAARM
CCn1c(-c2ccccc2F)nc2cc(C(=O)[O-])cc(NC(C)=O)c21	ZINC000299770439	258083819	/nfs/dbraw/zinc/08/38/19/258083819.db2.gz	SJVKNLZZJRRPPZ-UHFFFAOYSA-N	-1	0	341.342	3.519	50	0		EHAARM
CC[C@@H](CNC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002540511	258049918	/nfs/dbraw/zinc/04/99/18/258049918.db2.gz	UIMPTCRXHVBHOO-ZDUSSCGKSA-N	-1	0	339.391	3.636	50	0		EHAARM
Cc1nc([N-]c2ncc3c(n2)CC(C)(C)CC3=O)nc2ccccc12	ZINC000000105997	563227666	/nfs/dbraw/zinc/22/76/66/563227666.db2.gz	UDXFOOONNVDCCG-UHFFFAOYSA-N	-1	0	333.395	3.627	50	0		EHAARM
O=C(O)c1c[n-]c2c(sc(C(F)(F)F)c2-c2ccccc2)c1=O	ZINC000000108972	563229048	/nfs/dbraw/zinc/22/90/48/563229048.db2.gz	OSOGPOOGYHPMNL-UHFFFAOYSA-N	-1	0	339.294	3.974	50	0		EHAARM
O=C([O-])[C@@H]1Cc2c3ccccc3[nH]c2[C@H](c2ccccc2Cl)N1	ZINC000000188042	563255509	/nfs/dbraw/zinc/25/55/09/563255509.db2.gz	JNLXAXOXLWSEML-HOTGVXAUSA-N	-1	0	326.783	3.510	50	0	biogenic	EHAARM
CCc1ccc2nc([N-]c3ncc4c(n3)CCCC4=O)nc(C)c2c1	ZINC000000200146	563258703	/nfs/dbraw/zinc/25/87/03/563258703.db2.gz	TYKGDFHXJNSOER-UHFFFAOYSA-N	-1	0	333.395	3.553	50	0		EHAARM
CCc1ccc(CC)c(S(=O)(=O)[N-]c2cc(C)ccc2OC)c1	ZINC000000616499	563358462	/nfs/dbraw/zinc/35/84/62/563358462.db2.gz	RGSDNVMGJFSHHQ-UHFFFAOYSA-N	-1	0	333.453	3.929	50	0		EHAARM
CCc1ccc([C@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)o1	ZINC000071910694	563576383	/nfs/dbraw/zinc/57/63/83/563576383.db2.gz	WWWKQCZHWKOUEQ-CYBMUJFWSA-N	-1	0	329.425	3.889	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2cc(C)c(Cl)cc2Cl)n1	ZINC000012552656	563662705	/nfs/dbraw/zinc/66/27/05/563662705.db2.gz	HRSPXIIMLMOJIQ-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CCCCOc1cc(S(=O)(=O)[N-]c2ccccn2)ccc1Cl	ZINC000016649834	563818936	/nfs/dbraw/zinc/81/89/36/563818936.db2.gz	WHDHPUBRXGHHSC-UHFFFAOYSA-N	-1	0	340.832	3.715	50	0		EHAARM
COc1cccc([C@@H]2CCCN2Cc2nc(=O)c3sccc3[n-]2)c1	ZINC000058180099	563939201	/nfs/dbraw/zinc/93/92/01/563939201.db2.gz	MPVCPNSRRNYYRZ-HNNXBMFYSA-N	-1	0	341.436	3.743	50	0		EHAARM
O=C([O-])c1ccc(C[C@H]2CCCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000072160896	563966301	/nfs/dbraw/zinc/96/63/01/563966301.db2.gz	VUHMFWGTLKFMCQ-MRXNPFEDSA-N	-1	0	338.407	3.871	50	0		EHAARM
CC[C@@](C)(NC(=O)CCc1ccc(C(=O)[O-])cc1)c1nc(C)cs1	ZINC000097017788	563966789	/nfs/dbraw/zinc/96/67/89/563966789.db2.gz	MYACYYUJVAKAIU-GOSISDBHSA-N	-1	0	346.452	3.524	50	0		EHAARM
CCOc1ccc(-c2ccnc(NC3CCCC3)n2)cc1C(=O)[O-]	ZINC000077472037	563969946	/nfs/dbraw/zinc/96/99/46/563969946.db2.gz	BGMHWJYEYRSIKP-UHFFFAOYSA-N	-1	0	327.384	3.595	50	0		EHAARM
Cc1cc2cc(C(=O)N3CCc4ccccc4[C@@H]3CC(=O)[O-])ccc2o1	ZINC000095505428	563977130	/nfs/dbraw/zinc/97/71/30/563977130.db2.gz	WUKGQPVZWZSNCB-SFHVURJKSA-N	-1	0	349.386	3.956	50	0		EHAARM
CCOc1ccc(NC(=O)[C@H](CC(=O)[O-])[C@H](C)c2ccccc2)cc1	ZINC000000231648	563989069	/nfs/dbraw/zinc/98/90/69/563989069.db2.gz	VZJPWEDEZGGGAM-RDTXWAMCSA-N	-1	0	341.407	3.918	50	0		EHAARM
C[C@@H](CC(=O)N1CC[C@@](C)(C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237338760	563991925	/nfs/dbraw/zinc/99/19/25/563991925.db2.gz	LKJAXSMXGVKMGF-MEDUHNTESA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])CCCc1nc2ccccc2c2nc(C3CCCCC3)nn21	ZINC000408525815	563993306	/nfs/dbraw/zinc/99/33/06/563993306.db2.gz	OMARIXYMDIBWOB-UHFFFAOYSA-N	-1	0	338.411	3.733	50	0		EHAARM
O=C([O-])C[C@H](CC(=O)NCc1ccc(Cl)cc1)c1ccccc1	ZINC000145943263	563994967	/nfs/dbraw/zinc/99/49/67/563994967.db2.gz	LZTCVBOTFNGCPQ-HNNXBMFYSA-N	-1	0	331.799	3.605	50	0		EHAARM
C[C@@](CC(=O)Nc1ccc(F)c(Cl)c1)(C(=O)[O-])c1ccccc1	ZINC000013252608	564019670	/nfs/dbraw/zinc/01/96/70/564019670.db2.gz	SWDWOJWJBDYSLL-KRWDZBQOSA-N	-1	0	335.762	3.850	50	0		EHAARM
CCc1cccc(C)c1NC(=O)C[C@@](C)(C(=O)[O-])c1ccccc1	ZINC000013466780	564020033	/nfs/dbraw/zinc/02/00/33/564020033.db2.gz	GZWIRHZNZMYROV-HXUWFJFHSA-N	-1	0	325.408	3.929	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@@H](CCc2ccccc2)[C@H]1C(=O)[O-]	ZINC000221036046	564036062	/nfs/dbraw/zinc/03/60/62/564036062.db2.gz	PRZZNHCYHUYMIC-HOTGVXAUSA-N	-1	0	333.428	3.720	50	0		EHAARM
C[C@@H]1CCN(C(=O)Cc2ccc(C(=O)[O-])cc2)[C@H](c2ccco2)C1	ZINC000263334705	564056282	/nfs/dbraw/zinc/05/62/82/564056282.db2.gz	NCFVGDHRGNCBRK-CJNGLKHVSA-N	-1	0	327.380	3.520	50	0		EHAARM
Cc1ccc(NC(=O)[C@H](SCC(=O)[O-])c2ccccc2)cc1C	ZINC000001402888	564065101	/nfs/dbraw/zinc/06/51/01/564065101.db2.gz	RTSNGAJLQKAACD-QGZVFWFLSA-N	-1	0	329.421	3.801	50	0		EHAARM
CC(C)(C)OC(=O)NC[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)[O-]	ZINC000002505665	564065640	/nfs/dbraw/zinc/06/56/40/564065640.db2.gz	YBONWVFBNGRRHI-JTQLQIEISA-N	-1	0	348.226	3.761	50	0		EHAARM
O=S(=O)([N-]c1ccc2c[nH]nc2c1)c1cc(Cl)ccc1Cl	ZINC000001427085	564066803	/nfs/dbraw/zinc/06/68/03/564066803.db2.gz	MWPMLEHIISUOFB-UHFFFAOYSA-N	-1	0	342.207	3.671	50	0		EHAARM
CC[C@H](C)c1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000007053736	564070829	/nfs/dbraw/zinc/07/08/29/564070829.db2.gz	GHEZAYNWZVGJCG-LBPRGKRZSA-N	-1	0	333.409	3.699	50	0		EHAARM
O=C([O-])c1ccc(N2CCC[C@H](c3n[nH]cc3-c3ccccc3)C2)nc1	ZINC000067895090	564075011	/nfs/dbraw/zinc/07/50/11/564075011.db2.gz	FXNJGWGHXINWEE-INIZCTEOSA-N	-1	0	348.406	3.554	50	0		EHAARM
Cc1cccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)c1C	ZINC000063808954	564077225	/nfs/dbraw/zinc/07/72/25/564077225.db2.gz	FKRUKZGFLHPXGE-UHFFFAOYSA-N	-1	0	325.393	3.867	50	0		EHAARM
COc1ccc2c(CSc3ccccc3C(=O)[O-])cc(=O)oc2c1	ZINC000012930936	564078765	/nfs/dbraw/zinc/07/87/65/564078765.db2.gz	YRLIKDBAIAIKSU-UHFFFAOYSA-N	-1	0	342.372	3.792	50	0		EHAARM
O=C([O-])C[C@H](CC(=O)N(Cc1ccsc1)C1CC1)c1cccs1	ZINC000090607334	564086281	/nfs/dbraw/zinc/08/62/81/564086281.db2.gz	JNVIZEVLVAFJLG-ZDUSSCGKSA-N	-1	0	349.477	3.949	50	0		EHAARM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3cc(C)ccc3C)c(C)o2)n[nH]1	ZINC000075519119	564087631	/nfs/dbraw/zinc/08/76/31/564087631.db2.gz	NEWODDMAKJZYHB-UHFFFAOYSA-N	-1	0	345.424	3.704	50	0		EHAARM
Cc1c(C(=O)Nc2cc(C(F)(F)F)ccc2O)cnn1C(C)C	ZINC000092551773	564089053	/nfs/dbraw/zinc/08/90/53/564089053.db2.gz	PQGSJJRTCFQMFM-UHFFFAOYSA-N	-1	0	327.306	3.749	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@@H](C(=O)[O-])[C@H](C)CC)n1	ZINC000006555996	564092005	/nfs/dbraw/zinc/09/20/05/564092005.db2.gz	QULZSYPFJAEODG-QMTHXVAHSA-N	-1	0	327.384	3.850	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(-c3onc(C)c3C)o2)cc1	ZINC000064958528	564098525	/nfs/dbraw/zinc/09/85/25/564098525.db2.gz	GERKCMVKENYSMB-UHFFFAOYSA-N	-1	0	346.408	3.915	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)c(C)c3)o2)c1C	ZINC000064958559	564098532	/nfs/dbraw/zinc/09/85/32/564098532.db2.gz	FREKNXFXJCKTNE-UHFFFAOYSA-N	-1	0	346.408	3.969	50	0		EHAARM
O=C([O-])c1ccc(Nc2c(-c3ccccc3O)nc3cnccn32)cc1	ZINC000065322754	564105263	/nfs/dbraw/zinc/10/52/63/564105263.db2.gz	WPLKMXMGKMECNZ-UHFFFAOYSA-N	-1	0	346.346	3.544	50	0		EHAARM
O=C(Nc1ccc(Cl)c(F)c1)c1nc[n-]c1C(=O)c1ccccc1	ZINC000170600655	564109310	/nfs/dbraw/zinc/10/93/10/564109310.db2.gz	RXBVRIYJFPRTQY-UHFFFAOYSA-N	-1	0	343.745	3.686	50	0		EHAARM
CN1C(=O)[C@@H]2CCCC[C@]2(C(=O)[O-])[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000252590573	564120839	/nfs/dbraw/zinc/12/08/39/564120839.db2.gz	ATIVYQLDEAUSKI-WOSRLPQWSA-N	-1	0	342.222	3.768	50	0		EHAARM
CCSC(=S)N1[C@@H](C(=O)[O-])CS[C@H]1c1ccc(C)cc1	ZINC000002336932	564132391	/nfs/dbraw/zinc/13/23/91/564132391.db2.gz	RJKSJDQJAMUIJW-NEPJUHHUSA-N	-1	0	327.496	3.534	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000225457346	564134944	/nfs/dbraw/zinc/13/49/44/564134944.db2.gz	ICILTTWIPMCECT-UONOGXRCSA-N	-1	0	343.345	3.555	50	0		EHAARM
CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)OC)cc1	ZINC000012536247	564135284	/nfs/dbraw/zinc/13/52/84/564135284.db2.gz	VCMCLWXCKDGLFX-CYBMUJFWSA-N	-1	0	347.436	3.788	50	0		EHAARM
CC[C@@H](C)[C@@H](NC(=O)c1cc(F)c(F)c([O-])c1F)C(F)(F)F	ZINC000278223731	564138277	/nfs/dbraw/zinc/13/82/77/564138277.db2.gz	UQXHEBFDAIOSLM-BLTYZCFWSA-N	-1	0	329.240	3.516	50	0		EHAARM
Cc1noc(C2CC2)c1NC(=O)Nc1cccc(CCC(=O)[O-])c1	ZINC000263035862	564159418	/nfs/dbraw/zinc/15/94/18/564159418.db2.gz	LAZVWNJKXPTGKU-UHFFFAOYSA-N	-1	0	329.356	3.522	50	0		EHAARM
CC(C)(C)c1nc2cc([N-]S(=O)(=O)c3cccs3)ccc2o1	ZINC000032097435	564160756	/nfs/dbraw/zinc/16/07/56/564160756.db2.gz	WGZQFFVFQIAFEQ-UHFFFAOYSA-N	-1	0	336.438	3.988	50	0		EHAARM
CCn1c(CNC(=O)Nc2ccc(Cl)c(Cl)c2)n[nH]c1=S	ZINC000069982514	564173118	/nfs/dbraw/zinc/17/31/18/564173118.db2.gz	GLLRPQPMPQMTMV-UHFFFAOYSA-N	-1	0	346.243	3.589	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)NC2(c3cccc(Cl)c3)CC2)cc1	ZINC000238064577	600693091	/nfs/dbraw/zinc/69/30/91/600693091.db2.gz	MSHNSAQWMUNJIZ-UHFFFAOYSA-N	-1	0	343.810	3.776	50	0		EHAARM
O=C([O-])[C@H](C(=O)Nc1ccc(-c2nccs2)cc1)C1CCCC1	ZINC000663031432	939850525	/nfs/dbraw/zinc/85/05/25/939850525.db2.gz	WIYKMOONHHSSEW-AWEZNQCLSA-N	-1	0	330.409	3.640	50	0		EHAARM
CCc1sc(C(=O)N2CC[C@H](C(=O)[O-])c3ccccc32)cc1C	ZINC000322412616	970885044	/nfs/dbraw/zinc/88/50/44/970885044.db2.gz	ZQTJPUOAJLANMD-ZDUSSCGKSA-N	-1	0	329.421	3.838	50	0		EHAARM
O=C([O-])[C@H]1CCCN1C(=O)c1sc2cc(Cl)ccc2c1Cl	ZINC000037410288	957279499	/nfs/dbraw/zinc/27/94/99/957279499.db2.gz	PQDZWLRPVCFJBR-SECBINFHSA-N	-1	0	344.219	3.897	50	0		EHAARM
O=C([O-])c1cc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cs1	ZINC000170657001	1033402300	/nfs/dbraw/zinc/40/23/00/1033402300.db2.gz	USLSQAVUJCQSKW-OWOJBTEDSA-N	-1	0	342.401	3.861	50	0		EHAARM
Cc1[n-]n(-c2cccc(C(F)(F)F)c2)c(=O)c1N=Nc1ccccc1	ZINC000254759443	1120923416	/nfs/dbraw/zinc/92/34/16/1120923416.db2.gz	QDCYXOAEOBGIMR-UHFFFAOYSA-N	-1	0	346.312	3.896	50	0		EHAARM
CC(=O)Nc1c(C)ccc(NC(=O)CC2(C(=O)[O-])CCCCC2)c1C	ZINC000055151209	214279171	/nfs/dbraw/zinc/27/91/71/214279171.db2.gz	GZSMCSURKQGVBI-UHFFFAOYSA-N	-1	0	346.427	3.626	50	0		EHAARM
C[C@@H](CC(=O)[O-])CC(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000004691213	210248931	/nfs/dbraw/zinc/24/89/31/210248931.db2.gz	GZBJSQGSPLUVTF-CQSZACIVSA-N	-1	0	327.380	3.705	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000004652570	210238990	/nfs/dbraw/zinc/23/89/90/210238990.db2.gz	LTDGNQBCXLPCMP-QWRGUYRKSA-N	-1	0	330.211	3.501	50	0		EHAARM
CC(C)c1ccc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)cc1	ZINC000049409486	214006273	/nfs/dbraw/zinc/00/62/73/214006273.db2.gz	NMKNLMAWKZLEOU-UHFFFAOYSA-N	-1	0	342.420	3.681	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC2(C[C@@H](CC(=O)[O-])c3ccccc32)CC1	ZINC000035571286	213039059	/nfs/dbraw/zinc/03/90/59/213039059.db2.gz	FARYIPWNEVTXDV-CQSZACIVSA-N	-1	0	345.439	3.917	50	0		EHAARM
Cc1nn(-c2ccc(C(=O)[O-])cc2)c2oc(=O)cc(-c3ccccc3)c12	ZINC000035191265	213014675	/nfs/dbraw/zinc/01/46/75/213014675.db2.gz	XZUXLBUTEUZDDA-UHFFFAOYSA-N	-1	0	346.342	3.652	50	0		EHAARM
COC(=O)c1occc1/C=C(\CC(=O)[O-])c1nc2ccccc2s1	ZINC000032853600	212856998	/nfs/dbraw/zinc/85/69/98/212856998.db2.gz	KSEBOYACBKYKBV-DHZHZOJOSA-N	-1	0	343.360	3.691	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cccc(COC(C)C)c1	ZINC000072265396	216087455	/nfs/dbraw/zinc/08/74/55/216087455.db2.gz	UCQMQNQDTXLNBB-UHFFFAOYSA-N	-1	0	349.452	3.729	50	0		EHAARM
O=C([O-])c1cc2n(n1)[C@@H](C(F)(F)F)C[C@@H](c1ccc(Cl)cc1)N2	ZINC000000226881	209496238	/nfs/dbraw/zinc/49/62/38/209496238.db2.gz	QJWIAWGYDPQGOS-GXSJLCMTSA-N	-1	0	345.708	3.895	50	0		EHAARM
Cc1ccc(C(C)C)c(OCC(=O)Nc2ccc(C(=O)[O-])cc2)c1	ZINC000000087986	209412731	/nfs/dbraw/zinc/41/27/31/209412731.db2.gz	XOSYEAWJNJBWIF-UHFFFAOYSA-N	-1	0	327.380	3.834	50	0	biogenic	EHAARM
Cc1oc([C@@H](CC(C)C)NC(=O)OCc2ccccc2)nc1C(=O)[O-]	ZINC000218912251	241349749	/nfs/dbraw/zinc/34/97/49/241349749.db2.gz	MULLZAJRBDDYAA-CQSZACIVSA-N	-1	0	346.383	3.695	50	0		EHAARM
COc1ccc(-c2c/c(=N\CCC(=O)[O-])c3cc(C)ccc3o2)cc1	ZINC000015953115	211872270	/nfs/dbraw/zinc/87/22/70/211872270.db2.gz	BVDICSMRGRBKKK-HEHNFIMWSA-N	-1	0	337.375	3.792	50	0		EHAARM
CC(C)OCc1ccc(C(=O)N[C@H](CC(=O)[O-])c2cccs2)cc1	ZINC000013389675	211553474	/nfs/dbraw/zinc/55/34/74/211553474.db2.gz	ISTXTHGERCCWCY-OAHLLOKOSA-N	-1	0	347.436	3.619	50	0		EHAARM
CC(=O)Oc1ccc(NC(=O)CCC2CCCCC2)c(C(=O)[O-])c1	ZINC000013111612	211523070	/nfs/dbraw/zinc/52/30/70/211523070.db2.gz	HQFKMAGLRUCAMY-UHFFFAOYSA-N	-1	0	333.384	3.609	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccccc2OC(F)(F)F)cc1	ZINC000012507965	211394498	/nfs/dbraw/zinc/39/44/98/211394498.db2.gz	WUXSTHYZOUHMNE-UHFFFAOYSA-N	-1	0	331.315	3.694	50	0		EHAARM
O=c1nc[n-]c2c1sc1nc(C(F)(F)F)cc(-c3ccco3)c12	ZINC000012395069	211368344	/nfs/dbraw/zinc/36/83/44/211368344.db2.gz	HXMIJXIJDFPALA-UHFFFAOYSA-N	-1	0	337.282	3.812	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)c2ccccc12	ZINC000012291089	211333738	/nfs/dbraw/zinc/33/37/38/211333738.db2.gz	MSGRCXQYCFUILC-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
Cc1c(C(=O)Nc2ccccc2C(=O)[O-])oc2c1C(=O)CC(C)(C)C2	ZINC000009576777	211103490	/nfs/dbraw/zinc/10/34/90/211103490.db2.gz	HGKYVFJHOQIUKV-UHFFFAOYSA-N	-1	0	341.363	3.694	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3)s2)n[nH]1	ZINC000009686589	211113401	/nfs/dbraw/zinc/11/34/01/211113401.db2.gz	DHLMROHFSIELME-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)cc1	ZINC000095377049	218310325	/nfs/dbraw/zinc/31/03/25/218310325.db2.gz	RXSRTJKEBBWJOA-SFHVURJKSA-N	-1	0	348.402	3.886	50	0		EHAARM
O=c1[n-]c(Nc2cccc(C(F)(F)F)c2)nnc1Cc1ccccc1	ZINC000008741175	210996966	/nfs/dbraw/zinc/99/69/66/210996966.db2.gz	AQBKBVVZLMBDLY-UHFFFAOYSA-N	-1	0	346.312	3.930	50	0		EHAARM
C[C@H](C(=O)N1CCC[C@@H](CCC(=O)[O-])C1)c1cc2ccccc2o1	ZINC000097039521	218925756	/nfs/dbraw/zinc/92/57/56/218925756.db2.gz	XHEYQPURYRSSIK-KBPBESRZSA-N	-1	0	329.396	3.640	50	0		EHAARM
CC(C)OC(=O)[C@@H]1C2c3ccccc3C(c3ccccc32)[C@H]1C(=O)[O-]	ZINC000005002939	210357225	/nfs/dbraw/zinc/35/72/25/210357225.db2.gz	OSMMTMKDUSZPCL-CSODTCANSA-N	-1	0	336.387	3.546	50	0		EHAARM
Cc1ccc2[nH]c(C(=O)[O-])c(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)c2c1	ZINC000004871921	210309632	/nfs/dbraw/zinc/30/96/32/210309632.db2.gz	RRXODWMCQDDHKD-ZIAGYGMSSA-N	-1	0	334.375	3.917	50	0		EHAARM
COc1c(Cl)c(Cl)ccc1S(=O)(=O)[N-]c1cccc(C)n1	ZINC000006139061	258051750	/nfs/dbraw/zinc/05/17/50/258051750.db2.gz	SWWJOIQYGZNAFP-UHFFFAOYSA-N	-1	0	347.223	3.506	50	0		EHAARM
CCOc1ccc([N-]S(=O)(=O)c2ccccc2C(F)(F)F)cc1	ZINC000000074688	563216597	/nfs/dbraw/zinc/21/65/97/563216597.db2.gz	KVXOLAWXQSXRSW-UHFFFAOYSA-N	-1	0	345.342	3.905	50	0		EHAARM
Cc1cccc(OCCSc2nc3ccccc3n2CC(=O)[O-])c1	ZINC000002051954	563419618	/nfs/dbraw/zinc/41/96/18/563419618.db2.gz	RVCGIIJRZYPCIK-UHFFFAOYSA-N	-1	0	342.420	3.600	50	0		EHAARM
COc1ccc(Br)cc1CNc1ccccc1C(=O)[O-]	ZINC000002199884	563426625	/nfs/dbraw/zinc/42/66/25/563426625.db2.gz	NAHQQFSTRFRTDE-UHFFFAOYSA-N	-1	0	336.185	3.768	50	0		EHAARM
C[C@@H](C[NH2+][C@H](c1cccc(Cl)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997526	563683771	/nfs/dbraw/zinc/68/37/71/563683771.db2.gz	ASGIEMFZUXVBFN-LRDDRELGSA-N	-1	0	339.759	3.910	50	0		EHAARM
O=C([O-])c1cccc(N2N=C(c3ccc(Cl)s3)CCC2=O)c1	ZINC000013060449	563686816	/nfs/dbraw/zinc/68/68/16/563686816.db2.gz	RUSJYZXHKPQXRB-UHFFFAOYSA-N	-1	0	334.784	3.631	50	0		EHAARM
CC(C)c1cc(=O)n2nc(SCc3ccccc3Cl)[n-]c2n1	ZINC000018029796	563847491	/nfs/dbraw/zinc/84/74/91/563847491.db2.gz	MLVWDYOPYDOTPT-UHFFFAOYSA-N	-1	0	334.832	3.899	50	0		EHAARM
Nc1ccccc1-c1nnc(SCc2ccc(Cl)cc2)[n-]c1=O	ZINC000018099294	563848763	/nfs/dbraw/zinc/84/87/63/563848763.db2.gz	RTQSHOXJYRXVCK-UHFFFAOYSA-N	-1	0	344.827	3.772	50	0		EHAARM
Cc1cc(NC(=O)c2ccc([O-])c(Cl)c2)ccc1N1CCCC1=O	ZINC000024980143	563878929	/nfs/dbraw/zinc/87/89/29/563878929.db2.gz	UARXHVJJLCFMGY-UHFFFAOYSA-N	-1	0	344.798	3.733	50	0		EHAARM
Cc1ccccc1Cn1c2ccccc2nc1N1CCC(C(=O)[O-])CC1	ZINC000032917008	563914479	/nfs/dbraw/zinc/91/44/79/563914479.db2.gz	UFEROWMJPLPBKU-UHFFFAOYSA-N	-1	0	349.434	3.694	50	0		EHAARM
Cc1cc(C)c2c(n1)SCCN2C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000032918811	563914503	/nfs/dbraw/zinc/91/45/03/563914503.db2.gz	WMNDLWIKXKXNEH-UHFFFAOYSA-N	-1	0	343.408	3.541	50	0		EHAARM
Cc1csc([N-]S(=O)(=O)c2ccc(-c3ccccc3)cc2)n1	ZINC000001205260	563917831	/nfs/dbraw/zinc/91/78/31/563917831.db2.gz	JNYWPHOPAPMAAO-UHFFFAOYSA-N	-1	0	330.434	3.919	50	0		EHAARM
CC(C)n1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)[O-])c2ccccc21	ZINC000044318733	563930651	/nfs/dbraw/zinc/93/06/51/563930651.db2.gz	CRVWRCNVIFAHHL-HNNXBMFYSA-N	-1	0	346.427	3.743	50	0		EHAARM
Cc1[nH]nc(-c2ccc(S(=O)(=O)[N-]c3cc(C)ccc3C)o2)c1C	ZINC000033262027	563966320	/nfs/dbraw/zinc/96/63/20/563966320.db2.gz	LNSBIYGIPQBOCQ-UHFFFAOYSA-N	-1	0	345.424	3.704	50	0		EHAARM
CC(C)[C@H](NC(=O)CC1(C(=O)[O-])CCCCCC1)c1ccncc1	ZINC000072998264	563982205	/nfs/dbraw/zinc/98/22/05/563982205.db2.gz	BWMVMVRZBRHKBU-KRWDZBQOSA-N	-1	0	332.444	3.710	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccccc1Cc1ccccc1	ZINC000013021893	564019353	/nfs/dbraw/zinc/01/93/53/564019353.db2.gz	IOPXNQZIJDIBRJ-MSOLQXFVSA-N	-1	0	335.403	3.883	50	0		EHAARM
CSc1nc2ccc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])cc2s1	ZINC000013249562	564019639	/nfs/dbraw/zinc/01/96/39/564019639.db2.gz	DBLDZZWBSRXRGV-QWRGUYRKSA-N	-1	0	348.449	3.624	50	0		EHAARM
COc1ccc(NC(=O)C[C@@H](C(=O)[O-])[C@H](C)c2ccccc2)cc1	ZINC000000535121	564022072	/nfs/dbraw/zinc/02/20/72/564022072.db2.gz	ZJYVULGZOQUTOO-CXAGYDPISA-N	-1	0	327.380	3.528	50	0		EHAARM
Cc1ccsc1/C=C1/C(=O)N(c2cccc(C(=O)[O-])c2)N=C1C	ZINC000000268854	564024428	/nfs/dbraw/zinc/02/44/28/564024428.db2.gz	KIYPIXAPZMJUQM-NTEUORMPSA-N	-1	0	326.377	3.561	50	0		EHAARM
C[C@@H]([C@@H]1CCCO1)n1c(=O)c2c([n-]c1=S)sc1c2CCCC1	ZINC000017070772	564024841	/nfs/dbraw/zinc/02/48/41/564024841.db2.gz	YSISXRAGZZJPCJ-ONGXEEELSA-N	-1	0	336.482	3.739	50	0		EHAARM
O=C([O-])CC1(NC(=O)c2cccc(-c3ccco3)c2)CCCCC1	ZINC000219816445	564035434	/nfs/dbraw/zinc/03/54/34/564035434.db2.gz	QTEBZXPRDDEABD-UHFFFAOYSA-N	-1	0	327.380	3.854	50	0		EHAARM
Cc1[nH]nc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)c(C)c3)o2)c1C	ZINC000033262030	564036651	/nfs/dbraw/zinc/03/66/51/564036651.db2.gz	JFCHSZWBUCTATQ-UHFFFAOYSA-N	-1	0	345.424	3.704	50	0		EHAARM
Cc1ccc(/C=C2\C(=O)N(c3ccc(C(=O)[O-])cc3)N=C2C)s1	ZINC000022108304	564052201	/nfs/dbraw/zinc/05/22/01/564052201.db2.gz	IREVKIOSUUKWCR-DHDCSXOGSA-N	-1	0	326.377	3.561	50	0		EHAARM
CCc1ccc(NC(=O)N2CCc3ccccc3[C@H]2CC(=O)[O-])cc1	ZINC000015782052	564074159	/nfs/dbraw/zinc/07/41/59/564074159.db2.gz	JYYUNPKVUFQFPY-GOSISDBHSA-N	-1	0	338.407	3.855	50	0		EHAARM
O=C([O-])c1ccc(N2CCCC2)c(NC(=O)c2ccc(Cl)cc2)c1	ZINC000064820345	564096583	/nfs/dbraw/zinc/09/65/83/564096583.db2.gz	UXVOUYRCPVFTMO-UHFFFAOYSA-N	-1	0	344.798	3.891	50	0		EHAARM
CCCCN(C)c1ccc(C(=O)[O-])cc1NC(=O)c1ccccc1	ZINC000064820591	564096595	/nfs/dbraw/zinc/09/65/95/564096595.db2.gz	YYSJYPOFKZWIGP-UHFFFAOYSA-N	-1	0	326.396	3.873	50	0		EHAARM
Cc1cc(Cl)ccc1NC(=O)c1c([O-])c2sccc2n(C)c1=O	ZINC000065215386	564102845	/nfs/dbraw/zinc/10/28/45/564102845.db2.gz	VCOLGESNMLBSHC-UHFFFAOYSA-N	-1	0	348.811	3.520	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(-c3nnc(C(C)C)o3)o2)c1	ZINC000065246282	564103355	/nfs/dbraw/zinc/10/33/55/564103355.db2.gz	JTNBRNCPVHUOCF-UHFFFAOYSA-N	-1	0	347.396	3.562	50	0		EHAARM
CCCCn1cc(S(=O)(=O)[N-]c2ccc(C)cc2)c2cccnc21	ZINC000065242323	564103419	/nfs/dbraw/zinc/10/34/19/564103419.db2.gz	WJGWRTWKPAGQJF-UHFFFAOYSA-N	-1	0	343.452	3.946	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2cn(CC(C)C)c3ncccc23)c1	ZINC000065242286	564103423	/nfs/dbraw/zinc/10/34/23/564103423.db2.gz	GYDYDTXVNXDYBH-UHFFFAOYSA-N	-1	0	343.452	3.802	50	0		EHAARM
O=C([O-])c1ccc(Nc2c(-c3ccccc3)nc3cnccn32)cc1	ZINC000065322760	564105256	/nfs/dbraw/zinc/10/52/56/564105256.db2.gz	YLBJWVAGVSLAMC-UHFFFAOYSA-N	-1	0	330.347	3.838	50	0		EHAARM
C[C@@H]1C[C@H]1c1ccc(CN(C(=O)C2CCC(C(=O)[O-])CC2)C2CC2)o1	ZINC000194390498	564120496	/nfs/dbraw/zinc/12/04/96/564120496.db2.gz	VXHKUKXJZFXOAH-QROZZAMVSA-N	-1	0	345.439	3.785	50	0		EHAARM
C[C@H](CC(=O)N1CCC[C@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000096479546	564148576	/nfs/dbraw/zinc/14/85/76/564148576.db2.gz	DKGQWQJBIAJJCW-YPMHNXCESA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1ncc(-c2ccc(F)cc2)o1	ZINC000299743279	564150514	/nfs/dbraw/zinc/15/05/14/564150514.db2.gz	MWHSQLHZWGXSFM-KBMXLJTQSA-N	-1	0	344.386	3.698	50	0		EHAARM
CCC(=O)N1[C@H](C(=O)[O-])Cc2c3ccccc3[nH]c2[C@@H]1CC(C)C	ZINC000003147371	564155494	/nfs/dbraw/zinc/15/54/94/564155494.db2.gz	FVEKIDYDEYCOKO-HOTGVXAUSA-N	-1	0	328.412	3.503	50	0		EHAARM
O=C([O-])[C@@H]1CCCN(c2ncnc3scc(-c4ccccc4)c32)C1	ZINC000003391611	564157850	/nfs/dbraw/zinc/15/78/50/564157850.db2.gz	OBEBZEFOZOHARH-CYBMUJFWSA-N	-1	0	339.420	3.659	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc2oc(C(C)(C)C)nc2c1	ZINC000032097492	564160754	/nfs/dbraw/zinc/16/07/54/564160754.db2.gz	KAIMNFDVZPTURO-UHFFFAOYSA-N	-1	0	349.412	3.531	50	0		EHAARM
O=C([O-])C1CCC(Nc2cc(F)ccc2OCC(F)(F)F)CC1	ZINC000263454590	564162228	/nfs/dbraw/zinc/16/22/28/564162228.db2.gz	HATBFSCVUNSRPA-UHFFFAOYSA-N	-1	0	335.297	3.822	50	0		EHAARM
COc1cc([N+](=O)[O-])cc(/C=C2/Sc3ccccc3C2=O)c1[O-]	ZINC000033303261	564177469	/nfs/dbraw/zinc/17/74/69/564177469.db2.gz	URFXSYJLFDDPRT-VGOFMYFVSA-N	-1	0	329.333	3.639	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(Cc2cccc(F)c2)C2CCCC2)nc1	ZINC000642211170	600070691	/nfs/dbraw/zinc/07/06/91/600070691.db2.gz	FRHFBVZQHVNWBG-UHFFFAOYSA-N	-1	0	342.370	3.504	50	0		EHAARM
Cc1c2cc(F)ccc2oc1C(=O)N1CCCC[C@@H]1CCC(=O)[O-]	ZINC000261777573	950049616	/nfs/dbraw/zinc/04/96/16/950049616.db2.gz	XMZOLLCUEIXIAM-CYBMUJFWSA-N	-1	0	333.359	3.740	50	0		EHAARM
C[C@@H]1C[C@@H]1c1ccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)[O-])cc2)o1	ZINC000170595358	1033286617	/nfs/dbraw/zinc/28/66/17/1033286617.db2.gz	QBPSNAIFROBBJO-FVIVFAEASA-N	-1	0	336.347	3.647	50	0		EHAARM
CC(C)(C)OC(=O)Nc1c(F)cc(Br)cc1C(=O)[O-]	ZINC000146987905	1039913691	/nfs/dbraw/zinc/91/36/91/1039913691.db2.gz	XRELQOFFBFWKEM-UHFFFAOYSA-N	-1	0	334.141	3.633	50	0		EHAARM
O=C([O-])c1ccc2nc(/C=C\c3ccnn3C3CCOCC3)ccc2c1	ZINC000888100524	1043269164	/nfs/dbraw/zinc/26/91/64/1043269164.db2.gz	BILCSASOVKTDFJ-PLNGDYQASA-N	-1	0	349.390	3.651	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000004523505	210213819	/nfs/dbraw/zinc/21/38/19/210213819.db2.gz	XMJBBSPXYYWVOW-ZJUUUORDSA-N	-1	0	347.720	3.964	50	0		EHAARM
Cc1ccc(C)c(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c1	ZINC000100613757	219102974	/nfs/dbraw/zinc/10/29/74/219102974.db2.gz	MARDNKHYMIHOJI-UHFFFAOYSA-N	-1	0	348.402	3.522	50	0		EHAARM
CCOC(=O)c1sc([N-]c2nc3c(cccc3OC)s2)nc1C	ZINC000004102001	210120167	/nfs/dbraw/zinc/12/01/67/210120167.db2.gz	KBAYCBZZPYXSES-UHFFFAOYSA-N	-1	0	349.437	3.990	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1ccc(C(F)(F)F)cc1	ZINC000002575656	209870339	/nfs/dbraw/zinc/87/03/39/209870339.db2.gz	UKFKHDUXBBWVHB-LBPRGKRZSA-N	-1	0	347.333	3.616	50	0		EHAARM
Cc1c(NC(=O)COc2ccc(C(C)C)cc2)cccc1C(=O)[O-]	ZINC000001164459	209714149	/nfs/dbraw/zinc/71/41/49/209714149.db2.gz	FKBQRIGXFFMKNO-UHFFFAOYSA-N	-1	0	327.380	3.834	50	0		EHAARM
Cc1nnc(S[C@@H](C(=O)[O-])c2ccccc2)n1Cc1ccccc1	ZINC000036646402	213107710	/nfs/dbraw/zinc/10/77/10/213107710.db2.gz	ILXDTAJERRCAOM-MRXNPFEDSA-N	-1	0	339.420	3.553	50	0		EHAARM
Cc1ccc(-c2cc(C(=O)[N-]c3nnc(C4CC4)s3)on2)cc1	ZINC000036391365	213095098	/nfs/dbraw/zinc/09/50/98/213095098.db2.gz	DIDVWPMHZKJTRU-UHFFFAOYSA-N	-1	0	326.381	3.631	50	0		EHAARM
CC1=Nc2c(c(=O)[nH]n2C(C)C)[C@H](c2ccc(C(=O)[O-])cc2)S1	ZINC000071286116	215754165	/nfs/dbraw/zinc/75/41/65/215754165.db2.gz	DDWOQNJYOGHMSW-ZDUSSCGKSA-N	-1	0	331.397	3.754	50	0		EHAARM
CCOc1ccc(-c2ccnc(NC3CCCCC3)n2)cc1C(=O)[O-]	ZINC000071750163	215808111	/nfs/dbraw/zinc/80/81/11/215808111.db2.gz	HIXTXDKEWVIEAV-UHFFFAOYSA-N	-1	0	341.411	3.985	50	0		EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(Cc2ccccc2)C12CCCC2	ZINC000030822671	212711127	/nfs/dbraw/zinc/71/11/27/212711127.db2.gz	MOWXAAQSBVCOGG-SFHVURJKSA-N	-1	0	335.403	3.824	50	0		EHAARM
C[C@@H]1Cc2c(nc3ccccc3c2C(=O)[O-])/C(=C/c2cnn(C)c2)C1	ZINC000021956958	212266379	/nfs/dbraw/zinc/26/63/79/212266379.db2.gz	FLVSEHUZATYUBW-IGVUGNCQSA-N	-1	0	333.391	3.789	50	0		EHAARM
Cc1ccc(C(F)(F)F)cc1C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000223667236	241677608	/nfs/dbraw/zinc/67/76/08/241677608.db2.gz	UIUWSOXKWUQZPL-GFCCVEGCSA-N	-1	0	343.345	3.731	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3)s2)on1	ZINC000020978466	212192831	/nfs/dbraw/zinc/19/28/31/212192831.db2.gz	UISKQCNVNJIGQJ-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CC[C@@H](NC(=O)c1c(C(=O)[O-])cnn1C)c1ccc([C@@H](C)CC)cc1	ZINC000020616513	212156435	/nfs/dbraw/zinc/15/64/35/212156435.db2.gz	OBQVDMOPTVHBGL-BLLLJJGKSA-N	-1	0	343.427	3.513	50	0		EHAARM
Cc1ccc([C@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1C	ZINC000020616889	212156049	/nfs/dbraw/zinc/15/60/49/212156049.db2.gz	OGLOQIHCRMSYSJ-CHWSQXEVSA-N	-1	0	339.317	3.858	50	0		EHAARM
Cc1ccccc1-c1nsc2c1[n-]c(-c1nccs1)nc2=O	ZINC000253535069	244007826	/nfs/dbraw/zinc/00/78/26/244007826.db2.gz	DJTMKFJHWJMUJT-UHFFFAOYSA-N	-1	0	326.406	3.891	50	0		EHAARM
O=C(CC1CCOCC1)Nc1cc(Cl)cc(Br)c1[O-]	ZINC000079014398	217174537	/nfs/dbraw/zinc/17/45/37/217174537.db2.gz	UQUHBIUPDZUDCJ-UHFFFAOYSA-N	-1	0	348.624	3.563	50	0		EHAARM
CCc1ccc([C@H]2C[C@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000013959107	211660426	/nfs/dbraw/zinc/66/04/26/211660426.db2.gz	GFBPCMJFMGYTKE-DGCLKSJQSA-N	-1	0	339.317	3.804	50	0		EHAARM
Cc1nn(-c2ccc(C)cc2)c(C)c1[N-]S(=O)(=O)c1cccs1	ZINC000012544879	211404895	/nfs/dbraw/zinc/40/48/95/211404895.db2.gz	IDXXUAWNORYENL-UHFFFAOYSA-N	-1	0	347.465	3.660	50	0		EHAARM
CCCOc1c(Br)cc(/C=C/C(=O)[O-])cc1OCC	ZINC000011951624	211275075	/nfs/dbraw/zinc/27/50/75/211275075.db2.gz	DNTBSHSIVPVBLF-AATRIKPKSA-N	-1	0	329.190	3.734	50	0		EHAARM
Cc1cc(N[C@@H](C)c2nnc(C(C)C)o2)nc(-c2ccccc2[O-])n1	ZINC000091391450	218001072	/nfs/dbraw/zinc/00/10/72/218001072.db2.gz	APQFPDDNJAYZJZ-LBPRGKRZSA-N	-1	0	339.399	3.837	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(-c3cc(C)[nH]n3)s2)cc1	ZINC000009686430	211113434	/nfs/dbraw/zinc/11/34/34/211113434.db2.gz	YFCWSBMRPGIBLO-UHFFFAOYSA-N	-1	0	347.465	3.810	50	0		EHAARM
Cc1c(C(=O)Nc2ccc(C(=O)[O-])cc2)oc2c1C(=O)CC(C)(C)C2	ZINC000009485304	211090560	/nfs/dbraw/zinc/09/05/60/211090560.db2.gz	LAYRPGWEIISROL-UHFFFAOYSA-N	-1	0	341.363	3.694	50	0		EHAARM
COC(=O)c1c(SCc2ccccc2F)[n-]c2ccccc2c1=O	ZINC000009300292	211063518	/nfs/dbraw/zinc/06/35/18/211063518.db2.gz	WMAUJHPZJZUNCT-UHFFFAOYSA-N	-1	0	343.379	3.746	50	0		EHAARM
COc1cc2c(cc1NC(=O)CCCC(=O)[O-])oc1ccccc12	ZINC000009058152	211035964	/nfs/dbraw/zinc/03/59/64/211035964.db2.gz	CQQUWQUUFJWPCD-UHFFFAOYSA-N	-1	0	327.336	3.788	50	0		EHAARM
CCc1cccc(OC2CN(C(=O)c3ccc([O-])c(Cl)c3)C2)c1	ZINC000095388920	218320588	/nfs/dbraw/zinc/32/05/88/218320588.db2.gz	VICGMNWBDQNJIB-UHFFFAOYSA-N	-1	0	331.799	3.511	50	0		EHAARM
C[C@@H](NC(=O)C[C@](C)(C(=O)[O-])c1ccccc1)c1ccc(F)c(F)c1	ZINC000008388754	210946097	/nfs/dbraw/zinc/94/60/97/210946097.db2.gz	MEOFPPTVRMCKOQ-BLVKFPJESA-N	-1	0	347.361	3.575	50	0		EHAARM
C[C@H](CC(=O)N1CCC[C@@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000095969523	218474661	/nfs/dbraw/zinc/47/46/61/218474661.db2.gz	GWLAJJZILZHZKA-DGCLKSJQSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])c1cc(Br)ccc1OCc1ccccc1F	ZINC000007603996	210819785	/nfs/dbraw/zinc/81/97/85/210819785.db2.gz	RCTCBRGRXDLGJJ-UHFFFAOYSA-N	-1	0	325.133	3.865	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)[C@H]1CC(C)=C(C)C[C@@H]1C(=O)[O-]	ZINC000006731395	210694410	/nfs/dbraw/zinc/69/44/10/210694410.db2.gz	GARMDYLWECVQLZ-STQMWFEESA-N	-1	0	337.803	3.734	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)cc1C(=O)[O-]	ZINC000299748166	258008180	/nfs/dbraw/zinc/00/81/80/258008180.db2.gz	GHGMAQACQYORRR-HZPDHXFCSA-N	-1	0	347.798	3.702	50	0		EHAARM
O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1ccc2[n-]c(=S)oc2c1	ZINC000124184091	222389076	/nfs/dbraw/zinc/38/90/76/222389076.db2.gz	JNZRYOMTSLRNNU-CYBMUJFWSA-N	-1	0	346.452	3.728	50	0		EHAARM
CCO[C@H]1C[C@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000132592296	528129156	/nfs/dbraw/zinc/12/91/56/528129156.db2.gz	XVSQKNWXZXUTIU-GJZGRUSLSA-N	-1	0	346.452	3.536	50	0		EHAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000007053023	564103857	/nfs/dbraw/zinc/10/38/57/564103857.db2.gz	GMHJEQQIUUQFLU-UHFFFAOYSA-N	-1	0	331.315	3.515	50	0		EHAARM
O=[P@@]([O-])(O)[C@@H](NCc1ccccc1Cl)c1ccc(F)c(F)c1	ZINC000012997550	564135821	/nfs/dbraw/zinc/13/58/21/564135821.db2.gz	WRODWCJLYXSQAB-CQSZACIVSA-N	-1	0	347.685	3.584	50	0		EHAARM
Cc1sc2ncn([C@@H](C)C(=O)[O-])c(=O)c2c1-c1ccc(Cl)cc1	ZINC000000149250	563245746	/nfs/dbraw/zinc/24/57/46/563245746.db2.gz	JXYGYEDMVZBCCR-QMMMGPOBSA-N	-1	0	348.811	3.732	50	0		EHAARM
Cc1cc2c(cc1-c1c(C)oc3cc([O-])cc(C)c3c1=O)OCCO2	ZINC000000407427	563306994	/nfs/dbraw/zinc/30/69/94/563306994.db2.gz	AOQIRLOMVFZHQL-UHFFFAOYSA-N	-1	0	338.359	3.862	50	0		EHAARM
O=C([O-])CCCCCCCCCCN1C(=O)c2ccccc2C1=O	ZINC000002575990	563442855	/nfs/dbraw/zinc/44/28/55/563442855.db2.gz	KKNSERPTIKUDGJ-UHFFFAOYSA-N	-1	0	331.412	3.878	50	0		EHAARM
CCCCc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1	ZINC000003215151	563476773	/nfs/dbraw/zinc/47/67/73/563476773.db2.gz	OTSNMUDJXINAKM-UHFFFAOYSA-N	-1	0	347.436	3.837	50	0		EHAARM
O=C([O-])c1ccccc1SCC(=O)N[C@H]1CCCc2ccccc21	ZINC000003223091	563477342	/nfs/dbraw/zinc/47/73/42/563477342.db2.gz	LVJMOIGUACVSLW-INIZCTEOSA-N	-1	0	341.432	3.671	50	0		EHAARM
Cc1nc2c3ccccc3oc2c(N[C@H](Cc2ccccc2)C(=O)[O-])n1	ZINC000006925393	563591569	/nfs/dbraw/zinc/59/15/69/563591569.db2.gz	RXYAOWWCBNEJFM-OAHLLOKOSA-N	-1	0	347.374	3.792	50	0		EHAARM
O=C([O-])CSc1nc2ccccc2nc1Cc1ccccc1F	ZINC000012731030	563669423	/nfs/dbraw/zinc/66/94/23/563669423.db2.gz	XBNOFYLEZDIRLK-UHFFFAOYSA-N	-1	0	328.368	3.536	50	0		EHAARM
COc1cc(Cl)c(C)cc1NC(=O)CC1(C(=O)[O-])CCCC1	ZINC000032739797	563720984	/nfs/dbraw/zinc/72/09/84/563720984.db2.gz	MKYPATCPSGYUBD-UHFFFAOYSA-N	-1	0	325.792	3.631	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CC(=O)Nc3sc4c(c32)CCCC4)cc1	ZINC000015107362	563777986	/nfs/dbraw/zinc/77/79/86/563777986.db2.gz	YTZPSRRECXHMIO-ZDUSSCGKSA-N	-1	0	327.405	3.799	50	0		EHAARM
Cc1oc(-c2cccs2)nc1CC(=O)[N-]OCc1ccccc1	ZINC000025039261	563879920	/nfs/dbraw/zinc/87/99/20/563879920.db2.gz	BRSWOEQQKIZFIL-UHFFFAOYSA-N	-1	0	328.393	3.502	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)N1CCS[C@H]1c1ccc(Cl)cc1	ZINC000000194555	563988071	/nfs/dbraw/zinc/98/80/71/563988071.db2.gz	WBMUDYPJDDBFRN-INIZCTEOSA-N	-1	0	347.823	3.926	50	0		EHAARM
COc1ccc([C@@H]2S[C@H](C)C(=O)N2c2cccc(C(=O)[O-])c2)cc1	ZINC000000191273	563988166	/nfs/dbraw/zinc/98/81/66/563988166.db2.gz	CDAPDEHTTWYUPC-DIFFPNOSSA-N	-1	0	343.404	3.561	50	0		EHAARM
Cc1ccccc1C[C@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)[O-]	ZINC000221032928	563989600	/nfs/dbraw/zinc/98/96/00/563989600.db2.gz	VEISDHRYJDNLDB-CVEARBPZSA-N	-1	0	333.428	3.638	50	0		EHAARM
COc1cc(/C=C\c2ccc3ccccc3n2)ccc1OCC(=O)[O-]	ZINC000033463107	563992192	/nfs/dbraw/zinc/99/21/92/563992192.db2.gz	XWQKSSWWDZIVAJ-TWGQIWQCSA-N	-1	0	335.359	3.877	50	0		EHAARM
COc1ccc(Cn2c(=O)c3ccc(Cl)cc3[n-]c2=S)cc1	ZINC000000425272	563998945	/nfs/dbraw/zinc/99/89/45/563998945.db2.gz	BGUNVKZQJYPEGD-UHFFFAOYSA-N	-1	0	332.812	3.769	50	0		EHAARM
CCOP(=O)(OCC)[C@H]([N-]C(=O)C(F)(F)F)c1ccccc1	ZINC000003213947	564004214	/nfs/dbraw/zinc/00/42/14/564004214.db2.gz	SQAKCZLJLSFTAY-NSHDSACASA-N	-1	0	339.250	3.630	50	0		EHAARM
Cc1cc(Br)ccc1NC(=O)c1ccccc1C(=O)[O-]	ZINC000000398708	564012473	/nfs/dbraw/zinc/01/24/73/564012473.db2.gz	XZZHVJZAEOYJCP-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
Cc1ccc(N=C2S[C@@H](CC(=O)[O-])C(=O)N2C2CCCCC2)cc1	ZINC000008662595	564013647	/nfs/dbraw/zinc/01/36/47/564013647.db2.gz	LSOXDQJUHUWWCK-HNNXBMFYSA-N	-1	0	346.452	3.734	50	0		EHAARM
O=C([O-])CSc1nc2cc(Cl)ccc2n1Cc1ccccc1	ZINC000169615872	564017112	/nfs/dbraw/zinc/01/71/12/564017112.db2.gz	BGTKFCTXONQEGD-UHFFFAOYSA-N	-1	0	332.812	3.915	50	0		EHAARM
CCn1c(=O)c(-c2nc(-c3cccs3)no2)c([O-])c2ccccc21	ZINC000101725402	564019546	/nfs/dbraw/zinc/01/95/46/564019546.db2.gz	GZSLGLTXNQIQAP-UHFFFAOYSA-N	-1	0	339.376	3.506	50	0		EHAARM
CSc1ccccc1NC(=O)C[C@@](C)(C(=O)[O-])c1ccccc1	ZINC000013253615	564019664	/nfs/dbraw/zinc/01/96/64/564019664.db2.gz	CKVHLTQURKNYKH-GOSISDBHSA-N	-1	0	329.421	3.780	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2ccc(C(C)C)cc2)cc1C(=O)[O-]	ZINC000013348857	564019681	/nfs/dbraw/zinc/01/96/81/564019681.db2.gz	MDZQQZDKLVKQCI-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
O=C(Nc1ccc2ccccc2c1)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102727924	564020477	/nfs/dbraw/zinc/02/04/77/564020477.db2.gz	AFSOKAGBXHHIOR-ISLYRVAYSA-N	-1	0	330.343	3.700	50	0		EHAARM
O=C(Nc1ccc(Cl)c(Cl)c1)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102728289	564020478	/nfs/dbraw/zinc/02/04/78/564020478.db2.gz	NEPBILSTCNVNBO-BUHFOSPRSA-N	-1	0	349.173	3.853	50	0		EHAARM
C[C@H]1CN(c2nc(-c3ccccc3[O-])nc3ccccc32)C[C@H](C)O1	ZINC000000554187	564023080	/nfs/dbraw/zinc/02/30/80/564023080.db2.gz	SSGBQDDFWFXNHS-KBPBESRZSA-N	-1	0	335.407	3.616	50	0		EHAARM
Cc1cc2cc(Br)cc(Br)c2nc1C(=O)[O-]	ZINC000521399434	564073678	/nfs/dbraw/zinc/07/36/78/564073678.db2.gz	HPEHPKUSDXGRFE-UHFFFAOYSA-N	-1	0	344.990	3.766	50	0		EHAARM
CSc1cccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)c1	ZINC000075518934	564087597	/nfs/dbraw/zinc/08/75/97/564087597.db2.gz	MTOVKPJCKRITSA-UHFFFAOYSA-N	-1	0	349.437	3.501	50	0		EHAARM
C[C@H](Oc1c(=O)c2ccccc2oc1-c1ccc(Cl)cc1)C(=O)[O-]	ZINC000001791345	564087693	/nfs/dbraw/zinc/08/76/93/564087693.db2.gz	VFOMTFVUBBNBBK-JTQLQIEISA-N	-1	0	344.750	3.965	50	0		EHAARM
O=C([O-])c1cc(N2CCCCC2)ccc1NC(=O)c1ccc(F)cc1	ZINC000064588781	564092553	/nfs/dbraw/zinc/09/25/53/564092553.db2.gz	WIOIMWWEVMCKLH-UHFFFAOYSA-N	-1	0	342.370	3.767	50	0		EHAARM
O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc([O-])c(Cl)c1	ZINC000143557575	564093364	/nfs/dbraw/zinc/09/33/64/564093364.db2.gz	QIRXZCKVNGEQES-CRAIPNDOSA-N	-1	0	345.826	3.943	50	0		EHAARM
C[C@@H](C(=O)NCCCC(=O)[O-])c1ccc(-c2ccccc2)c(F)c1	ZINC000006764276	564097324	/nfs/dbraw/zinc/09/73/24/564097324.db2.gz	LHLFIBBLXOUKEB-CYBMUJFWSA-N	-1	0	329.371	3.577	50	0		EHAARM
CCOC(=O)c1ccccc1[N-]c1nc(-c2ccc(OC)cc2)no1	ZINC000006803208	564098281	/nfs/dbraw/zinc/09/82/81/564098281.db2.gz	QGZULOMPMLWIAH-UHFFFAOYSA-N	-1	0	339.351	3.666	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)cc1F	ZINC000065031149	564099780	/nfs/dbraw/zinc/09/97/80/564099780.db2.gz	WRVXHXGFEUKDSE-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
COc1ccccc1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000006919622	564101374	/nfs/dbraw/zinc/10/13/74/564101374.db2.gz	NIWGFHIVTVQMEJ-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
CCCCn1cc(S(=O)(=O)[N-]c2cccc(F)c2)c2cccnc21	ZINC000065242341	564103438	/nfs/dbraw/zinc/10/34/38/564103438.db2.gz	FYOCIQZOBNTQKD-UHFFFAOYSA-N	-1	0	347.415	3.776	50	0		EHAARM
O=C([O-])Cc1c(-c2ccc(F)cc2)oc2c1c(=O)oc1ccccc21	ZINC000524732319	564103711	/nfs/dbraw/zinc/10/37/11/564103711.db2.gz	KJRPFZLWVSOBSA-UHFFFAOYSA-N	-1	0	338.290	3.972	50	0		EHAARM
O=C(CCC1CCCC1)N1CCC(c2n[nH]c(=S)n2C2CC2)CC1	ZINC000065512943	564106744	/nfs/dbraw/zinc/10/67/44/564106744.db2.gz	MXLUKCZGIJYEIR-UHFFFAOYSA-N	-1	0	348.516	3.952	50	0		EHAARM
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2cnc3ccccc3c2)n[nH]1	ZINC000170617507	564110156	/nfs/dbraw/zinc/11/01/56/564110156.db2.gz	JXDQWAMWAVUQKB-LBPRGKRZSA-N	-1	0	344.440	3.662	50	0		EHAARM
CN(C(=O)OC(C)(C)C)[C@@H](C(=O)[O-])c1cccc(Cl)c1Cl	ZINC000069550574	564118253	/nfs/dbraw/zinc/11/82/53/564118253.db2.gz	ZTCFCPXMNLBKKH-LLVKDONJSA-N	-1	0	334.199	3.986	50	0		EHAARM
CCCO[C@@H]1CCCN(C(=O)c2ccc3[n-]c(=S)oc3c2)CC1	ZINC000170647602	564120298	/nfs/dbraw/zinc/12/02/98/564120298.db2.gz	SIXMSLKQRKCEED-CYBMUJFWSA-N	-1	0	334.441	3.538	50	0		EHAARM
CCCC[C@@H](C(=O)[O-])[C@@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002226287	564124451	/nfs/dbraw/zinc/12/44/51/564124451.db2.gz	OUABTEZBKXLQFA-GOEBONIOSA-N	-1	0	343.427	3.728	50	0		EHAARM
O=S(=O)([N-]c1ccc2ncccc2c1)c1c(F)cccc1Cl	ZINC000095945415	564142177	/nfs/dbraw/zinc/14/21/77/564142177.db2.gz	QZBQKSCFXFOAKB-UHFFFAOYSA-N	-1	0	336.775	3.828	50	0		EHAARM
O=C([O-])c1cnc(/C=C\c2ccc(OCc3ccccn3)cc2)s1	ZINC000096189862	564145925	/nfs/dbraw/zinc/14/59/25/564145925.db2.gz	WZSGGPQOVCOOEJ-TWGQIWQCSA-N	-1	0	338.388	3.986	50	0		EHAARM
CCn1c2ccccc2nc1SCc1nc(=O)c2sccc2[n-]1	ZINC000007987255	564161847	/nfs/dbraw/zinc/16/18/47/564161847.db2.gz	OFYNROIWCZKRFV-UHFFFAOYSA-N	-1	0	342.449	3.647	50	0		EHAARM
Cc1nn(C(C)C)c(C)c1[N-]S(=O)(=O)c1cc(F)ccc1Cl	ZINC000069442713	564169525	/nfs/dbraw/zinc/16/95/25/564169525.db2.gz	HSFNNJFITOPLGD-UHFFFAOYSA-N	-1	0	345.827	3.674	50	0		EHAARM
CC(=NNc1cccc(C(=O)[O-])c1)c1ccccc1Br	ZINC000254300714	605592354	/nfs/dbraw/zinc/59/23/54/605592354.db2.gz	KOLBWSCXRPAUQJ-UHFFFAOYSA-N	-1	0	333.185	3.983	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H](NC(=O)C[C@@H]2CCc3ccccc32)c2ccccc21	ZINC000653330308	954160352	/nfs/dbraw/zinc/16/03/52/954160352.db2.gz	CRNFRWADMYJIOW-KYNGSXCRSA-N	-1	0	335.403	3.536	50	0		EHAARM
Cc1ccc(C2(NC(=O)CCc3ccccc3C(=O)[O-])CCC2)cc1	ZINC000649265696	975406371	/nfs/dbraw/zinc/40/63/71/975406371.db2.gz	NGQDCEIGTPMXKE-UHFFFAOYSA-N	-1	0	337.419	3.821	50	0		EHAARM
COc1ccc(Br)cc1C=NNc1cccc(C(=O)[O-])c1	ZINC000013139288	1034793227	/nfs/dbraw/zinc/79/32/27/1034793227.db2.gz	RVBCVFMKHBMCME-UHFFFAOYSA-N	-1	0	349.184	3.602	50	0		EHAARM
O=C([O-])C/C(=C\c1ccnn1CC1CCC1)c1nc2ccccc2o1	ZINC000630951918	1137425267	/nfs/dbraw/zinc/42/52/67/1137425267.db2.gz	QSJGDSZSFDWGOY-GXDHUFHOSA-N	-1	0	337.379	3.840	50	0		EHAARM
CCc1nc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)sc1C	ZINC000053570443	214189027	/nfs/dbraw/zinc/18/90/27/214189027.db2.gz	JXLXMAATARXBKD-UHFFFAOYSA-N	-1	0	346.437	3.578	50	0		EHAARM
CC(C)CN(Cc1cccs1)C(=O)c1cccc(NCC(=O)[O-])c1	ZINC000055100324	214272866	/nfs/dbraw/zinc/27/28/66/214272866.db2.gz	ACUDGWUDBSXUPD-UHFFFAOYSA-N	-1	0	346.452	3.543	50	0		EHAARM
CC[C@H](C)[C@H](Nc1nc(C(F)(F)F)nc2ccccc21)C(=O)[O-]	ZINC000062742117	214731440	/nfs/dbraw/zinc/73/14/40/214731440.db2.gz	UOAPBVAOUIPKES-KWQFWETISA-N	-1	0	327.306	3.560	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000004523507	210214056	/nfs/dbraw/zinc/21/40/56/210214056.db2.gz	XMJBBSPXYYWVOW-UWVGGRQHSA-N	-1	0	347.720	3.964	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2cccc(C)c2C)c1=O	ZINC000100602487	219102557	/nfs/dbraw/zinc/10/25/57/219102557.db2.gz	YOHAFCNOFYKLOE-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2cc(C)cc(C)c2)c1=O	ZINC000100709858	219104862	/nfs/dbraw/zinc/10/48/62/219104862.db2.gz	SMEDZCRBRZYICO-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
CC(C)(C)OC(=O)NC[C@@H](Cc1cccc2ccccc21)C(=O)[O-]	ZINC000039959768	213246251	/nfs/dbraw/zinc/24/62/51/213246251.db2.gz	WXQGOWCFXXGOLZ-OAHLLOKOSA-N	-1	0	329.396	3.608	50	0		EHAARM
Cc1ccc(C[C@@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000035141849	213009816	/nfs/dbraw/zinc/00/98/16/213009816.db2.gz	KECJLAFHJZNHLM-AWEZNQCLSA-N	-1	0	331.799	3.921	50	0		EHAARM
Cc1cc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])ccc1Br	ZINC000000402028	209569783	/nfs/dbraw/zinc/56/97/83/209569783.db2.gz	GBXVFMOXCSZQBR-RYUDHWBXSA-N	-1	0	340.217	3.587	50	0		EHAARM
Cc1ccc(C(=O)[O-])c(C(=O)Nc2nc3c(cccc3C)s2)c1	ZINC000000053223	209391734	/nfs/dbraw/zinc/39/17/34/209391734.db2.gz	CAOKAYMKMVKTPV-UHFFFAOYSA-N	-1	0	326.377	3.864	50	0		EHAARM
Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccccc1OC(F)F	ZINC000022841986	212327538	/nfs/dbraw/zinc/32/75/38/212327538.db2.gz	GYVAYILIYCTODE-UHFFFAOYSA-N	-1	0	331.315	3.536	50	0		EHAARM
CC[C@@H](C)c1ccc([C@@H](CC)NC(=O)c2c(C(=O)[O-])cnn2C)cc1	ZINC000020616511	212155874	/nfs/dbraw/zinc/15/58/74/212155874.db2.gz	OBQVDMOPTVHBGL-MLGOLLRUSA-N	-1	0	343.427	3.513	50	0		EHAARM
CCc1ccc(-c2cc(C(F)F)c3c(C)nn(CC(=O)[O-])c3n2)cc1	ZINC000020349781	212121432	/nfs/dbraw/zinc/12/14/32/212121432.db2.gz	SFMFCTLBDXFJHR-UHFFFAOYSA-N	-1	0	345.349	3.991	50	0		EHAARM
Cc1c(C(=O)[O-])sc2ncnc(Nc3ccc(N(C)C)cc3)c12	ZINC000020328626	212119697	/nfs/dbraw/zinc/11/96/97/212119697.db2.gz	WJFDTCSCDJFIRE-UHFFFAOYSA-N	-1	0	328.397	3.508	50	0		EHAARM
Cc1nc2sc(-c3ccccc3)cc2c(N2CCC[C@H]2C(=O)[O-])n1	ZINC000020318172	212118710	/nfs/dbraw/zinc/11/87/10/212118710.db2.gz	XKHXCVSEIWKLKJ-AWEZNQCLSA-N	-1	0	339.420	3.720	50	0		EHAARM
O=S(=O)(C=C([O-])c1cc2ccccc2o1)c1ccc(Cl)cc1	ZINC000019822843	212073352	/nfs/dbraw/zinc/07/33/52/212073352.db2.gz	CZASCJWOTBKKNY-UHFFFAOYSA-N	-1	0	334.780	3.743	50	0		EHAARM
CCN(Cc1ccc(Cl)s1)Cc1nc(=O)c2sccc2[n-]1	ZINC000018936029	211996320	/nfs/dbraw/zinc/99/63/20/211996320.db2.gz	BXCUUNJKLGQQDK-UHFFFAOYSA-N	-1	0	339.873	3.722	50	0		EHAARM
COc1ccc(-c2c(C)[n-]n3c2nc(C)c(CCC(C)C)c3=O)cc1	ZINC000009935379	211135029	/nfs/dbraw/zinc/13/50/29/211135029.db2.gz	GDSZXGHZZIGJRU-UHFFFAOYSA-N	-1	0	339.439	3.904	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)c(C)c3)s2)n[nH]1	ZINC000009686493	211113510	/nfs/dbraw/zinc/11/35/10/211113510.db2.gz	BQIJEWHETIWLFI-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
Cc1nc(-c2ccc(Cl)cc2)nc2sc3c([n-]cnc3=O)c21	ZINC000009547432	211101228	/nfs/dbraw/zinc/10/12/28/211101228.db2.gz	TVQKGKCBWHBNGJ-UHFFFAOYSA-N	-1	0	328.784	3.557	50	0		EHAARM
Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cc(Cl)ccc1O	ZINC000095349106	218283916	/nfs/dbraw/zinc/28/39/16/218283916.db2.gz	UCXVKBGPGAQNJC-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
CCc1ccc(S(=O)(=O)Nc2cccc3ccc(O)cc32)cc1	ZINC000095431816	218373421	/nfs/dbraw/zinc/37/34/21/218373421.db2.gz	OFWNKAROCLEUGP-UHFFFAOYSA-N	-1	0	327.405	3.909	50	0		EHAARM
Cc1ccsc1[C@H]1C[C@H]1C(=O)N(C)Cc1ccc(C(=O)[O-])cc1	ZINC000097035895	218924283	/nfs/dbraw/zinc/92/42/83/218924283.db2.gz	OQSQRTSEELCGLT-LSDHHAIUSA-N	-1	0	329.421	3.517	50	0		EHAARM
CCOc1ccc(C(=O)c2[nH]c(=O)c3ccccc3c2[O-])cc1Cl	ZINC000004937278	210329274	/nfs/dbraw/zinc/32/92/74/210329274.db2.gz	KORACIPALWXIEI-UHFFFAOYSA-N	-1	0	343.766	3.517	50	0		EHAARM
Cc1cc(C)cc(C[C@@H](CC(=O)[O-])C(=O)Nc2ccc(F)cc2)c1	ZINC000004854311	210301549	/nfs/dbraw/zinc/30/15/49/210301549.db2.gz	ASGNVVQIYFURJY-HNNXBMFYSA-N	-1	0	329.371	3.715	50	0		EHAARM
CC(=O)Nc1ccc(NC(=O)c2cc(F)c([O-])c(F)c2)c(Cl)c1	ZINC000097377405	219019321	/nfs/dbraw/zinc/01/93/21/219019321.db2.gz	LOOKGONORKBARB-UHFFFAOYSA-N	-1	0	340.713	3.535	50	0		EHAARM
C[C@@H](Oc1cc2oc(=O)cc(-c3ccccc3)c2cc1Cl)C(=O)[O-]	ZINC000004772103	210276170	/nfs/dbraw/zinc/27/61/70/210276170.db2.gz	IHPVIWJZZRTWJJ-SNVBAGLBSA-N	-1	0	344.750	3.965	50	0		EHAARM
O=C([O-])[C@@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc32)C1	ZINC000003358751	135660216	/nfs/dbraw/zinc/66/02/16/135660216.db2.gz	BCKATJICOMMUMO-CYBMUJFWSA-N	-1	0	339.420	3.659	50	0		EHAARM
O=C(c1cnc2nc(N3CCCCC3)sc2c1)c1ccccc1[O-]	ZINC000012990620	518202277	/nfs/dbraw/zinc/20/22/77/518202277.db2.gz	XMUBWPZPUMFWEE-UHFFFAOYSA-N	-1	0	339.420	3.618	50	0		EHAARM
Cc1onc(C(=O)[O-])c1CN(Cc1c(F)cccc1Cl)C1CC1	ZINC000244811473	526855506	/nfs/dbraw/zinc/85/55/06/526855506.db2.gz	SDJRTWZRZCLDDM-UHFFFAOYSA-N	-1	0	338.766	3.638	50	0		EHAARM
CC(=O)c1cccc([N-]S(=O)(=O)c2c(Cl)cccc2Cl)c1	ZINC000000387199	563303432	/nfs/dbraw/zinc/30/34/32/563303432.db2.gz	JYLWXLVWWNKIQB-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
COc1ccccc1NC(=O)c1cc(Cl)c(Cl)cc1C(=O)[O-]	ZINC000000245298	563265753	/nfs/dbraw/zinc/26/57/53/563265753.db2.gz	CIJQHWQSZOMQNU-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
Cc1ccnc([N-]S(=O)(=O)c2cc(C)c(Cl)cc2Cl)c1	ZINC000000380228	563299692	/nfs/dbraw/zinc/29/96/92/563299692.db2.gz	PJYLPKPBCDKVHX-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(Br)s2)cc1	ZINC000000479280	563335762	/nfs/dbraw/zinc/33/57/62/563335762.db2.gz	GASAJTOKPXNPAO-UHFFFAOYSA-N	-1	0	346.271	3.874	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cc2ccncc2)cc1)c1cccs1	ZINC000001059484	563371872	/nfs/dbraw/zinc/37/18/72/563371872.db2.gz	SKISRTSGTWSZJC-UHFFFAOYSA-N	-1	0	330.434	3.535	50	0		EHAARM
CSc1ccc(S(=O)(=O)[N-]c2ccc3ccccc3n2)cc1	ZINC000001440312	563389145	/nfs/dbraw/zinc/38/91/45/563389145.db2.gz	NJFWQZSHIOGWBE-UHFFFAOYSA-N	-1	0	330.434	3.758	50	0		EHAARM
CC1(COc2ccc(C[C@@H]3SC(=O)[N-]C3=O)cc2)CCCCC1	ZINC000001481754	563391043	/nfs/dbraw/zinc/39/10/43/563391043.db2.gz	YZFWTZACSRHJQD-HNNXBMFYSA-N	-1	0	333.453	3.930	50	0	in-man	EHAARM
COc1ccc2c(c1)c(CC(=O)[O-])c(C)n2Cc1ccc(F)cc1	ZINC000002507398	563434910	/nfs/dbraw/zinc/43/49/10/563434910.db2.gz	DIGWWZCEDODOMZ-UHFFFAOYSA-N	-1	0	327.355	3.773	50	0		EHAARM
C[C@@H](CCC(=O)[O-])NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002547861	563440485	/nfs/dbraw/zinc/44/04/85/563440485.db2.gz	ASUWOMDZJCFFDR-ZDUSSCGKSA-N	-1	0	339.391	3.778	50	0		EHAARM
CCN(Cc1ccccc1)C(=O)CSc1ccccc1C(=O)[O-]	ZINC000003244600	563478124	/nfs/dbraw/zinc/47/81/24/563478124.db2.gz	CHJMRBWCALZMMW-UHFFFAOYSA-N	-1	0	329.421	3.526	50	0		EHAARM
O=S(=O)([N-]c1cccc(Br)c1)c1ccc(F)cc1F	ZINC000007052592	563594348	/nfs/dbraw/zinc/59/43/48/563594348.db2.gz	SPDGVOGNWBUOTN-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
Cc1sc(NC(=O)CCCC(=O)[O-])nc1-c1ccc(Cl)cc1	ZINC000002785362	563612764	/nfs/dbraw/zinc/61/27/64/563612764.db2.gz	FAPVYXCQQTXBAC-UHFFFAOYSA-N	-1	0	338.816	3.965	50	0		EHAARM
Cc1ccc(Nc2nc(=O)c(Cc3ccc(Cl)cc3)n[n-]2)cc1C	ZINC000008741249	563638749	/nfs/dbraw/zinc/63/87/49/563638749.db2.gz	SUWMZXKSFKODPN-UHFFFAOYSA-N	-1	0	340.814	3.770	50	0		EHAARM
COc1ccc(Cc2nnc(Nc3cc(C)cc(C)c3)[n-]c2=O)cc1	ZINC000008741326	563638847	/nfs/dbraw/zinc/63/88/47/563638847.db2.gz	OWWVOOCYKOMKTH-UHFFFAOYSA-N	-1	0	336.395	3.537	50	0		EHAARM
Cc1ccc(Nc2nnc(Cc3ccc(Cl)cc3)c(=O)[n-]2)cc1	ZINC000016777338	563823392	/nfs/dbraw/zinc/82/33/92/563823392.db2.gz	UXUCGNXLBDQPNK-UHFFFAOYSA-N	-1	0	326.787	3.873	50	0		EHAARM
Cc1ccc(N2[N-]C(=O)/C(=C\c3ccc(Cl)cc3Cl)C2=O)cc1	ZINC000000206729	563829272	/nfs/dbraw/zinc/82/92/72/563829272.db2.gz	KHTPXQMATLGAKM-RIYZIHGNSA-N	-1	0	347.201	3.763	50	0		EHAARM
O=C1[N-]C(=O)N(c2cccc(Cl)c2)C(=O)C1=Cc1ccccc1	ZINC000000454543	563844093	/nfs/dbraw/zinc/84/40/93/563844093.db2.gz	ZVJZYQDCSJYFDR-ZROIWOOFSA-N	-1	0	326.739	3.847	50	0		EHAARM
COc1cc(/C=C/c2ncc(C(=O)[O-])s2)ccc1OC(F)F	ZINC000058344303	563943176	/nfs/dbraw/zinc/94/31/76/563943176.db2.gz	IABDIWDOCKDVNZ-HWKANZROSA-N	-1	0	327.308	3.622	50	0		EHAARM
O=C([O-])c1ccccc1-c1c(-c2ccccc2)ncn1Cc1ncc[nH]1	ZINC000065491295	563961520	/nfs/dbraw/zinc/96/15/20/563961520.db2.gz	XULLKOLSAHDDHV-UHFFFAOYSA-N	-1	0	344.374	3.687	50	0		EHAARM
COc1ccccc1[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000000074694	563974464	/nfs/dbraw/zinc/97/44/64/563974464.db2.gz	ACORCYLISMGRHN-UHFFFAOYSA-N	-1	0	331.315	3.515	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(Cc2cccnc2)C2CCCCC2)s1	ZINC000097492444	563981590	/nfs/dbraw/zinc/98/15/90/563981590.db2.gz	VNIORHHLKDHYRK-UHFFFAOYSA-N	-1	0	344.436	3.816	50	0		EHAARM
CCCCOc1ccccc1SCCOc1nc(C)cc(=O)[n-]1	ZINC000014084370	563983175	/nfs/dbraw/zinc/98/31/75/563983175.db2.gz	NEAFZLMQTODGSN-UHFFFAOYSA-N	-1	0	334.441	3.841	50	0		EHAARM
Cc1nc(-c2ccccc2Cl)sc1C(=O)Nc1nncs1	ZINC000050296202	563989967	/nfs/dbraw/zinc/98/99/67/563989967.db2.gz	AQXZYINWMSAYRF-UHFFFAOYSA-N	-1	0	336.829	3.876	50	0		EHAARM
CCCc1ccc(-c2nc(NC(=O)CCC(=O)[O-])sc2C)cc1	ZINC000000373732	563991861	/nfs/dbraw/zinc/99/18/61/563991861.db2.gz	YNJRMCNISALMSH-UHFFFAOYSA-N	-1	0	332.425	3.874	50	0		EHAARM
O=C([O-])CCCC(=O)N1N=C(c2ccccc2)C[C@@H]1c1cccs1	ZINC000000386005	563992021	/nfs/dbraw/zinc/99/20/21/563992021.db2.gz	ARHKFOCZRIYCHN-OAHLLOKOSA-N	-1	0	342.420	3.681	50	0		EHAARM
Cc1cc2[nH]c(C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)cc2c(C)c1	ZINC000237621347	563993460	/nfs/dbraw/zinc/99/34/60/563993460.db2.gz	ADJACQSUZMVJEY-AWEZNQCLSA-N	-1	0	328.412	3.502	50	0		EHAARM
O=c1c2ccccc2[n-]c(=S)n1[C@@H]1CCOC2(CCCCC2)C1	ZINC000128444678	563996120	/nfs/dbraw/zinc/99/61/20/563996120.db2.gz	KXXIUXWDAYSIAK-CYBMUJFWSA-N	-1	0	330.453	3.740	50	0		EHAARM
CCCN(CC)c1ccc(C(=O)Nc2ccccc2C(=O)[O-])cc1	ZINC000583651008	564018311	/nfs/dbraw/zinc/01/83/11/564018311.db2.gz	DAVBPVCRQDTDMM-UHFFFAOYSA-N	-1	0	326.396	3.873	50	0		EHAARM
O=C([O-])C1=Nc2cc(-c3ccccc3)nn2[C@@H](c2ccccc2F)C1	ZINC000101353790	564019371	/nfs/dbraw/zinc/01/93/71/564019371.db2.gz	CBMUACUVJPRLLY-QGZVFWFLSA-N	-1	0	335.338	3.673	50	0		EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CC2)[C@@H]1c1ccccc1Cl	ZINC000045923094	564028913	/nfs/dbraw/zinc/02/89/13/564028913.db2.gz	KQJTWDKMBAIVCP-IAGOWNOFSA-N	-1	0	341.794	3.868	50	0		EHAARM
COc1ccccc1CN(Cc1nc(=O)c2sccc2[n-]1)C1CC1	ZINC000048275389	564030600	/nfs/dbraw/zinc/03/06/00/564030600.db2.gz	IIXJWNHSOJHSMY-UHFFFAOYSA-N	-1	0	341.436	3.570	50	0		EHAARM
O=C([O-])C[C@@H]1CCCCN1C(=O)c1ccccc1Oc1ccccc1	ZINC000221268796	564036073	/nfs/dbraw/zinc/03/60/73/564036073.db2.gz	MIYKUJJJNVOEAI-HNNXBMFYSA-N	-1	0	339.391	3.948	50	0		EHAARM
O=C(c1cnc2cc3c(cc2c1)OC(F)(F)O3)c1cc(F)ccc1[O-]	ZINC000012612188	564060607	/nfs/dbraw/zinc/06/06/07/564060607.db2.gz	LGTLEWWZVIMKKD-UHFFFAOYSA-N	-1	0	347.248	3.632	50	0		EHAARM
CC(C)N(C(=O)c1ccccc1-c1cc(C(=O)[O-])n(C)c1)C(C)C	ZINC000534670789	564061536	/nfs/dbraw/zinc/06/15/36/564061536.db2.gz	JLRPCKIFWFKTST-UHFFFAOYSA-N	-1	0	328.412	3.649	50	0		EHAARM
O=[P@@]([O-])(O)[C@H](Nc1ccc(F)cc1)c1ccc(OC(F)F)cc1	ZINC000012950433	564080186	/nfs/dbraw/zinc/08/01/86/564080186.db2.gz	NOWNTVWKXFXQDO-ZDUSSCGKSA-N	-1	0	347.229	3.716	50	0		EHAARM
CCc1ccc2oc(-c3ccccc3)c(O[C@@H](C)C(=O)[O-])c(=O)c2c1	ZINC000001987545	564090381	/nfs/dbraw/zinc/09/03/81/564090381.db2.gz	MOBRXFKKPLRVOT-LBPRGKRZSA-N	-1	0	338.359	3.874	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3)s2)on1	ZINC000006887797	564100759	/nfs/dbraw/zinc/10/07/59/564100759.db2.gz	RXICMJYYQMSMDB-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
Cc1c(Cl)cccc1NC(=O)c1c([O-])c2sccc2n(C)c1=O	ZINC000065215328	564102838	/nfs/dbraw/zinc/10/28/38/564102838.db2.gz	YMWBNVYDXDOPJM-UHFFFAOYSA-N	-1	0	348.811	3.520	50	0		EHAARM
CCCCn1cc(S(=O)(=O)[N-]c2ccccc2C)c2cccnc21	ZINC000065242324	564103387	/nfs/dbraw/zinc/10/33/87/564103387.db2.gz	KELLNXMUSNKQAZ-UHFFFAOYSA-N	-1	0	343.452	3.946	50	0		EHAARM
CC(C)(C)C(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])cc1	ZINC000170021736	564104834	/nfs/dbraw/zinc/10/48/34/564104834.db2.gz	SSFUFMNHLJTUDR-CABCVRRESA-N	-1	0	329.396	3.521	50	0		EHAARM
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000007402737	564107983	/nfs/dbraw/zinc/10/79/83/564107983.db2.gz	LVCPEPFRBXGXDK-UHFFFAOYSA-N	-1	0	335.734	3.867	50	0		EHAARM
Cc1c([N-]S(=O)(=O)c2cc(F)ccc2C)[nH]nc1-c1ccccc1	ZINC000089651289	564112883	/nfs/dbraw/zinc/11/28/83/564112883.db2.gz	JPZBUCGCPQMASZ-UHFFFAOYSA-N	-1	0	345.399	3.633	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@@H](CCSC)C(=O)[O-])n1	ZINC000006605191	564117391	/nfs/dbraw/zinc/11/73/91/564117391.db2.gz	VPFZJOZNCDOAEJ-NSHDSACASA-N	-1	0	345.424	3.557	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@H](c2ccc(Cl)cc2)[C@H]1C(=O)[O-]	ZINC000139784373	564133618	/nfs/dbraw/zinc/13/36/18/564133618.db2.gz	WOCFNKDQXQVEJM-KGLIPLIRSA-N	-1	0	339.819	3.908	50	0		EHAARM
CC(C)C[C@@H]1SCC(=O)Nc2c1cnn2-c1ccc(C(=O)[O-])cc1	ZINC000095476961	564141430	/nfs/dbraw/zinc/14/14/30/564141430.db2.gz	PNHLLUWJHDICTN-AWEZNQCLSA-N	-1	0	345.424	3.993	50	0		EHAARM
Cc1nn(-c2ccccc2)c(N)c1Sc1ccccc1C(=O)[O-]	ZINC000003198916	564155883	/nfs/dbraw/zinc/15/58/83/564155883.db2.gz	WPNRNQPYBSYURM-UHFFFAOYSA-N	-1	0	325.393	3.612	50	0		EHAARM
CCc1cc(=O)n2[n-]c(COc3ccccc3)c(-c3ccccc3)c2n1	ZINC000008739684	564167143	/nfs/dbraw/zinc/16/71/43/564167143.db2.gz	BBHQVEKWNZLVFP-UHFFFAOYSA-N	-1	0	345.402	3.831	50	0		EHAARM
Cc1ccc(C[C@@H](CC(=O)Nc2cc(C)ccc2C)C(=O)[O-])cc1	ZINC000071405917	564175015	/nfs/dbraw/zinc/17/50/15/564175015.db2.gz	OGNCYTBJYAERQZ-KRWDZBQOSA-N	-1	0	325.408	3.884	50	0		EHAARM
O=C([O-])Cc1cccc(NC(=O)C2(c3c(F)cccc3F)CCC2)c1	ZINC000263243450	962388368	/nfs/dbraw/zinc/38/83/68/962388368.db2.gz	RWHLRFFCLJUEOZ-UHFFFAOYSA-N	-1	0	345.345	3.652	50	0		EHAARM
CC(C)c1nn(C)c(Cl)c1/C=C/c1ncc(C(=O)[O-])c(C(C)C)n1	ZINC000078869147	1016461082	/nfs/dbraw/zinc/46/10/82/1016461082.db2.gz	DUKGXUQHCSKUMP-VOTSOKGWSA-N	-1	0	348.834	3.979	50	0		EHAARM
O=C([O-])c1cnc(NCc2cccnc2)nc1-c1ccc(Cl)cc1	ZINC000169751787	1032599466	/nfs/dbraw/zinc/59/94/66/1032599466.db2.gz	AEDNRBJSANIVDO-UHFFFAOYSA-N	-1	0	340.770	3.502	50	0		EHAARM
O=S(=O)(/C=C/c1ccccc1)Nc1ccccc1OC(F)F	ZINC000007409130	1024215506	/nfs/dbraw/zinc/21/55/06/1024215506.db2.gz	QLFIRBIOCQWSER-ZHACJKMWSA-N	-1	0	325.336	3.701	50	0		EHAARM
O=C([O-])c1cn2c(n1)[C@H](c1ccccc1)N(CC1CCCCC1)CC2	ZINC000675013696	1039850205	/nfs/dbraw/zinc/85/02/05/1039850205.db2.gz	BGMJUKFQEKCPCT-SFHVURJKSA-N	-1	0	339.439	3.567	50	0		EHAARM
CC[C@@H](C)n1ncc2c1nc(/C=C\c1cncs1)cc2C(=O)[O-]	ZINC000566305720	1130804501	/nfs/dbraw/zinc/80/45/01/1130804501.db2.gz	ZJFVIMWTSNLBCX-UMCURTJPSA-N	-1	0	328.397	3.727	50	0		EHAARM
Cc1ccc(Cl)c(S(=O)(=O)[N-]c2cnn([C@@H](C)C3CC3)c2)c1	ZINC000187743063	1131951561	/nfs/dbraw/zinc/95/15/61/1131951561.db2.gz	VRKNDYMITANBPC-NSHDSACASA-N	-1	0	339.848	3.617	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)CSc1ccccc1)c1cccc(Cl)c1	ZINC000004686101	210248218	/nfs/dbraw/zinc/24/82/18/210248218.db2.gz	XZSUEMNKDLEHQX-HNNXBMFYSA-N	-1	0	349.839	3.764	50	0		EHAARM
O=[P@]([O-])(O[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1	ZINC000004348100	210177539	/nfs/dbraw/zinc/17/75/39/210177539.db2.gz	RZTBXNRUCKJMNZ-ZDUSSCGKSA-N	-1	0	334.205	3.957	50	0		EHAARM
Cc1ccc(C)c(S(=O)(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)c1	ZINC000004317871	210169012	/nfs/dbraw/zinc/16/90/12/210169012.db2.gz	IWNBBLQTRVXIMO-UHFFFAOYSA-N	-1	0	349.358	3.668	50	0		EHAARM
Cc1ccc(COc2ccc3c(C)c(CC(=O)[O-])c(=O)oc3c2)cc1	ZINC000004045940	210107736	/nfs/dbraw/zinc/10/77/36/210107736.db2.gz	GDGSNHCEXIQBHS-UHFFFAOYSA-N	-1	0	338.359	3.616	50	0	biogenic	EHAARM
O=C([O-])[C@H]1CS[C@H](c2cccc(OCc3ccc(Cl)cc3)c2)N1	ZINC000003642578	210069876	/nfs/dbraw/zinc/06/98/76/210069876.db2.gz	MTJOHDVAHGAFOD-HZPDHXFCSA-N	-1	0	349.839	3.707	50	0		EHAARM
CC(C)(C)c1ccc([C@@H](CC(=O)[O-])NC(=O)Cc2ccccc2)cc1	ZINC000003628993	210069429	/nfs/dbraw/zinc/06/94/29/210069429.db2.gz	GLXOJZFFKJUVNN-GOSISDBHSA-N	-1	0	339.435	3.859	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000000469933	209620964	/nfs/dbraw/zinc/62/09/64/209620964.db2.gz	ROIKMTUWAVFFOQ-UHFFFAOYSA-N	-1	0	338.237	3.864	50	0		EHAARM
CCOc1ccc(NC(=O)C[C@@H](C(=O)[O-])[C@H](C)c2ccccc2)cc1	ZINC000035142207	213009358	/nfs/dbraw/zinc/00/93/58/213009358.db2.gz	BALWTZPZJNFWNG-RDTXWAMCSA-N	-1	0	341.407	3.918	50	0		EHAARM
Cc1sc2ncn([C@H](C)C(=O)[O-])c(=O)c2c1-c1ccc(Cl)cc1	ZINC000000149252	209453950	/nfs/dbraw/zinc/45/39/50/209453950.db2.gz	JXYGYEDMVZBCCR-MRVPVSSYSA-N	-1	0	348.811	3.732	50	0		EHAARM
Cc1cc(C)c(S(=O)(=O)Nc2cccc(/C=C/C(=O)[O-])c2)c(C)c1	ZINC000000046730	209389388	/nfs/dbraw/zinc/38/93/88/209389388.db2.gz	MKFZMVNUDTUTER-BQYQJAHWSA-N	-1	0	345.420	3.510	50	0		EHAARM
Cc1nn(C(C)C)c(C)c1NC(=O)C[C@@H](CC(=O)[O-])c1ccccc1	ZINC000226750032	242113204	/nfs/dbraw/zinc/11/32/04/242113204.db2.gz	HTBBXKSBLMHJGZ-INIZCTEOSA-N	-1	0	343.427	3.668	50	0		EHAARM
CCc1ccc([C@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)s1	ZINC000020617182	212156406	/nfs/dbraw/zinc/15/64/06/212156406.db2.gz	XZYUWMYRDNFJAQ-KOLCDFICSA-N	-1	0	345.346	3.866	50	0		EHAARM
CCOC[C@H]1CCN(C(=O)c2cc(Cl)c3ccccc3c2[O-])C1	ZINC000080035647	217274202	/nfs/dbraw/zinc/27/42/02/217274202.db2.gz	JPDYDYALVZALJU-LBPRGKRZSA-N	-1	0	333.815	3.697	50	0		EHAARM
CC(C)c1ccccc1O[C@H]1C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C1	ZINC000014632460	211748491	/nfs/dbraw/zinc/74/84/91/211748491.db2.gz	KVRRXHHSBFJMFJ-ZFWWWQNUSA-N	-1	0	349.427	3.651	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000012773576	211452433	/nfs/dbraw/zinc/45/24/33/211452433.db2.gz	LVVQTXAAIVLYMP-NXEZZACHSA-N	-1	0	347.720	3.964	50	0		EHAARM
Cc1c([O-])c(-c2cc[nH]c(=S)n2)cc2c3c(c(=O)oc12)CCCC3	ZINC000011866514	211260183	/nfs/dbraw/zinc/26/01/83/211260183.db2.gz	GOWBARZZAUQNNX-UHFFFAOYSA-N	-1	0	340.404	3.805	50	0		EHAARM
COc1ccc(-c2c(C)[n-]n3c2nc(-c2ccc(F)cc2)cc3=O)cc1	ZINC000009935373	211134022	/nfs/dbraw/zinc/13/40/22/211134022.db2.gz	QQNFZJZFFQUHJH-UHFFFAOYSA-N	-1	0	349.365	3.813	50	0		EHAARM
O=S(=O)([N-]c1cc(Cl)ccc1O)c1cccc(Cl)c1F	ZINC000095349109	218283875	/nfs/dbraw/zinc/28/38/75/218283875.db2.gz	IEDSYYKUUHUJRK-UHFFFAOYSA-N	-1	0	336.171	3.639	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)c3cccn3C3CC3)C2)cc1	ZINC000095389190	218320241	/nfs/dbraw/zinc/32/02/41/218320241.db2.gz	ZETYWPPSRZCCIN-INIZCTEOSA-N	-1	0	338.407	3.541	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)c3cccn3C3CC3)C2)cc1	ZINC000095389191	218320286	/nfs/dbraw/zinc/32/02/86/218320286.db2.gz	ZETYWPPSRZCCIN-MRXNPFEDSA-N	-1	0	338.407	3.541	50	0		EHAARM
Cc1cc2cc(C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)oc2cc1C	ZINC000097045110	258068244	/nfs/dbraw/zinc/06/82/44/258068244.db2.gz	YQHHIZOZPBXJPL-AWEZNQCLSA-N	-1	0	329.396	3.767	50	0		EHAARM
Cc1sc2ncn([C@H](C)C(=O)[O-])c(=O)c2c1-c1ccc(C)c(C)c1	ZINC000000148663	518194558	/nfs/dbraw/zinc/19/45/58/518194558.db2.gz	SYZWKYNOJNGYEK-LLVKDONJSA-N	-1	0	342.420	3.696	50	0		EHAARM
O=C([O-])c1cccnc1Sc1ncc(C(F)(F)F)cc1Cl	ZINC000000166432	563249577	/nfs/dbraw/zinc/24/95/77/563249577.db2.gz	VLGROHDCHOAOOQ-UHFFFAOYSA-N	-1	0	334.706	3.998	50	0		EHAARM
CC(C)(C)C(=O)Nc1cccc(C(=O)Nc2ccccc2C(=O)[O-])c1	ZINC000000244282	563265798	/nfs/dbraw/zinc/26/57/98/563265798.db2.gz	BRLZZYQHVGZZJP-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
CSc1ncc(CC(=O)[O-])c(Sc2ccc(Cl)cc2)n1	ZINC000000347535	563288026	/nfs/dbraw/zinc/28/80/26/563288026.db2.gz	SCYMZFIBGHCJIG-UHFFFAOYSA-N	-1	0	326.830	3.630	50	0		EHAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1ccc2ccccc2c1	ZINC000000618652	563360309	/nfs/dbraw/zinc/36/03/09/563360309.db2.gz	MDPWTGXJJRZBGA-UHFFFAOYSA-N	-1	0	331.368	3.788	50	0		EHAARM
COc1ccc([C@@H]2[C@@H](C(=O)[O-])CCC(=O)N2c2ccc(C)cc2)cc1	ZINC000003888159	563490596	/nfs/dbraw/zinc/49/05/96/563490596.db2.gz	WUXFDDOWIRXNME-PKOBYXMFSA-N	-1	0	339.391	3.573	50	0		EHAARM
Cc1c([O-])ccc2c(=O)c(Oc3cnn(-c4ccccc4)c3)coc12	ZINC000008299429	563625929	/nfs/dbraw/zinc/62/59/29/563625929.db2.gz	PORNTELQMGYTIO-UHFFFAOYSA-N	-1	0	334.331	3.785	50	0		EHAARM
Cc1oc(-c2ccc(C(=O)[O-])cc2)nc1CN1CCc2ccccc21	ZINC000015774321	563792269	/nfs/dbraw/zinc/79/22/69/563792269.db2.gz	JPKWVXCWEHCVOA-UHFFFAOYSA-N	-1	0	334.375	3.911	50	0		EHAARM
CCn1nccc1-c1cc(C(=O)[O-])c2cc(Br)ccc2n1	ZINC000017072047	563835285	/nfs/dbraw/zinc/83/52/85/563835285.db2.gz	BXZPFHUJBHIWAR-UHFFFAOYSA-N	-1	0	346.184	3.579	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc2cccnc21	ZINC000074826907	563967008	/nfs/dbraw/zinc/96/70/08/563967008.db2.gz	FMPBEDOPRAYBDY-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
Cc1cc(C)c([C@@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])cc1C	ZINC000072233757	563986039	/nfs/dbraw/zinc/98/60/39/563986039.db2.gz	MRDDWYJJPJNRBG-GOEBONIOSA-N	-1	0	333.428	3.789	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@H](CCc2ccccc2)[C@@H]1C(=O)[O-]	ZINC000221035921	563989604	/nfs/dbraw/zinc/98/96/04/563989604.db2.gz	PRZZNHCYHUYMIC-HZPDHXFCSA-N	-1	0	333.428	3.720	50	0		EHAARM
Cc1ccccc1N1C(=O)[C@@H](CC(=O)[O-])S/C1=N/C1CCCCC1	ZINC000100507706	563992653	/nfs/dbraw/zinc/99/26/53/563992653.db2.gz	DFYMSSYLAPFLCW-AMGRQBIBSA-N	-1	0	346.452	3.607	50	0		EHAARM
Cc1n[n-]c(SCc2c(Cl)ccc(Cl)c2Cl)nc1=O	ZINC000005625775	564006121	/nfs/dbraw/zinc/00/61/21/564006121.db2.gz	DFVRUCQUICPUEQ-UHFFFAOYSA-N	-1	0	336.631	3.726	50	0		EHAARM
Cc1nc2[n-]c(C(c3ccccc3)c3ccccc3)nn2c(=O)c1C	ZINC000018221985	564018934	/nfs/dbraw/zinc/01/89/34/564018934.db2.gz	UYBQLZYVMMSMFD-UHFFFAOYSA-N	-1	0	330.391	3.627	50	0		EHAARM
O=C(Nc1cccc2ccccc21)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102727794	564020483	/nfs/dbraw/zinc/02/04/83/564020483.db2.gz	LUYWXOCVLAXOAY-ISLYRVAYSA-N	-1	0	330.343	3.700	50	0		EHAARM
COC(=O)[C@@H]1[C@H](c2ccccc2)C=C[C@@H](c2ccccc2)[C@@H]1C(=O)[O-]	ZINC000013154058	564026318	/nfs/dbraw/zinc/02/63/18/564026318.db2.gz	ZXGPHADSLBDYNB-CADBVGFASA-N	-1	0	336.387	3.614	50	0		EHAARM
O=C([O-])C[C@@H](/N=C/c1cc(Br)ccc1O)c1ccccc1	ZINC000034633923	564033125	/nfs/dbraw/zinc/03/31/25/564033125.db2.gz	CUSYDOOHCWEMBN-YFEUJDIGSA-N	-1	0	348.196	3.790	50	0		EHAARM
CCc1ccc(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)cc1	ZINC000012561165	564059599	/nfs/dbraw/zinc/05/95/99/564059599.db2.gz	HQZJNVODXFRIFD-UHFFFAOYSA-N	-1	0	339.420	3.507	50	0		EHAARM
COc1ccc(C[C@H]2CCCN2C(=O)c2c([O-])cc(F)cc2F)cc1	ZINC000083944054	564065014	/nfs/dbraw/zinc/06/50/14/564065014.db2.gz	RBSCKBFFAUUWFU-CQSZACIVSA-N	-1	0	347.361	3.526	50	0		EHAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@H]1CCCC[C@@H]1C(F)(F)F	ZINC000089351069	564089778	/nfs/dbraw/zinc/08/97/78/564089778.db2.gz	MZPRIWZQWQHZIF-KBPBESRZSA-N	-1	0	343.345	3.712	50	0		EHAARM
O=C([O-])C1CCN(c2ncnc3scc(-c4ccccc4)c32)CC1	ZINC000000066504	564090410	/nfs/dbraw/zinc/09/04/10/564090410.db2.gz	IOORWIDBOQBHEY-UHFFFAOYSA-N	-1	0	339.420	3.659	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2ccc(F)c(C)c2)c2cccnc21	ZINC000065242269	564103411	/nfs/dbraw/zinc/10/34/11/564103411.db2.gz	RDFBDRVMJNFDBN-UHFFFAOYSA-N	-1	0	347.415	3.695	50	0		EHAARM
Cc1c(C(=O)N2CCCC[C@H]2CC(=O)[O-])oc2c1c(C)ccc2C	ZINC000170071373	564105233	/nfs/dbraw/zinc/10/52/33/564105233.db2.gz	LCYOOHRKIRUXPD-AWEZNQCLSA-N	-1	0	329.396	3.827	50	0		EHAARM
CC[C@@](NC(=O)[C@H](C)Sc1ccccc1)(C(=O)[O-])c1ccccc1	ZINC000170592056	564108816	/nfs/dbraw/zinc/10/88/16/564108816.db2.gz	VWQPJNOOJVNPKT-LIRRHRJNSA-N	-1	0	343.448	3.674	50	0		EHAARM
O=C(CCc1nc(C2CCCC2)no1)Nc1cccc(Cl)c1[O-]	ZINC000089768076	564113625	/nfs/dbraw/zinc/11/36/25/564113625.db2.gz	AEAGDBPJAKHQCW-UHFFFAOYSA-N	-1	0	335.791	3.658	50	0		EHAARM
COc1cc(F)cc(NC(=O)[C@@](C)(CC(=O)[O-])C2CCCCC2)c1	ZINC000170663902	564121285	/nfs/dbraw/zinc/12/12/85/564121285.db2.gz	IUUXJAITWCWEHY-SFHVURJKSA-N	-1	0	337.391	3.834	50	0		EHAARM
COc1cc(F)cc(NC(=O)[C@](C)(CC(=O)[O-])C2CCCCC2)c1	ZINC000170663901	564121307	/nfs/dbraw/zinc/12/13/07/564121307.db2.gz	IUUXJAITWCWEHY-GOSISDBHSA-N	-1	0	337.391	3.834	50	0		EHAARM
O=C(c1s[n-]c(=O)c1Cl)N(Cc1ccco1)Cc1ccco1	ZINC000253405180	564130615	/nfs/dbraw/zinc/13/06/15/564130615.db2.gz	HWTSKZVETSVGOD-UHFFFAOYSA-N	-1	0	338.772	3.531	50	0		EHAARM
O=S(=O)([N-]c1nccc2sccc21)c1cccc2ccccc21	ZINC000096013513	564144786	/nfs/dbraw/zinc/14/47/86/564144786.db2.gz	OAYGHHBSLWNXHA-UHFFFAOYSA-N	-1	0	340.429	3.672	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@H]2CCCC[C@H]2C(F)(F)F)cc1	ZINC000096479748	564148609	/nfs/dbraw/zinc/14/86/09/564148609.db2.gz	SLGWRFLXCDWQDC-KGLIPLIRSA-N	-1	0	343.345	3.555	50	0		EHAARM
C[C@H](NC(=O)C[C@@](C)(C(=O)[O-])c1ccccc1)c1ccc(F)c(F)c1	ZINC000008388756	564164879	/nfs/dbraw/zinc/16/48/79/564164879.db2.gz	MEOFPPTVRMCKOQ-HXPMCKFVSA-N	-1	0	347.361	3.575	50	0		EHAARM
O=C(NCCc1coc(-c2ccccc2)n1)c1ccc([O-])c(Cl)c1	ZINC000069454882	564169645	/nfs/dbraw/zinc/16/96/45/564169645.db2.gz	KWBRAYXSYHAUAY-UHFFFAOYSA-N	-1	0	342.782	3.673	50	0		EHAARM
Cc1ncc(C(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)c(C(C)C)n1	ZINC000192851405	600480190	/nfs/dbraw/zinc/48/01/90/600480190.db2.gz	QYUKTNLBNHQYTE-UHFFFAOYSA-N	-1	0	333.775	3.512	50	0		EHAARM
O=C([O-])[C@H]1CCN(C(=O)[C@H]2CCCc3ccccc32)c2ccccc21	ZINC000327396516	971395718	/nfs/dbraw/zinc/39/57/18/971395718.db2.gz	STARTMRHHKVCMM-ROUUACIJSA-N	-1	0	335.403	3.712	50	0		EHAARM
O=C([O-])C1CCC(Nc2ccc(-c3ncc4n3CCCC4)cc2)CC1	ZINC000263467682	962655666	/nfs/dbraw/zinc/65/56/66/962655666.db2.gz	KLNPFVCDUPMNFC-UHFFFAOYSA-N	-1	0	339.439	3.942	50	0		EHAARM
Cc1cn2c(/C=C/c3ncc(C(=O)[O-])c(C(C)C)n3)c(C)nc2s1	ZINC000172488495	1032740383	/nfs/dbraw/zinc/74/03/83/1032740383.db2.gz	AWTURFXGJUWAFZ-AATRIKPKSA-N	-1	0	342.424	3.795	50	0		EHAARM
CC(C)Oc1cccc(CN(C)C(=O)c2ccc(C(=O)[O-])cc2F)c1	ZINC000262734441	1033249448	/nfs/dbraw/zinc/24/94/48/1033249448.db2.gz	IHKPTYAXLUVSTH-UHFFFAOYSA-N	-1	0	345.370	3.583	50	0		EHAARM
COCc1cc(NC(=O)c2cccc3ccccc32)cc(C(=O)[O-])c1	ZINC000427682885	1026062702	/nfs/dbraw/zinc/06/27/02/1026062702.db2.gz	OWMOWAWGFJYXNG-UHFFFAOYSA-N	-1	0	335.359	3.937	50	0		EHAARM
CN(C(=O)CC1(C(=O)[O-])CCC1)C1c2ccccc2-c2ccccc21	ZINC000262913140	1031322897	/nfs/dbraw/zinc/32/28/97/1031322897.db2.gz	YSOLCXQPGFBTQF-UHFFFAOYSA-N	-1	0	335.403	3.860	50	0		EHAARM
COc1cccc(C[C@H](CC(=O)Nc2cc(C)ccc2C)C(=O)[O-])c1	ZINC000004977252	1042701143	/nfs/dbraw/zinc/70/11/43/1042701143.db2.gz	VRIPSUIDZXILHM-MRXNPFEDSA-N	-1	0	341.407	3.584	50	0		EHAARM
Cc1cc([O-])c(C2=NCCS[C@@H](c3ccc(Cl)cc3)C2)c(=O)o1	ZINC000005730259	1137359435	/nfs/dbraw/zinc/35/94/35/1137359435.db2.gz	JBKBAKSDOZAJSE-OAHLLOKOSA-N	-1	0	349.839	3.975	50	0		EHAARM
O=C([O-])/C=C\c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1	ZINC000221915054	1138223551	/nfs/dbraw/zinc/22/35/51/1138223551.db2.gz	XDWOFOARYLYJLD-FLIBITNWSA-N	-1	0	348.358	3.621	50	0		EHAARM
C[C@@H](c1cc(F)ccc1F)N(C)Cc1nc(=O)c2sccc2[n-]1	ZINC000053125897	214165307	/nfs/dbraw/zinc/16/53/07/214165307.db2.gz	SQHSNBORJZEJHD-VIFPVBQESA-N	-1	0	335.379	3.868	50	0		EHAARM
C[C@H](CC(=O)[O-])CC(=O)Nc1ccc(OCCc2ccccc2)cc1	ZINC000004690995	210249076	/nfs/dbraw/zinc/24/90/76/210249076.db2.gz	VAPZLYLULJYPNS-HNNXBMFYSA-N	-1	0	341.407	3.748	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc(Cl)ccc2Cl)C1	ZINC000049842040	214034198	/nfs/dbraw/zinc/03/41/98/214034198.db2.gz	MOVMZWCTSGTBNQ-SNVBAGLBSA-N	-1	0	330.211	3.710	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)COc1ccc(Cl)cc1Cl	ZINC000004600607	210231090	/nfs/dbraw/zinc/23/10/90/210231090.db2.gz	AUJIDMFVYFPUIF-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
Cc1nnc(SCc2cc(=O)n(-c3ccc(Cl)cc3)[n-]2)s1	ZINC000100072201	219090403	/nfs/dbraw/zinc/09/04/03/219090403.db2.gz	HBBXBVVHRDWUTD-UHFFFAOYSA-N	-1	0	338.845	3.684	50	0		EHAARM
CCCCN(CC)C(=O)Cc1c2cc(Cl)ccc2[nH]c1C(=O)[O-]	ZINC000004111764	210121526	/nfs/dbraw/zinc/12/15/26/210121526.db2.gz	XSCSREIVXZLWST-UHFFFAOYSA-N	-1	0	336.819	3.711	50	0		EHAARM
Cc1c(C(=O)[O-])sc2ncnc(N[C@H](C)c3ncccc3C)c12	ZINC000067514096	215156595	/nfs/dbraw/zinc/15/65/95/215156595.db2.gz	KGCGLFNTDNFGBS-SNVBAGLBSA-N	-1	0	328.397	3.574	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)C1	ZINC000039632466	213240518	/nfs/dbraw/zinc/24/05/18/213240518.db2.gz	QVKSDHWLOJFLMX-STQMWFEESA-N	-1	0	328.195	3.989	50	0		EHAARM
COc1ccc2c(c1)c(CC(=O)[O-])c(C)n2C(=O)C1CCCCC1	ZINC000038266588	213205967	/nfs/dbraw/zinc/20/59/67/213205967.db2.gz	AWPBTRHQEYHZJD-UHFFFAOYSA-N	-1	0	329.396	3.806	50	0		EHAARM
Cc1cc(=O)oc2c1c(-c1ccccc1)nn2-c1cccc(C(=O)[O-])c1	ZINC000036075297	213059812	/nfs/dbraw/zinc/05/98/12/213059812.db2.gz	XNJADJCONHMIFW-UHFFFAOYSA-N	-1	0	346.342	3.652	50	0		EHAARM
O=C([O-])c1cccc(C[C@@H]2CCN(C(=O)c3ccccc3Cl)C2)c1	ZINC000072133333	216022499	/nfs/dbraw/zinc/02/24/99/216022499.db2.gz	WHWBQIHLXLBDKI-AWEZNQCLSA-N	-1	0	343.810	3.743	50	0		EHAARM
CC(C)[C@H](Nc1ncnc2scc(-c3ccccc3)c21)C(=O)[O-]	ZINC000000237104	209497683	/nfs/dbraw/zinc/49/76/83/209497683.db2.gz	JIEWHKZCGHMHAG-AWEZNQCLSA-N	-1	0	327.409	3.879	50	0		EHAARM
O=C([O-])c1cc(-c2ccccc2O)nc2n[nH]c(-c3ccccc3)c21	ZINC000072332300	216156296	/nfs/dbraw/zinc/15/62/96/216156296.db2.gz	DJQVYQLBZMARFX-UHFFFAOYSA-N	-1	0	331.331	3.696	50	0		EHAARM
O=C(/C=C/c1ccccc1)Nc1sc2c(c1C(=O)[O-])CCCC2	ZINC000000210990	209486282	/nfs/dbraw/zinc/48/62/82/209486282.db2.gz	SDJSLSJBWUWELZ-ZHACJKMWSA-N	-1	0	327.405	3.977	50	0		EHAARM
CC(=O)c1cccc(Nc2nccc(Nc3ccccc3C(=O)[O-])n2)c1	ZINC000028294360	212614072	/nfs/dbraw/zinc/61/40/72/212614072.db2.gz	NRNHYMKCTIIIKE-UHFFFAOYSA-N	-1	0	348.362	3.865	50	0		EHAARM
CCCOc1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000023385841	212374823	/nfs/dbraw/zinc/37/48/23/212374823.db2.gz	BSBVXIBHBWBYME-UHFFFAOYSA-N	-1	0	327.352	3.554	50	0		EHAARM
Cc1c(C(=O)[O-])sc2ncnc(NCCCc3ccccc3)c12	ZINC000021715909	212243059	/nfs/dbraw/zinc/24/30/59/212243059.db2.gz	LCKSLUSOOCDHEG-UHFFFAOYSA-N	-1	0	327.409	3.743	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(CCC(F)(F)F)C2CCCCC2)cn1	ZINC000238031165	242903985	/nfs/dbraw/zinc/90/39/85/242903985.db2.gz	OMCJAVNORWGRPW-UHFFFAOYSA-N	-1	0	344.333	3.507	50	0		EHAARM
CC[C@@H](C)c1ccc([C@H](CC)NC(=O)c2c(C(=O)[O-])cnn2C)cc1	ZINC000020616514	212155795	/nfs/dbraw/zinc/15/57/95/212155795.db2.gz	OBQVDMOPTVHBGL-WBMJQRKESA-N	-1	0	343.427	3.513	50	0		EHAARM
Cc1nc2sc(-c3ccccc3)cc2c(N2CCC[C@@H]2C(=O)[O-])n1	ZINC000020318169	212118484	/nfs/dbraw/zinc/11/84/84/212118484.db2.gz	XKHXCVSEIWKLKJ-CQSZACIVSA-N	-1	0	339.420	3.720	50	0		EHAARM
COc1ccc(-c2nc3ccccc3c(C)c2CC(=O)[O-])cc1OC	ZINC000019413858	212025250	/nfs/dbraw/zinc/02/52/50/212025250.db2.gz	CWWVWISANONSSK-UHFFFAOYSA-N	-1	0	337.375	3.855	50	0		EHAARM
C[C@@H]1Cc2c(nc3ccccc3c2C(=O)[O-])/C(=C\c2cnn(C)c2)C1	ZINC000014177485	211701358	/nfs/dbraw/zinc/70/13/58/211701358.db2.gz	FLVSEHUZATYUBW-CJAAZZPWSA-N	-1	0	333.391	3.789	50	0		EHAARM
CCc1cc(C(=O)[O-])c2c(C3CC3)nn(-c3ccc(OC)cc3)c2n1	ZINC000012399152	211367813	/nfs/dbraw/zinc/36/78/13/211367813.db2.gz	QMCHZIFPHIIRKM-UHFFFAOYSA-N	-1	0	337.379	3.567	50	0		EHAARM
COc1ccc(NC(=O)[C@H](Cc2ccc(C)cc2)[C@H](C)C(=O)[O-])cc1	ZINC000005414079	210459180	/nfs/dbraw/zinc/45/91/80/210459180.db2.gz	ZRKOPNCQBPMWIZ-KBXCAEBGSA-N	-1	0	341.407	3.522	50	0		EHAARM
C[C@H](Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(=O)[O-]	ZINC000005141479	210398320	/nfs/dbraw/zinc/39/83/20/210398320.db2.gz	YUVKUEAFAVKILW-VIFPVBQESA-N	-1	0	327.258	3.745	50	0	in-vitro	EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccccc1Cl	ZINC000005126404	210394696	/nfs/dbraw/zinc/39/46/96/210394696.db2.gz	GQOPPVJASPEMJI-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
CC(C)OC(=O)[C@@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1C(=O)[O-]	ZINC000005002937	210357952	/nfs/dbraw/zinc/35/79/52/210357952.db2.gz	OSMMTMKDUSZPCL-WZOJCFFYSA-N	-1	0	336.387	3.546	50	0		EHAARM
CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)[N-]c1cccnc1	ZINC000004970409	210343451	/nfs/dbraw/zinc/34/34/51/210343451.db2.gz	WTABKXFXTAEFTF-UHFFFAOYSA-N	-1	0	334.441	3.713	50	0		EHAARM
Cc1ccc([C@H]2CC(c3cccs3)=NN2C(=O)CCC(=O)[O-])cc1	ZINC000004858072	210303748	/nfs/dbraw/zinc/30/37/48/210303748.db2.gz	SLKYRQVJTUUSMY-OAHLLOKOSA-N	-1	0	342.420	3.599	50	0		EHAARM
Cc1cc(C)cc(C[C@H](CC(=O)[O-])C(=O)Nc2ccc(F)cc2)c1	ZINC000004854312	210302269	/nfs/dbraw/zinc/30/22/69/210302269.db2.gz	ASGNVVQIYFURJY-OAHLLOKOSA-N	-1	0	329.371	3.715	50	0		EHAARM
O=C([O-])CCc1ccc(-c2ccccc2)n1NC(=O)c1ccccc1	ZINC000004834785	210292281	/nfs/dbraw/zinc/29/22/81/210292281.db2.gz	DEHAKGIXOCLKJJ-UHFFFAOYSA-N	-1	0	334.375	3.556	50	0		EHAARM
Cc1ccc(CC(=O)N[C@@H](CC(=O)[O-])c2ccc(Cl)s2)s1	ZINC000095463976	564140899	/nfs/dbraw/zinc/14/08/99/564140899.db2.gz	MAOYPHNHZKPNMZ-JTQLQIEISA-N	-1	0	343.857	3.646	50	0		EHAARM
COc1cccc(C(=O)Nc2sc3c(c2C(=O)[O-])CCCC3)c1	ZINC000000090066	563221855	/nfs/dbraw/zinc/22/18/55/563221855.db2.gz	CRFITBLJZAUCAW-UHFFFAOYSA-N	-1	0	331.393	3.586	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](C(=O)[O-])C(c1ccccc1)c1ccccc1	ZINC000002556727	563440962	/nfs/dbraw/zinc/44/09/62/563440962.db2.gz	TYJDOLCFYZSNQC-QGZVFWFLSA-N	-1	0	341.407	3.796	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C)c(C)c1	ZINC000002846017	563455316	/nfs/dbraw/zinc/45/53/16/563455316.db2.gz	PQVBFGGIRKKPAN-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CCCOc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(Cl)cn1	ZINC000008714638	563636385	/nfs/dbraw/zinc/63/63/85/563636385.db2.gz	PSBUDWPVXKYTDH-UHFFFAOYSA-N	-1	0	340.832	3.633	50	0		EHAARM
C[C@H](C[NH2+][C@H](c1cccc(Cl)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997528	563683751	/nfs/dbraw/zinc/68/37/51/563683751.db2.gz	ASGIEMFZUXVBFN-WBMJQRKESA-N	-1	0	339.759	3.910	50	0		EHAARM
CCN(CC)C(=O)c1cccc(NC(=O)c2ccc([O-])c(Cl)c2)c1	ZINC000024925456	563877589	/nfs/dbraw/zinc/87/75/89/563877589.db2.gz	FBHXPLCHYFGCFC-UHFFFAOYSA-N	-1	0	346.814	3.780	50	0		EHAARM
C[C@@H](c1cc2ccccc2o1)N(C)Cc1nc(=O)c2sccc2[n-]1	ZINC000030005545	563909171	/nfs/dbraw/zinc/90/91/71/563909171.db2.gz	XPBMANWMAUCSTO-NSHDSACASA-N	-1	0	339.420	3.924	50	0		EHAARM
O=S(=O)([N-]c1ccncc1)c1c(Cl)cccc1C(F)(F)F	ZINC000072292631	563910253	/nfs/dbraw/zinc/91/02/53/563910253.db2.gz	NXDWZDVBMZQEJM-UHFFFAOYSA-N	-1	0	336.722	3.555	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000043583362	563913014	/nfs/dbraw/zinc/91/30/14/563913014.db2.gz	ZYYGWBDLTYVADV-JTQLQIEISA-N	-1	0	330.211	3.710	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1CC(=O)c1cccc(Br)c1	ZINC000043879311	563925947	/nfs/dbraw/zinc/92/59/47/563925947.db2.gz	HXMGBTCEMUDHJI-ZWNOBZJWSA-N	-1	0	325.202	3.913	50	0		EHAARM
Cc1ccsc1[C@H]1C[C@@H]1C(=O)N(C)Cc1ccc(C(=O)[O-])cc1	ZINC000097035891	563966939	/nfs/dbraw/zinc/96/69/39/563966939.db2.gz	OQSQRTSEELCGLT-GJZGRUSLSA-N	-1	0	329.421	3.517	50	0		EHAARM
COc1cc(C(=O)N2CCCC[C@H]2c2ccc(F)cc2)ccc1O	ZINC000077504210	563969995	/nfs/dbraw/zinc/96/99/95/563969995.db2.gz	WMQHAONHVSCHDG-INIZCTEOSA-N	-1	0	329.371	3.907	50	0		EHAARM
Cc1ccccc1C[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)[O-]	ZINC000072233758	563986071	/nfs/dbraw/zinc/98/60/71/563986071.db2.gz	VEISDHRYJDNLDB-JKSUJKDBSA-N	-1	0	333.428	3.638	50	0		EHAARM
Cc1nc2sc3c(c2c(N[C@@H](CC(C)C)C(=O)[O-])n1)CCCC3	ZINC000000237038	563989051	/nfs/dbraw/zinc/98/90/51/563989051.db2.gz	AHUGUMBYIFEESI-LBPRGKRZSA-N	-1	0	333.457	3.790	50	0		EHAARM
CCOc1ccc(NC(=O)[C@H](CC(=O)[O-])Cc2ccc(C)cc2)cc1	ZINC000000249105	563989454	/nfs/dbraw/zinc/98/94/54/563989454.db2.gz	SNAHCYLESZADEH-INIZCTEOSA-N	-1	0	341.407	3.666	50	0		EHAARM
CCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2OC)cc1	ZINC000005262282	564001666	/nfs/dbraw/zinc/00/16/66/564001666.db2.gz	CQJJBJVYAOOYBT-UHFFFAOYSA-N	-1	0	325.817	3.712	50	0		EHAARM
CC(C)c1ccc(N(C)C(=O)CSc2n[n-]c(=S)s2)cc1	ZINC000155783194	564008334	/nfs/dbraw/zinc/00/83/34/564008334.db2.gz	CKSJYNWITMKDSD-UHFFFAOYSA-N	-1	0	339.511	3.705	50	0		EHAARM
CCOc1ccc(NC[C@H](CC(=O)[O-])c2nc3ccccc3[nH]2)cc1	ZINC000017307992	564011593	/nfs/dbraw/zinc/01/15/93/564011593.db2.gz	IJXCDDGLIQWDKI-ZDUSSCGKSA-N	-1	0	339.395	3.632	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccccc1Cc1ccccc1	ZINC000013021891	564019349	/nfs/dbraw/zinc/01/93/49/564019349.db2.gz	IOPXNQZIJDIBRJ-QZTJIDSGSA-N	-1	0	335.403	3.883	50	0		EHAARM
O=C([O-])C1CCN(C(=O)c2sc3cc(F)ccc3c2Cl)CC1	ZINC000013167099	564019607	/nfs/dbraw/zinc/01/96/07/564019607.db2.gz	LURUGEPLNXGVMR-UHFFFAOYSA-N	-1	0	341.791	3.631	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cccc(-n3cccn3)c2)c(Cl)c1	ZINC000045774251	564028628	/nfs/dbraw/zinc/02/86/28/564028628.db2.gz	BJNGYBMHUDORFU-UHFFFAOYSA-N	-1	0	347.827	3.635	50	0		EHAARM
Cc1[nH]c(=S)sc1CC(=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000159296174	564033827	/nfs/dbraw/zinc/03/38/27/564033827.db2.gz	ZTTPSVVNQVMHCI-UHFFFAOYSA-N	-1	0	349.264	3.934	50	0		EHAARM
N=c1[n-]nc(-c2cn(-c3ccccc3)nc2-c2ccc(F)cc2)s1	ZINC000606422417	564043411	/nfs/dbraw/zinc/04/34/11/564043411.db2.gz	YUEUUPCCSLVHDY-UHFFFAOYSA-N	-1	0	337.383	3.609	50	0		EHAARM
Cc1nc2cc(NC(=O)CC3(CC(=O)[O-])CCCCC3)ccc2o1	ZINC000029010536	564047297	/nfs/dbraw/zinc/04/72/97/564047297.db2.gz	NGHUDAHFVZFROP-UHFFFAOYSA-N	-1	0	330.384	3.890	50	0		EHAARM
O=c1cc([O-])c2sc3nc(C(F)(F)F)cc(C4CC4)c3c2[nH]1	ZINC000005813559	564055138	/nfs/dbraw/zinc/05/51/38/564055138.db2.gz	ANDSLDADBVQUAM-UHFFFAOYSA-N	-1	0	326.299	3.740	50	0		EHAARM
Cc1cc(-c2ccnc(-n3ncc(C(=O)[O-])c3C3CC3)n2)c(C)s1	ZINC000299774134	564060788	/nfs/dbraw/zinc/06/07/88/564060788.db2.gz	AXIMKPPTNSBLIV-UHFFFAOYSA-N	-1	0	340.408	3.583	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c(C)c1	ZINC000001298995	564063023	/nfs/dbraw/zinc/06/30/23/564063023.db2.gz	BEDYXCDTOBIPHX-UHFFFAOYSA-N	-1	0	348.402	3.522	50	0		EHAARM
Cc1ccc(C)c(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c1	ZINC000001295220	564063049	/nfs/dbraw/zinc/06/30/49/564063049.db2.gz	ARZWNUIYHNROCY-UHFFFAOYSA-N	-1	0	348.402	3.522	50	0		EHAARM
O=[P@@]([O-])(O)[C@@H](Nc1ccc(F)cc1)c1ccc(OC(F)F)cc1	ZINC000012950429	564080166	/nfs/dbraw/zinc/08/01/66/564080166.db2.gz	NOWNTVWKXFXQDO-CYBMUJFWSA-N	-1	0	347.229	3.716	50	0		EHAARM
CCOc1cc(C(C)C)c(S(=O)(=O)[N-]c2ccccn2)cc1C	ZINC000256029764	564089917	/nfs/dbraw/zinc/08/99/17/564089917.db2.gz	DWTFVXQHRJVISZ-UHFFFAOYSA-N	-1	0	334.441	3.713	50	0		EHAARM
C[S@](=O)c1ccc(NC(=O)Nc2ccc(O)c(Cl)c2)cc1F	ZINC000192221854	564090053	/nfs/dbraw/zinc/09/00/53/564090053.db2.gz	HIBGBJGHKJPEFS-QFIPXVFZSA-N	-1	0	342.779	3.566	50	0		EHAARM
Cc1nnc(-c2csc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)c2)o1	ZINC000065098570	564101078	/nfs/dbraw/zinc/10/10/78/564101078.db2.gz	QSPKUECHEWRIKV-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2cccc(C)c2C)c1=O	ZINC000065215426	564102882	/nfs/dbraw/zinc/10/28/82/564102882.db2.gz	JEXLVVGLUXNIER-UHFFFAOYSA-N	-1	0	342.420	3.658	50	0		EHAARM
Cc1cc(C(=O)N[C@@](C)(C(=O)[O-])C2CC2)sc1-c1ccc(F)cc1	ZINC000170592083	564108866	/nfs/dbraw/zinc/10/88/66/564108866.db2.gz	ZUQOTXORLJLHHF-GOSISDBHSA-N	-1	0	347.411	3.846	50	0		EHAARM
Cc1cc([N-]S(=O)(=O)c2ccco2)ccc1Oc1ccncc1	ZINC000195349097	564123312	/nfs/dbraw/zinc/12/33/12/564123312.db2.gz	RADSKCMSUREOJF-UHFFFAOYSA-N	-1	0	330.365	3.576	50	0		EHAARM
O=C([O-])[C@H](CC(=O)N1CCc2sc(Cl)cc2C1)c1ccccc1	ZINC000634922860	1137481059	/nfs/dbraw/zinc/48/10/59/1137481059.db2.gz	MCYFDIHIBXOBHB-CYBMUJFWSA-N	-1	0	349.839	3.545	50	0		EHAARM
O=C([O-])[C@H](CC(=O)N1CCC[C@]2(CC=CCC2)C1)c1ccccc1	ZINC000634885240	1137481184	/nfs/dbraw/zinc/48/11/84/1137481184.db2.gz	CNYXSCSNAOMZGA-YLJYHZDGSA-N	-1	0	327.424	3.594	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000004652569	210237904	/nfs/dbraw/zinc/23/79/04/210237904.db2.gz	LTDGNQBCXLPCMP-MNOVXSKESA-N	-1	0	330.211	3.501	50	0		EHAARM
CCc1ccc(S(=O)(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)cc1	ZINC000004370956	210181925	/nfs/dbraw/zinc/18/19/25/210181925.db2.gz	VLZLESHBHRYICE-UHFFFAOYSA-N	-1	0	349.358	3.614	50	0		EHAARM
O=c1c2cc(Br)ccc2[n-]c(=S)n1Cc1ccccc1	ZINC000101093699	219116115	/nfs/dbraw/zinc/11/61/15/219116115.db2.gz	YOPJMKIQSXAMSG-UHFFFAOYSA-N	-1	0	347.237	3.870	50	0		EHAARM
CCN(C(=O)Cc1c(C(=O)[O-])c(C)cn1CC)c1cccc(Cl)c1	ZINC000064980684	214819487	/nfs/dbraw/zinc/81/94/87/214819487.db2.gz	VLTZJRGWWWFNSX-UHFFFAOYSA-N	-1	0	348.830	3.764	50	0		EHAARM
CC(C)(C)c1nc2cc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])ccc2o1	ZINC000046834805	213811599	/nfs/dbraw/zinc/81/15/99/213811599.db2.gz	SHVUYRASNIKGOH-OLZOCXBDSA-N	-1	0	342.395	3.731	50	0		EHAARM
O=C([O-])C(F)(F)Sc1nnc(SCc2ccccc2)s1	ZINC000004050067	210106924	/nfs/dbraw/zinc/10/69/24/210106924.db2.gz	FHFVEQCVQICEGX-UHFFFAOYSA-N	-1	0	334.394	3.600	50	0		EHAARM
O=C([O-])C[C@H](c1ccc(C(F)(F)F)cc1)N1Cc2ccccc2C1=O	ZINC000004014652	210099994	/nfs/dbraw/zinc/09/99/94/210099994.db2.gz	GGJXKBHOEZYVDP-OAHLLOKOSA-N	-1	0	349.308	3.877	50	0		EHAARM
O=C1CCCC2=Nc3nonc3N[C@H](c3ccc4ncccc4c3)C12	ZINC000102736686	219226135	/nfs/dbraw/zinc/22/61/35/219226135.db2.gz	BJCXGJAZAAMXJP-MRXNPFEDSA-N	-1	0	333.351	3.853	50	0		EHAARM
O=C([O-])c1cn(-c2ccccc2)c2c1NC(=O)C[C@@H]2c1cccnc1	ZINC000040313102	213290633	/nfs/dbraw/zinc/29/06/33/213290633.db2.gz	YYYTVANVCLRRKW-CQSZACIVSA-N	-1	0	333.347	3.694	50	0	biogenic	EHAARM
O=C(NCc1cccnc1OC1CCCC1)c1ccc([O-])c(Cl)c1	ZINC000031982522	212781866	/nfs/dbraw/zinc/78/18/66/212781866.db2.gz	ILBABNUPRKYUEE-UHFFFAOYSA-N	-1	0	346.814	3.692	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@@H](C(=O)Nc2ccc(Cl)c(Cl)c2)C1	ZINC000000315611	209533147	/nfs/dbraw/zinc/53/31/47/209533147.db2.gz	STPKQKKLSGRYFG-QWRGUYRKSA-N	-1	0	328.195	3.989	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000018126298	211982582	/nfs/dbraw/zinc/98/25/82/211982582.db2.gz	GMAHHPTXNYEWFM-UHFFFAOYSA-N	-1	0	343.326	3.709	50	0		EHAARM
O=c1c2c3c(sc2[n-]c(=S)n1Cc1ccccn1)CCCCC3	ZINC000017071731	211953192	/nfs/dbraw/zinc/95/31/92/211953192.db2.gz	LIBOKSPISKWYEL-UHFFFAOYSA-N	-1	0	343.477	3.833	50	0		EHAARM
C[C@@H](NC(=O)c1cc(F)cc(Cl)c1[O-])c1nc2ccccc2[nH]1	ZINC000078995494	217169062	/nfs/dbraw/zinc/16/90/62/217169062.db2.gz	DQPDEQUBUCHJDT-MRVPVSSYSA-N	-1	0	333.750	3.552	50	0		EHAARM
Cc1cccc([C@H]2CC(c3cccs3)=NN2C(=O)CCC(=O)[O-])c1	ZINC000079106328	217195655	/nfs/dbraw/zinc/19/56/55/217195655.db2.gz	MAIOQASIRVPYGQ-OAHLLOKOSA-N	-1	0	342.420	3.599	50	0		EHAARM
O=C([O-])/C=C/c1cnc(/C=C/c2nccn2Cc2ccccc2)s1	ZINC000079943378	217265462	/nfs/dbraw/zinc/26/54/62/217265462.db2.gz	LOHZRQJMHJHOMF-KHHFIZIMSA-N	-1	0	337.404	3.656	50	0		EHAARM
O=S(=O)([N-]c1ccccc1OC(F)(F)F)c1ccc(F)cc1	ZINC000012525980	211398941	/nfs/dbraw/zinc/39/89/41/211398941.db2.gz	CNVYJCAWDIXWPQ-UHFFFAOYSA-N	-1	0	335.278	3.525	50	0		EHAARM
CC(C)c1cc(C(F)(F)F)c2c(n1)sc1c2[nH]c(=O)cc1[O-]	ZINC000012382854	211363081	/nfs/dbraw/zinc/36/30/81/211363081.db2.gz	LILUVBAINZRPBF-UHFFFAOYSA-N	-1	0	328.315	3.986	50	0		EHAARM
CCCCc1c(C)nc2c(-c3ccc(OC)cc3)c(C)[n-]n2c1=O	ZINC000009698363	211117013	/nfs/dbraw/zinc/11/70/13/211117013.db2.gz	VNALLBRYNOYSFQ-UHFFFAOYSA-N	-1	0	325.412	3.658	50	0		EHAARM
CCc1cccc([N-]S(=O)(=O)c2ccc(-c3cc(C)[nH]n3)s2)c1	ZINC000009686539	211113278	/nfs/dbraw/zinc/11/32/78/211113278.db2.gz	HVMRMBQPKFIFDL-UHFFFAOYSA-N	-1	0	347.465	3.810	50	0		EHAARM
Cc1cccc(C)c1OC1CN(C(=O)c2ccc([O-])c(Cl)c2)C1	ZINC000095388791	218320442	/nfs/dbraw/zinc/32/04/42/218320442.db2.gz	NOEXKXMIOGNHBF-UHFFFAOYSA-N	-1	0	331.799	3.566	50	0		EHAARM
O=C([O-])CC1(CNC(=O)CCc2c[nH]c3ccccc23)CCCCC1	ZINC000008764735	211002028	/nfs/dbraw/zinc/00/20/28/211002028.db2.gz	SNSCTRWPGBQXRD-UHFFFAOYSA-N	-1	0	342.439	3.642	50	0	biogenic	EHAARM
O=C([O-])COc1cccc(NC(=O)c2ccc(Cl)c(Cl)c2)c1	ZINC000008189165	210909050	/nfs/dbraw/zinc/90/90/50/210909050.db2.gz	UTBOYYXXTIKXMR-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
Cc1ccc2nc(NC(=O)[C@H]3CC(C)=CC[C@@H]3C(=O)[O-])sc2c1	ZINC000004976938	210346350	/nfs/dbraw/zinc/34/63/50/210346350.db2.gz	IVCSMRNUYHKNBU-RYUDHWBXSA-N	-1	0	330.409	3.600	50	0		EHAARM
COc1cc(Cl)c(S(=O)(=O)[N-]c2cccc(C)n2)cc1Cl	ZINC000004970471	210343726	/nfs/dbraw/zinc/34/37/26/210343726.db2.gz	QDHZKKLZEJDOAE-UHFFFAOYSA-N	-1	0	347.223	3.506	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc2oc3c(c2c1)CCCC3	ZINC000004788698	210278824	/nfs/dbraw/zinc/27/88/24/210278824.db2.gz	VLLLKBSANCJDDA-HUUCEWRRSA-N	-1	0	339.391	3.917	50	0		EHAARM
C[C@H](Sc1nc(-c2ccccc2)cc(C(F)(F)F)n1)C(=O)[O-]	ZINC000000268087	563269359	/nfs/dbraw/zinc/26/93/59/563269359.db2.gz	WUJPUDGNAYCPGB-QMMMGPOBSA-N	-1	0	328.315	3.728	50	0		EHAARM
Nc1nc(Nc2ccc(Cl)cc2)nc(-c2cc(Cl)ccc2[O-])n1	ZINC000000347213	563288065	/nfs/dbraw/zinc/28/80/65/563288065.db2.gz	WLDARDNBOLWMHI-UHFFFAOYSA-N	-1	0	348.193	3.877	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[O-]	ZINC000002386870	563431208	/nfs/dbraw/zinc/43/12/08/563431208.db2.gz	KSDWBXFRQWMWHO-LLVKDONJSA-N	-1	0	334.199	3.514	50	0		EHAARM
Cc1cc(Br)ccc1[N-]S(=O)(=O)c1cccs1	ZINC000006706507	563581271	/nfs/dbraw/zinc/58/12/71/563581271.db2.gz	JXZOZKACCRLABB-UHFFFAOYSA-N	-1	0	332.244	3.620	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cn1)c1ccc(Cl)cc1Cl	ZINC000006706860	563581295	/nfs/dbraw/zinc/58/12/95/563581295.db2.gz	PGMJLVXHVWCNNM-UHFFFAOYSA-N	-1	0	337.615	3.843	50	0		EHAARM
Cc1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])c(Br)c1	ZINC000002744408	563611216	/nfs/dbraw/zinc/61/12/16/563611216.db2.gz	OQGQWGTZRYVECK-GHMZBOCLSA-N	-1	0	340.217	3.587	50	0		EHAARM
C[C@@H]1CCc2c(sc3[n-]c(=S)n(Cc4cccnc4)c(=O)c23)C1	ZINC000017071733	563834989	/nfs/dbraw/zinc/83/49/89/563834989.db2.gz	GRFGWRMOMMCUSZ-SNVBAGLBSA-N	-1	0	343.477	3.689	50	0		EHAARM
O=C([O-])[C@@]1(Cc2cccc(Cl)c2)CCCN(c2ncccc2F)C1	ZINC000071721291	563964795	/nfs/dbraw/zinc/96/47/95/563964795.db2.gz	IESGEADFIMIWIY-GOSISDBHSA-N	-1	0	348.805	3.788	50	0		EHAARM
CC(=O)NCC[C@H]1CCCCN1Cc1c(Cl)ccc([O-])c1Cl	ZINC000077425621	563969551	/nfs/dbraw/zinc/96/95/51/563969551.db2.gz	LHMDXDZFRBBGBZ-GFCCVEGCSA-N	-1	0	345.270	3.580	50	0		EHAARM
O=C([O-])[C@@H](NC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccc(F)cc1	ZINC000095520826	563977415	/nfs/dbraw/zinc/97/74/15/563977415.db2.gz	CJJSXJUHVLPDRI-HLJROMEYSA-N	-1	0	345.414	3.674	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@H](CCc2ccccc2)[C@H]1C(=O)[O-]	ZINC000221035989	563989594	/nfs/dbraw/zinc/98/95/94/563989594.db2.gz	PRZZNHCYHUYMIC-CVEARBPZSA-N	-1	0	333.428	3.720	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@H]1CCCC[C@H]1C)c2=O	ZINC000000425246	563998955	/nfs/dbraw/zinc/99/89/55/563998955.db2.gz	ISKIQBBLHZBAII-YGRLFVJLSA-N	-1	0	332.425	3.597	50	0		EHAARM
CC(C)(C)OC1CCN(C(=O)c2ccc3[n-]c(=S)oc3c2)CC1	ZINC000151529265	564004328	/nfs/dbraw/zinc/00/43/28/564004328.db2.gz	UBSGHGCQJOUACH-UHFFFAOYSA-N	-1	0	334.441	3.536	50	0		EHAARM
Cc1ccc(NC(=O)CC2(C(=O)[O-])CCCC2)c(Br)c1	ZINC000012697766	564018790	/nfs/dbraw/zinc/01/87/90/564018790.db2.gz	PJPDTPUOPBDHOF-UHFFFAOYSA-N	-1	0	340.217	3.731	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)C1	ZINC000108462633	564028261	/nfs/dbraw/zinc/02/82/61/564028261.db2.gz	RCKGLMJLSQQWLG-NWANDNLSSA-N	-1	0	335.831	3.547	50	0		EHAARM
O=C([O-])C1CCC(Nc2ccc(NC(=O)c3ccco3)cc2)CC1	ZINC000263447930	564056362	/nfs/dbraw/zinc/05/63/62/564056362.db2.gz	GKACRHMTSLYSIB-UHFFFAOYSA-N	-1	0	328.368	3.587	50	0		EHAARM
O=C([O-])[C@@H](CC(=O)Nc1cccc(Br)c1)c1ccccc1	ZINC000012696617	564063410	/nfs/dbraw/zinc/06/34/10/564063410.db2.gz	NUAKBFXQQQRJDZ-AWEZNQCLSA-N	-1	0	348.196	3.646	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccccc2F)cc1Br	ZINC000012745294	564065616	/nfs/dbraw/zinc/06/56/16/564065616.db2.gz	DSGGNNVIXSOUEO-UHFFFAOYSA-N	-1	0	344.205	3.697	50	0		EHAARM
O=C([O-])C1(NC(=O)Cc2ccc(-c3ccccc3)cc2)CCCCC1	ZINC000012771506	564068952	/nfs/dbraw/zinc/06/89/52/564068952.db2.gz	OUAFEASMTVZNPQ-UHFFFAOYSA-N	-1	0	337.419	3.800	50	0		EHAARM
Cc1cccc2sc(NC(=O)[C@@H]3CC(C)=CC[C@H]3C(=O)[O-])nc21	ZINC000006217820	564082988	/nfs/dbraw/zinc/08/29/88/564082988.db2.gz	GJCVSXKJGOPOAN-VXGBXAGGSA-N	-1	0	330.409	3.600	50	0		EHAARM
O=S(=O)([N-]c1ccccc1)c1c(F)cc(F)cc1Br	ZINC000006317227	564084578	/nfs/dbraw/zinc/08/45/78/564084578.db2.gz	ZLIDOLNGDSXKLT-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
Cc1nc(-c2cccc([N-]S(=O)(=O)c3cccs3)c2)cs1	ZINC000006582355	564092299	/nfs/dbraw/zinc/09/22/99/564092299.db2.gz	MMCMWYSMAWYWGS-UHFFFAOYSA-N	-1	0	336.463	3.981	50	0		EHAARM
COc1cccc(-c2cc(C(=O)[O-])c3c(n[nH]c3-c3ccccc3)n2)c1	ZINC000006748972	564097051	/nfs/dbraw/zinc/09/70/51/564097051.db2.gz	SZAYVQCUIRNLKB-UHFFFAOYSA-N	-1	0	345.358	3.999	50	0		EHAARM
Cc1nnc(-c2ccc(S(=O)(=O)[N-]c3c(C)cccc3C)s2)o1	ZINC000064919951	564097698	/nfs/dbraw/zinc/09/76/98/564097698.db2.gz	AEAGNNFLVKEQLL-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)cc1C	ZINC000065031116	564099773	/nfs/dbraw/zinc/09/97/73/564099773.db2.gz	BAZSIPHTDLESFJ-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CC1=Nc2c(c(=O)[nH]n2C(C)C)[C@@H](c2ccc(C(=O)[O-])cc2)S1	ZINC000071286118	564110942	/nfs/dbraw/zinc/11/09/42/564110942.db2.gz	DDWOQNJYOGHMSW-CYBMUJFWSA-N	-1	0	331.397	3.754	50	0		EHAARM
O=C(Nc1ccccc1[N-]S(=O)(=O)c1ccccc1)C1=CCCC1	ZINC000089847796	564114246	/nfs/dbraw/zinc/11/42/46/564114246.db2.gz	FMIDQZCQSSVJOY-UHFFFAOYSA-N	-1	0	342.420	3.536	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)c1cc(C2CC2)n(C(C)(C)C)n1	ZINC000225444488	564134818	/nfs/dbraw/zinc/13/48/18/564134818.db2.gz	AWXUVZUEVBXLIE-UHFFFAOYSA-N	-1	0	341.411	3.774	50	0		EHAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)c2coc3ccccc23)CC1	ZINC000095959395	564142661	/nfs/dbraw/zinc/14/26/61/564142661.db2.gz	GJJXJAUCXZRBDS-UHFFFAOYSA-N	-1	0	349.386	3.691	50	0		EHAARM
Cc1ccc(-c2nc3ccc(Cl)cc3n2O[C@H](C)C(=O)[O-])cc1	ZINC000002508523	564150153	/nfs/dbraw/zinc/15/01/53/564150153.db2.gz	CCHSVFWARMTYNG-LLVKDONJSA-N	-1	0	330.771	3.567	50	0		EHAARM
CCCCNC(=O)c1ccc2c(c1)[n-]c(=S)n(C1CCCC1)c2=O	ZINC000002971685	564153915	/nfs/dbraw/zinc/15/39/15/564153915.db2.gz	LBLKNDMXUOPPHK-UHFFFAOYSA-N	-1	0	345.468	3.704	50	0		EHAARM
Cc1ccc(-c2nc3ccc(Cl)cc3n2O[C@@H](C)C(=O)[O-])cc1	ZINC000003063696	564154905	/nfs/dbraw/zinc/15/49/05/564154905.db2.gz	CCHSVFWARMTYNG-NSHDSACASA-N	-1	0	330.771	3.567	50	0		EHAARM
COC(=O)c1ccc(NC(=O)CC2(CC(=O)[O-])CCCCC2)c(C)c1	ZINC000042623623	564175101	/nfs/dbraw/zinc/17/51/01/564175101.db2.gz	YAUAZDJAZSPMOR-UHFFFAOYSA-N	-1	0	347.411	3.535	50	0		EHAARM
O=C([O-])c1ccc(C=C(Cl)c2nc3ccccc3c(=O)[nH]2)cc1	ZINC000096767678	958340505	/nfs/dbraw/zinc/34/05/05/958340505.db2.gz	COVQQJNYECOMBF-UKTHLTGXSA-N	-1	0	326.739	3.771	50	0		EHAARM
Cc1cc(Br)c(C(=O)[O-])cc1NC(=O)OC(C)(C)C	ZINC000306674579	1021527426	/nfs/dbraw/zinc/52/74/26/1021527426.db2.gz	QRWKDAKEEJZGCZ-UHFFFAOYSA-N	-1	0	330.178	3.803	50	0		EHAARM
CC(C)c1nc(/C=C/c2c(Cl)nc(Cl)n2C)ncc1C(=O)[O-]	ZINC000170635760	1033370636	/nfs/dbraw/zinc/37/06/36/1033370636.db2.gz	DLCRUMAXZAWLCN-SNAWJCMRSA-N	-1	0	341.198	3.509	50	0		EHAARM
COc1cc(-c2cc(F)ccc2OC[C@H]2CCOC2)ccc1C(=O)[O-]	ZINC000565237876	1130750857	/nfs/dbraw/zinc/75/08/57/1130750857.db2.gz	LSXHPKMQGXWCMK-LBPRGKRZSA-N	-1	0	346.354	3.615	50	0		EHAARM
COc1ccc(-c2c(C)[n-]n3c2nc(Cc2ccccc2)cc3=O)cc1	ZINC000004705413	210255333	/nfs/dbraw/zinc/25/53/33/210255333.db2.gz	OSUFHFBMYNEJEF-UHFFFAOYSA-N	-1	0	345.402	3.597	50	0		EHAARM
COc1ccccc1NC(=O)c1c(C)nc2ccccc2c1C(=O)[O-]	ZINC000002430105	209848931	/nfs/dbraw/zinc/84/89/31/209848931.db2.gz	HIHSZFIQBRRKDN-UHFFFAOYSA-N	-1	0	336.347	3.502	50	0		EHAARM
CCOc1ccc(NC(=O)C[C@@H](Cc2ccc(C)cc2)C(=O)[O-])cc1	ZINC000035141838	213009252	/nfs/dbraw/zinc/00/92/52/213009252.db2.gz	DWDCNHAXXBTHKL-MRXNPFEDSA-N	-1	0	341.407	3.666	50	0		EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CCCC2)C12CCCCC2	ZINC000030822674	212710877	/nfs/dbraw/zinc/71/08/77/212710877.db2.gz	ANKIAATVFMALOB-KRWDZBQOSA-N	-1	0	327.424	3.956	50	0	biogenic	EHAARM
CC(=O)Oc1ccc(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)cc1	ZINC000000312853	209530316	/nfs/dbraw/zinc/53/03/16/209530316.db2.gz	YHIIQXZSSOULLX-UHFFFAOYSA-N	-1	0	340.162	3.877	50	0		EHAARM
O=S(=O)([N-]c1ccccn1)c1ccc(Oc2ccccc2)cc1	ZINC000000051686	209390820	/nfs/dbraw/zinc/39/08/20/209390820.db2.gz	SZQSEHPSIRLYEM-UHFFFAOYSA-N	-1	0	326.377	3.675	50	0		EHAARM
CC(=C\c1ccccc1)/C=C1/SC(=O)N(CCCC(=O)[O-])C1=O	ZINC000027229267	212550139	/nfs/dbraw/zinc/55/01/39/212550139.db2.gz	GYNBIQYSIWHSCB-NCPBJGSTSA-N	-1	0	331.393	3.534	50	0		EHAARM
CCOc1ccc(-c2noc(-c3c[n-]c4ccc(C)cc4c3=O)n2)cc1	ZINC000075352728	216611887	/nfs/dbraw/zinc/61/18/87/216611887.db2.gz	PIBVSIKNGVUCOM-UHFFFAOYSA-N	-1	0	347.374	3.952	50	0		EHAARM
O=C([O-])c1ccc(F)c(NC(=O)c2ccccc2C(F)(F)F)c1	ZINC000225442621	241864419	/nfs/dbraw/zinc/86/44/19/241864419.db2.gz	WLZHPRLJDKZEGY-UHFFFAOYSA-N	-1	0	327.233	3.795	50	0		EHAARM
Cc1nc(-c2cc(C(=O)N3CCCC[C@H]3CCC(=O)[O-])co2)cs1	ZINC000237788770	242794554	/nfs/dbraw/zinc/79/45/54/242794554.db2.gz	GBQUCSOLVOSZIM-ZDUSSCGKSA-N	-1	0	348.424	3.571	50	0		EHAARM
CCc1ccc([C@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)s1	ZINC000020617186	212156486	/nfs/dbraw/zinc/15/64/86/212156486.db2.gz	XZYUWMYRDNFJAQ-MWLCHTKSSA-N	-1	0	345.346	3.866	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000013021849	211513865	/nfs/dbraw/zinc/51/38/65/211513865.db2.gz	RXRPOEJOFUHQDK-RBUKOAKNSA-N	-1	0	333.387	3.863	50	0		EHAARM
CC(C)(C)C(=O)Nc1cccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])c1	ZINC000012381326	211361472	/nfs/dbraw/zinc/36/14/72/211361472.db2.gz	UJJJUWGCLMWZPE-GJZGRUSLSA-N	-1	0	346.427	3.501	50	0		EHAARM
CC(C)c1ccc(S(=O)(=O)[N-]c2nc3c(s2)CCCC3)cc1	ZINC000012383064	211363210	/nfs/dbraw/zinc/36/32/10/211363210.db2.gz	OWZNJHPZQJZIFZ-UHFFFAOYSA-N	-1	0	336.482	3.946	50	0		EHAARM
Cc1c(C(=O)Nc2ccc(C(=O)[O-])cc2)oc2c1[C@@H](O)CC(C)(C)C2	ZINC000008992394	211028301	/nfs/dbraw/zinc/02/83/01/211028301.db2.gz	LYZPUTREXWENRJ-ZDUSSCGKSA-N	-1	0	343.379	3.544	50	0		EHAARM
CCc1ccccc1OC1CN(C(=O)c2ccc([O-])c(Cl)c2)C1	ZINC000095385585	218316997	/nfs/dbraw/zinc/31/69/97/218316997.db2.gz	FQRCNWBJLRJRTG-UHFFFAOYSA-N	-1	0	331.799	3.511	50	0		EHAARM
Cc1oc(CN(C)C(=O)c2ccc(C(F)(F)F)cc2)cc1C(=O)[O-]	ZINC000095425057	218366783	/nfs/dbraw/zinc/36/67/83/218366783.db2.gz	KYORLJZRRFSWCY-UHFFFAOYSA-N	-1	0	341.285	3.577	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccccc2Cl)cc1Cl	ZINC000005126984	210394455	/nfs/dbraw/zinc/39/44/55/210394455.db2.gz	KVNKFZUDUZGUNI-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
O=C([O-])CCCC(=O)N1N=C(c2ccccc2)C[C@H]1c1ccccc1	ZINC000005023951	210365113	/nfs/dbraw/zinc/36/51/13/210365113.db2.gz	BGFZGVJPBAPETG-SFHVURJKSA-N	-1	0	336.391	3.619	50	0		EHAARM
CCOc1ccc(N[C@@H](c2ccc(F)cc2)[P@@](=O)([O-])O)cc1	ZINC000012536578	258054642	/nfs/dbraw/zinc/05/46/42/258054642.db2.gz	VJKPMEUICKFXRC-OAHLLOKOSA-N	-1	0	325.276	3.513	50	0		EHAARM
O=[P@@]([O-])(O)[C@H](Nc1ccc(OC(F)F)cc1)c1cccs1	ZINC000012537061	258055152	/nfs/dbraw/zinc/05/51/52/258055152.db2.gz	IOZILNFNIQOTRP-NSHDSACASA-N	-1	0	335.268	3.638	50	0		EHAARM
COc1cccc(/C=C2/Sc3ccc(C(=O)[O-])cc3N(C)C2=O)c1	ZINC000003029891	135659053	/nfs/dbraw/zinc/65/90/53/135659053.db2.gz	UTXSAQGYHTZPGU-CXUHLZMHSA-N	-1	0	341.388	3.503	50	0		EHAARM
COc1ccc(-c2noc(CC(=O)[O-])c2-c2ccc(OC)cc2)cc1	ZINC000000003767	563211485	/nfs/dbraw/zinc/21/14/85/563211485.db2.gz	DJEIHHYCDCTAAH-UHFFFAOYSA-N	-1	0	339.347	3.653	50	0	in-man	EHAARM
CCOc1ccc(Cc2n[n-]c(=S)n2-c2ccc(OC)cc2)cc1	ZINC000000392158	563304216	/nfs/dbraw/zinc/30/42/16/563304216.db2.gz	ZBKPJDOBNPSLIR-UHFFFAOYSA-N	-1	0	341.436	3.928	50	0		EHAARM
CC(=O)NC([N-]c1ccccc1Cl)(C(F)(F)F)C(F)(F)F	ZINC000003138657	563474254	/nfs/dbraw/zinc/47/42/54/563474254.db2.gz	KHPDMVULMPTXOG-UHFFFAOYSA-N	-1	0	334.647	3.709	50	0		EHAARM
Cc1noc(C2CC2)c1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000126905701	563635993	/nfs/dbraw/zinc/63/59/93/563635993.db2.gz	KCBUBAZYUMKAPY-UHFFFAOYSA-N	-1	0	346.330	3.680	50	0		EHAARM
CCCCCOc1cc(C)ccc1S(=O)(=O)[N-]c1cccnc1	ZINC000012560572	563663161	/nfs/dbraw/zinc/66/31/61/563663161.db2.gz	LHUWTSMDKHCZNA-UHFFFAOYSA-N	-1	0	334.441	3.760	50	0		EHAARM
COC(=O)c1cccc(Nc2cc(C)nc(-c3ccccc3[O-])n2)c1	ZINC000013127867	563689952	/nfs/dbraw/zinc/68/99/52/563689952.db2.gz	JNFNAYSDLSPUSC-UHFFFAOYSA-N	-1	0	335.363	3.688	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)C[C@H](C(=O)[O-])c1ccccc1	ZINC000013250265	563693018	/nfs/dbraw/zinc/69/30/18/563693018.db2.gz	FYQUYGFSNNNGQX-ZDUSSCGKSA-N	-1	0	333.771	3.546	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)c1cc(F)c(F)cc1Cl)c1cccs1	ZINC000013389515	563697439	/nfs/dbraw/zinc/69/74/39/563697439.db2.gz	UAJMBGSZSREYKX-NSHDSACASA-N	-1	0	345.754	3.626	50	0		EHAARM
CCOc1cc(/C=C/C(=O)[O-])c(Br)cc1OC(C)C	ZINC000013747643	563720838	/nfs/dbraw/zinc/72/08/38/563720838.db2.gz	MLUZYHXZRGOXOK-AATRIKPKSA-N	-1	0	329.190	3.733	50	0		EHAARM
CCc1c(C)sc2[n-]c(=S)n(Cc3cnn(CC)c3C)c(=O)c12	ZINC000017072452	563836056	/nfs/dbraw/zinc/83/60/56/563836056.db2.gz	DWCIYZGDCZUUJF-UHFFFAOYSA-N	-1	0	348.497	3.565	50	0		EHAARM
COc1ccc(-c2c(C)sc3[n-]c(=S)[nH]c(=O)c32)cc1OC	ZINC000017778739	563845460	/nfs/dbraw/zinc/84/54/60/563845460.db2.gz	JOHLXVNHJONFDU-UHFFFAOYSA-N	-1	0	334.422	3.640	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC000043589640	563913532	/nfs/dbraw/zinc/91/35/32/563913532.db2.gz	PIIMGGRNLYUBAY-SNVBAGLBSA-N	-1	0	330.211	3.710	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1c(C)cc(C)cc1C	ZINC000032971323	563920085	/nfs/dbraw/zinc/92/00/85/563920085.db2.gz	ITLKNQDYRRJIBA-UHFFFAOYSA-N	-1	0	346.408	3.969	50	0		EHAARM
COc1ccc(Nc2nccc(Nc3ccc(C(=O)[O-])cc3)n2)cc1	ZINC000096693813	563962199	/nfs/dbraw/zinc/96/21/99/563962199.db2.gz	SNCHAMOOIUABSJ-UHFFFAOYSA-N	-1	0	336.351	3.671	50	0		EHAARM
O=C([O-])[C@@]1(Cc2ccc(F)cc2)CCCN(c2ccc(Cl)cn2)C1	ZINC000071764687	563965465	/nfs/dbraw/zinc/96/54/65/563965465.db2.gz	ZPMAHVKFJIDBTR-GOSISDBHSA-N	-1	0	348.805	3.788	50	0		EHAARM
Cc1cccc(-c2noc(CSc3ccc(CC(=O)[O-])cc3)n2)c1	ZINC000097103272	563967601	/nfs/dbraw/zinc/96/76/01/563967601.db2.gz	YGGSSKHJUNEGNC-UHFFFAOYSA-N	-1	0	340.404	3.964	50	0		EHAARM
O=C([O-])[C@H](Nc1nc(C(F)(F)F)nc2ccccc21)c1ccccc1	ZINC000000151344	563987406	/nfs/dbraw/zinc/98/74/06/563987406.db2.gz	ZPSCGBCFUMEHEO-CYBMUJFWSA-N	-1	0	347.296	3.886	50	0		EHAARM
Cc1cc(C)c([C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])cc1C	ZINC000221032665	563989599	/nfs/dbraw/zinc/98/95/99/563989599.db2.gz	MRDDWYJJPJNRBG-HOCLYGCPSA-N	-1	0	333.428	3.789	50	0		EHAARM
COc1ccccc1Cn1c(=O)c2ccc(Cl)cc2[n-]c1=S	ZINC000000425273	563998939	/nfs/dbraw/zinc/99/89/39/563998939.db2.gz	XMJVSKUDKVNTMW-UHFFFAOYSA-N	-1	0	332.812	3.769	50	0		EHAARM
C[C@@H](NC(=O)C(C)(C)C1CCCC1)c1ccc(OCC(=O)[O-])cc1	ZINC000262868882	564013029	/nfs/dbraw/zinc/01/30/29/564013029.db2.gz	AVIKCVNACMTVBD-CYBMUJFWSA-N	-1	0	333.428	3.544	50	0		EHAARM
COc1ccc(CC(=O)Nc2cc(Cl)c([O-])c(Cl)c2)cc1	ZINC000018042244	564017854	/nfs/dbraw/zinc/01/78/54/564017854.db2.gz	TZTXGUYAIGEJFY-UHFFFAOYSA-N	-1	0	326.179	3.889	50	0		EHAARM
CSc1ccccc1NC(=O)CSc1ccccc1C(=O)[O-]	ZINC000012930883	564019296	/nfs/dbraw/zinc/01/92/96/564019296.db2.gz	NUUNJISIJCKOKU-UHFFFAOYSA-N	-1	0	333.434	3.838	50	0		EHAARM
CCn1c2ccccc2c([O-])c(-c2nc(-c3ccc(C)cc3)no2)c1=O	ZINC000101725567	564019545	/nfs/dbraw/zinc/01/95/45/564019545.db2.gz	JZUIJSWXAZVPCM-UHFFFAOYSA-N	-1	0	347.374	3.752	50	0		EHAARM
CSc1nc2ccc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])cc2s1	ZINC000013249561	564019642	/nfs/dbraw/zinc/01/96/42/564019642.db2.gz	DBLDZZWBSRXRGV-MNOVXSKESA-N	-1	0	348.449	3.624	50	0		EHAARM
C[C@H]([C@H]1CCCO1)n1c(=O)c2c([n-]c1=S)sc1c2CCCC1	ZINC000017070775	564024863	/nfs/dbraw/zinc/02/48/63/564024863.db2.gz	YSISXRAGZZJPCJ-MWLCHTKSSA-N	-1	0	336.482	3.739	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2cc(-c3ccno3)oc2C)cc1	ZINC000032971277	564036337	/nfs/dbraw/zinc/03/63/37/564036337.db2.gz	KYMMWTSIWBLKQR-UHFFFAOYSA-N	-1	0	332.381	3.606	50	0		EHAARM
CCc1nc(/C(C#N)=C/c2cccc(O[C@@H](C)C(=O)[O-])c2)sc1C	ZINC000096291708	564049711	/nfs/dbraw/zinc/04/97/11/564049711.db2.gz	FCYJCNVQEYXYTJ-KYJZABPNSA-N	-1	0	342.420	3.930	50	0		EHAARM
CCOC(=O)c1ccc(-c2c(C)oc3cc([O-])cc(C)c3c2=O)o1	ZINC000005905859	564056928	/nfs/dbraw/zinc/05/69/28/564056928.db2.gz	OHTODRBRTLVGNP-UHFFFAOYSA-N	-1	0	328.320	3.552	50	0	biogenic	EHAARM
Cc1nn(-c2ccccn2)c2nc(-c3cccs3)cc(C(=O)[O-])c12	ZINC000003298715	564059123	/nfs/dbraw/zinc/05/91/23/564059123.db2.gz	FXLHMWCKIUTJCW-UHFFFAOYSA-N	-1	0	336.376	3.551	50	0		EHAARM
O=C([O-])c1cc(/C=C/c2ccc3c(c2)OCCO3)nc2ccccc21	ZINC000007155800	564082079	/nfs/dbraw/zinc/08/20/79/564082079.db2.gz	NTTLEYZAFWUIGA-FNORWQNLSA-N	-1	0	333.343	3.875	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@H](CC(C)C)C(=O)[O-])n1	ZINC000006225946	564083077	/nfs/dbraw/zinc/08/30/77/564083077.db2.gz	JMENKYVSPWBBQI-GFCCVEGCSA-N	-1	0	327.384	3.850	50	0		EHAARM
CCCOc1ccccc1[N-]S(=O)(=O)c1ccccc1Cl	ZINC000006315717	564084540	/nfs/dbraw/zinc/08/45/40/564084540.db2.gz	HUNSAXYSBBGVIO-UHFFFAOYSA-N	-1	0	325.817	3.930	50	0		EHAARM
CCCCN(CCCC)C(=O)c1nsnc1-c1ccccc1O	ZINC000017990974	564085678	/nfs/dbraw/zinc/08/56/78/564085678.db2.gz	JHCFGQUKCJFDDS-UHFFFAOYSA-N	-1	0	333.457	3.953	50	0		EHAARM
COc1ccccc1[C@H]1CCN(C(=O)c2cc(F)cc(Cl)c2[O-])C1	ZINC000089473591	564090762	/nfs/dbraw/zinc/09/07/62/564090762.db2.gz	PBCWRNHLSZPVPI-NSHDSACASA-N	-1	0	349.789	3.823	50	0		EHAARM
COc1cc(C(=O)[O-])c(NC(=O)OCc2ccccc2)cc1Cl	ZINC000536960196	564091807	/nfs/dbraw/zinc/09/18/07/564091807.db2.gz	TZQSMHASSDXTLR-UHFFFAOYSA-N	-1	0	335.743	3.796	50	0		EHAARM
C[C@H](C(=O)NCCCC(=O)[O-])c1ccc(-c2ccccc2)c(F)c1	ZINC000006764275	564097336	/nfs/dbraw/zinc/09/73/36/564097336.db2.gz	LHLFIBBLXOUKEB-ZDUSSCGKSA-N	-1	0	329.371	3.577	50	0		EHAARM
Cc1nnc(-c2ccc(S(=O)(=O)[N-]c3cc(C)ccc3C)s2)o1	ZINC000064920009	564097678	/nfs/dbraw/zinc/09/76/78/564097678.db2.gz	ZFGPJCHYZZNQKE-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
O=S(=O)([N-]c1cc(-c2ccsc2)no1)c1cccc(Cl)c1	ZINC000065153425	564102069	/nfs/dbraw/zinc/10/20/69/564102069.db2.gz	CAIHMAIRVYNDPI-UHFFFAOYSA-N	-1	0	340.813	3.857	50	0		EHAARM
O=C([O-])Cc1c(-c2ccsc2)oc2c1c(=O)oc1ccccc21	ZINC000524731694	564103720	/nfs/dbraw/zinc/10/37/20/564103720.db2.gz	HPQAXULSAUQPKV-UHFFFAOYSA-N	-1	0	326.329	3.895	50	0	biogenic	EHAARM
COc1cc(Cl)c(C)cc1[N-]S(=O)(=O)c1cccc(F)c1	ZINC000007428435	564108448	/nfs/dbraw/zinc/10/84/48/564108448.db2.gz	MFBDSOJOUINONI-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
COc1cccc(-c2cc(=O)n3[n-]c(C)c(-c4ccccc4)c3n2)c1	ZINC000017045817	564116231	/nfs/dbraw/zinc/11/62/31/564116231.db2.gz	XIQXHACQTFMRMH-UHFFFAOYSA-N	-1	0	331.375	3.674	50	0		EHAARM
O=C([O-])Cc1ccccc1NC(=O)c1cc(F)cc(C(F)(F)F)c1	ZINC000195542618	564123681	/nfs/dbraw/zinc/12/36/81/564123681.db2.gz	PYVDWJUIVXBERA-UHFFFAOYSA-N	-1	0	341.260	3.724	50	0		EHAARM
Cc1ncc([N-]S(=O)(=O)c2ccc(Cl)cc2)c(C)c1Cl	ZINC000096182462	564145845	/nfs/dbraw/zinc/14/58/45/564145845.db2.gz	PZAWPVRQXLHUOZ-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1	ZINC000096479742	564148583	/nfs/dbraw/zinc/14/85/83/564148583.db2.gz	SLGWRFLXCDWQDC-UONOGXRCSA-N	-1	0	343.345	3.555	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)/C=C\c2ccc(Cl)s2)C1	ZINC000218456787	564160016	/nfs/dbraw/zinc/16/00/16/564160016.db2.gz	YDTCJJHASGYGEY-XOIDGJRKSA-N	-1	0	327.833	3.518	50	0		EHAARM
O=C([O-])[C@@H]1CCCN1c1nnc(-c2cc(Cl)cc(Cl)c2)s1	ZINC000263445411	564162198	/nfs/dbraw/zinc/16/21/98/564162198.db2.gz	YJMBRXKERPYPIU-JTQLQIEISA-N	-1	0	344.223	3.565	50	0		EHAARM
O=C([O-])[C@@H]1CCCCN1Cc1nc(-c2c(F)cccc2F)cs1	ZINC000263563874	564163946	/nfs/dbraw/zinc/16/39/46/564163946.db2.gz	DPNRJENYAHONLL-ZDUSSCGKSA-N	-1	0	338.379	3.527	50	0		EHAARM
C[C@@H](c1cccnc1)N(C)C(=O)c1ccc(Cl)c(Cl)c1[O-]	ZINC000069703654	564171620	/nfs/dbraw/zinc/17/16/20/564171620.db2.gz	AHBZTYJHYSGSJG-VIFPVBQESA-N	-1	0	325.195	3.927	50	0		EHAARM
Cc1ccc([C@H](c2sc3nc(C)nn3c2[O-])N2CCCCCC2)o1	ZINC000041637145	564174229	/nfs/dbraw/zinc/17/42/29/564174229.db2.gz	VXPMXAJUPSOCOU-CQSZACIVSA-N	-1	0	346.456	3.672	50	0		EHAARM
COc1ccc(-c2cc(=O)n3[n-]c(-c4cccc(F)c4)cc3n2)cc1	ZINC000106299902	564177274	/nfs/dbraw/zinc/17/72/74/564177274.db2.gz	IDKRLCOKGLWZNB-UHFFFAOYSA-N	-1	0	335.338	3.917	50	0		EHAARM
O=C([O-])/C=C/c1csc(/C=C/c2cnn(Cc3ccccc3)c2)n1	ZINC000170617535	1033339109	/nfs/dbraw/zinc/33/91/09/1033339109.db2.gz	FDKMETPBDVMTSN-CDJQDVQCSA-N	-1	0	337.404	3.656	50	0		EHAARM
O=C(/C=C\c1ccccc1)Nc1sc2c(c1C(=O)[O-])CCCC2	ZINC000016696296	1035420874	/nfs/dbraw/zinc/42/08/74/1035420874.db2.gz	SDJSLSJBWUWELZ-KHPPLWFESA-N	-1	0	327.405	3.977	50	0		EHAARM
Cc1ccc(Cl)c(S(=O)(=O)[N-]c2cnn([C@H](C)C3CC3)c2)c1	ZINC000187743083	1037496729	/nfs/dbraw/zinc/49/67/29/1037496729.db2.gz	VRKNDYMITANBPC-LLVKDONJSA-N	-1	0	339.848	3.617	50	0		EHAARM
Cc1ccc2nc3c(c(C(=O)[O-])c2c1)CCC/C3=C\c1cnn(C)c1	ZINC000014179036	1038601598	/nfs/dbraw/zinc/60/15/98/1038601598.db2.gz	NFGTVZWXFGDOGB-NTEUORMPSA-N	-1	0	333.391	3.852	50	0		EHAARM
CCc1ccc([C@@H]2CCCN2C(=O)N=c2nc(C(C)(C)C)[n-]s2)o1	ZINC000331694543	1041071334	/nfs/dbraw/zinc/07/13/34/1041071334.db2.gz	YSIQTMRMWSFODN-LBPRGKRZSA-N	-1	0	348.472	3.782	50	0		EHAARM
C[C@H](CC(=O)[O-])CC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000565550199	1130767476	/nfs/dbraw/zinc/76/74/76/1130767476.db2.gz	VBXGCRVYJJQGGI-KXBFYZLASA-N	-1	0	337.419	3.814	50	0		EHAARM
O=C([O-])c1cc2nc(-c3ccc(Cl)cc3)cc(C(F)(F)F)n2n1	ZINC000004731376	210262236	/nfs/dbraw/zinc/26/22/36/210262236.db2.gz	PHWXMWUQBLSUBM-UHFFFAOYSA-N	-1	0	341.676	3.767	50	0		EHAARM
CCn1ccc2cc(NC(=O)c3cc(=O)c4ccccc4[n-]3)ccc21	ZINC000058356209	214559868	/nfs/dbraw/zinc/55/98/68/214559868.db2.gz	MOIMNTCNXANMOV-UHFFFAOYSA-N	-1	0	331.375	3.755	50	0		EHAARM
CC(C)c1nc2cc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])ccc2o1	ZINC000046834812	213811285	/nfs/dbraw/zinc/81/12/85/213811285.db2.gz	JLBYQXXZLIBVSW-CHWSQXEVSA-N	-1	0	328.368	3.557	50	0		EHAARM
Nc1nc2ncc(C(=O)c3cc(Cl)cc(Cl)c3[O-])cc2s1	ZINC000003418790	210034442	/nfs/dbraw/zinc/03/44/42/210034442.db2.gz	MRKCFRHCSVSAEV-UHFFFAOYSA-N	-1	0	340.191	3.517	50	0		EHAARM
CCCc1nc(CNc2ncnc3sc(C(=O)[O-])c(C)c32)cs1	ZINC000067688485	215184132	/nfs/dbraw/zinc/18/41/32/215184132.db2.gz	PZHLWTPPNCRZLP-UHFFFAOYSA-N	-1	0	348.453	3.719	50	0		EHAARM
O=S(=O)([N-]c1ccc(F)cc1)c1ccc(Br)cc1F	ZINC000068741045	215329666	/nfs/dbraw/zinc/32/96/66/215329666.db2.gz	XCNLDZBYWFPSRS-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
Cc1cc(C)cc(Oc2ccc(N3C[C@@H](C(=O)[O-])CC3=O)cc2)c1	ZINC000040451247	213304579	/nfs/dbraw/zinc/30/45/79/213304579.db2.gz	HRMHHNNXVGSQJJ-AWEZNQCLSA-N	-1	0	325.364	3.533	50	0		EHAARM
Cc1cc(F)ccc1[C@H]1[C@H](C(=O)[O-])CCC(=O)N1Cc1ccsc1	ZINC000069919895	215631054	/nfs/dbraw/zinc/63/10/54/215631054.db2.gz	QGKAVKUDQRSEQY-WBVHZDCISA-N	-1	0	347.411	3.760	50	0		EHAARM
O=C([O-])[C@@H]1CC[C@@H]1C(=O)Nc1nc(-c2ccc(Cl)s2)cs1	ZINC000000117963	209432882	/nfs/dbraw/zinc/43/28/82/209432882.db2.gz	OIDOYFPJSCJXLV-NKWVEPMBSA-N	-1	0	342.829	3.574	50	0		EHAARM
Nc1nc(-c2ccccc2OCc2ccc(C(=O)[O-])cc2)cs1	ZINC000020331990	212119389	/nfs/dbraw/zinc/11/93/89/212119389.db2.gz	TXNSGDPFRKMHHE-UHFFFAOYSA-N	-1	0	326.377	3.670	50	0		EHAARM
O=c1[n-]c(SCc2ccccc2Cl)nnc1-c1ccccc1	ZINC000011990960	211275756	/nfs/dbraw/zinc/27/57/56/211275756.db2.gz	GOCYDWNSYLKMEM-UHFFFAOYSA-N	-1	0	329.812	3.778	50	0		EHAARM
Cc1ccccc1N1CCN([C@H](C(=O)[O-])c2ccc(Cl)cc2)CC1	ZINC000091690374	218048060	/nfs/dbraw/zinc/04/80/60/218048060.db2.gz	ODOSEGNPHJCCBW-SFHVURJKSA-N	-1	0	344.842	3.596	50	0		EHAARM
CC(C)n1cccc1C(=O)N1CCC[C@H](c2cccc(C(=O)[O-])c2)C1	ZINC000095355001	218288351	/nfs/dbraw/zinc/28/83/51/218288351.db2.gz	VUVGKAXOOQDNGR-KRWDZBQOSA-N	-1	0	340.423	3.787	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)NCc3cccs3)C2)cc1	ZINC000095376202	218309290	/nfs/dbraw/zinc/30/92/90/218309290.db2.gz	NGSCENYEJRXABB-HNNXBMFYSA-N	-1	0	344.436	3.536	50	0		EHAARM
O=S(=O)([N-]c1ccccc1OC(F)F)c1ccc(Cl)s1	ZINC000006820409	210722731	/nfs/dbraw/zinc/72/27/31/210722731.db2.gz	VLHDVBZUQOERBW-UHFFFAOYSA-N	-1	0	339.772	3.804	50	0		EHAARM
COc1cc(/C=C\c2ncc(C(=O)[O-])s2)ccc1OC(F)F	ZINC000096402118	218750344	/nfs/dbraw/zinc/75/03/44/218750344.db2.gz	IABDIWDOCKDVNZ-HYXAFXHYSA-N	-1	0	327.308	3.622	50	0		EHAARM
O=C([O-])C[C@@H](c1cccc(C(F)(F)F)c1)N1Cc2ccccc2C1=O	ZINC000005776501	210533698	/nfs/dbraw/zinc/53/36/98/210533698.db2.gz	CDPADJRQVFTFOB-HNNXBMFYSA-N	-1	0	349.308	3.877	50	0		EHAARM
O=C([O-])CCCC(=O)N1N=C(c2ccccc2)C[C@@H]1c1ccccc1	ZINC000005023952	210365797	/nfs/dbraw/zinc/36/57/97/210365797.db2.gz	BGFZGVJPBAPETG-GOSISDBHSA-N	-1	0	336.391	3.619	50	0		EHAARM
COc1c(Cl)c(Cl)ccc1S(=O)(=O)[N-]c1ncccc1C	ZINC000004970473	210343429	/nfs/dbraw/zinc/34/34/29/210343429.db2.gz	FCOUBJBSMIJTKZ-UHFFFAOYSA-N	-1	0	347.223	3.506	50	0		EHAARM
Cc1ccc(OCC(=O)Nc2ccc(Cl)cc2C(=O)[O-])cc1C	ZINC000004953610	210338922	/nfs/dbraw/zinc/33/89/22/210338922.db2.gz	OCTDCEGNXUXKIK-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
O=C([O-])Cc1c(-c2ccc(O)cc2)oc2c1c(=O)oc1ccccc21	ZINC000524730599	257843359	/nfs/dbraw/zinc/84/33/59/257843359.db2.gz	OOKZNZCSGYDOMF-UHFFFAOYSA-N	-1	0	336.299	3.539	50	0	biogenic	EHAARM
Cc1ccc2c(c1)CCCN2C(=O)[C@@H]1CC(C)=C(C)C[C@H]1C(=O)[O-]	ZINC000017067058	135711334	/nfs/dbraw/zinc/71/13/34/135711334.db2.gz	XEDQTOBUZGSKLA-IAGOWNOFSA-N	-1	0	327.424	3.721	50	0		EHAARM
Cc1cc(C)c([N-]S(=O)(=O)c2cnn(-c3ccccc3)c2)c(C)c1	ZINC000121739647	221919112	/nfs/dbraw/zinc/91/91/12/221919112.db2.gz	JUASZGFOCCPNBE-UHFFFAOYSA-N	-1	0	341.436	3.598	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(F)c(Cl)c1	ZINC000000615595	563358064	/nfs/dbraw/zinc/35/80/64/563358064.db2.gz	CMTKXUWNUYZHHV-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
Cc1oc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2c1C(=O)[O-]	ZINC000000096991	563224549	/nfs/dbraw/zinc/22/45/49/563224549.db2.gz	FSWXPHBTKMMOFE-UHFFFAOYSA-N	-1	0	345.376	3.549	50	0		EHAARM
O=C([O-])[C@@H](CC(=O)c1ccccc1)Nc1ccc(Br)cc1	ZINC000000194167	563257341	/nfs/dbraw/zinc/25/73/41/563257341.db2.gz	XMGNQAJSAZVAPS-CQSZACIVSA-N	-1	0	348.196	3.587	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@]1(Cc1ccccc1Cl)C(=O)[O-]	ZINC000000391967	563304150	/nfs/dbraw/zinc/30/41/50/563304150.db2.gz	WNUHKLSUIDCUPW-KRWDZBQOSA-N	-1	0	339.819	3.737	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2Cl)cc1	ZINC000000464110	563327929	/nfs/dbraw/zinc/32/79/29/563327929.db2.gz	KGLJVYNIBQPPQN-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
COc1ccc(Oc2ccc(NC(=O)CCCC(=O)[O-])cc2)cc1	ZINC000000466522	563328461	/nfs/dbraw/zinc/32/84/61/563328461.db2.gz	PELQVHDXMWBLKP-UHFFFAOYSA-N	-1	0	329.352	3.681	50	0		EHAARM
O=C([O-])C[C@H](c1cccc(C(F)(F)F)c1)N1Cc2ccccc2C1=O	ZINC000002597317	563443937	/nfs/dbraw/zinc/44/39/37/563443937.db2.gz	CDPADJRQVFTFOB-OAHLLOKOSA-N	-1	0	349.308	3.877	50	0		EHAARM
Cc1ccccc1OCCSc1nc2ccccc2n1CC(=O)[O-]	ZINC000003108383	563472451	/nfs/dbraw/zinc/47/24/51/563472451.db2.gz	NPOWKXOEFGGRMA-UHFFFAOYSA-N	-1	0	342.420	3.600	50	0		EHAARM
C[C@H](c1ccc2ccccc2c1)[C@@H](NC(=O)OC(C)(C)C)C(=O)[O-]	ZINC000005723129	563547405	/nfs/dbraw/zinc/54/74/05/563547405.db2.gz	WUVVJXQHWJQEQZ-MLGOLLRUSA-N	-1	0	329.396	3.921	50	0		EHAARM
O=C([O-])c1cnn(-c2nc(-c3cccs3)cs2)c1C(F)(F)F	ZINC000005763881	563549486	/nfs/dbraw/zinc/54/94/86/563549486.db2.gz	VDBHEQWWNJWTBU-UHFFFAOYSA-N	-1	0	345.327	3.774	50	0		EHAARM
O=c1c2c(nc3c(-c4ccccc4)c(Cc4ccccc4)[n-]n31)CCC2	ZINC000006557634	563572420	/nfs/dbraw/zinc/57/24/20/563572420.db2.gz	SZZYIIZKNPWVET-UHFFFAOYSA-N	-1	0	341.414	3.769	50	0		EHAARM
Cc1sc(NC(=O)CCCC(=O)[O-])nc1-c1ccc(C)cc1C	ZINC000002755138	563612421	/nfs/dbraw/zinc/61/24/21/563612421.db2.gz	PBEBJGSYFYXRIE-UHFFFAOYSA-N	-1	0	332.425	3.929	50	0		EHAARM
CCOc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1cccc(C)n1	ZINC000008714946	563636742	/nfs/dbraw/zinc/63/67/42/563636742.db2.gz	NFYMONBZNMYFRW-UHFFFAOYSA-N	-1	0	334.441	3.713	50	0		EHAARM
O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1cccnc1Cl	ZINC000032895074	563780660	/nfs/dbraw/zinc/78/06/60/563780660.db2.gz	KXFHZICVSKVYEW-UHFFFAOYSA-N	-1	0	336.722	3.555	50	0		EHAARM
Cc1nc2[n-]c(SCc3ccccc3)nn2c(=O)c1CCC(C)C	ZINC000018240864	563851362	/nfs/dbraw/zinc/85/13/62/563851362.db2.gz	BXBPKXROVUWPCL-UHFFFAOYSA-N	-1	0	342.468	3.607	50	0		EHAARM
CC(=O)Nc1ccccc1[N-]S(=O)(=O)c1ccc2ccccc2c1	ZINC000000318747	563917317	/nfs/dbraw/zinc/91/73/17/563917317.db2.gz	SCTMECHGEWPEEX-UHFFFAOYSA-N	-1	0	340.404	3.599	50	0		EHAARM
Cc1ccc(O)c(C(=O)C=C([O-])c2cccc(Br)c2)c1	ZINC000101097829	563919496	/nfs/dbraw/zinc/91/94/96/563919496.db2.gz	XWTSVSJHFPTFRY-UHFFFAOYSA-N	-1	0	333.181	3.919	50	0		EHAARM
Cc1ccccc1[N-]S(=O)(=O)c1ccc(Br)cc1F	ZINC000096170848	563980000	/nfs/dbraw/zinc/98/00/00/563980000.db2.gz	SUPMJWGWIHBBIY-UHFFFAOYSA-N	-1	0	344.205	3.697	50	0		EHAARM
CCOc1ccc2[nH]c(S[C@@H](C(=O)[O-])c3ccccc3)nc2c1	ZINC000000157511	563987473	/nfs/dbraw/zinc/98/74/73/563987473.db2.gz	NQKFMKPCVWNYPX-OAHLLOKOSA-N	-1	0	328.393	3.880	50	0		EHAARM
Cc1cccc2c(CCC(=O)N3CCC[C@@H](CCC(=O)[O-])C3)c[nH]c21	ZINC000237760290	563993774	/nfs/dbraw/zinc/99/37/74/563993774.db2.gz	JJKVYRMVUUVGCB-HNNXBMFYSA-N	-1	0	342.439	3.512	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2cccc3cccnc32)cc1Cl	ZINC000000423527	563998340	/nfs/dbraw/zinc/99/83/40/563998340.db2.gz	ASNFBFORYNTSQC-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
Cc1cc2oc(-c3ccco3)c(O[C@@H](C)C(=O)[O-])c(=O)c2cc1C	ZINC000005580599	564005910	/nfs/dbraw/zinc/00/59/10/564005910.db2.gz	MIEKWPKQWRAHON-NSHDSACASA-N	-1	0	328.320	3.522	50	0		EHAARM
CC(=O)c1cccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c1	ZINC000000441666	564012620	/nfs/dbraw/zinc/01/26/20/564012620.db2.gz	ZITSUWFAISYYRS-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
COc1ccc(-n2[n-]c(C)c(Cc3ccccc3Cl)c2=O)cc1	ZINC000017879320	564013190	/nfs/dbraw/zinc/01/31/90/564013190.db2.gz	GBSRQGHDNPLMTI-UHFFFAOYSA-N	-1	0	328.799	3.727	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000002321239	564013328	/nfs/dbraw/zinc/01/33/28/564013328.db2.gz	MMLMUEBHVMHOEP-ZWKOTPCHSA-N	-1	0	337.419	3.783	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)C[C@](C)(C(=O)[O-])c1ccccc1	ZINC000008746173	564016463	/nfs/dbraw/zinc/01/64/63/564016463.db2.gz	DPWAJKNLIJOZRK-SFHVURJKSA-N	-1	0	347.798	3.720	50	0		EHAARM
CCc1ccc(-c2noc(-c3c([O-])c4ccccc4n(C)c3=O)n2)cc1	ZINC000101725727	564019540	/nfs/dbraw/zinc/01/95/40/564019540.db2.gz	RMUZBHFEXQBKIV-UHFFFAOYSA-N	-1	0	347.374	3.524	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2ccccc2C(C)C)cc1C(=O)[O-]	ZINC000013348935	564019674	/nfs/dbraw/zinc/01/96/74/564019674.db2.gz	ZCJHJFOJKSOOIN-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
O=C([O-])CCC(=O)Nc1ccc(-c2nc3cc(Cl)ccc3o2)cc1	ZINC000000552670	564023011	/nfs/dbraw/zinc/02/30/11/564023011.db2.gz	IUVPUSRDISDAKL-UHFFFAOYSA-N	-1	0	344.754	3.952	50	0		EHAARM
C[C@]12CC[C@@H]3[C@H](CC=C4C[C@H](O)CC[C@@]43C)[C@H]1CC[C@@]2(O)CC(=O)[O-]	ZINC000257346216	564055878	/nfs/dbraw/zinc/05/58/78/564055878.db2.gz	VAPBKEAUXQVFHX-XNTISYABSA-N	-1	0	348.483	3.516	50	0		EHAARM
CCCc1ccc(N[C@H](c2cccc(OC)c2)[P@@](=O)([O-])O)cc1	ZINC000012540642	564058665	/nfs/dbraw/zinc/05/86/65/564058665.db2.gz	JHYHBCRIYQEHLQ-KRWDZBQOSA-N	-1	0	335.340	3.936	50	0		EHAARM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3ccccc3)c(C)s2)on1	ZINC000075435345	564084696	/nfs/dbraw/zinc/08/46/96/564084696.db2.gz	YJBQQSBFCMEXBR-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc(C(C)C)cc1	ZINC000006328206	564085053	/nfs/dbraw/zinc/08/50/53/564085053.db2.gz	RLAOPUXVZNTFRU-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
O=c1[nH]c2ccc(Cl)cc2c([O-])c1-c1nc(-c2cccs2)no1	ZINC000075536647	564087930	/nfs/dbraw/zinc/08/79/30/564087930.db2.gz	HZDBDFMDPUABCN-UHFFFAOYSA-N	-1	0	345.767	3.666	50	0		EHAARM
CC[C@@H](NC(=O)[C@H](C)c1ccc(-c2ccccc2)c(F)c1)C(=O)[O-]	ZINC000006760091	564097308	/nfs/dbraw/zinc/09/73/08/564097308.db2.gz	ZQADHETUQGSDGN-SJKOYZFVSA-N	-1	0	329.371	3.576	50	0		EHAARM
O=S(=O)([N-]c1ccc(OC(F)F)cc1)c1ccc(Cl)s1	ZINC000006820394	564098762	/nfs/dbraw/zinc/09/87/62/564098762.db2.gz	CYWOUAYMFBUASY-UHFFFAOYSA-N	-1	0	339.772	3.804	50	0		EHAARM
Cc1c(Cl)cccc1NC(=O)c1c([O-])c2sccc2[nH]c1=O	ZINC000065215148	564102850	/nfs/dbraw/zinc/10/28/50/564102850.db2.gz	OXUHGQWFFBWPCQ-UHFFFAOYSA-N	-1	0	334.784	3.509	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3sccc3[nH]c2=O)cc1Cl	ZINC000065215147	564102852	/nfs/dbraw/zinc/10/28/52/564102852.db2.gz	BHZIHTFOJTXRFR-UHFFFAOYSA-N	-1	0	334.784	3.509	50	0		EHAARM
CCOc1cc(Cl)c(S(=O)(=O)[N-]c2cccnc2)cc1Cl	ZINC000007348630	564107277	/nfs/dbraw/zinc/10/72/77/564107277.db2.gz	FUOYKIGEVGEISF-UHFFFAOYSA-N	-1	0	347.223	3.588	50	0		EHAARM
Cc1nc(-c2cc(C(=O)Nc3cc(C(=O)[O-])ccc3F)co2)cs1	ZINC000095989555	564144096	/nfs/dbraw/zinc/14/40/96/564144096.db2.gz	GOXILRRPJDNXEO-UHFFFAOYSA-N	-1	0	346.339	3.801	50	0		EHAARM
Cc1nn(-c2ccccn2)c2nc(-c3ccc(F)cc3)cc(C(=O)[O-])c12	ZINC000008428704	564165222	/nfs/dbraw/zinc/16/52/22/564165222.db2.gz	YXRYEYUHMGJYPB-UHFFFAOYSA-N	-1	0	348.337	3.628	50	0		EHAARM
CC(C)c1ccccc1NS(=O)(=O)c1ccc(/C=C/C(=O)[O-])cc1	ZINC000012605573	601317907	/nfs/dbraw/zinc/31/79/07/601317907.db2.gz	DJDFZPVGBGCMID-FMIVXFBMSA-N	-1	0	345.420	3.709	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NC(=O)[C@@H]2CCCc3ccccc32)cc1	ZINC000630327339	975254368	/nfs/dbraw/zinc/25/43/68/975254368.db2.gz	DGQJKVOHZBMASA-CEXWTWQISA-N	-1	0	335.403	3.933	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2cccs2)cs1	ZINC000000816578	1033808310	/nfs/dbraw/zinc/80/83/10/1033808310.db2.gz	VCETXPQBXFFOCP-UWVGGRQHSA-N	-1	0	336.438	3.701	50	0	aggregator	EHAARM
N#Cc1c(SCC(=O)[O-])nc(-c2cccs2)c2c1CCCC2	ZINC000006702223	1044222275	/nfs/dbraw/zinc/22/22/75/1044222275.db2.gz	VLKFZEMYIOLGKY-UHFFFAOYSA-N	-1	0	330.434	3.737	50	0		EHAARM
O=C(N[C@@H]1CCCOc2ccc(F)cc21)c1ccc([O-])c(Cl)c1	ZINC000054283415	214229309	/nfs/dbraw/zinc/22/93/09/214229309.db2.gz	YKENJPUTGREMGI-CQSZACIVSA-N	-1	0	335.762	3.828	50	0		EHAARM
Cc1nn(C(C)C)c(C)c1[N-]S(=O)(=O)c1ccc(Cl)cc1	ZINC000055649182	214336779	/nfs/dbraw/zinc/33/67/79/214336779.db2.gz	RICDPVHUCSVKCG-UHFFFAOYSA-N	-1	0	327.837	3.535	50	0		EHAARM
CC[C@H](NC(=O)[C@H]1CC=CC[C@@H]1C(=O)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000004651024	210236716	/nfs/dbraw/zinc/23/67/16/210236716.db2.gz	XIKYNLRAQBQZED-BFRNDWSSSA-N	-1	0	345.483	3.765	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000004612057	210232199	/nfs/dbraw/zinc/23/21/99/210232199.db2.gz	STMFJDTXVZATRV-QWHCGFSZSA-N	-1	0	348.399	3.779	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CSCc2ccc(Cl)cc2)cc1	ZINC000004523769	210213882	/nfs/dbraw/zinc/21/38/82/210213882.db2.gz	OINOQKKMWRXMLD-UHFFFAOYSA-N	-1	0	335.812	3.910	50	0		EHAARM
CCc1cc2c(cc1O[C@H](C)C(=O)[O-])oc(=O)cc2-c1ccccc1	ZINC000004387704	210186326	/nfs/dbraw/zinc/18/63/26/210186326.db2.gz	HIQCVTLJKKHOBY-GFCCVEGCSA-N	-1	0	338.359	3.874	50	0		EHAARM
COc1ccccc1Nc1nnc(Cc2ccccc2Cl)c(=O)[n-]1	ZINC000004225148	210147475	/nfs/dbraw/zinc/14/74/75/210147475.db2.gz	GHZIBGGEFKBIHP-UHFFFAOYSA-N	-1	0	342.786	3.574	50	0		EHAARM
COc1ccc([C@H]2Nc3nonc3N=C3CC(C)(C)CC(=O)C32)cc1	ZINC000102742135	219226761	/nfs/dbraw/zinc/22/67/61/219226761.db2.gz	NLQQWYLFCGASAB-OAHLLOKOSA-N	-1	0	340.383	3.950	50	0		EHAARM
Cc1cc(SCCC(=O)[O-])c2cc(Br)ccc2n1	ZINC000067321027	215133485	/nfs/dbraw/zinc/13/34/85/215133485.db2.gz	RFLNCKQGCVYEKE-UHFFFAOYSA-N	-1	0	326.215	3.873	50	0		EHAARM
O=C([O-])c1ccc(-c2ccccc2CN2CCOCC2)cc1Cl	ZINC000067973780	215264280	/nfs/dbraw/zinc/26/42/80/215264280.db2.gz	CHEJRQYHFWSLDJ-UHFFFAOYSA-N	-1	0	331.799	3.537	50	0		EHAARM
O=C([O-])[C@H]1C=CCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000002583140	209871188	/nfs/dbraw/zinc/87/11/88/209871188.db2.gz	YSQFCCXPDNQENP-AWEZNQCLSA-N	-1	0	349.386	3.508	50	0		EHAARM
CC(C)c1nc(/C=C\c2cnn(-c3ccccc3)c2)ncc1C(=O)[O-]	ZINC000104158792	219354482	/nfs/dbraw/zinc/35/44/82/219354482.db2.gz	DQDIADSLWLXLEN-HJWRWDBZSA-N	-1	0	334.379	3.654	50	0		EHAARM
CC(C)(C)OC(=O)N1CCc2c(sc(-n3cccc3)c2C(=O)[O-])C1	ZINC000040447987	213305087	/nfs/dbraw/zinc/30/50/87/213305087.db2.gz	KBFCBVKXFOJEMF-UHFFFAOYSA-N	-1	0	348.424	3.530	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@H](C(=O)Nc2cc(Cl)cc(Cl)c2)C1	ZINC000039632462	213240557	/nfs/dbraw/zinc/24/05/57/213240557.db2.gz	QVKSDHWLOJFLMX-QWHCGFSZSA-N	-1	0	328.195	3.989	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2SCCN2C(=O)Nc2ccccc2)cc1	ZINC000036138756	213073113	/nfs/dbraw/zinc/07/31/13/213073113.db2.gz	GKZPEUHFIHNYTK-HNNXBMFYSA-N	-1	0	328.393	3.664	50	0		EHAARM
O=C([O-])CCCNC(=O)c1cc(-c2cccs2)nc2ccccc21	ZINC000072400979	216194039	/nfs/dbraw/zinc/19/40/39/216194039.db2.gz	RIYRJUUELWAYDH-UHFFFAOYSA-N	-1	0	340.404	3.558	50	0		EHAARM
CC(C)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000000056906	209392763	/nfs/dbraw/zinc/39/27/63/209392763.db2.gz	UGNIYGNGCNXHTR-SFHVURJKSA-N	-1	0	339.391	3.634	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@@H]2c2ccsc2)cc1	ZINC000136970710	223674098	/nfs/dbraw/zinc/67/40/98/223674098.db2.gz	SXQPUZDKXAGKKM-MRXNPFEDSA-N	-1	0	329.421	3.743	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1Cc1ccccc1	ZINC000013021887	211513171	/nfs/dbraw/zinc/51/31/71/211513171.db2.gz	IOPXNQZIJDIBRJ-ZWKOTPCHSA-N	-1	0	335.403	3.883	50	0		EHAARM
Cc1ccc(C)c(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)c1	ZINC000012507894	211394565	/nfs/dbraw/zinc/39/45/65/211394565.db2.gz	SZAPDJFLMWOJFD-UHFFFAOYSA-N	-1	0	339.420	3.561	50	0		EHAARM
Cc1nn(CC(=O)[O-])c2nc(-c3ccc(F)cc3)cc(C(F)F)c12	ZINC000012395302	211367439	/nfs/dbraw/zinc/36/74/39/211367439.db2.gz	CDQUTUFWHJDSTB-UHFFFAOYSA-N	-1	0	335.285	3.568	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2cc(C)[nH]n2)s1	ZINC000009686427	211114146	/nfs/dbraw/zinc/11/41/46/211114146.db2.gz	OJWWRQWPOWPCQW-UHFFFAOYSA-N	-1	0	347.465	3.810	50	0		EHAARM
CC(C)n1cccc1C(=O)N1CCC[C@@H](c2ccc(C(=O)[O-])cc2)C1	ZINC000095368840	218301441	/nfs/dbraw/zinc/30/14/41/218301441.db2.gz	ACUFQKHQOIJSLT-QGZVFWFLSA-N	-1	0	340.423	3.787	50	0		EHAARM
Cc1cc(OCC(=O)[O-])ccc1NC(=O)C1(c2ccccc2)CCC1	ZINC000095425246	218367889	/nfs/dbraw/zinc/36/78/89/218367889.db2.gz	MYVDHCXHEDUPRI-UHFFFAOYSA-N	-1	0	339.391	3.519	50	0		EHAARM
CSc1cccc(NC(=O)Nc2c([O-])c3ccccc3oc2=O)c1	ZINC000006745895	210698628	/nfs/dbraw/zinc/69/86/28/210698628.db2.gz	RZMACAUMPBSJEM-UHFFFAOYSA-N	-1	0	342.376	3.865	50	0		EHAARM
CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000005008223	210360177	/nfs/dbraw/zinc/36/01/77/210360177.db2.gz	PIPHJIAVRSNMCM-CMPLNLGQSA-N	-1	0	328.195	3.915	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1	ZINC000004748880	210268705	/nfs/dbraw/zinc/26/87/05/210268705.db2.gz	XLCGWOVMXCXCHL-AWEZNQCLSA-N	-1	0	338.190	3.939	50	0		EHAARM
Cc1cccc(C(C)C)c1NC(=O)c1ccccc1[N-]S(C)(=O)=O	ZINC000004757092	210271684	/nfs/dbraw/zinc/27/16/84/210271684.db2.gz	YKGVDXIFJSJDRJ-UHFFFAOYSA-N	-1	0	346.452	3.742	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)cc1C(=O)[O-]	ZINC000299753330	258006855	/nfs/dbraw/zinc/00/68/55/258006855.db2.gz	XVGNTKKUDHZOOB-LSDHHAIUSA-N	-1	0	347.798	3.702	50	0		EHAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000006402454	258051911	/nfs/dbraw/zinc/05/19/11/258051911.db2.gz	HGVAJYUWPFBDPF-ROUUACIJSA-N	-1	0	338.407	3.502	50	0		EHAARM
COc1cc(C(=O)/C=C\c2ccsc2)ccc1SCC(=O)[O-]	ZINC000096297151	522052076	/nfs/dbraw/zinc/05/20/76/522052076.db2.gz	PDSPZCZENOIEDZ-RQOWECAXSA-N	-1	0	334.418	3.830	50	0		EHAARM
COc1cc(C(=O)[O-])cc(Cl)c1OC(=O)c1ccc(Cl)cc1	ZINC000217042922	536541930	/nfs/dbraw/zinc/54/19/30/536541930.db2.gz	JFQJMGWFYGQZJM-UHFFFAOYSA-N	-1	0	341.146	3.919	50	0		EHAARM
Cc1[nH]c(C)c(C([O-])(C(F)(F)F)C(F)(F)F)c1Br	ZINC000002519548	563438404	/nfs/dbraw/zinc/43/84/04/563438404.db2.gz	VWBVVFCKZLLPKM-UHFFFAOYSA-N	-1	0	340.061	3.706	50	0		EHAARM
CC(C)OC(=O)C1[C@@H](c2ccccc2)C(C(=O)[O-])[C@@H]1c1ccccc1	ZINC000000083584	563219223	/nfs/dbraw/zinc/21/92/23/563219223.db2.gz	JPDDMZAETFWSGR-YXWAVELNSA-N	-1	0	338.403	3.836	50	0		EHAARM
O=C([O-])[C@H]1CC[C@@H]1C(=O)Nc1nc(-c2ccc(Cl)s2)cs1	ZINC000000117972	563232871	/nfs/dbraw/zinc/23/28/71/563232871.db2.gz	OIDOYFPJSCJXLV-BQBZGAKWSA-N	-1	0	342.829	3.574	50	0		EHAARM
CCOc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2OC)cc1	ZINC000000310789	563280593	/nfs/dbraw/zinc/28/05/93/563280593.db2.gz	QSJHPXREXIYYRP-UHFFFAOYSA-N	-1	0	341.816	3.548	50	0		EHAARM
CCOc1ccc([C@@H]2[C@H](C(=O)[O-])CCC(=O)N2C2CCCCC2)cc1	ZINC000001394559	563386324	/nfs/dbraw/zinc/38/63/24/563386324.db2.gz	IGAXLNWFPCVKLI-IEBWSBKVSA-N	-1	0	345.439	3.782	50	0		EHAARM
Cc1ccc([C@@H](CC(=O)[O-])NC(=O)c2c(F)cccc2Cl)cc1	ZINC000013178510	563692032	/nfs/dbraw/zinc/69/20/32/563692032.db2.gz	VQGVFHGRWCXPHJ-CQSZACIVSA-N	-1	0	335.762	3.733	50	0		EHAARM
Cc1nc(-c2ccccc2Cl)nc2sc3c([n-]cnc3=O)c21	ZINC000013691166	563712207	/nfs/dbraw/zinc/71/22/07/563712207.db2.gz	WNSMYNCONRVZSX-UHFFFAOYSA-N	-1	0	328.784	3.969	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CC(=O)Nc3sc4c(c32)CCCC4)cc1	ZINC000015107365	563778345	/nfs/dbraw/zinc/77/83/45/563778345.db2.gz	YTZPSRRECXHMIO-CYBMUJFWSA-N	-1	0	327.405	3.799	50	0		EHAARM
COc1ccc(-c2csc3c2[n-]c(SC)nc3=O)cc1OC	ZINC000062591980	563953856	/nfs/dbraw/zinc/95/38/56/563953856.db2.gz	CWDABCVFIHLMJS-UHFFFAOYSA-N	-1	0	334.422	3.803	50	0		EHAARM
CCC[C@@H](NC(=O)c1ccccc1NCC(=O)[O-])c1cccs1	ZINC000065501999	563961716	/nfs/dbraw/zinc/96/17/16/563961716.db2.gz	SLGMJYHRRQXIJA-CQSZACIVSA-N	-1	0	332.425	3.516	50	0		EHAARM
O=C([O-])Cc1cccc(-n2ccnc2-c2ccc(F)c(Cl)c2)c1	ZINC000077564279	563970340	/nfs/dbraw/zinc/97/03/40/563970340.db2.gz	MINZLYQDBOSACV-UHFFFAOYSA-N	-1	0	330.746	3.959	50	0		EHAARM
Cc1ccc(NC(=O)c2sccc2Br)cc1C(=O)[O-]	ZINC000097212427	563970503	/nfs/dbraw/zinc/97/05/03/563970503.db2.gz	MAEUPVZZFNFCFB-UHFFFAOYSA-N	-1	0	340.198	3.770	50	0		EHAARM
Cc1cc2[nH]c(C(=O)N3CCC[C@H](CCC(=O)[O-])C3)cc2c(C)c1	ZINC000237621413	563993447	/nfs/dbraw/zinc/99/34/47/563993447.db2.gz	ADJACQSUZMVJEY-CQSZACIVSA-N	-1	0	328.412	3.502	50	0		EHAARM
CCCc1cc(-c2nc(C)c(C(=O)Nc3nncs3)s2)ccn1	ZINC000061721514	564000518	/nfs/dbraw/zinc/00/05/18/564000518.db2.gz	NEWBACBRKPBWGW-UHFFFAOYSA-N	-1	0	345.453	3.570	50	0		EHAARM
Cn1c(=O)c([O-])c2c3c(c(Cl)cc(Cl)c31)C(=O)c1ccccc1-2	ZINC000001022097	564002262	/nfs/dbraw/zinc/00/22/62/564002262.db2.gz	CRLULZVGARVPCW-UHFFFAOYSA-N	-1	0	346.169	3.762	50	0		EHAARM
CC[C@H](C)[C@@H](Nc1nc(C)nc2sc3c(c21)CCCC3)C(=O)[O-]	ZINC000005575373	564005729	/nfs/dbraw/zinc/00/57/29/564005729.db2.gz	VKNRJLBBRIYWOZ-LKFCYVNXSA-N	-1	0	333.457	3.790	50	0		EHAARM
C[C@]1(c2ccc(C(=O)[O-])cc2)CC1(Br)Br	ZINC000000495047	564017912	/nfs/dbraw/zinc/01/79/12/564017912.db2.gz	BOIGKTDSXXTJSY-SNVBAGLBSA-N	-1	0	334.007	3.532	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@H](C(=O)[O-])[C@H](C)CC)n1	ZINC000000539007	564022215	/nfs/dbraw/zinc/02/22/15/564022215.db2.gz	QULZSYPFJAEODG-YGRLFVJLSA-N	-1	0	327.384	3.850	50	0		EHAARM
COc1ccccc1NC(=O)C[C@@H](Cc1cc(C)cc(C)c1)C(=O)[O-]	ZINC000005724809	564024092	/nfs/dbraw/zinc/02/40/92/564024092.db2.gz	DYUHVHMVVQNFKA-MRXNPFEDSA-N	-1	0	341.407	3.584	50	0		EHAARM
O=C(c1cnn(Cc2cccc3cccnc32)c1)c1cc(F)ccc1[O-]	ZINC000048356165	564031378	/nfs/dbraw/zinc/03/13/78/564031378.db2.gz	YAOHBCHEBLVWCM-UHFFFAOYSA-N	-1	0	347.349	3.555	50	0		EHAARM
COC(=O)Nc1ccc(NC(=O)CC2(CC(=O)[O-])CCCCC2)cc1	ZINC000048383557	564031728	/nfs/dbraw/zinc/03/17/28/564031728.db2.gz	UZPXCTUWTBTZQP-UHFFFAOYSA-N	-1	0	348.399	3.619	50	0		EHAARM
Cc1cccc(S(=O)(=O)[N-]c2n[nH]cc2-c2cccc(Cl)c2)c1	ZINC000084213118	564067425	/nfs/dbraw/zinc/06/74/25/564067425.db2.gz	UHQJJNNRKHQRSY-UHFFFAOYSA-N	-1	0	347.827	3.839	50	0		EHAARM
COC(=O)[C@]12CC=CC[C@@]1(C(=O)[O-])CCc1ccc3ccccc3c12	ZINC000071785965	564076302	/nfs/dbraw/zinc/07/63/02/564076302.db2.gz	KVGVJVPOIGPKSI-LEWJYISDSA-N	-1	0	336.387	3.618	50	0		EHAARM
O=P([O-])([O-])[C@H]([NH2+]C[C@@H]1CCCc2ccccc21)c1ccc(F)cc1	ZINC000012949501	564079788	/nfs/dbraw/zinc/07/97/88/564079788.db2.gz	IZVZWRXPGQHJMQ-YJBOKZPZSA-N	-1	0	349.342	3.712	50	0		EHAARM
O=C([N-]c1cccc(Cl)c1SCC(F)F)c1cccc[n+]1[O-]	ZINC000075142755	564080719	/nfs/dbraw/zinc/08/07/19/564080719.db2.gz	OSNHHYOGVXQHRO-UHFFFAOYSA-N	-1	0	344.770	3.583	50	0		EHAARM
COc1cc(C(C)=NNc2cccc(C(=O)[O-])c2)ccc1SC	ZINC000252474457	564090171	/nfs/dbraw/zinc/09/01/71/564090171.db2.gz	FIMYJSBHHFXTMJ-UHFFFAOYSA-N	-1	0	330.409	3.951	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)OCc1ccccc1)c1ccc(Cl)cc1	ZINC000001734296	564099099	/nfs/dbraw/zinc/09/90/99/564099099.db2.gz	DHXHWTXUFRFSIW-OAHLLOKOSA-N	-1	0	333.771	3.782	50	0		EHAARM
Cc1ccc([C@@H](C)C(=O)Nc2ccc(C)c(O[C@H](C)C(=O)[O-])c2)cc1	ZINC000170067797	564105175	/nfs/dbraw/zinc/10/51/75/564105175.db2.gz	IOUHBHZLGHKSOZ-HUUCEWRRSA-N	-1	0	341.407	3.898	50	0		EHAARM
COC(=O)c1ccc(/C=C/c2cc(C(=O)[O-])c3ccc(F)cc3n2)o1	ZINC000065518695	564106799	/nfs/dbraw/zinc/10/67/99/564106799.db2.gz	AOFUWMFQAFCPJS-ONEGZZNKSA-N	-1	0	341.294	3.622	50	0		EHAARM
Cc1noc(C2CC2)c1[N-]S(=O)(=O)c1c(Cl)ccc(F)c1F	ZINC000252495262	564119663	/nfs/dbraw/zinc/11/96/63/564119663.db2.gz	OORWSMMUCGVYJC-UHFFFAOYSA-N	-1	0	348.758	3.593	50	0		EHAARM
Cn1c(C(=O)Nc2ccc(F)c(C(=O)[O-])c2)ccc1-c1ccccc1	ZINC000170672170	564121343	/nfs/dbraw/zinc/12/13/43/564121343.db2.gz	VUAOVYXRAASCSQ-UHFFFAOYSA-N	-1	0	338.338	3.782	50	0		EHAARM
Cc1oc(-c2ccccc2)c(C(=O)N[C@@H]2CC[C@H](C(=O)[O-])C2)c1C	ZINC000263522479	564124287	/nfs/dbraw/zinc/12/42/87/564124287.db2.gz	HWZHEMRIMDVXFV-LSDHHAIUSA-N	-1	0	327.380	3.547	50	0		EHAARM
CC(C)[C@@H]1SCC(=O)Nc2c1cnn2-c1ccc(C(=O)[O-])cc1	ZINC000095475200	564141417	/nfs/dbraw/zinc/14/14/17/564141417.db2.gz	ZYPMIJQCHGALLP-AWEZNQCLSA-N	-1	0	331.397	3.602	50	0		EHAARM
Cc1ccc(C)c(NC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@@H](C)C4)c1	ZINC000299738292	564150474	/nfs/dbraw/zinc/15/04/74/564150474.db2.gz	RCJRUMXOMWXLBM-ZDUSSCGKSA-N	-1	0	348.402	3.693	50	0		EHAARM
O=S(=O)([N-]c1ccc2oc(C3CC3)nc2c1)c1ccc(Cl)nc1	ZINC000032097294	564160762	/nfs/dbraw/zinc/16/07/62/564160762.db2.gz	ZSTIROZQOCEOLH-UHFFFAOYSA-N	-1	0	349.799	3.554	50	0		EHAARM
Cc1ccc(C)c([C@@H](C)NC(=O)C[C@@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000008388750	564164880	/nfs/dbraw/zinc/16/48/80/564164880.db2.gz	FEUVPANUXSVSBS-IIBYNOLFSA-N	-1	0	339.435	3.913	50	0		EHAARM
COC(=O)C[C@@H](c1c([O-])c2ccccc2oc1=O)C1CCCCC1	ZINC000143357242	564174249	/nfs/dbraw/zinc/17/42/49/564174249.db2.gz	KSDRQDDHRLICSE-CQSZACIVSA-N	-1	0	330.380	3.726	50	0	biogenic	EHAARM
Cc1cc(C)cc(C[C@@H](C(=O)[O-])[C@H](C)C(=O)Nc2ccccc2)c1	ZINC000071405950	564174991	/nfs/dbraw/zinc/17/49/91/564174991.db2.gz	ANBMXTJXOBLPPU-MAUKXSAKSA-N	-1	0	325.408	3.822	50	0		EHAARM
Cc1cc2[nH]c(C(=O)N3C[C@H](C(=O)[O-])c4ccccc43)cc2c(C)c1	ZINC000192937163	600278884	/nfs/dbraw/zinc/27/88/84/600278884.db2.gz	BINYAGHSTCGEMK-HNNXBMFYSA-N	-1	0	334.375	3.613	50	0		EHAARM
O=C([O-])[C@@H](CNC(=O)c1cccc(C(F)F)c1)C1CCCCC1	ZINC000630268026	975211739	/nfs/dbraw/zinc/21/17/39/975211739.db2.gz	UKZMOVCJNIUBMC-AWEZNQCLSA-N	-1	0	325.355	3.635	50	0		EHAARM
Cc1cc(CN=Nc2ccccc2C(=O)[O-])c(C)n1CC(F)(F)F	ZINC000254398051	1016771789	/nfs/dbraw/zinc/77/17/89/1016771789.db2.gz	JFGMHNYRTHWZIT-UHFFFAOYSA-N	-1	0	339.317	3.811	50	0		EHAARM
O=C([O-])[C@@H]1CC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000843317778	1133759967	/nfs/dbraw/zinc/75/99/67/1133759967.db2.gz	RODNMECPSSFAFU-CABCVRRESA-N	-1	0	342.370	3.868	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000004652571	210238700	/nfs/dbraw/zinc/23/87/00/210238700.db2.gz	LTDGNQBCXLPCMP-GHMZBOCLSA-N	-1	0	330.211	3.501	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@@H](C(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000004600166	210230287	/nfs/dbraw/zinc/23/02/87/210230287.db2.gz	PXDLPTSECRXUQH-OLZOCXBDSA-N	-1	0	327.302	3.701	50	0		EHAARM
Cc1cccc(-n2c([S-])nc3c(-c4ccccc4)c[nH]c3c2=O)c1	ZINC000100071566	219090054	/nfs/dbraw/zinc/09/00/54/219090054.db2.gz	LNZLMJUSYFRQIE-UHFFFAOYSA-N	-1	0	333.416	3.978	50	0		EHAARM
Cc1[n-]n(-c2nc(C)cc(C)n2)c(=O)c1Cc1cccc2ccccc21	ZINC000100127633	219091789	/nfs/dbraw/zinc/09/17/89/219091789.db2.gz	RWEOPSULUDRVEY-IBGZPJMESA-N	-1	0	344.418	3.828	50	0		EHAARM
CCn1c(=O)c(C(=O)Nc2ccccc2Cl)c([O-])c2ccccc21	ZINC000100498455	219100247	/nfs/dbraw/zinc/10/02/47/219100247.db2.gz	DPLCMIUTQNLZFS-UHFFFAOYSA-N	-1	0	342.782	3.633	50	0		EHAARM
COc1cccc(C(=O)N[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1	ZINC000004089479	210117444	/nfs/dbraw/zinc/11/74/44/210117444.db2.gz	OBBKXDRLZIHHQZ-SFHVURJKSA-N	-1	0	341.407	3.764	50	0		EHAARM
Cc1cccc(S(=O)(=O)[N-]c2ccc(C)c3c2OC(C)(C)C3)c1	ZINC000003997670	210096607	/nfs/dbraw/zinc/09/66/07/210096607.db2.gz	UJIQPZJUMZYWBJ-UHFFFAOYSA-N	-1	0	331.437	3.818	50	0		EHAARM
CC1(C)[C@@]2(C(=O)[O-])CC[C@]1(C)[C@@H](OC(=O)C(Cl)(Cl)Cl)C2	ZINC000003865365	210080764	/nfs/dbraw/zinc/08/07/64/210080764.db2.gz	FMKGPXSVDZSZAP-BPTDKIDVSA-N	-1	0	343.634	3.569	50	0		EHAARM
Cc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(OC(F)F)cc2)cc1	ZINC000003399299	210027962	/nfs/dbraw/zinc/02/79/62/210027962.db2.gz	OPRUGNWYAZDJSK-OAHLLOKOSA-N	-1	0	349.333	3.542	50	0		EHAARM
CC(C)(C)OC(=O)NC[C@H](Cc1cccc2ccccc21)C(=O)[O-]	ZINC000039959769	213245581	/nfs/dbraw/zinc/24/55/81/213245581.db2.gz	WXQGOWCFXXGOLZ-HNNXBMFYSA-N	-1	0	329.396	3.608	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)[C@H]2CC[C@@](C)(C(=O)[O-])C2(C)C)cc1	ZINC000000223916	209495397	/nfs/dbraw/zinc/49/53/97/209495397.db2.gz	DUOIEPVTIVMMNP-UZLBHIALSA-N	-1	0	346.471	3.998	50	0		EHAARM
Cc1sc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204909	209483184	/nfs/dbraw/zinc/48/31/84/209483184.db2.gz	OAJOTIZEIAAZEE-KBPBESRZSA-N	-1	0	344.436	3.948	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)NCc2csc3ccccc23)[C@H](C(=O)[O-])C1	ZINC000000069829	209399629	/nfs/dbraw/zinc/39/96/29/209399629.db2.gz	VWDPEQJAESBSCA-JKSUJKDBSA-N	-1	0	343.448	3.965	50	0		EHAARM
Cc1nc(-c2csc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)c2)no1	ZINC000021701788	212240739	/nfs/dbraw/zinc/24/07/39/212240739.db2.gz	HVWMSOOCOPPPJH-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CC[C@@H](Cc1ccccc1)N(C)C(=O)/C=C/c1ccc(C(=O)[O-])cc1	ZINC000237023870	242453057	/nfs/dbraw/zinc/45/30/57/242453057.db2.gz	SKGIWZSEFNLFRJ-VUVZNRFTSA-N	-1	0	337.419	3.878	50	0		EHAARM
COc1cc2ncc(C(=O)c3cc(Cl)ccc3[O-])cc2c(OC)c1	ZINC000020102565	212100402	/nfs/dbraw/zinc/10/04/02/212100402.db2.gz	VBMAPFYQUVLLHX-UHFFFAOYSA-N	-1	0	343.766	3.842	50	0		EHAARM
O=C(Nc1ccc(-n2ccnc2)cc1)c1cc(F)cc(Cl)c1[O-]	ZINC000078995451	217168681	/nfs/dbraw/zinc/16/86/81/217168681.db2.gz	XBFGGZLFWVYNRP-UHFFFAOYSA-N	-1	0	331.734	3.623	50	0		EHAARM
Cc1cc(C(=O)N2C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C2)ccc1Cl	ZINC000091819128	218070395	/nfs/dbraw/zinc/07/03/95/218070395.db2.gz	HMGYCUXYYHIAAG-JKSUJKDBSA-N	-1	0	343.810	3.589	50	0		EHAARM
O=C([O-])c1ccc(C(F)(F)F)cc1NC(=O)c1ccc(F)cc1F	ZINC000006936385	210746425	/nfs/dbraw/zinc/74/64/25/210746425.db2.gz	ZOSNTFBHVNFFBO-UHFFFAOYSA-N	-1	0	345.223	3.934	50	0		EHAARM
CN(C[C@H]1CCOC1)C(=O)c1cc(-c2ccccc2)cc(Cl)c1[O-]	ZINC000096481549	218857214	/nfs/dbraw/zinc/85/72/14/218857214.db2.gz	ZDYZPCJNDMGREW-CYBMUJFWSA-N	-1	0	345.826	3.821	50	0		EHAARM
CC[C@H](C(=O)Nc1cc(OC)c(OC)cc1C(=O)[O-])c1ccccc1	ZINC000005059946	210378698	/nfs/dbraw/zinc/37/86/98/210378698.db2.gz	CVVOJOJMQDCUFQ-ZDUSSCGKSA-N	-1	0	343.379	3.534	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])n2)cc1	ZINC000000996317	258048980	/nfs/dbraw/zinc/04/89/80/258048980.db2.gz	XSFUUEIBDYMQJY-KBPBESRZSA-N	-1	0	342.420	3.724	50	0		EHAARM
O=C([O-])c1cccc(CS[C@@H](C(=O)NC2CC2)c2ccccc2)c1	ZINC000032885589	258059113	/nfs/dbraw/zinc/05/91/13/258059113.db2.gz	JRAACMHMXIAANZ-QGZVFWFLSA-N	-1	0	341.432	3.638	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)C2(Cc3ccccc3)CCC2)C1	ZINC000097045128	258068046	/nfs/dbraw/zinc/06/80/46/258068046.db2.gz	RQSBBTQXDYZMKI-KRWDZBQOSA-N	-1	0	329.440	3.503	50	0		EHAARM
O=C([O-])c1nn2c(nc(-c3cccs3)cc2C(F)(F)F)c1Cl	ZINC000000196127	563257687	/nfs/dbraw/zinc/25/76/87/563257687.db2.gz	UDHSFHYANTUMDK-UHFFFAOYSA-N	-1	0	347.705	3.828	50	0		EHAARM
CC(=O)Nc1ccc(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)cc1	ZINC000001074586	563373564	/nfs/dbraw/zinc/37/35/64/563373564.db2.gz	QGUOELOVXIPBDH-UHFFFAOYSA-N	-1	0	339.178	3.910	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000001177093	563377705	/nfs/dbraw/zinc/37/77/05/563377705.db2.gz	XMJBBSPXYYWVOW-VHSXEESVSA-N	-1	0	347.720	3.964	50	0		EHAARM
O=C([O-])c1ccc(COc2ccc(Br)cc2Cl)o1	ZINC000002521380	563438640	/nfs/dbraw/zinc/43/86/40/563438640.db2.gz	GMUGPBYRNBSZIP-UHFFFAOYSA-N	-1	0	331.549	3.973	50	0		EHAARM
O=C([O-])c1ccc(Cn2nc(C(F)F)c(Cl)c2C(F)F)o1	ZINC000002549578	563440443	/nfs/dbraw/zinc/44/04/43/563440443.db2.gz	HUTHTKGQAQFYIH-UHFFFAOYSA-N	-1	0	326.633	3.751	50	0		EHAARM
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc1cccc(C(=O)[O-])c1	ZINC000003223821	563477246	/nfs/dbraw/zinc/47/72/46/563477246.db2.gz	DNMXJICLNUMBIM-UHFFFAOYSA-N	-1	0	347.436	3.792	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000002747132	563611688	/nfs/dbraw/zinc/61/16/88/563611688.db2.gz	LLRZMGIWYNSYSC-OLZOCXBDSA-N	-1	0	346.383	3.555	50	0		EHAARM
COc1ccc(Cc2nnc(Nc3cccc(C)c3C)[n-]c2=O)cc1	ZINC000016806836	563824463	/nfs/dbraw/zinc/82/44/63/563824463.db2.gz	PVRGHYSPDCJFFW-UHFFFAOYSA-N	-1	0	336.395	3.537	50	0		EHAARM
Cc1ccc2c(c1)CCCN2C(=O)[C@H]1CC(C)=C(C)C[C@H]1C(=O)[O-]	ZINC000017067060	563831334	/nfs/dbraw/zinc/83/13/34/563831334.db2.gz	XEDQTOBUZGSKLA-DLBZAZTESA-N	-1	0	327.424	3.721	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2cc(Cl)ccc2O)CCCCC1	ZINC000029011462	563904881	/nfs/dbraw/zinc/90/48/81/563904881.db2.gz	CHJVVZDYCFNXEE-UHFFFAOYSA-N	-1	0	325.792	3.799	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1cc(C)ccc1C	ZINC000032971306	563920096	/nfs/dbraw/zinc/92/00/96/563920096.db2.gz	AXAALULMQNAMAZ-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)c2ccn(C3CCCC3)n2)cc1Cl	ZINC000097035404	563966934	/nfs/dbraw/zinc/96/69/34/563966934.db2.gz	MPEGNHWMIGKFIK-UHFFFAOYSA-N	-1	0	333.775	3.602	50	0		EHAARM
Cc1cc(-c2csc(S(=O)(=O)[N-]c3ccc(C)cc3)c2)on1	ZINC000033290251	563973090	/nfs/dbraw/zinc/97/30/90/563973090.db2.gz	MTETXRKYVOGXFD-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
Cc1cc(=O)c2c([O-])c(-c3cscn3)c(C(F)(F)F)oc-2c1	ZINC000005277010	564002292	/nfs/dbraw/zinc/00/22/92/564002292.db2.gz	DWWJHMUESMVXJF-UHFFFAOYSA-N	-1	0	327.283	3.949	50	0		EHAARM
O=C([O-])COc1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1	ZINC000000467926	564012678	/nfs/dbraw/zinc/01/26/78/564012678.db2.gz	BRANVKNXYPCRBM-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
CC(=O)Nc1ccc2oc(-c3ccc([O-])c(Br)c3)nc2c1	ZINC000000553232	564022947	/nfs/dbraw/zinc/02/29/47/564022947.db2.gz	SBEPPVRBDYZEBN-UHFFFAOYSA-N	-1	0	347.168	3.921	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000108492094	564028327	/nfs/dbraw/zinc/02/83/27/564028327.db2.gz	ZMKQHAOCSWUPGS-APHBMKBZSA-N	-1	0	335.831	3.547	50	0		EHAARM
Cc1ccc([C@@H](NC(=O)OCc2ccccc2)[P@](C)(=O)[O-])cc1	ZINC000075261143	564081255	/nfs/dbraw/zinc/08/12/55/564081255.db2.gz	IMNIQEWIEGJEEH-INIZCTEOSA-N	-1	0	333.324	3.820	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000006402457	564085577	/nfs/dbraw/zinc/08/55/77/564085577.db2.gz	HGVAJYUWPFBDPF-ZWKOTPCHSA-N	-1	0	338.407	3.502	50	0		EHAARM
Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)c1ccc(C(=O)[O-])o1	ZINC000191648023	564087142	/nfs/dbraw/zinc/08/71/42/564087142.db2.gz	BVHRSRLTBDZBSC-SNVBAGLBSA-N	-1	0	336.413	3.699	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2ccccc2C(C)(C)C)cc1C(=O)[O-]	ZINC000006549998	564091898	/nfs/dbraw/zinc/09/18/98/564091898.db2.gz	OMYVZKBQZOTNFE-UHFFFAOYSA-N	-1	0	347.436	3.792	50	0		EHAARM
O=S(=O)([N-]c1ccccc1OC(F)F)c1ccc2c(c1)CCC2	ZINC000006919736	564101399	/nfs/dbraw/zinc/10/13/99/564101399.db2.gz	MZUJUFUWAIDSCA-UHFFFAOYSA-N	-1	0	339.363	3.578	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cc(C)ccc2C)c2cccnc21	ZINC000065242226	564103383	/nfs/dbraw/zinc/10/33/83/564103383.db2.gz	LBZCKQUJCQSTRT-UHFFFAOYSA-N	-1	0	343.452	3.864	50	0		EHAARM
O=C([O-])c1ccc(NNC(=O)Nc2ccccc2C(F)(F)F)cc1	ZINC000003086028	564107787	/nfs/dbraw/zinc/10/77/87/564107787.db2.gz	IILDAFSUMKYZBD-UHFFFAOYSA-N	-1	0	339.273	3.552	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccccc1C(F)(F)F	ZINC000000479917	564116756	/nfs/dbraw/zinc/11/67/56/564116756.db2.gz	YVVFCMBRTOJFTA-UHFFFAOYSA-N	-1	0	345.342	3.823	50	0		EHAARM
O=C([O-])c1cc(NCCc2ccc(C(F)(F)F)cc2)ccc1O	ZINC000034885635	564128421	/nfs/dbraw/zinc/12/84/21/564128421.db2.gz	UTMVACIBQLDZLP-UHFFFAOYSA-N	-1	0	325.286	3.764	50	0		EHAARM
C[C@@H](C[NH2+][C@@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997530	564135855	/nfs/dbraw/zinc/13/58/55/564135855.db2.gz	VOOWOTDGINXRPG-MEDUHNTESA-N	-1	0	341.294	3.534	50	0		EHAARM
O=C([N-]c1ccccc1SCc1ccsc1)c1cccc[n+]1[O-]	ZINC000080099888	564139145	/nfs/dbraw/zinc/13/91/45/564139145.db2.gz	SIIBLDLTVTYBPR-UHFFFAOYSA-N	-1	0	342.445	3.926	50	0		EHAARM
CC(C)c1nc([C@H](C)NC(=O)CCc2ccc(C(=O)[O-])cc2)cs1	ZINC000095969742	564143422	/nfs/dbraw/zinc/14/34/22/564143422.db2.gz	FPDGHDHOGFOJPR-LBPRGKRZSA-N	-1	0	346.452	3.775	50	0		EHAARM
C[C@@H](CC(=O)N1CCC[C@@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000095969522	564143424	/nfs/dbraw/zinc/14/34/24/564143424.db2.gz	GWLAJJZILZHZKA-WCQYABFASA-N	-1	0	343.345	3.522	50	0		EHAARM
CCOC(=O)c1c(=O)[nH]c2scc(-c3ccc(Cl)cc3)c2c1[O-]	ZINC000057327530	564153597	/nfs/dbraw/zinc/15/35/97/564153597.db2.gz	NOFUWPMPOBPILY-UHFFFAOYSA-N	-1	0	349.795	3.792	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)c2ccccc2F)cc1C(=O)[O-]	ZINC000058065129	564157410	/nfs/dbraw/zinc/15/74/10/564157410.db2.gz	IYXHPZZCNNNXRG-UHFFFAOYSA-N	-1	0	330.359	3.622	50	0		EHAARM
CCO[C@H]1C[C@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000073984568	564176453	/nfs/dbraw/zinc/17/64/53/564176453.db2.gz	WEPOGIXLFWMSAL-KBPBESRZSA-N	-1	0	332.425	3.568	50	0		EHAARM
O=C(c1ccc([O-])c(Cl)c1)N1CC[C@H](COCc2ccccc2)C1	ZINC000075161290	564176473	/nfs/dbraw/zinc/17/64/73/564176473.db2.gz	GUTIHROSXGKDAH-HNNXBMFYSA-N	-1	0	345.826	3.725	50	0		EHAARM
C[C@H](Cc1ccc(NC(=O)[C@H]2CCc3cc(F)ccc32)cc1)C(=O)[O-]	ZINC000563451654	974533278	/nfs/dbraw/zinc/53/32/78/974533278.db2.gz	ZZOYREMPIFTHOO-XIKOKIGWSA-N	-1	0	341.382	3.757	50	0		EHAARM
C[C@@H](C(=O)[O-])c1cccc(NC(=O)[C@@H]2CCc3cc(F)ccc32)c1	ZINC000574651748	974786872	/nfs/dbraw/zinc/78/68/72/974786872.db2.gz	IQSQEEVGWQKKOO-PIGZYNQJSA-N	-1	0	327.355	3.682	50	0		EHAARM
O=C([O-])c1nc(/C=C/c2ccccc2F)sc1Br	ZINC000253426128	1128462100	/nfs/dbraw/zinc/46/21/00/1128462100.db2.gz	OYZALHSAZLKHLS-AATRIKPKSA-N	-1	0	328.162	3.913	50	0		EHAARM
O=C([O-])C/C(=C\c1cc(F)c([O-])c(F)c1)c1nc2ccccc2o1	ZINC000221833259	1138219579	/nfs/dbraw/zinc/21/95/79/1138219579.db2.gz	DUIMVLJMUYFLRX-BJMVGYQFSA-N	-1	0	331.274	3.827	50	0		EHAARM
Cc1cc(-c2csc(S(=O)(=O)[N-]c3ccc(F)cc3)c2)on1	ZINC000049547513	214017582	/nfs/dbraw/zinc/01/75/82/214017582.db2.gz	YQCWRVFTSYNDAL-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
CCCc1c(C)nc2[n-]c(SCc3ccccc3Cl)nn2c1=O	ZINC000100133750	219092414	/nfs/dbraw/zinc/09/24/14/219092414.db2.gz	NWQWDPVGQILUCU-UHFFFAOYSA-N	-1	0	348.859	3.624	50	0		EHAARM
O=C([O-])c1ccc(-n2nc(C(F)(F)F)c3c2-c2ccoc2CC3)cc1	ZINC000004186629	210142505	/nfs/dbraw/zinc/14/25/05/210142505.db2.gz	RVHHPVQHQFIGDW-UHFFFAOYSA-N	-1	0	348.280	3.948	50	0		EHAARM
Cc1c2cc3c(cc2oc(=O)c1CC(=O)[O-])OC1(CCCCC1)CC3	ZINC000004088129	210116494	/nfs/dbraw/zinc/11/64/94/210116494.db2.gz	DNRIWPCBIREDLI-UHFFFAOYSA-N	-1	0	342.391	3.756	50	0	biogenic	EHAARM
Cc1c(OCc2ccccc2)ccc2c(C)c(CC(=O)[O-])c(=O)oc12	ZINC000004046669	210107862	/nfs/dbraw/zinc/10/78/62/210107862.db2.gz	QCQNQYRVBTVEJF-UHFFFAOYSA-N	-1	0	338.359	3.616	50	0	biogenic	EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CC2)[C@H]1c1ccccc1Cl	ZINC000045923085	213766409	/nfs/dbraw/zinc/76/64/09/213766409.db2.gz	KQJTWDKMBAIVCP-SJORKVTESA-N	-1	0	341.794	3.868	50	0		EHAARM
O=C([O-])c1ccc(O[C@@H](O)Cn2c3ccccc3c3ccccc32)cc1	ZINC000003904789	210089387	/nfs/dbraw/zinc/08/93/87/210089387.db2.gz	PKMCFEARKYKHNA-HXUWFJFHSA-N	-1	0	347.370	3.890	50	0		EHAARM
COc1ccccc1[C@@H]1Nc2nonc2N=C2CC(C)(C)CC(=O)C21	ZINC000102741933	219226493	/nfs/dbraw/zinc/22/64/93/219226493.db2.gz	PPOFBLXTNUIUBZ-HNNXBMFYSA-N	-1	0	340.383	3.950	50	0		EHAARM
O=C([O-])c1ccc(-c2cccc(CN3CCOCC3)c2)c(Cl)c1	ZINC000067541773	215159845	/nfs/dbraw/zinc/15/98/45/215159845.db2.gz	MHQAYRUQWXRPMD-UHFFFAOYSA-N	-1	0	331.799	3.537	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000069158234	215365395	/nfs/dbraw/zinc/36/53/95/215365395.db2.gz	GEAOKMRNZRGOMW-OLZOCXBDSA-N	-1	0	342.420	3.779	50	0		EHAARM
CC1=CC[C@H](C(=O)[O-])[C@H](C(=O)Nc2ccc(Cl)c(Cl)c2)C1	ZINC000000315613	209533292	/nfs/dbraw/zinc/53/32/92/209533292.db2.gz	STPKQKKLSGRYFG-WDEREUQCSA-N	-1	0	328.195	3.989	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@@H](C(=O)Nc2ccc(Cl)c(Cl)c2)C1	ZINC000000315607	209532639	/nfs/dbraw/zinc/53/26/39/209532639.db2.gz	STPKQKKLSGRYFG-MNOVXSKESA-N	-1	0	328.195	3.989	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC000225901565	242075620	/nfs/dbraw/zinc/07/56/20/242075620.db2.gz	WSNYDIRTGGFGKJ-QMMMGPOBSA-N	-1	0	336.240	3.772	50	0		EHAARM
COCc1cccc(NC(=O)C[C@@H](CC(=O)[O-])c2ccc(F)cc2)c1	ZINC000226753724	242112952	/nfs/dbraw/zinc/11/29/52/242112952.db2.gz	SZMTUMPZWSYRGO-HNNXBMFYSA-N	-1	0	345.370	3.559	50	0		EHAARM
Cc1nc2cc(F)ccc2cc1C(=O)N1CCCC[C@@H]1CCC(=O)[O-]	ZINC000237745257	242778559	/nfs/dbraw/zinc/77/85/59/242778559.db2.gz	HFAIRAMCNAZVNZ-OAHLLOKOSA-N	-1	0	344.386	3.542	50	0		EHAARM
Cc1ccc2cc(C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)c(C)nc2c1	ZINC000237888193	242839385	/nfs/dbraw/zinc/83/93/85/242839385.db2.gz	IWOJFXYNLXJRIH-HNNXBMFYSA-N	-1	0	340.423	3.569	50	0		EHAARM
CSc1ccc(-c2noc(-c3c[n-]c4ccccc4c3=O)n2)cc1	ZINC000020716882	212164059	/nfs/dbraw/zinc/16/40/59/212164059.db2.gz	PIRXYQRVMHDXAG-UHFFFAOYSA-N	-1	0	335.388	3.967	50	0		EHAARM
COc1ccc(Cl)cc1/C=C/C(=O)Nc1ccccc1C(=O)[O-]	ZINC000013943543	211658557	/nfs/dbraw/zinc/65/85/57/211658557.db2.gz	UOJMUKADJPLIDH-RMKNXTFCSA-N	-1	0	331.755	3.699	50	0		EHAARM
O=S1(=O)[N-]C(SCc2ccccc2)=Nc2ccc(Cl)cc21	ZINC000012361100	211356247	/nfs/dbraw/zinc/35/62/47/211356247.db2.gz	PBKUJKQLJOTBQW-UHFFFAOYSA-N	-1	0	338.841	3.744	50	0		EHAARM
Cc1ccccc1N1CCN([C@@H](C(=O)[O-])c2ccc(Cl)cc2)CC1	ZINC000091690376	218047430	/nfs/dbraw/zinc/04/74/30/218047430.db2.gz	ODOSEGNPHJCCBW-GOSISDBHSA-N	-1	0	344.842	3.596	50	0		EHAARM
CCOc1cc2cc(C(=O)c3cc(F)ccc3[O-])cnc2cc1OC	ZINC000009458395	211088112	/nfs/dbraw/zinc/08/81/12/211088112.db2.gz	QTPNYNZTBFLWRQ-UHFFFAOYSA-N	-1	0	341.338	3.718	50	0		EHAARM
COC(=O)c1c(SCc2ccc(F)cc2)[n-]c2ccccc2c1=O	ZINC000009300289	211063053	/nfs/dbraw/zinc/06/30/53/211063053.db2.gz	GBCRVORJLYWQSM-UHFFFAOYSA-N	-1	0	343.379	3.746	50	0		EHAARM
Cc1nc2c3ccccc3oc2c(N[C@@H](C(=O)[O-])c2ccccc2)n1	ZINC000006925394	210744110	/nfs/dbraw/zinc/74/41/10/210744110.db2.gz	ZOPMELGXYYGHSX-OAHLLOKOSA-N	-1	0	333.347	3.922	50	0		EHAARM
CC[C@H](NC(=O)[C@H](C)c1ccc(-c2ccccc2)c(F)c1)C(=O)[O-]	ZINC000006760090	210703818	/nfs/dbraw/zinc/70/38/18/210703818.db2.gz	ZQADHETUQGSDGN-PXAZEXFGSA-N	-1	0	329.371	3.576	50	0		EHAARM
CC(C)c1cccc(NS(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000096747794	218888911	/nfs/dbraw/zinc/88/89/11/218888911.db2.gz	KCMNIWKLLBCIKC-FLIBITNWSA-N	-1	0	345.420	3.709	50	0		EHAARM
Cc1n[nH]c(SC(=Cc2ccc(Cl)cc2Cl)C(=O)[O-])n1	ZINC000006129873	258051727	/nfs/dbraw/zinc/05/17/27/258051727.db2.gz	IPEIKLNFWLMKOI-WMZJFQQLSA-N	-1	0	330.196	3.638	50	0		EHAARM
O=S(=O)([N-]c1cc(C(F)(F)F)ccc1F)c1cccs1	ZINC000017066578	563830658	/nfs/dbraw/zinc/83/06/58/563830658.db2.gz	ZAQZUCRFBUMEOY-UHFFFAOYSA-N	-1	0	325.308	3.707	50	0		EHAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(C(C)(C)C)cc2)c1	ZINC000000138814	563241489	/nfs/dbraw/zinc/24/14/89/563241489.db2.gz	LWZYIJWRNUPYFW-UHFFFAOYSA-N	-1	0	349.452	3.802	50	0		EHAARM
Cc1sc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204923	563259320	/nfs/dbraw/zinc/25/93/20/563259320.db2.gz	WBTSRBHBHLSUHT-KBPBESRZSA-N	-1	0	342.420	3.724	50	0		EHAARM
Cc1cc(C(=O)[O-])c(NC(=O)c2ccccc2Br)s1	ZINC000000227474	563263437	/nfs/dbraw/zinc/26/34/37/563263437.db2.gz	OJDCQZYHDUESRB-UHFFFAOYSA-N	-1	0	340.198	3.770	50	0		EHAARM
CC(=O)c1c(C)oc2ccc([N-]S(=O)(=O)c3cccs3)cc21	ZINC000000911330	563365977	/nfs/dbraw/zinc/36/59/77/563365977.db2.gz	SZMQKBJICFJMQE-UHFFFAOYSA-N	-1	0	335.406	3.806	50	0		EHAARM
CCc1nc2c3ccccc3oc2c(N[C@H](CCSC)C(=O)[O-])n1	ZINC000001897415	563415597	/nfs/dbraw/zinc/41/55/97/563415597.db2.gz	VPFZJOZNCDOAEJ-LLVKDONJSA-N	-1	0	345.424	3.557	50	0		EHAARM
O=C([O-])CCCCCC(=O)c1ccccc1I	ZINC000002579881	563442898	/nfs/dbraw/zinc/44/28/98/563442898.db2.gz	AUBOBJJZBBICII-UHFFFAOYSA-N	-1	0	346.164	3.509	50	0		EHAARM
Cc1sc(NC(=O)CCCC(=O)[O-])nc1-c1cc(C)ccc1C	ZINC000002785459	563612728	/nfs/dbraw/zinc/61/27/28/563612728.db2.gz	NDKYJVAIASONBQ-UHFFFAOYSA-N	-1	0	332.425	3.929	50	0		EHAARM
O=C([O-])c1ccc(O[C@@H](C(=O)N2CCCCC2)c2ccccc2)cc1	ZINC000013413604	563698053	/nfs/dbraw/zinc/69/80/53/563698053.db2.gz	NBDPIWAZBUDGRK-GOSISDBHSA-N	-1	0	339.391	3.517	50	0		EHAARM
Cc1c(NC(=O)[C@@H](C)SCc2ccccc2)cccc1C(=O)[O-]	ZINC000013843373	563726086	/nfs/dbraw/zinc/72/60/86/563726086.db2.gz	RFVIDKGCYVUZMI-CYBMUJFWSA-N	-1	0	329.421	3.954	50	0		EHAARM
Cc1ccc2oc(-c3ccc(NC(=O)CCCC(=O)[O-])cc3)nc2c1	ZINC000013896389	563728804	/nfs/dbraw/zinc/72/88/04/563728804.db2.gz	UGCPASIJBTWPNH-UHFFFAOYSA-N	-1	0	338.363	3.997	50	0		EHAARM
COc1ccc(-c2cc(=O)n3[n-]c(C)c(-c4ccc(F)cc4)c3n2)cc1	ZINC000018222471	563851368	/nfs/dbraw/zinc/85/13/68/563851368.db2.gz	GNPOOWLKRVOXNU-UHFFFAOYSA-N	-1	0	349.365	3.813	50	0		EHAARM
COc1c(Cl)c(Cl)ccc1S(=O)(=O)[N-]c1cccc(O)c1	ZINC000032601889	563914091	/nfs/dbraw/zinc/91/40/91/563914091.db2.gz	UXIYVUICXXTTNF-UHFFFAOYSA-N	-1	0	348.207	3.508	50	0		EHAARM
CCCOc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1cccnc1	ZINC000041091882	563924214	/nfs/dbraw/zinc/92/42/14/563924214.db2.gz	SFNPTAWJVZYXHQ-UHFFFAOYSA-N	-1	0	348.468	3.969	50	0		EHAARM
O=C([O-])c1cnc(/C=C/c2cnn(-c3ccc(Cl)cc3)c2)s1	ZINC000058344355	563943188	/nfs/dbraw/zinc/94/31/88/563943188.db2.gz	XSVGXDJSAFMTEV-LZCJLJQNSA-N	-1	0	331.784	3.851	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@H](CCCc2ccccc2)[C@H]1C(=O)[O-]	ZINC000072233756	563986066	/nfs/dbraw/zinc/98/60/66/563986066.db2.gz	JJVIAYZDVHANGB-HOTGVXAUSA-N	-1	0	333.428	3.720	50	0		EHAARM
CC[C@H](C(=O)N1CCC(C(=O)[O-])CC1)c1cccc(C(F)(F)F)c1	ZINC000237072458	563987550	/nfs/dbraw/zinc/98/75/50/563987550.db2.gz	YATCAWFTNQQCHT-AWEZNQCLSA-N	-1	0	343.345	3.522	50	0		EHAARM
Cc1ccnc([N-]S(=O)(=O)c2ccc(C3CCCCC3)cc2)n1	ZINC000028224746	563987627	/nfs/dbraw/zinc/98/76/27/563987627.db2.gz	TTZANPVSQBRAET-UHFFFAOYSA-N	-1	0	331.441	3.634	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC000237968996	563994324	/nfs/dbraw/zinc/99/43/24/563994324.db2.gz	XYBXGNSUMAKHOY-NSHDSACASA-N	-1	0	335.787	3.803	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)C[C@@H]2CCCc3ccccc32)C1	ZINC000238008772	563994405	/nfs/dbraw/zinc/99/44/05/563994405.db2.gz	CBKLKLLLLIEKNL-WBVHZDCISA-N	-1	0	329.440	3.600	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)Nc2ccc(C(C)(C)C)cc2)cc1	ZINC000003203068	564004162	/nfs/dbraw/zinc/00/41/62/564004162.db2.gz	ZNMAJXDIKOCNQK-UHFFFAOYSA-N	-1	0	346.452	3.803	50	0		EHAARM
COc1ccccc1-n1[n-]c(C)c(Cc2ccccc2Cl)c1=O	ZINC000017879340	564013171	/nfs/dbraw/zinc/01/31/71/564013171.db2.gz	CJKXVHORGDIPCY-UHFFFAOYSA-N	-1	0	328.799	3.727	50	0		EHAARM
CSc1nn2c([n-]1)nc(C)c(Cc1cccc3ccccc31)c2=O	ZINC000018240877	564018928	/nfs/dbraw/zinc/01/89/28/564018928.db2.gz	WCITVOPKXZWHTL-UHFFFAOYSA-N	-1	0	336.420	3.604	50	0		EHAARM
CC(C)[C@H](NC(=O)Nc1ccc(Oc2ccccc2)cc1)C(=O)[O-]	ZINC000000541308	564022491	/nfs/dbraw/zinc/02/24/91/564022491.db2.gz	YCXZBTBXYJIWMI-INIZCTEOSA-N	-1	0	328.368	3.710	50	0		EHAARM
CC(C)(C)c1nc2cc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])ccc2o1	ZINC000046834806	564025383	/nfs/dbraw/zinc/02/53/83/564025383.db2.gz	SHVUYRASNIKGOH-STQMWFEESA-N	-1	0	342.395	3.731	50	0		EHAARM
CO[C@@]1(C)C[C@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C1(C)C	ZINC000081485064	564032379	/nfs/dbraw/zinc/03/23/79/564032379.db2.gz	WIOMVHIALISFIU-GUYCJALGSA-N	-1	0	334.441	3.766	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2ccccc2c1	ZINC000005885577	564056843	/nfs/dbraw/zinc/05/68/43/564056843.db2.gz	SMYJKYYIOOEXHM-UHFFFAOYSA-N	-1	0	325.389	3.843	50	0		EHAARM
O=C([O-])CCCC(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000002083819	564058263	/nfs/dbraw/zinc/05/82/63/564058263.db2.gz	KZOUVLYTDAPUFG-UHFFFAOYSA-N	-1	0	325.408	3.580	50	0		EHAARM
CN(Cc1nc2ccccc2s1)Cc1nc(=O)c2sccc2[n-]1	ZINC000012684435	564062653	/nfs/dbraw/zinc/06/26/53/564062653.db2.gz	GYXVGWBQKIMPBE-UHFFFAOYSA-N	-1	0	342.449	3.639	50	0		EHAARM
CCn1c(=O)c(C(=O)Nc2cccc(Cl)c2)c([O-])c2ccccc21	ZINC000001294012	564063045	/nfs/dbraw/zinc/06/30/45/564063045.db2.gz	IVAQQXSSMVBZRY-UHFFFAOYSA-N	-1	0	342.782	3.633	50	0		EHAARM
Cc1cccc2sc(NC(=O)[C@@H]3CC(C)=CC[C@@H]3C(=O)[O-])nc21	ZINC000006217817	564082973	/nfs/dbraw/zinc/08/29/73/564082973.db2.gz	GJCVSXKJGOPOAN-NWDGAFQWSA-N	-1	0	330.409	3.600	50	0		EHAARM
O=c1c(-c2nc(-c3ccccc3F)no2)c[n-]c2ccc(F)cc21	ZINC000075441527	564084799	/nfs/dbraw/zinc/08/47/99/564084799.db2.gz	CVATWVNGPXACRE-UHFFFAOYSA-N	-1	0	325.274	3.523	50	0		EHAARM
Nc1nc(-c2ccc(Oc3ccccc3)cc2)c(CC(=O)[O-])s1	ZINC000006673136	564095802	/nfs/dbraw/zinc/09/58/02/564095802.db2.gz	CEXYRFGDYHMRNN-UHFFFAOYSA-N	-1	0	326.377	3.812	50	0		EHAARM
C[C@H]1CCCN(c2ccc(C(=O)[O-])cc2NC(=O)c2ccccc2)C1	ZINC000064820602	564096586	/nfs/dbraw/zinc/09/65/86/564096586.db2.gz	VHKDLRIQWBHMIL-AWEZNQCLSA-N	-1	0	338.407	3.873	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)o2)c1C	ZINC000064958564	564098541	/nfs/dbraw/zinc/09/85/41/564098541.db2.gz	YYYUIQJWAWRWDY-UHFFFAOYSA-N	-1	0	346.408	3.969	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cccc(C)c2)c2cccnc21	ZINC000065242235	564103391	/nfs/dbraw/zinc/10/33/91/564103391.db2.gz	MWNCGTOOMZPRFV-UHFFFAOYSA-N	-1	0	329.425	3.556	50	0		EHAARM
O=c1nc(CSc2nc(-c3ccccc3)co2)[n-]c2ccsc21	ZINC000195096841	564122758	/nfs/dbraw/zinc/12/27/58/564122758.db2.gz	ULVSWZJYVJRNKW-UHFFFAOYSA-N	-1	0	341.417	3.932	50	0		EHAARM
CSc1ccc([C@@H](NCc2ccc(C)cc2)[P@@](=O)([O-])O)cc1	ZINC000012997514	564135848	/nfs/dbraw/zinc/13/58/48/564135848.db2.gz	GDOQVOLONZBMDA-INIZCTEOSA-N	-1	0	337.381	3.683	50	0		EHAARM
Cc1ccc(CC(=O)N[C@H](CC(=O)[O-])c2ccc(Cl)s2)s1	ZINC000095463977	564140915	/nfs/dbraw/zinc/14/09/15/564140915.db2.gz	MAOYPHNHZKPNMZ-SNVBAGLBSA-N	-1	0	343.857	3.646	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@@H]1CCC[C@@H](C)[C@@H]1C)c2=O	ZINC000020645198	564141718	/nfs/dbraw/zinc/14/17/18/564141718.db2.gz	VBIHYWPJMKUNNZ-JRPNMDOOSA-N	-1	0	346.452	3.843	50	0		EHAARM
C[C@@]([N-]S(=O)(=O)c1cccc(F)c1)(c1ccccc1)C(F)(F)F	ZINC000095944112	564142159	/nfs/dbraw/zinc/14/21/59/564142159.db2.gz	AATOHMHVIMHSRX-CQSZACIVSA-N	-1	0	347.333	3.582	50	0		EHAARM
CC(C)(C)c1ccc([C@H]2c3sc(=O)[nH]c3SC=C2C(=O)[O-])cc1	ZINC000096318913	564146792	/nfs/dbraw/zinc/14/67/92/564146792.db2.gz	QAWWCASCVQAUQW-GFCCVEGCSA-N	-1	0	347.461	3.940	50	0		EHAARM
O=c1[n-]c(Nc2cccc(Cl)c2Cl)nnc1Cc1ccccc1	ZINC000002718740	564152219	/nfs/dbraw/zinc/15/22/19/564152219.db2.gz	WWJMZIGFKOEYFZ-UHFFFAOYSA-N	-1	0	347.205	3.806	50	0		EHAARM
O=C([O-])[C@H]1CCCN(c2ncnc3sc(-c4ccccc4)cc32)C1	ZINC000003358752	564157674	/nfs/dbraw/zinc/15/76/74/564157674.db2.gz	BCKATJICOMMUMO-ZDUSSCGKSA-N	-1	0	339.420	3.659	50	0		EHAARM
Cc1ccc([C@@H]2[C@@H](C(=O)[O-])CCC(=O)N2CCc2cccs2)s1	ZINC000069664818	564171381	/nfs/dbraw/zinc/17/13/81/564171381.db2.gz	OUKBJPIOKYHCDC-BBRMVZONSA-N	-1	0	349.477	3.725	50	0		EHAARM
CCO[C@@H]1C[C@@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000073984570	564176463	/nfs/dbraw/zinc/17/64/63/564176463.db2.gz	WEPOGIXLFWMSAL-ZIAGYGMSSA-N	-1	0	332.425	3.568	50	0		EHAARM
O=C([O-])[C@@H]1CCCN1C(=O)c1sc2cc(Cl)ccc2c1Cl	ZINC000037410289	600235930	/nfs/dbraw/zinc/23/59/30/600235930.db2.gz	PQDZWLRPVCFJBR-VIFPVBQESA-N	-1	0	344.219	3.897	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(C2CC2)[C@H]2CCc3ccccc32)s1	ZINC000238012035	961075580	/nfs/dbraw/zinc/07/55/80/961075580.db2.gz	ZPVWWFVPESIIRT-AWEZNQCLSA-N	-1	0	327.405	3.738	50	0		EHAARM
Cc1ccccc1Oc1ccc(S(=O)(=O)[N-]c2cccnc2)cc1	ZINC000000463601	1033550064	/nfs/dbraw/zinc/55/00/64/1033550064.db2.gz	CAWQOKMWIYXOBK-UHFFFAOYSA-N	-1	0	340.404	3.983	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)Nc1nc(-c2cccs2)cs1	ZINC000000816577	1033807280	/nfs/dbraw/zinc/80/72/80/1033807280.db2.gz	VCETXPQBXFFOCP-NXEZZACHSA-N	-1	0	336.438	3.701	50	0	aggregator	EHAARM
CC1=CC(=O)C(=C([O-])C=Cc2ccc(-c3ccccc3)cc2)C(=O)O1	ZINC000034705145	1129823724	/nfs/dbraw/zinc/82/37/24/1129823724.db2.gz	AYDSXJQLMORBSH-FNUUXAGOSA-N	-1	0	332.355	3.582	50	0		EHAARM
Cc1ccc(-c2[n-][nH]c(=NC(=O)[C@H]3CCCc4ccccc43)c2C)o1	ZINC000568353747	1130969105	/nfs/dbraw/zinc/96/91/05/1130969105.db2.gz	YYHIWWYGBVWLBT-INIZCTEOSA-N	-1	0	335.407	3.767	50	0		EHAARM
CC(C)n1ccc2ccc(C(=O)NC[C@H]3CC[C@H](C(=O)[O-])CC3)cc21	ZINC000952963484	1137483609	/nfs/dbraw/zinc/48/36/09/1137483609.db2.gz	UBVWIUOJDWFQSM-KOMQPUFPSA-N	-1	0	342.439	3.843	50	0		EHAARM
C[C@H]1CCCN(c2ccc(Cl)cc2NC(=O)CCCC(=O)[O-])C1	ZINC000952967423	1137485030	/nfs/dbraw/zinc/48/50/30/1137485030.db2.gz	ZTUNFGTURQOMPG-LBPRGKRZSA-N	-1	0	338.835	3.770	50	0		EHAARM
CC(C)(C)OC(=O)N1C[C@H](Cc2ccc(Cl)cc2)C[C@H]1C(=O)[O-]	ZINC000004241338	210149418	/nfs/dbraw/zinc/14/94/18/210149418.db2.gz	CYTDFJOBCYJCOQ-OCCSQVGLSA-N	-1	0	339.819	3.593	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccc(Cl)s2)cc1Cl	ZINC000003328287	210008093	/nfs/dbraw/zinc/00/80/93/210008093.db2.gz	QICYCGZIHDYWGG-UHFFFAOYSA-N	-1	0	338.237	3.864	50	0		EHAARM
O=S(=O)([N-]c1cccc(OCc2ccncc2)c1)c1cccs1	ZINC000041616307	213457409	/nfs/dbraw/zinc/45/74/09/213457409.db2.gz	HZOLNMKNBKIBOF-UHFFFAOYSA-N	-1	0	346.433	3.523	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1	ZINC000000615596	209679724	/nfs/dbraw/zinc/67/97/24/209679724.db2.gz	MALDCIXGGULVTD-UHFFFAOYSA-N	-1	0	345.342	3.823	50	0		EHAARM
Cc1nn(-c2ccc(C(=O)[O-])cc2)c(N)c1-c1ccc(Cl)cc1	ZINC000034926199	212999650	/nfs/dbraw/zinc/99/96/50/212999650.db2.gz	PASSNPIQQZUGDM-UHFFFAOYSA-N	-1	0	327.771	3.782	50	0		EHAARM
O=C([O-])c1ccccc1-c1cc(NCc2ccccn2)nc2[nH]ccc21	ZINC000072132114	216022176	/nfs/dbraw/zinc/02/21/76/216022176.db2.gz	YJGNBQMBLSFTND-UHFFFAOYSA-N	-1	0	344.374	3.935	50	0		EHAARM
CC[C@@H](C)c1ccc(O)c(NC(=O)Cc2ccccc2C(=O)[O-])c1	ZINC000072401469	216194295	/nfs/dbraw/zinc/19/42/95/216194295.db2.gz	VTAIQMQZOJDRLG-GFCCVEGCSA-N	-1	0	327.380	3.785	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)Oc2ccc(C(C)(C)C)cc2)cc1	ZINC000000063634	209395255	/nfs/dbraw/zinc/39/52/55/209395255.db2.gz	YADFDDLNLZXDEQ-UHFFFAOYSA-N	-1	0	347.436	3.770	50	0		EHAARM
O=C([O-])c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2	ZINC000022147758	212280291	/nfs/dbraw/zinc/28/02/91/212280291.db2.gz	BOJUOGNLBNUJAD-UHFFFAOYSA-N	-1	0	330.693	3.731	50	0		EHAARM
CCOc1ccc(-c2noc(-c3c[n-]c4ccccc4c3=O)n2)cc1	ZINC000020735499	212166982	/nfs/dbraw/zinc/16/69/82/212166982.db2.gz	YVUKQDSGOWVUII-UHFFFAOYSA-N	-1	0	333.347	3.644	50	0		EHAARM
Cc1ccc(-c2cc(C(F)F)c3c(C)nn(CC(=O)[O-])c3n2)s1	ZINC000020604134	212152382	/nfs/dbraw/zinc/15/23/82/212152382.db2.gz	SXUVZWWDMKHICM-UHFFFAOYSA-N	-1	0	337.351	3.799	50	0		EHAARM
Cc1nn(CC(=O)[O-])c2nc(-c3ccc(C)cc3)cc(C(F)F)c12	ZINC000020349779	212121401	/nfs/dbraw/zinc/12/14/01/212121401.db2.gz	BBYQNRWJRBAXAQ-UHFFFAOYSA-N	-1	0	331.322	3.737	50	0		EHAARM
Fc1cc(F)cc(Cc2n[n-]c(=S)n2-c2ccc3c(c2)OCO3)c1	ZINC000012324326	211347098	/nfs/dbraw/zinc/34/70/98/211347098.db2.gz	NAQKOKCAQXWWGG-UHFFFAOYSA-N	-1	0	347.346	3.528	50	0		EHAARM
CCSc1nnc([N-]C(=O)c2cc(-c3ccccc3)on2)s1	ZINC000011917151	211270022	/nfs/dbraw/zinc/27/00/22/211270022.db2.gz	CDVFTWHIGHAGHO-UHFFFAOYSA-N	-1	0	332.410	3.557	50	0		EHAARM
COc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccc(F)cc1	ZINC000011613851	211226857	/nfs/dbraw/zinc/22/68/57/211226857.db2.gz	ADLUSVFMYRJXHV-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
COc1ccc(Cc2nnc(Nc3ccc(C)c(C)c3)[n-]c2=O)cc1	ZINC000008997445	211029988	/nfs/dbraw/zinc/02/99/88/211029988.db2.gz	YRFDPDGJBDPDSM-UHFFFAOYSA-N	-1	0	336.395	3.537	50	0		EHAARM
CC[C@@H](C)[C@@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)c1ccccc1	ZINC000095361111	218294807	/nfs/dbraw/zinc/29/48/07/218294807.db2.gz	IORYCVSFYDWOFH-SJKOYZFVSA-N	-1	0	329.396	3.732	50	0		EHAARM
O=C(Cc1csc(-c2cccs2)n1)[N-]OCc1ccccc1	ZINC000008775225	211005447	/nfs/dbraw/zinc/00/54/47/211005447.db2.gz	OIHZHNJSKKIZGC-UHFFFAOYSA-N	-1	0	330.434	3.662	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)CCCc1cccs1)c1ccc(F)cc1	ZINC000095393697	218325765	/nfs/dbraw/zinc/32/57/65/218325765.db2.gz	SDIHBGUBIDUHQG-HNNXBMFYSA-N	-1	0	335.400	3.542	50	0		EHAARM
CC1(C)[C@H](C(=O)Nc2ccc(C(=O)[O-])cc2)[C@H]1C=C(Cl)Cl	ZINC000005008231	210360863	/nfs/dbraw/zinc/36/08/63/210360863.db2.gz	PIPHJIAVRSNMCM-PWSUYJOCSA-N	-1	0	328.195	3.915	50	0		EHAARM
COc1cc(OC)cc(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)c1	ZINC000004842950	210296326	/nfs/dbraw/zinc/29/63/26/210296326.db2.gz	UAIFFXFXSOKEKD-UHFFFAOYSA-N	-1	0	342.178	3.969	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)c1ccc(OCC(F)(F)F)cc1	ZINC000521393996	257949302	/nfs/dbraw/zinc/94/93/02/257949302.db2.gz	AHPAMLNIOAZFKR-UHFFFAOYSA-N	-1	0	339.269	3.578	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@H]2C[C@H]2c2ccccc2Cl)cc1C(=O)[O-]	ZINC000299753328	258006486	/nfs/dbraw/zinc/00/64/86/258006486.db2.gz	XVGNTKKUDHZOOB-GJZGRUSLSA-N	-1	0	347.798	3.702	50	0		EHAARM
CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000132592489	527799111	/nfs/dbraw/zinc/79/91/11/527799111.db2.gz	XVSQKNWXZXUTIU-HUUCEWRRSA-N	-1	0	346.452	3.536	50	0		EHAARM
COc1ccc(-c2csc(Cc3ccccc3)n2)c2occ([O-])c21	ZINC000225519917	536498299	/nfs/dbraw/zinc/49/82/99/536498299.db2.gz	OYCBCWMCJZYJBQ-UHFFFAOYSA-N	-1	0	337.400	3.985	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(Br)s2)cc1C	ZINC000007053196	564103859	/nfs/dbraw/zinc/10/38/59/564103859.db2.gz	ZQNWOMVGWBSNHW-UHFFFAOYSA-N	-1	0	346.271	3.928	50	0		EHAARM
COc1ccc(Sc2ccccc2COC(C)=O)c(C(=O)[O-])c1	ZINC000000086255	563220450	/nfs/dbraw/zinc/22/04/50/563220450.db2.gz	UMQSRIXJBDFJKX-UHFFFAOYSA-N	-1	0	332.377	3.608	50	0		EHAARM
O=C([O-])c1cc(Cl)c(=O)n(Cc2c(Cl)cccc2Cl)c1	ZINC000000169898	563250875	/nfs/dbraw/zinc/25/08/75/563250875.db2.gz	LOEJZAMNHQPBSH-UHFFFAOYSA-N	-1	0	332.570	3.555	50	0		EHAARM
CCOc1ccc(C(=O)Nc2cccc(C(=O)[O-])c2C)cc1Cl	ZINC000000367787	563296764	/nfs/dbraw/zinc/29/67/64/563296764.db2.gz	UGBPTUYFJGUHDC-UHFFFAOYSA-N	-1	0	333.771	3.998	50	0		EHAARM
COc1ccc(C(=O)[O-])cc1COc1ccc(Br)cc1	ZINC000001009225	563368283	/nfs/dbraw/zinc/36/82/83/563368283.db2.gz	ZJCUSJROIZJACQ-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
Cc1cc2oc(-c3ccccc3)c(O[C@@H](C)C(=O)[O-])c(=O)c2cc1C	ZINC000001923684	563416489	/nfs/dbraw/zinc/41/64/89/563416489.db2.gz	XOXQOCNIUVJITQ-ZDUSSCGKSA-N	-1	0	338.359	3.929	50	0		EHAARM
O=S(=O)(Cc1ccc(Cl)cc1)[N-]c1nc2c(s1)CCCC2	ZINC000002873858	563459383	/nfs/dbraw/zinc/45/93/83/563459383.db2.gz	KJZXARPYPPZCGN-UHFFFAOYSA-N	-1	0	342.873	3.617	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc(C)c(OCC)cc1C	ZINC000008132577	563622094	/nfs/dbraw/zinc/62/20/94/563622094.db2.gz	SOHQSGXFEYUBRJ-UHFFFAOYSA-N	-1	0	349.452	3.902	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1O	ZINC000008189888	563623195	/nfs/dbraw/zinc/62/31/95/563623195.db2.gz	FEKNEJPRAXKITK-UHFFFAOYSA-N	-1	0	347.370	3.861	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2cc3ccccc3cc2C(=O)[O-])cc1	ZINC000012461856	563661558	/nfs/dbraw/zinc/66/15/58/563661558.db2.gz	CDOUMSHICHGNCA-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
COC(=O)c1ccc(Nc2cc(C)nc(-c3ccccc3[O-])n2)cc1	ZINC000013127858	563689972	/nfs/dbraw/zinc/68/99/72/563689972.db2.gz	UHGKECWMKCFMNO-UHFFFAOYSA-N	-1	0	335.363	3.688	50	0		EHAARM
CN(Cc1nc2ccccc2s1)C(=O)c1ccc([O-])c(Cl)c1	ZINC000032740973	563721762	/nfs/dbraw/zinc/72/17/62/563721762.db2.gz	MOFXQCVOKRTLRO-UHFFFAOYSA-N	-1	0	332.812	3.928	50	0		EHAARM
CC[C@@H](C)N(CC(=O)[O-])C(=O)c1sc2nc(C)cc(C)c2c1C	ZINC000119104498	563868749	/nfs/dbraw/zinc/86/87/49/563868749.db2.gz	OBILBIZQXWHCQF-LLVKDONJSA-N	-1	0	334.441	3.547	50	0		EHAARM
Cc1nn(-c2nc(-c3ccc(F)cc3)cs2)c(C)c1CCC(=O)[O-]	ZINC000026421227	563891858	/nfs/dbraw/zinc/89/18/58/563891858.db2.gz	VTNODBWETVLFIK-UHFFFAOYSA-N	-1	0	345.399	3.769	50	0		EHAARM
O=C([O-])CCSc1nnc(-c2ccccc2)n1-c1ccccc1	ZINC000000309471	563917295	/nfs/dbraw/zinc/91/72/95/563917295.db2.gz	HXFPMQFTRHHUQR-UHFFFAOYSA-N	-1	0	325.393	3.501	50	0		EHAARM
O=S(=O)([N-]c1cccc2cccnc21)c1cccc2ncccc21	ZINC000058365792	563943807	/nfs/dbraw/zinc/94/38/07/563943807.db2.gz	XTCMVSVAJOXHOG-UHFFFAOYSA-N	-1	0	335.388	3.584	50	0		EHAARM
Cc1ccc(C[N@H+](Cc2nc(=O)c3sccc3[n-]2)C2CC2)cc1	ZINC000096743045	563962257	/nfs/dbraw/zinc/96/22/57/563962257.db2.gz	MZYFQPODPFASFY-UHFFFAOYSA-N	-1	0	325.437	3.870	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)COc2ccc(Cl)cc2Cl)cc1	ZINC000000028123	563963318	/nfs/dbraw/zinc/96/33/18/563963318.db2.gz	SZIOAQJGSJGHJR-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
O=C([O-])Cc1c2ccccc2[nH]c1C(=O)N1CCC2(C1)CCCCC2	ZINC000585134060	563971904	/nfs/dbraw/zinc/97/19/04/563971904.db2.gz	CDTSHNWEGIZCJD-UHFFFAOYSA-N	-1	0	340.423	3.591	50	0		EHAARM
C[C@H](CC(=O)N1CC[C@](C)(C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237543452	563993131	/nfs/dbraw/zinc/99/31/31/563993131.db2.gz	LKJAXSMXGVKMGF-BZNIZROVSA-N	-1	0	343.345	3.522	50	0		EHAARM
COc1ccccc1Cn1c(=O)c2cc(Cl)ccc2[n-]c1=S	ZINC000000425321	563998943	/nfs/dbraw/zinc/99/89/43/563998943.db2.gz	DXQVTPKBUQTETD-UHFFFAOYSA-N	-1	0	332.812	3.769	50	0		EHAARM
O=C([O-])c1ccc2[nH+]cc(C(=O)[O-])c(Nc3ccc(F)cc3)c2c1	ZINC000005610186	564006359	/nfs/dbraw/zinc/00/63/59/564006359.db2.gz	KKCUJQOFKBPIKP-UHFFFAOYSA-N	-1	0	326.283	3.514	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000000268427	564012294	/nfs/dbraw/zinc/01/22/94/564012294.db2.gz	GLTIFAPRQURZFG-ZIAGYGMSSA-N	-1	0	331.412	3.598	50	0		EHAARM
COc1ccc2nc(NC(=O)c3cc(C)ccc3C(=O)[O-])sc2c1	ZINC000000786211	564012922	/nfs/dbraw/zinc/01/29/22/564012922.db2.gz	VOYXLOBWGKGFPV-UHFFFAOYSA-N	-1	0	342.376	3.564	50	0		EHAARM
CC1=C(C)CN(C(=O)c2cc(Cl)cc(Br)c2[O-])CC1	ZINC000225469669	564047053	/nfs/dbraw/zinc/04/70/53/564047053.db2.gz	ABVQFQWUUOTYLZ-UHFFFAOYSA-N	-1	0	344.636	3.990	50	0		EHAARM
COc1ccc(-c2csc(NCc3ccco3)n2)c2occ([O-])c21	ZINC000225519725	564047524	/nfs/dbraw/zinc/04/75/24/564047524.db2.gz	VSRPYMVWCPCPIE-UHFFFAOYSA-N	-1	0	342.376	3.599	50	0		EHAARM
C[C@H]1CCN(C(=O)Cc2ccc(C(=O)[O-])cc2)[C@@H](c2ccco2)C1	ZINC000263334708	564056281	/nfs/dbraw/zinc/05/62/81/564056281.db2.gz	NCFVGDHRGNCBRK-XJKSGUPXSA-N	-1	0	327.380	3.520	50	0		EHAARM
COc1ccccc1[N-]c1nc(-c2cccc(OC)c2OC)no1	ZINC000015770814	564073703	/nfs/dbraw/zinc/07/37/03/564073703.db2.gz	WQAQZQSCURGKNG-UHFFFAOYSA-N	-1	0	327.340	3.506	50	0		EHAARM
Cc1ccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)c(C)c1	ZINC000063808955	564077238	/nfs/dbraw/zinc/07/72/38/564077238.db2.gz	LSLIPFHQIGUTLH-UHFFFAOYSA-N	-1	0	325.393	3.867	50	0		EHAARM
CCCC1CCC([NH2+]CCc2cccc(F)c2)(P(=O)([O-])[O-])CC1	ZINC000012907707	564077813	/nfs/dbraw/zinc/07/78/13/564077813.db2.gz	ODBKISLRJQIZQO-UHFFFAOYSA-N	-1	0	343.379	3.822	50	0		EHAARM
O=C([O-])CCCC(=O)Nc1ccc(OCCc2ccccc2)cc1	ZINC000006228310	564083076	/nfs/dbraw/zinc/08/30/76/564083076.db2.gz	RBLKZGOYCQGWGP-UHFFFAOYSA-N	-1	0	327.380	3.502	50	0		EHAARM
CC[C@@H](C)[C@H](NC(=O)c1cc(F)c(F)c([O-])c1F)C(F)(F)F	ZINC000278223736	564084570	/nfs/dbraw/zinc/08/45/70/564084570.db2.gz	UQXHEBFDAIOSLM-GCXOYZPQSA-N	-1	0	329.240	3.516	50	0		EHAARM
O=C([O-])[C@H]1CCCN(c2nc(-c3ccsc3)nc3ccccc32)C1	ZINC000012979928	564084960	/nfs/dbraw/zinc/08/49/60/564084960.db2.gz	VAZWJLOEBSYNSE-LBPRGKRZSA-N	-1	0	339.420	3.659	50	0		EHAARM
O=C([O-])c1c(F)cc(-c2ccccc2OC[C@H]2CCOC2)cc1F	ZINC000569139357	564086402	/nfs/dbraw/zinc/08/64/02/564086402.db2.gz	BTXUTZIPUYWTRZ-NSHDSACASA-N	-1	0	334.318	3.745	50	0		EHAARM
COc1ccccc1[C@@H]1CCN(C(=O)c2cc(F)cc(Cl)c2[O-])C1	ZINC000089473588	564090755	/nfs/dbraw/zinc/09/07/55/564090755.db2.gz	PBCWRNHLSZPVPI-LLVKDONJSA-N	-1	0	349.789	3.823	50	0		EHAARM
Cc1nnc(-c2ccc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)s2)o1	ZINC000064920031	564097670	/nfs/dbraw/zinc/09/76/70/564097670.db2.gz	FPZCXPVXZZLIRO-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CCn1nccc1-c1csc(S(=O)(=O)[N-]c2ccccc2C)c1	ZINC000065112416	564101291	/nfs/dbraw/zinc/10/12/91/564101291.db2.gz	QMYCMXPNEHBXJW-UHFFFAOYSA-N	-1	0	347.465	3.741	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2cccc(Cl)c2)c2cccnc21	ZINC000065242252	564103421	/nfs/dbraw/zinc/10/34/21/564103421.db2.gz	PAJIOEOKTPXJPO-UHFFFAOYSA-N	-1	0	349.843	3.901	50	0		EHAARM
Cc1ccc(OCCCC(=O)Nc2ccccc2CC(=O)[O-])cc1C	ZINC000170675926	564121369	/nfs/dbraw/zinc/12/13/69/564121369.db2.gz	DTUCIHZECZNNJO-UHFFFAOYSA-N	-1	0	341.407	3.728	50	0		EHAARM
C[C@H](C[NH2+][C@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997536	564135832	/nfs/dbraw/zinc/13/58/32/564135832.db2.gz	VOOWOTDGINXRPG-BZNIZROVSA-N	-1	0	341.294	3.534	50	0		EHAARM
CC(C)C[C@H]1SCC(=O)Nc2c1cnn2-c1ccc(C(=O)[O-])cc1	ZINC000095476960	564141450	/nfs/dbraw/zinc/14/14/50/564141450.db2.gz	PNHLLUWJHDICTN-CQSZACIVSA-N	-1	0	345.424	3.993	50	0		EHAARM
O=C([O-])C1CCN(C(=O)N[C@@H](c2cccc(F)c2)C2CCCC2)CC1	ZINC000263198532	564160471	/nfs/dbraw/zinc/16/04/71/564160471.db2.gz	HDTSUGQOPVLROU-QGZVFWFLSA-N	-1	0	348.418	3.563	50	0		EHAARM
C[C@@H](NC(=O)C[C@@](C)(C(=O)[O-])c1ccccc1)c1ccc(F)c(F)c1	ZINC000008388757	564164875	/nfs/dbraw/zinc/16/48/75/564164875.db2.gz	MEOFPPTVRMCKOQ-CWTRNNRKSA-N	-1	0	347.361	3.575	50	0		EHAARM
Cc1cc(Cl)cc2c(=O)c(O)c(-c3ccc(C(=O)[O-])cc3)oc12	ZINC000041195142	564173611	/nfs/dbraw/zinc/17/36/11/564173611.db2.gz	BULOWNATJNWYDA-UHFFFAOYSA-N	-1	0	330.723	3.826	50	0		EHAARM
O=C([O-])c1ccc(F)c(NC(=O)c2sccc2Br)c1	ZINC000070164175	564173636	/nfs/dbraw/zinc/17/36/36/564173636.db2.gz	SNUCPXYBENOTAZ-UHFFFAOYSA-N	-1	0	344.161	3.600	50	0		EHAARM
C[S@@](=O)Cc1cccc(NC(=O)c2ccc3[n-]c(=S)oc3c2)c1	ZINC000073731720	564176360	/nfs/dbraw/zinc/17/63/60/564176360.db2.gz	AGOXAMCYYPSRHX-QHCPKHFHSA-N	-1	0	346.433	3.621	50	0		EHAARM
C[C@@H](C(=O)NC1CCC(C(=O)[O-])CC1)c1ccc(Cl)c(Cl)c1	ZINC000261960202	601058444	/nfs/dbraw/zinc/05/84/44/601058444.db2.gz	ANAOCCIPYXJLQC-GRZMOONWSA-N	-1	0	344.238	3.857	50	0		EHAARM
O=C([O-])[C@H](CC(F)F)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000262982238	962071336	/nfs/dbraw/zinc/07/13/36/962071336.db2.gz	KVXSXIYDMRQOCN-AWEZNQCLSA-N	-1	0	325.355	3.573	50	0		EHAARM
COc1ccc([C@@H]2C[C@H]2C(=O)Nc2cccc([C@@H](C)C(=O)[O-])c2)cc1	ZINC000659160507	975759004	/nfs/dbraw/zinc/75/90/04/975759004.db2.gz	KBZFATJIJLDWRJ-OCBCSQNSSA-N	-1	0	339.391	3.626	50	0		EHAARM
O=C([O-])Cc1cccc(NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)c1	ZINC000261947140	1022064097	/nfs/dbraw/zinc/06/40/97/1022064097.db2.gz	VUOLVKRUFDJAQT-OLZOCXBDSA-N	-1	0	329.318	3.621	50	0		EHAARM
CC[C@](C)(CC(=O)[O-])CC(=O)Nc1ccc(Br)cc1C	ZINC000006847362	1040147569	/nfs/dbraw/zinc/14/75/69/1040147569.db2.gz	MARIWOPTOQBRJX-HNNXBMFYSA-N	-1	0	342.233	3.977	50	0		EHAARM
O=c1nc(-c2ncccn2)[n-]c2scc(-c3ccccc3Cl)c21	ZINC000054751996	214253646	/nfs/dbraw/zinc/25/36/46/214253646.db2.gz	KOJZVLWDUASKFU-UHFFFAOYSA-N	-1	0	340.795	3.762	50	0		EHAARM
CC[C@H](NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000004651022	210237271	/nfs/dbraw/zinc/23/72/71/210237271.db2.gz	XIKYNLRAQBQZED-ZBMYSJOMSA-N	-1	0	345.483	3.765	50	0		EHAARM
Cc1cccc(-n2c(SCC(=O)[O-])nnc2-c2cccs2)c1C	ZINC000004618198	210232216	/nfs/dbraw/zinc/23/22/16/210232216.db2.gz	LHZKMFZRJIUFTR-UHFFFAOYSA-N	-1	0	345.449	3.789	50	0		EHAARM
Cc1ccc(/C=C\S(=O)(=O)Nc2c(F)ccc(C)c2C(=O)[O-])cc1	ZINC000098059463	219075898	/nfs/dbraw/zinc/07/58/98/219075898.db2.gz	ORZOIJDTTYKHTE-KTKRTIGZSA-N	-1	0	349.383	3.553	50	0		EHAARM
O=[P@]([O-])(O[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1	ZINC000004348201	210176916	/nfs/dbraw/zinc/17/69/16/210176916.db2.gz	RZTBXNRUCKJMNZ-CYBMUJFWSA-N	-1	0	334.205	3.957	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3nnc(C(C)C)o3)o2)cc1	ZINC000065246280	214852681	/nfs/dbraw/zinc/85/26/81/214852681.db2.gz	ZXJKHOADHSGSJX-UHFFFAOYSA-N	-1	0	347.396	3.562	50	0		EHAARM
O=C([O-])c1cc(-c2ccccc2)nc2c1cnn2Cc1cccc(F)c1	ZINC000004218265	210147406	/nfs/dbraw/zinc/14/74/06/210147406.db2.gz	JXKSACISZMXPDA-UHFFFAOYSA-N	-1	0	347.349	3.984	50	0		EHAARM
CCCCCCOC(=O)c1ccc(NC(=O)CCCC(=O)[O-])cc1	ZINC000004084150	210116187	/nfs/dbraw/zinc/11/61/87/210116187.db2.gz	CHAPKRLWMALTDE-UHFFFAOYSA-N	-1	0	335.400	3.617	50	0		EHAARM
COCCn1c(=O)c2c(-c3ccc(F)cc3)csc2[n-]c1=S	ZINC000003887600	210084885	/nfs/dbraw/zinc/08/48/85/210084885.db2.gz	SPOQUKDVEPJHSG-UHFFFAOYSA-N	-1	0	336.413	3.573	50	0		EHAARM
COc1cccc([C@@H]2Nc3nonc3N=C3CC(C)(C)CC(=O)C32)c1	ZINC000102740075	219226397	/nfs/dbraw/zinc/22/63/97/219226397.db2.gz	HNORHMYTGYPJMV-HNNXBMFYSA-N	-1	0	340.383	3.950	50	0		EHAARM
O=C([O-])CC1(CNC(=O)CCn2ccc3ccccc32)CCCCC1	ZINC000040268602	213287113	/nfs/dbraw/zinc/28/71/13/213287113.db2.gz	XTJZDXXYBXREMN-UHFFFAOYSA-N	-1	0	342.439	3.573	50	0		EHAARM
COC(=O)c1ccc(/C=C\c2cc(C(=O)[O-])c3ccccc3n2)cc1	ZINC000033718100	212960154	/nfs/dbraw/zinc/96/01/54/212960154.db2.gz	NRCMQGJQHJQTQB-FLIBITNWSA-N	-1	0	333.343	3.890	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1Oc1ccccc1	ZINC000000153376	209455887	/nfs/dbraw/zinc/45/58/87/209455887.db2.gz	JTYFXKUXQBOWBU-UHFFFAOYSA-N	-1	0	344.392	3.885	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cccc3cccnc32)c(Cl)c1	ZINC000022514162	212303431	/nfs/dbraw/zinc/30/34/31/212303431.db2.gz	OWJUPDLRSKXKFC-UHFFFAOYSA-N	-1	0	332.812	3.997	50	0		EHAARM
CCOC[C@@H]1CCN(C(=O)c2cc(Cl)c3ccccc3c2[O-])C1	ZINC000080035646	217274276	/nfs/dbraw/zinc/27/42/76/217274276.db2.gz	JPDYDYALVZALJU-GFCCVEGCSA-N	-1	0	333.815	3.697	50	0		EHAARM
O=c1[n-]c(Nc2ccc(N3CCCCC3)cc2)nnc1-c1ccccc1	ZINC000011905829	211266401	/nfs/dbraw/zinc/26/64/01/211266401.db2.gz	MCHMOXREVHGAID-UHFFFAOYSA-N	-1	0	347.422	3.566	50	0		EHAARM
CC[C@@]1(C(=O)[O-])CCCN(C(=O)c2c(F)ccc(C)c2Cl)C1	ZINC000091548710	218020671	/nfs/dbraw/zinc/02/06/71/218020671.db2.gz	FBJDNVWUNVZBGE-MRXNPFEDSA-N	-1	0	327.783	3.505	50	0		EHAARM
CSc1nc(=O)c2sc3nc(C)c4c(c3c2[n-]1)CC(C)(C)OC4	ZINC000009692014	211116032	/nfs/dbraw/zinc/11/60/32/211116032.db2.gz	FIQLRQPRFAAAMQ-UHFFFAOYSA-N	-1	0	347.465	3.827	50	0		EHAARM
O=S1(=O)[N-]C(SCc2ccc(Cl)cc2)=Nc2ccccc21	ZINC000009708796	211117722	/nfs/dbraw/zinc/11/77/22/211117722.db2.gz	OKFRZWKJNCULCQ-UHFFFAOYSA-N	-1	0	338.841	3.744	50	0		EHAARM
CC(C)c1nc([C@@H](C)NC(=O)CCc2ccc(C(=O)[O-])cc2)cs1	ZINC000095969741	218474941	/nfs/dbraw/zinc/47/49/41/218474941.db2.gz	FPDGHDHOGFOJPR-GFCCVEGCSA-N	-1	0	346.452	3.775	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2cc(Cl)c(Cl)cc2C)n1	ZINC000008714951	563636663	/nfs/dbraw/zinc/63/66/63/563636663.db2.gz	IZWOJJRFLZOSSS-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
O=C([O-])c1cccc2c1-c1ccc(I)cc1C2	ZINC000000135407	563240046	/nfs/dbraw/zinc/24/00/46/563240046.db2.gz	CUQWLXGXIQEWQY-UHFFFAOYSA-N	-1	0	336.128	3.561	50	0		EHAARM
O=S(=O)([N-]c1n[nH]c2cccc(Cl)c21)c1ccc(Cl)cc1	ZINC000000142652	563242919	/nfs/dbraw/zinc/24/29/19/563242919.db2.gz	NPSYBDLSGBCIDW-UHFFFAOYSA-N	-1	0	342.207	3.671	50	0		EHAARM
CC(C)(C)c1ccc(C(=O)Nc2ccc(OCC(=O)[O-])cc2)cc1	ZINC000000462334	563327323	/nfs/dbraw/zinc/32/73/23/563327323.db2.gz	OXHZFMSDFXUKDF-UHFFFAOYSA-N	-1	0	327.380	3.700	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc(Cl)ccc1OC	ZINC000001173524	563377298	/nfs/dbraw/zinc/37/72/98/563377298.db2.gz	PUXXHSNYEGICQM-UHFFFAOYSA-N	-1	0	341.816	3.548	50	0		EHAARM
O=C([O-])C1(NC(=O)OCC2c3ccccc3-c3ccccc32)CCC1	ZINC000001433307	563389261	/nfs/dbraw/zinc/38/92/61/563389261.db2.gz	QGLSMDZVGLRTKH-UHFFFAOYSA-N	-1	0	337.375	3.532	50	0		EHAARM
CCc1ccc(OCCCC(=O)Nc2cccc(C(=O)[O-])c2)cc1	ZINC000001773432	563410616	/nfs/dbraw/zinc/41/06/16/563410616.db2.gz	TWVLTNDHVLYZLS-UHFFFAOYSA-N	-1	0	327.380	3.745	50	0		EHAARM
O=C([O-])c1cc(-c2ccc3c(c2)OCO3)nc2c(Cl)cccc12	ZINC000002526083	563439228	/nfs/dbraw/zinc/43/92/28/563439228.db2.gz	BACYTQQAAZNBGD-UHFFFAOYSA-N	-1	0	327.723	3.982	50	0		EHAARM
CCOc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1	ZINC000002884342	563461441	/nfs/dbraw/zinc/46/14/41/563461441.db2.gz	YCTSLQCGKKFCOM-UHFFFAOYSA-N	-1	0	325.817	3.848	50	0		EHAARM
CCCCCOc1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)[O-])cc1	ZINC000003017286	563469827	/nfs/dbraw/zinc/46/98/27/563469827.db2.gz	FRQAZRBRWXLBLT-DLBZAZTESA-N	-1	0	331.412	3.861	50	0		EHAARM
C[C@H](C[NH2+][C@@H](c1cccc(Cl)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997524	563683809	/nfs/dbraw/zinc/68/38/09/563683809.db2.gz	ASGIEMFZUXVBFN-MLGOLLRUSA-N	-1	0	339.759	3.910	50	0		EHAARM
Cc1ccccc1CN[C@@H](c1cccc(Cl)c1)[P@@](=O)([O-])O	ZINC000012997490	563683863	/nfs/dbraw/zinc/68/38/63/563683863.db2.gz	DJEFIEQGZSTSAG-OAHLLOKOSA-N	-1	0	325.732	3.615	50	0		EHAARM
S=c1[n-]nc(-c2ccc(Br)cc2)n1-c1cccnc1	ZINC000013552647	563701432	/nfs/dbraw/zinc/70/14/32/563701432.db2.gz	LTCDLTLOHRZRGS-UHFFFAOYSA-N	-1	0	333.214	3.754	50	0		EHAARM
CCCCOc1cc(S(=O)(=O)[N-]c2cccnc2)ccc1Cl	ZINC000016647964	563818920	/nfs/dbraw/zinc/81/89/20/563818920.db2.gz	WGCNNQSRNLOIFS-UHFFFAOYSA-N	-1	0	340.832	3.715	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1ccc(C)cc1C	ZINC000032971310	563920107	/nfs/dbraw/zinc/92/01/07/563920107.db2.gz	AYKWVBPSGYLOKJ-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
CC[C@@H](C)[C@@H](Nc1nc(C(F)(F)F)nc2ccccc21)C(=O)[O-]	ZINC000062742118	563954530	/nfs/dbraw/zinc/95/45/30/563954530.db2.gz	UOAPBVAOUIPKES-LDYMZIIASA-N	-1	0	327.306	3.560	50	0		EHAARM
O=C([O-])[C@@]1(CCCc2ccccc2)CCCN(c2nccs2)C1	ZINC000071614712	563964652	/nfs/dbraw/zinc/96/46/52/563964652.db2.gz	MCFKMCQWXWWXIK-SFHVURJKSA-N	-1	0	330.453	3.837	50	0		EHAARM
CCOc1ccc(-c2ccnc(-c3csc(C)n3)n2)cc1C(=O)[O-]	ZINC000071763871	563965477	/nfs/dbraw/zinc/96/54/77/563965477.db2.gz	OUCBDOAPHMBZGV-UHFFFAOYSA-N	-1	0	341.392	3.672	50	0		EHAARM
Cc1ccc(C)c(Sc2ccc(N3CCC(C(=O)[O-])CC3)nn2)c1	ZINC000033268069	563967172	/nfs/dbraw/zinc/96/71/72/563967172.db2.gz	OAHUBTROTMTIRG-UHFFFAOYSA-N	-1	0	343.452	3.546	50	0		EHAARM
CC(C)(C(=O)[O-])c1ccc(NC(=O)c2ccn(C3CCCC3)n2)cc1	ZINC000097036087	563971315	/nfs/dbraw/zinc/97/13/15/563971315.db2.gz	BPRWVGMCYIQBIL-UHFFFAOYSA-N	-1	0	341.411	3.613	50	0		EHAARM
O=C([O-])c1c(NC(=O)c2c(F)cccc2F)sc2c1CCCC2	ZINC000000137400	563987044	/nfs/dbraw/zinc/98/70/44/563987044.db2.gz	RJYVHCAUKLJGOI-UHFFFAOYSA-N	-1	0	337.347	3.856	50	0		EHAARM
CC(C)[C@@H](Nc1ncnc2scc(-c3ccccc3)c21)C(=O)[O-]	ZINC000000237106	564012276	/nfs/dbraw/zinc/01/22/76/564012276.db2.gz	JIEWHKZCGHMHAG-CQSZACIVSA-N	-1	0	327.409	3.879	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@@H]1CCCC[C@H]1C(=O)[O-]	ZINC000005383799	564013986	/nfs/dbraw/zinc/01/39/86/564013986.db2.gz	UWWCJMRSYZRTMP-ZIAGYGMSSA-N	-1	0	333.428	3.822	50	0		EHAARM
Cc1nnc(SCc2cccc(Oc3ccccc3)c2)[n-]c1=O	ZINC000018086147	564017936	/nfs/dbraw/zinc/01/79/36/564017936.db2.gz	YLKFGAKMWNJVHI-UHFFFAOYSA-N	-1	0	325.393	3.970	50	0		EHAARM
O=c1c2sc3ncccc3c2[n-]c(=S)n1Cc1cccs1	ZINC000101275685	564019345	/nfs/dbraw/zinc/01/93/45/564019345.db2.gz	AUVXLFRTNFTSGD-UHFFFAOYSA-N	-1	0	331.447	3.779	50	0		EHAARM
CCC[C@@H](NS(=O)(=O)c1ccc(C)c(C(=O)[O-])c1)c1ccccc1	ZINC000013089467	564019417	/nfs/dbraw/zinc/01/94/17/564019417.db2.gz	ZZUPRWOYNQXCGW-QGZVFWFLSA-N	-1	0	347.436	3.513	50	0		EHAARM
CSc1ccccc1NC(=O)C[C@](C)(C(=O)[O-])c1ccccc1	ZINC000013253617	564019663	/nfs/dbraw/zinc/01/96/63/564019663.db2.gz	CKVHLTQURKNYKH-SFHVURJKSA-N	-1	0	329.421	3.780	50	0		EHAARM
O=C([O-])c1cccc(CSc2nnc(Cc3ccccc3)o2)c1	ZINC000000529173	564021362	/nfs/dbraw/zinc/02/13/62/564021362.db2.gz	MRFYYQYSTHLYGO-UHFFFAOYSA-N	-1	0	326.377	3.651	50	0		EHAARM
O=C([O-])c1ccc(CN2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1	ZINC000263398825	564056294	/nfs/dbraw/zinc/05/62/94/564056294.db2.gz	HLFCZXQMONPIEM-QGZVFWFLSA-N	-1	0	331.799	3.612	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000012773572	564069143	/nfs/dbraw/zinc/06/91/43/564069143.db2.gz	LVVQTXAAIVLYMP-UWVGGRQHSA-N	-1	0	347.720	3.964	50	0		EHAARM
COC(=O)c1c(SCc2ccc(C)cc2)[n-]c2ccccc2c1=O	ZINC000015731498	564072653	/nfs/dbraw/zinc/07/26/53/564072653.db2.gz	JAGNQXUOMPQIOS-UHFFFAOYSA-N	-1	0	339.416	3.915	50	0		EHAARM
CSCCc1ccc(NC(=O)c2cc(F)c(F)c([O-])c2F)cc1	ZINC000185790489	564074870	/nfs/dbraw/zinc/07/48/70/564074870.db2.gz	CNVAIVQTRBGCHU-UHFFFAOYSA-N	-1	0	341.354	3.967	50	0		EHAARM
CCCCCc1nc2ccccc2c(=O)n1-c1ccc(C(=O)[O-])cc1	ZINC000001834271	564088799	/nfs/dbraw/zinc/08/87/99/564088799.db2.gz	FTHCCEBOKJEOQY-UHFFFAOYSA-N	-1	0	336.391	3.817	50	0	biogenic	EHAARM
O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc([O-])c(Cl)c1	ZINC000143557203	564093402	/nfs/dbraw/zinc/09/34/02/564093402.db2.gz	QIRXZCKVNGEQES-MAUKXSAKSA-N	-1	0	345.826	3.943	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1cnc2ccccc2c1	ZINC000006706918	564096239	/nfs/dbraw/zinc/09/62/39/564096239.db2.gz	YVBIXROGJRXBAE-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
C[C@@H]1CCCN(c2ccc(C(=O)[O-])cc2NC(=O)c2ccccc2)C1	ZINC000064820601	564096585	/nfs/dbraw/zinc/09/65/85/564096585.db2.gz	VHKDLRIQWBHMIL-CQSZACIVSA-N	-1	0	338.407	3.873	50	0		EHAARM
CCCN(C[C@@H]1CCCCO1)C(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000170642135	564118950	/nfs/dbraw/zinc/11/89/50/564118950.db2.gz	ZAEDREWFHFHELX-ZDUSSCGKSA-N	-1	0	334.441	3.538	50	0		EHAARM
O=C([O-])c1ccccc1NC(=O)c1ccc(OC(F)(F)F)cc1	ZINC000013166034	564120106	/nfs/dbraw/zinc/12/01/06/564120106.db2.gz	RYMWPJNGDKWFMN-UHFFFAOYSA-N	-1	0	325.242	3.536	50	0		EHAARM
O=C([O-])Cc1ccc(OCc2nc(-c3cccc(Cl)c3)no2)cc1	ZINC000013421387	564134042	/nfs/dbraw/zinc/13/40/42/564134042.db2.gz	RQJMSDATLPVGLV-UHFFFAOYSA-N	-1	0	344.754	3.596	50	0		EHAARM
CCC1(C(=O)Nc2cc(C(=O)[O-])c(Br)cc2C)CC1	ZINC000311827626	564134352	/nfs/dbraw/zinc/13/43/52/564134352.db2.gz	JMNLTZUZWRIFOR-UHFFFAOYSA-N	-1	0	326.190	3.584	50	0		EHAARM
C[C@@H](C[NH2+][C@H](c1ccc(F)c(F)c1)P(=O)([O-])[O-])c1ccccc1	ZINC000012997533	564135851	/nfs/dbraw/zinc/13/58/51/564135851.db2.gz	VOOWOTDGINXRPG-ZBEGNZNMSA-N	-1	0	341.294	3.534	50	0		EHAARM
COc1ccccc1CN[C@H](c1ccc(C(C)C)cc1)[P@@](=O)([O-])O	ZINC000012997563	564135864	/nfs/dbraw/zinc/13/58/64/564135864.db2.gz	FXCYMDVIPQCQCE-SFHVURJKSA-N	-1	0	349.367	3.785	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@@H]2CCCC[C@H]2C(F)(F)F)cc1	ZINC000096479746	564148575	/nfs/dbraw/zinc/14/85/75/564148575.db2.gz	SLGWRFLXCDWQDC-ZIAGYGMSSA-N	-1	0	343.345	3.555	50	0		EHAARM
O=C([O-])Cc1cccc(NC(=O)/C=C\c2nc3ccccc3s2)c1	ZINC000492188930	602070356	/nfs/dbraw/zinc/07/03/56/602070356.db2.gz	UBFVQEBGXGEOFC-HJWRWDBZSA-N	-1	0	338.388	3.575	50	0		EHAARM
O=C([O-])[C@H]1CCN(C(=O)[C@@H]2CCCc3ccccc32)c2ccccc21	ZINC000327396514	971395336	/nfs/dbraw/zinc/39/53/36/971395336.db2.gz	STARTMRHHKVCMM-MSOLQXFVSA-N	-1	0	335.403	3.712	50	0		EHAARM
O=C([O-])c1ccccc1CC(=O)N[C@@H](C1CCCCC1)C(F)(F)F	ZINC000668301040	954567031	/nfs/dbraw/zinc/56/70/31/954567031.db2.gz	BPLJLBKQKPBWFM-HNNXBMFYSA-N	-1	0	343.345	3.555	50	0		EHAARM
Cc1nc(/C(C#N)=C/c2ccc(OCCC(=O)[O-])cc2)sc1C	ZINC000170638453	1033375710	/nfs/dbraw/zinc/37/57/10/1033375710.db2.gz	CEQAPBBTBKBCHE-NTEUORMPSA-N	-1	0	328.393	3.678	50	0		EHAARM
Cc1nn(-c2ccc(C)cc2)c2nc(-c3ccco3)cc(C(=O)[O-])c12	ZINC000006848331	1040136764	/nfs/dbraw/zinc/13/67/64/1040136764.db2.gz	UNUYGCSKJDWOLC-UHFFFAOYSA-N	-1	0	333.347	3.996	50	0		EHAARM
CC1(C)C[C@]1(CNC(=O)Cc1ccc(O)c(F)c1)c1ccccc1	ZINC000827848535	1131409371	/nfs/dbraw/zinc/40/93/71/1131409371.db2.gz	SYWXMSRPAUQRGL-FQEVSTJZSA-N	-1	0	327.399	3.558	50	0		EHAARM
COc1cccc(-c2nc3cc(C)c(C)cc3[nH]2)c1O[C@@H](C)C(=O)[O-]	ZINC000055386844	214315414	/nfs/dbraw/zinc/31/54/14/214315414.db2.gz	MHQYERXYKVLYJB-LBPRGKRZSA-N	-1	0	340.379	3.707	50	0		EHAARM
COc1ccccc1-n1c([S-])nc2c(-c3ccccc3)c[nH]c2c1=O	ZINC000100071582	219089714	/nfs/dbraw/zinc/08/97/14/219089714.db2.gz	LMCJZLDAJQOMQY-UHFFFAOYSA-N	-1	0	349.415	3.678	50	0		EHAARM
O=c1cc(CSc2ccccn2)[n-]n1-c1nc2ccccc2s1	ZINC000100134568	219092233	/nfs/dbraw/zinc/09/22/33/219092233.db2.gz	MFOSTCGTGBMDIS-UHFFFAOYSA-N	-1	0	340.433	3.875	50	0		EHAARM
O=c1c2c(nc3c(-c4cccc(Br)c4)c[n-]n31)CCCC2	ZINC000100642274	219103292	/nfs/dbraw/zinc/10/32/92/219103292.db2.gz	CQWHEDALYIXIOW-UHFFFAOYSA-N	-1	0	344.212	3.743	50	0		EHAARM
COc1cccc(C[C@@H](CC(=O)[O-])C(=O)Nc2cc(C)ccc2C)c1	ZINC000004428053	210192178	/nfs/dbraw/zinc/19/21/78/210192178.db2.gz	CYAKMJNBMBWOTC-INIZCTEOSA-N	-1	0	341.407	3.584	50	0		EHAARM
O=C([O-])C[C@@H](c1ccc(C(F)(F)F)cc1)N1Cc2ccccc2C1=O	ZINC000004014650	210100463	/nfs/dbraw/zinc/10/04/63/210100463.db2.gz	GGJXKBHOEZYVDP-HNNXBMFYSA-N	-1	0	349.308	3.877	50	0		EHAARM
CC(C)CCCCCCOc1ccc([C@@H](CC(N)=O)C(=O)[O-])cc1	ZINC000002295554	209838795	/nfs/dbraw/zinc/83/87/95/209838795.db2.gz	AJVJZPMMDYNMMZ-QGZVFWFLSA-N	-1	0	335.444	3.716	50	0		EHAARM
Cc1nc(-c2cc(S(=O)(=O)[N-]c3ccccc3C)c(C)s2)no1	ZINC000035539123	213036868	/nfs/dbraw/zinc/03/68/68/213036868.db2.gz	BZUVMEVDYSRSAV-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000000264142	209509447	/nfs/dbraw/zinc/50/94/47/209509447.db2.gz	IECYYKHKZBFEAY-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
Cc1ccc2[nH]c(SCCOc3ccc(C(=O)[O-])cc3)nc2c1	ZINC000020396954	212124353	/nfs/dbraw/zinc/12/43/53/212124353.db2.gz	VINYVPZABNXDJT-UHFFFAOYSA-N	-1	0	328.393	3.741	50	0		EHAARM
Cc1cc(C)c(OCC(=O)Nc2ccc(C(=O)[O-])cc2)c(Cl)c1	ZINC000020144379	212105650	/nfs/dbraw/zinc/10/56/50/212105650.db2.gz	SJTCHODFBWMSHZ-UHFFFAOYSA-N	-1	0	333.771	3.673	50	0		EHAARM
CCOc1ccc(-n2c3ccccc3nc2SCC(=O)[O-])cc1	ZINC000012504707	211394624	/nfs/dbraw/zinc/39/46/24/211394624.db2.gz	IXTAKYDPUFKVJJ-UHFFFAOYSA-N	-1	0	328.393	3.601	50	0		EHAARM
CCc1cc(C(=O)[O-])c2c(C3CC3)nn(-c3ccccc3F)c2n1	ZINC000012399132	211367895	/nfs/dbraw/zinc/36/78/95/211367895.db2.gz	WZVIJZMWFSGXLS-UHFFFAOYSA-N	-1	0	325.343	3.698	50	0		EHAARM
Cc1ncc(-c2c(-c3ccccc3)ncn2CCCCC(=O)[O-])cn1	ZINC000091780346	218065290	/nfs/dbraw/zinc/06/52/90/218065290.db2.gz	IDWYTLKQNQZYJA-UHFFFAOYSA-N	-1	0	336.395	3.570	50	0		EHAARM
Cc1ncsc1CCN(C)[C@@H](C(=O)[O-])c1c(F)cccc1Cl	ZINC000095369876	218303325	/nfs/dbraw/zinc/30/33/25/218303325.db2.gz	DTFDVLSHEFPGMY-CQSZACIVSA-N	-1	0	342.823	3.544	50	0		EHAARM
Cc1c(NC(=O)Cc2cc(-c3ccccc3)on2)cccc1C(=O)[O-]	ZINC000095424394	218367013	/nfs/dbraw/zinc/36/70/13/218367013.db2.gz	BTIOTXWZRFYETL-UHFFFAOYSA-N	-1	0	336.347	3.529	50	0		EHAARM
COc1ccccc1[C@H]1[C@H](C(=O)[O-])CCC(=O)N1c1ccc(C)cc1	ZINC000004200324	135663013	/nfs/dbraw/zinc/66/30/13/135663013.db2.gz	MSAZOYMMVYAYHB-APWZRJJASA-N	-1	0	339.391	3.573	50	0		EHAARM
CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc1ccccc1C(=O)[O-]	ZINC000000041900	563212897	/nfs/dbraw/zinc/21/28/97/563212897.db2.gz	BRFXGVVYPHCOTN-JOYOIKCWSA-N	-1	0	328.195	3.915	50	0		EHAARM
CCOC(=O)c1[nH]c2cc(Cl)cc(Cl)c2c1CCC(=O)[O-]	ZINC000000112938	563230514	/nfs/dbraw/zinc/23/05/14/563230514.db2.gz	UUBZROKNETVXIK-UHFFFAOYSA-N	-1	0	330.167	3.669	50	0		EHAARM
CC(C)(C)c1ccccc1OCC(=O)Nc1cccc(C(=O)[O-])c1	ZINC000000133624	563239412	/nfs/dbraw/zinc/23/94/12/563239412.db2.gz	MANWCCKAYZPQRW-UHFFFAOYSA-N	-1	0	327.380	3.700	50	0		EHAARM
CCc1ccc(NC(=O)CSCc2ccc(C(=O)[O-])cc2)cc1	ZINC000000148714	563245393	/nfs/dbraw/zinc/24/53/93/563245393.db2.gz	QFBRKYVORNMEDM-UHFFFAOYSA-N	-1	0	329.421	3.819	50	0		EHAARM
CC1(C)[C@H](C(=O)Nc2nc3ccccc3s2)CC[C@]1(C)C(=O)[O-]	ZINC000000191664	563256936	/nfs/dbraw/zinc/25/69/36/563256936.db2.gz	MUKSDTCHANCPAN-DYZYQPBXSA-N	-1	0	332.425	3.762	50	0		EHAARM
Cc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000000226869	563263027	/nfs/dbraw/zinc/26/30/27/563263027.db2.gz	QAMKCWLSDIAWSU-JQWIXIFHSA-N	-1	0	325.290	3.550	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@]1(Cc1cccc(Cl)c1)C(=O)[O-]	ZINC000000391969	563304177	/nfs/dbraw/zinc/30/41/77/563304177.db2.gz	KLTFJXPAPHYWKB-KRWDZBQOSA-N	-1	0	339.819	3.737	50	0		EHAARM
COc1ccccc1Oc1ccc(NC(=O)CCCC(=O)[O-])cc1	ZINC000000466657	563328368	/nfs/dbraw/zinc/32/83/68/563328368.db2.gz	MLABBLSCGGHEGW-UHFFFAOYSA-N	-1	0	329.352	3.681	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)cc1	ZINC000000832291	563364545	/nfs/dbraw/zinc/36/45/45/563364545.db2.gz	NLQNBNQLBPWKAU-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
O=C([O-])c1ccc(CNc2ncnc3sc4c(c32)CCCC4)cc1	ZINC000001972841	563417200	/nfs/dbraw/zinc/41/72/00/563417200.db2.gz	DSHSTMGQQUBCRX-UHFFFAOYSA-N	-1	0	339.420	3.880	50	0		EHAARM
CC[C@@H](C)c1ccc(OCC(=O)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000006953179	563592287	/nfs/dbraw/zinc/59/22/87/563592287.db2.gz	OLKMCIFUOSDSLI-CYBMUJFWSA-N	-1	0	327.380	3.916	50	0		EHAARM
Cc1ccc2nc(-c3ccc(NC(=O)/C=C\C(=O)[O-])cc3)sc2c1	ZINC000032650037	563914175	/nfs/dbraw/zinc/91/41/75/563914175.db2.gz	HDYOIHVTWSZHQB-HJWRWDBZSA-N	-1	0	338.388	3.851	50	0		EHAARM
Cc1nccc(N2CCC[C@](C/C=C/c3ccccc3)(C(=O)[O-])C2)n1	ZINC000071767697	563965568	/nfs/dbraw/zinc/96/55/68/563965568.db2.gz	QSKBYULSADLCEJ-MRSBXDGLSA-N	-1	0	337.423	3.560	50	0		EHAARM
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N(C)Cc1ccc(C(=O)[O-])cc1	ZINC000097035889	563966908	/nfs/dbraw/zinc/96/69/08/563966908.db2.gz	OQSQRTSEELCGLT-CABCVRRESA-N	-1	0	329.421	3.517	50	0		EHAARM
O=C([O-])C[C@@H](/N=C\c1cc(Br)ccc1O)c1ccccc1	ZINC000230138597	563983217	/nfs/dbraw/zinc/98/32/17/563983217.db2.gz	CUSYDOOHCWEMBN-FNHQQPGVSA-N	-1	0	348.196	3.790	50	0		EHAARM
CCSC(=S)N1[C@H](C(=O)[O-])CS[C@H]1c1ccc(C)cc1	ZINC000005528907	564005042	/nfs/dbraw/zinc/00/50/42/564005042.db2.gz	RJKSJDQJAMUIJW-RYUDHWBXSA-N	-1	0	327.496	3.534	50	0		EHAARM
COc1ccc(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)cc1OC	ZINC000000367795	564012434	/nfs/dbraw/zinc/01/24/34/564012434.db2.gz	NXCMMGNAQGQKQD-UHFFFAOYSA-N	-1	0	342.178	3.969	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000484059	564012449	/nfs/dbraw/zinc/01/24/49/564012449.db2.gz	QWHZBNHBBJIOFC-VHSXEESVSA-N	-1	0	338.816	3.779	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@H]1CCCC[C@H]1C(=O)[O-]	ZINC000005383801	564013977	/nfs/dbraw/zinc/01/39/77/564013977.db2.gz	UWWCJMRSYZRTMP-UONOGXRCSA-N	-1	0	333.428	3.822	50	0		EHAARM
O=C([O-])c1ccccc1SCC(=O)N1CCSc2ccccc21	ZINC000012937261	564019311	/nfs/dbraw/zinc/01/93/11/564019311.db2.gz	SNJGJZVGSYOYOF-UHFFFAOYSA-N	-1	0	345.445	3.616	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1Cc1ccccc1	ZINC000013021889	564019341	/nfs/dbraw/zinc/01/93/41/564019341.db2.gz	IOPXNQZIJDIBRJ-ROUUACIJSA-N	-1	0	335.403	3.883	50	0		EHAARM
Cc1ccc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)c(C)c1	ZINC000013185388	564019620	/nfs/dbraw/zinc/01/96/20/564019620.db2.gz	HSRSOZMFTJWNHF-UHFFFAOYSA-N	-1	0	337.419	3.562	50	0		EHAARM
CCc1cccc(C)c1NC(=O)C[C@](C)(C(=O)[O-])c1ccccc1	ZINC000013466782	564020032	/nfs/dbraw/zinc/02/00/32/564020032.db2.gz	GZWIRHZNZMYROV-FQEVSTJZSA-N	-1	0	325.408	3.929	50	0		EHAARM
O=C1CC(c2ccccc2)CC([O-])=C1[S@@](=O)c1ccc(Cl)cc1	ZINC000108809358	564028467	/nfs/dbraw/zinc/02/84/67/564028467.db2.gz	RJKDYYATTWYCNA-LGKJNRANSA-N	-1	0	346.835	3.532	50	0		EHAARM
COc1cc(C)c(S(=O)(=O)[N-]c2cccc3cccnc32)cc1C	ZINC000055574832	564031905	/nfs/dbraw/zinc/03/19/05/564031905.db2.gz	IWUHKAJBAPOIDZ-UHFFFAOYSA-N	-1	0	342.420	3.661	50	0		EHAARM
CCc1ccc(NC2=NC(=O)[C@@H](Cc3ccc(OC)cc3)S2)cc1	ZINC000005809664	564033144	/nfs/dbraw/zinc/03/31/44/564033144.db2.gz	NOFQLRCPBFPDLE-QGZVFWFLSA-N	-1	0	340.448	3.910	50	0		EHAARM
CCCC[C@@](CNC(=O)c1ccccc1)(C(=O)[O-])c1ccccc1	ZINC000005951755	564057271	/nfs/dbraw/zinc/05/72/71/564057271.db2.gz	YPYKAHPEDRNLRD-FQEVSTJZSA-N	-1	0	325.408	3.629	50	0		EHAARM
Cn1cc(-c2ccc(OCc3ccccc3)c(F)c2)c(C(=O)[O-])n1	ZINC000534583362	564061104	/nfs/dbraw/zinc/06/11/04/564061104.db2.gz	HWJWXUIHTXSMSX-UHFFFAOYSA-N	-1	0	326.327	3.503	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cc1)c1ccc(-c2cc[nH]n2)s1	ZINC000075351817	564082023	/nfs/dbraw/zinc/08/20/23/564082023.db2.gz	MKWDFFPWOCPRIF-UHFFFAOYSA-N	-1	0	339.829	3.592	50	0		EHAARM
Cc1[nH]c2ccc(C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)cc2c1C	ZINC000237726375	564085458	/nfs/dbraw/zinc/08/54/58/564085458.db2.gz	HLDBBHSSFLLFCO-AWEZNQCLSA-N	-1	0	328.412	3.502	50	0		EHAARM
CC(C)(CC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1)C(=O)[O-]	ZINC000092844392	564089030	/nfs/dbraw/zinc/08/90/30/564089030.db2.gz	PCUPSFDUWCHKRP-UHFFFAOYSA-N	-1	0	339.391	3.728	50	0		EHAARM
O=c1c(Oc2ccc(Br)cc2)coc2cc([O-])cc(O)c12	ZINC000006557400	564092027	/nfs/dbraw/zinc/09/20/27/564092027.db2.gz	SDIKDVUXKIIIOD-UHFFFAOYSA-N	-1	0	349.136	3.759	50	0	biogenic	EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2ccno2)s1	ZINC000065031074	564099732	/nfs/dbraw/zinc/09/97/32/564099732.db2.gz	BAVVLOAABTUQCL-UHFFFAOYSA-N	-1	0	334.422	3.766	50	0		EHAARM
Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(-c2ccno2)s1	ZINC000065031071	564099746	/nfs/dbraw/zinc/09/97/46/564099746.db2.gz	IJFOEYCOVPDYFR-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2cccc(Cl)c2)c1=O	ZINC000065215422	564102835	/nfs/dbraw/zinc/10/28/35/564102835.db2.gz	YYGIDBZDSKIMIE-UHFFFAOYSA-N	-1	0	348.811	3.694	50	0		EHAARM
O=C([O-])c1cccc(Nc2c(-c3cccc(O)c3)nc3cnccn32)c1	ZINC000065322800	564105245	/nfs/dbraw/zinc/10/52/45/564105245.db2.gz	BKPMPSDRXIPBJZ-UHFFFAOYSA-N	-1	0	346.346	3.544	50	0		EHAARM
O=C([O-])C[C@@H]1CCCN(C(=O)CCc2ccc(-c3ccccc3)o2)C1	ZINC000089851195	564114341	/nfs/dbraw/zinc/11/43/41/564114341.db2.gz	OKGAJTYOQRZQLN-HNNXBMFYSA-N	-1	0	341.407	3.593	50	0		EHAARM
C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)C2CCC(C(=O)[O-])CC2)C2CC2)o1	ZINC000194390469	564120523	/nfs/dbraw/zinc/12/05/23/564120523.db2.gz	VXHKUKXJZFXOAH-WNZJFKNXSA-N	-1	0	345.439	3.785	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC000253370687	564130354	/nfs/dbraw/zinc/13/03/54/564130354.db2.gz	UYFZCNMOEGGLPX-RCBQFDQVSA-N	-1	0	335.831	3.547	50	0		EHAARM
COc1ccc2c(c1)c(Sc1ccccc1)c(CC(=O)[O-])n2C	ZINC000013923783	564134791	/nfs/dbraw/zinc/13/47/91/564134791.db2.gz	MTEDYEQFBZKBBZ-UHFFFAOYSA-N	-1	0	327.405	3.965	50	0		EHAARM
Cc1nc2ccc(NC(=O)CC3(C(=O)[O-])CCCCC3)cc2s1	ZINC000013249549	564136141	/nfs/dbraw/zinc/13/61/41/564136141.db2.gz	XELFVNDXKMZOAR-UHFFFAOYSA-N	-1	0	332.425	3.968	50	0		EHAARM
O=C(N[C@H](c1cccnc1)c1cccc(C(F)(F)F)c1)C(F)F	ZINC000225627374	564150013	/nfs/dbraw/zinc/15/00/13/564150013.db2.gz	IUVGQCCOVZYGER-LBPRGKRZSA-N	-1	0	330.256	3.571	50	0		EHAARM
CCCCC[C@H]1c2[nH]c3ccccc3c2C[C@H](C(=O)[O-])N1C(C)=O	ZINC000003024600	564154477	/nfs/dbraw/zinc/15/44/77/564154477.db2.gz	LKEGYTFONVXESR-DLBZAZTESA-N	-1	0	328.412	3.647	50	0		EHAARM
O=C([O-])[C@@H]1CC[C@H](C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)C1	ZINC000263176888	564160216	/nfs/dbraw/zinc/16/02/16/564160216.db2.gz	GULOXMLUFYXIAU-UONOGXRCSA-N	-1	0	349.390	3.669	50	0		EHAARM
Cc1ncc(C(=O)Nc2cc(Cl)cc(C(=O)[O-])c2)c(C(C)C)n1	ZINC000192888190	600624518	/nfs/dbraw/zinc/62/45/18/600624518.db2.gz	DKYBMVWIXLDCEY-UHFFFAOYSA-N	-1	0	333.775	3.512	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@](C)(C(=O)[O-])c1cc(Cl)cc(Cl)c1	ZINC000395313839	939137984	/nfs/dbraw/zinc/13/79/84/939137984.db2.gz	XRUHHIRUUARMLC-CQSZACIVSA-N	-1	0	334.199	3.818	50	0		EHAARM
C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)C3(C(=O)[O-])CC3)c2)C1	ZINC000154836514	959038779	/nfs/dbraw/zinc/03/87/79/959038779.db2.gz	CBECHBJZNDQVJE-XJKSGUPXSA-N	-1	0	331.412	3.585	50	0		EHAARM
O=C([O-])[C@H]1CC[C@H](C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)CC1	ZINC000606441922	975016011	/nfs/dbraw/zinc/01/60/11/975016011.db2.gz	CCVYJVPFPYGVPC-JVCGSSHBSA-N	-1	0	327.424	3.582	50	0		EHAARM
Cc1ccc(Cl)c(S(=O)(=O)[N-]c2nc(C3CC3)cs2)c1	ZINC000120283271	1014899115	/nfs/dbraw/zinc/89/91/15/1014899115.db2.gz	YPLDOOCVDZVXJJ-UHFFFAOYSA-N	-1	0	328.846	3.783	50	0		EHAARM
Cc1ccc(O)c(C(=O)C=C([O-])c2ccc(Br)cc2)c1	ZINC000101064661	1019551538	/nfs/dbraw/zinc/55/15/38/1019551538.db2.gz	FAPPXMYLPGYRAB-UHFFFAOYSA-N	-1	0	333.181	3.919	50	0		EHAARM
Cc1ccc(/C=C/S(=O)(=O)Nc2c(F)ccc(C)c2C(=O)[O-])cc1	ZINC000084148604	1120350195	/nfs/dbraw/zinc/35/01/95/1120350195.db2.gz	ORZOIJDTTYKHTE-MDZDMXLPSA-N	-1	0	349.383	3.553	50	0		EHAARM
CC(C)n1ccc2cc(C(=O)NC[C@H]3CC[C@H](C(=O)[O-])CC3)ccc21	ZINC000952964204	1137483630	/nfs/dbraw/zinc/48/36/30/1137483630.db2.gz	TZGXAONFYAYMLT-SHTZXODSSA-N	-1	0	342.439	3.843	50	0		EHAARM
Cc1cc(NCc2cc(CC(C)C)no2)nc(-c2ccccc2[O-])n1	ZINC000952964648	1137483682	/nfs/dbraw/zinc/48/36/82/1137483682.db2.gz	OORKMFZUQLQTEK-UHFFFAOYSA-N	-1	0	338.411	3.956	50	0		EHAARM
C[C@@H](NC(=O)c1ccccc1C(=O)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000004675978	210244393	/nfs/dbraw/zinc/24/43/93/210244393.db2.gz	UTKYOJIITUTECN-JSFDKUKPSA-N	-1	0	327.424	3.720	50	0		EHAARM
COc1ccccc1Cn1c(=O)c2oc3ccccc3c2[n-]c1=S	ZINC000100026637	219089217	/nfs/dbraw/zinc/08/92/17/219089217.db2.gz	NQKLQRQTARKXEW-UHFFFAOYSA-N	-1	0	338.388	3.862	50	0		EHAARM
CCCCCn1c(=O)c2cc(Br)ccc2[n-]c1=S	ZINC000100435392	219098972	/nfs/dbraw/zinc/09/89/72/219098972.db2.gz	HZIKACZFOHOVLM-UHFFFAOYSA-N	-1	0	327.247	3.638	50	0		EHAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2ccc(C)cc2C)c1=O	ZINC000049409516	214006066	/nfs/dbraw/zinc/00/60/66/214006066.db2.gz	RRAVIWWRNMQVGR-UHFFFAOYSA-N	-1	0	342.420	3.658	50	0		EHAARM
O=C(c1c(-c2ccccc2)[n-]n(-c2ccccc2)c1=O)c1ccccc1	ZINC000100933117	219112108	/nfs/dbraw/zinc/11/21/08/219112108.db2.gz	OCRPEIMPIAQRJR-LJQANCHMSA-N	-1	0	340.382	3.937	50	0		EHAARM
O=C(c1c(-c2ccccc2)[n-]n(-c2ccccc2)c1=O)c1ccccc1	ZINC000100933115	219112203	/nfs/dbraw/zinc/11/22/03/219112203.db2.gz	OCRPEIMPIAQRJR-IBGZPJMESA-N	-1	0	340.382	3.937	50	0		EHAARM
CC(C)=C1[C@@H]2C=C[C@H]1[C@H](C(=O)[O-])[C@H]2C(=O)Nc1cc(C)ccc1C	ZINC000004380630	210184018	/nfs/dbraw/zinc/18/40/18/210184018.db2.gz	WXJDHIUYCWULNV-DACLVMHWSA-N	-1	0	325.408	3.711	50	0		EHAARM
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(-c2ccno2)o1	ZINC000064958640	214815722	/nfs/dbraw/zinc/81/57/22/214815722.db2.gz	PYLWYNDLNZXRNH-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
CC(C)c1ccccc1NC(=O)c1c([O-])c2sccc2[nH]c1=O	ZINC000065215277	214844784	/nfs/dbraw/zinc/84/47/84/214844784.db2.gz	IRLTYHHTTGWPMH-UHFFFAOYSA-N	-1	0	328.393	3.671	50	0		EHAARM
Cc1ccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)cc1C	ZINC000047931996	213875349	/nfs/dbraw/zinc/87/53/49/213875349.db2.gz	KVAFOPBGSQCAGN-UHFFFAOYSA-N	-1	0	325.393	3.867	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)cc1C	ZINC000032860467	212857640	/nfs/dbraw/zinc/85/76/40/212857640.db2.gz	OXGKNUWXKVGLCE-UHFFFAOYSA-N	-1	0	339.420	3.561	50	0		EHAARM
O=C([O-])c1ccc(Cn2ccnc2-c2ccc(O)c(Cl)c2)cc1	ZINC000072157074	216047338	/nfs/dbraw/zinc/04/73/38/216047338.db2.gz	XORDYADQOJKMHD-UHFFFAOYSA-N	-1	0	328.755	3.656	50	0		EHAARM
CCOC(=O)C=C([O-])c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000000167125	209460669	/nfs/dbraw/zinc/46/06/69/209460669.db2.gz	IBRYPSPFMRZTCX-UHFFFAOYSA-N	-1	0	328.208	3.860	50	0		EHAARM
Cc1ccc(C)c(-c2noc(-c3c([O-])c4ccccc4[nH]c3=O)n2)c1	ZINC000075536600	216632450	/nfs/dbraw/zinc/63/24/50/216632450.db2.gz	WONLUYOVPDSPMK-UHFFFAOYSA-N	-1	0	333.347	3.568	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000020509583	212141497	/nfs/dbraw/zinc/14/14/97/212141497.db2.gz	PSHSPWLMOCXLJN-ZWKOTPCHSA-N	-1	0	335.403	3.559	50	0		EHAARM
CCSCCN(C(=O)c1cccc(C(=O)[O-])c1)C1CCCCC1	ZINC000252500533	243822955	/nfs/dbraw/zinc/82/29/55/243822955.db2.gz	SXIMDFSEIFWJMA-UHFFFAOYSA-N	-1	0	335.469	3.913	50	0		EHAARM
Cc1nn(-c2ccc(C(=O)[O-])cc2)c2c1[C@H](C(C)C)SCC(=O)N2	ZINC000079491783	217233000	/nfs/dbraw/zinc/23/30/00/217233000.db2.gz	KYJQJHNJHZMHEP-HNNXBMFYSA-N	-1	0	345.424	3.911	50	0		EHAARM
O=C([O-])c1c(-c2ccc(Br)cc2)noc1C(F)(F)F	ZINC000086033161	217689078	/nfs/dbraw/zinc/68/90/78/217689078.db2.gz	ITXIEESFOXYALY-UHFFFAOYSA-N	-1	0	336.063	3.821	50	0		EHAARM
CSc1nc2ccc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])cc2s1	ZINC000013249566	211538007	/nfs/dbraw/zinc/53/80/07/211538007.db2.gz	DBLDZZWBSRXRGV-WDEREUQCSA-N	-1	0	348.449	3.624	50	0		EHAARM
COc1ccc(-n2[n-]c(C)c(Cc3ccc(Cl)cc3)c2=O)cc1	ZINC000009939643	211135316	/nfs/dbraw/zinc/13/53/16/211135316.db2.gz	WMUWJZMJIQUDHT-UHFFFAOYSA-N	-1	0	328.799	3.727	50	0		EHAARM
Cc1cccc(C(=O)Nn2c(CCC(=O)[O-])ccc2-c2ccccc2)c1	ZINC000009095712	211039485	/nfs/dbraw/zinc/03/94/85/211039485.db2.gz	BYRUDJCIJCKLLT-UHFFFAOYSA-N	-1	0	348.402	3.865	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)cc1	ZINC000095377048	218309725	/nfs/dbraw/zinc/30/97/25/218309725.db2.gz	RXSRTJKEBBWJOA-GOSISDBHSA-N	-1	0	348.402	3.886	50	0		EHAARM
Cc1ccc(-c2cc(C)nc([N-]S(=O)(=O)c3ccccc3)n2)cc1	ZINC000006550349	210651175	/nfs/dbraw/zinc/65/11/75/210651175.db2.gz	BWTSKNOSNLYNLO-UHFFFAOYSA-N	-1	0	339.420	3.561	50	0		EHAARM
C[C@@H](C(=O)[O-])[C@@H](NC(=O)c1ccc(F)cc1Cl)c1ccccc1	ZINC000097018285	218916108	/nfs/dbraw/zinc/91/61/08/218916108.db2.gz	HOMZQDZQJYQNIA-MEBBXXQBSA-N	-1	0	335.762	3.671	50	0		EHAARM
Cc1ccc(C[C@@H](C(=O)Nc2ccc(F)cc2)[C@H](C)C(=O)[O-])cc1	ZINC000004801828	210280655	/nfs/dbraw/zinc/28/06/55/210280655.db2.gz	BBRLINWIXHPXMR-SUMWQHHRSA-N	-1	0	329.371	3.652	50	0		EHAARM
Cc1ccc(C[C@@H](CC(=O)[O-])C(=O)Nc2cc(C)ccc2C)cc1	ZINC000004756050	210272870	/nfs/dbraw/zinc/27/28/70/210272870.db2.gz	USFQIVBCTNVHKY-KRWDZBQOSA-N	-1	0	325.408	3.884	50	0		EHAARM
Cc1cc([N-]S(=O)(=O)c2cccs2)ccc1Br	ZINC000000378916	563299414	/nfs/dbraw/zinc/29/94/14/563299414.db2.gz	SBSBBAFFUFDTNR-UHFFFAOYSA-N	-1	0	332.244	3.620	50	0		EHAARM
Cc1nc2ccc(Br)cc2c(Cl)c1CCC(=O)[O-]	ZINC000000446509	563317812	/nfs/dbraw/zinc/31/78/12/563317812.db2.gz	CBMTUDJKBYUTAI-UHFFFAOYSA-N	-1	0	328.593	3.976	50	0		EHAARM
CC(C)(C)OC(=O)N1[C@@H](c2ccc(Cl)cc2)SC[C@@H]1C(=O)[O-]	ZINC000001406901	563388099	/nfs/dbraw/zinc/38/80/99/563388099.db2.gz	MCVPXTHCXZFQMW-VXGBXAGGSA-N	-1	0	343.832	3.776	50	0		EHAARM
CCc1ccc(-c2cc(C(F)(F)F)n3nc(C(=O)[O-])cc3n2)cc1	ZINC000002781099	563450894	/nfs/dbraw/zinc/45/08/94/563450894.db2.gz	MKDOXRWEOJRIBH-UHFFFAOYSA-N	-1	0	335.285	3.676	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)c1cc(F)c(F)cc1Cl)c1cccs1	ZINC000013389513	563697328	/nfs/dbraw/zinc/69/73/28/563697328.db2.gz	UAJMBGSZSREYKX-LLVKDONJSA-N	-1	0	345.754	3.626	50	0		EHAARM
O=C([O-])C1CCN(C(=O)c2ccc(Oc3ccc(F)cc3)cc2)CC1	ZINC000013425680	563698444	/nfs/dbraw/zinc/69/84/44/563698444.db2.gz	MBYFZSRUMRBSFO-UHFFFAOYSA-N	-1	0	343.354	3.555	50	0		EHAARM
CCc1ccc([C@H]2C[C@@H](C(F)(F)F)n3nc(C(=O)[O-])cc3N2)cc1	ZINC000013959103	563733140	/nfs/dbraw/zinc/73/31/40/563733140.db2.gz	GFBPCMJFMGYTKE-YPMHNXCESA-N	-1	0	339.317	3.804	50	0		EHAARM
O=C([O-])[C@H](CC(=O)Nc1ccc2c(c1)CCC2)c1ccc(F)cc1	ZINC000025206564	563882241	/nfs/dbraw/zinc/88/22/41/563882241.db2.gz	QAPWJYZHBIOITB-QGZVFWFLSA-N	-1	0	327.355	3.511	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cccc(Cl)c2Cl)C1	ZINC000043589655	563913571	/nfs/dbraw/zinc/91/35/71/563913571.db2.gz	PJJYNDYSLYBCOG-JTQLQIEISA-N	-1	0	330.211	3.710	50	0		EHAARM
CCCCOc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cn2)cc1	ZINC000041095734	563924273	/nfs/dbraw/zinc/92/42/73/563924273.db2.gz	ZGAARBCOVNAZEN-UHFFFAOYSA-N	-1	0	340.832	3.715	50	0		EHAARM
COC(=O)N(C)c1ccc(NC(=O)c2ccc([O-])c(Cl)c2)cc1	ZINC000058016902	563936720	/nfs/dbraw/zinc/93/67/20/563936720.db2.gz	YYRJMBMJDJQJLT-UHFFFAOYSA-N	-1	0	334.759	3.501	50	0		EHAARM
CC[C@@H](C)[C@H](Nc1nc(C(F)(F)F)nc2ccccc21)C(=O)[O-]	ZINC000062742116	563954558	/nfs/dbraw/zinc/95/45/58/563954558.db2.gz	UOAPBVAOUIPKES-KCJUWKMLSA-N	-1	0	327.306	3.560	50	0		EHAARM
Cc1c(=O)[nH]c(SCc2nnc(C(C)C)o2)nc1-c1ccccc1	ZINC000097141230	563968309	/nfs/dbraw/zinc/96/83/09/563968309.db2.gz	UGTBEWJFNLWIAD-UHFFFAOYSA-N	-1	0	342.424	3.544	50	0		EHAARM
O=C(Nc1ccccc1Cl)Nc1c(=O)oc2ccccc2c1[O-]	ZINC000006746438	563970668	/nfs/dbraw/zinc/97/06/68/563970668.db2.gz	JHUZLXNGLGRKLB-UHFFFAOYSA-N	-1	0	330.727	3.796	50	0		EHAARM
Cc1nc(C(C)C)sc1C(=O)N(C)[C@@H](C(=O)[O-])c1cccs1	ZINC000095528238	563977517	/nfs/dbraw/zinc/97/75/17/563977517.db2.gz	RKEFUMJDLDJWBV-LLVKDONJSA-N	-1	0	338.454	3.534	50	0		EHAARM
COc1ccc(NC(=O)c2cc(Cl)c(Cl)cc2C(=O)[O-])cc1	ZINC000000245296	563989279	/nfs/dbraw/zinc/98/92/79/563989279.db2.gz	FNVWPDFDUAFJSE-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
CCOc1ccc([C@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])cc1	ZINC000221039696	563989656	/nfs/dbraw/zinc/98/96/56/563989656.db2.gz	USZJCPNSXWNJIA-CVEARBPZSA-N	-1	0	349.427	3.653	50	0		EHAARM
Cc1cc([C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C(=O)[O-])ccc1F	ZINC000221040166	563989732	/nfs/dbraw/zinc/98/97/32/563989732.db2.gz	VVAKZLAABFIUDS-ZFWWWQNUSA-N	-1	0	337.391	3.702	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000368925	563991770	/nfs/dbraw/zinc/99/17/70/563991770.db2.gz	UFJUJIGDWOIYFD-ZJUUUORDSA-N	-1	0	336.800	3.555	50	0		EHAARM
O=C([O-])CCCC(=O)N1N=C(c2ccccc2)C[C@H]1c1cccs1	ZINC000000386006	563992027	/nfs/dbraw/zinc/99/20/27/563992027.db2.gz	ARHKFOCZRIYCHN-HNNXBMFYSA-N	-1	0	342.420	3.681	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc3ccc(Cl)cc3[nH]2)C1	ZINC000238018685	563994401	/nfs/dbraw/zinc/99/44/01/563994401.db2.gz	FAICWBVEFUUSEK-LLVKDONJSA-N	-1	0	334.803	3.538	50	0		EHAARM
Cc1nc(CC(C)C)sc1C(=O)Nc1cc(C(=O)[O-])ccc1C	ZINC000120231776	563996516	/nfs/dbraw/zinc/99/65/16/563996516.db2.gz	ZZCRVIAQSPEYGQ-UHFFFAOYSA-N	-1	0	332.425	3.909	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)CC1(C(=O)[O-])CCCCC1	ZINC000013250261	564019630	/nfs/dbraw/zinc/01/96/30/564019630.db2.gz	QOYKSJXUKGEZQZ-UHFFFAOYSA-N	-1	0	325.792	3.712	50	0		EHAARM
C[C@](CC(=O)Nc1cc(Cl)ccc1F)(C(=O)[O-])c1ccccc1	ZINC000013254246	564019669	/nfs/dbraw/zinc/01/96/69/564019669.db2.gz	JBLRHQJKFYNRLQ-QGZVFWFLSA-N	-1	0	335.762	3.850	50	0		EHAARM
COc1ccc(-n2cc(C(=O)c3ccc4ccccc4c3[O-])cn2)cc1	ZINC000001395039	564064683	/nfs/dbraw/zinc/06/46/83/564064683.db2.gz	LLLTULSFLRBWJA-UHFFFAOYSA-N	-1	0	344.370	3.971	50	0		EHAARM
O=c1c(-c2ccccc2)nc(-c2ccc(Br)cc2)cn1[O-]	ZINC000001396725	564064910	/nfs/dbraw/zinc/06/49/10/564064910.db2.gz	IIUCVUNVQGVCPC-UHFFFAOYSA-N	-1	0	343.180	3.577	50	0		EHAARM
CCc1ccc([C@H]([NH2+]CCc2ccccc2C)P(=O)([O-])[O-])cc1	ZINC000012949474	564079781	/nfs/dbraw/zinc/07/97/81/564079781.db2.gz	ARCMVNIYOPROKV-GOSISDBHSA-N	-1	0	333.368	3.566	50	0		EHAARM
CCOc1ccccc1-c1noc(-c2c[n-]c3ccc(C)cc3c2=O)n1	ZINC000075352732	564082013	/nfs/dbraw/zinc/08/20/13/564082013.db2.gz	LZEQTRYIRNUPMW-UHFFFAOYSA-N	-1	0	347.374	3.952	50	0		EHAARM
Cc1cc(-c2cc(S(=O)(=O)[N-]c3ccc(C)c(F)c3)c(C)o2)n[nH]1	ZINC000075519136	564087643	/nfs/dbraw/zinc/08/76/43/564087643.db2.gz	NCOUAFBLBLJUBG-UHFFFAOYSA-N	-1	0	349.387	3.535	50	0		EHAARM
CCCc1cc(=O)oc2cc(OCc3ccc(C(=O)[O-])o3)ccc12	ZINC000000318706	564090484	/nfs/dbraw/zinc/09/04/84/564090484.db2.gz	BWFBOGJOAIHDFG-UHFFFAOYSA-N	-1	0	328.320	3.616	50	0	biogenic	EHAARM
CC1CCN(c2ccc(NC(=O)c3ccccc3)c(C(=O)[O-])c2)CC1	ZINC000064589013	564092528	/nfs/dbraw/zinc/09/25/28/564092528.db2.gz	BZHZXMFIGGWEOC-UHFFFAOYSA-N	-1	0	338.407	3.873	50	0		EHAARM
CCN(C(=O)Cc1c(C(=O)[O-])c(C)cn1CC)c1cc(C)ccc1C	ZINC000064980695	564098905	/nfs/dbraw/zinc/09/89/05/564098905.db2.gz	KCHCMVGQMPXQTH-UHFFFAOYSA-N	-1	0	342.439	3.727	50	0		EHAARM
COc1cc(/C=C/c2nc3ccccc3s2)ccc1OCC(=O)[O-]	ZINC000006876230	564100283	/nfs/dbraw/zinc/10/02/83/564100283.db2.gz	KEEVXVBVNZTLGM-VQHVLOKHSA-N	-1	0	341.388	3.939	50	0		EHAARM
CC(=O)c1cccc(NC(=O)[C@](C)(CC(=O)[O-])C2CCCCC2)c1	ZINC000169975467	564104125	/nfs/dbraw/zinc/10/41/25/564104125.db2.gz	OLGYTFTZAUMNAF-LJQANCHMSA-N	-1	0	331.412	3.889	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)nc2Cl)c(C)c1O	ZINC000065504023	564106642	/nfs/dbraw/zinc/10/66/42/564106642.db2.gz	GEDHTJFRHMOLOY-UHFFFAOYSA-N	-1	0	347.223	3.512	50	0		EHAARM
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000007402828	564107928	/nfs/dbraw/zinc/10/79/28/564107928.db2.gz	VXTQGSSTDFHDAV-UHFFFAOYSA-N	-1	0	335.734	3.867	50	0		EHAARM
CCCC[C@H](C(=O)[O-])[C@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002226288	564124450	/nfs/dbraw/zinc/12/44/50/564124450.db2.gz	OUABTEZBKXLQFA-ZBFHGGJFSA-N	-1	0	343.427	3.728	50	0		EHAARM
O=[P@@]([O-])(O)[C@H](NCc1ccccc1Cl)c1ccc(F)c(F)c1	ZINC000012997552	564135839	/nfs/dbraw/zinc/13/58/39/564135839.db2.gz	WRODWCJLYXSQAB-AWEZNQCLSA-N	-1	0	347.685	3.584	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@@H]1CCC[C@@H](C)[C@H]1C)c2=O	ZINC000003912004	564159677	/nfs/dbraw/zinc/15/96/77/564159677.db2.gz	VBIHYWPJMKUNNZ-UEKVPHQBSA-N	-1	0	346.452	3.843	50	0		EHAARM
O=C([O-])[C@H]1CCCN1c1nnc(-c2cc(Cl)cc(Cl)c2)s1	ZINC000263445413	564162208	/nfs/dbraw/zinc/16/22/08/564162208.db2.gz	YJMBRXKERPYPIU-SNVBAGLBSA-N	-1	0	344.223	3.565	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3c(n2)onc3-c2ccco2)cc1	ZINC000008342511	564164588	/nfs/dbraw/zinc/16/45/88/564164588.db2.gz	KCVOLXITTUNKTB-UHFFFAOYSA-N	-1	0	336.303	3.857	50	0		EHAARM
O=C(c1cnn2c(c1)c(-c1ccccc1)[nH]c2=S)c1ccccc1[O-]	ZINC000008345956	564164684	/nfs/dbraw/zinc/16/46/84/564164684.db2.gz	UDRADWIZJRDGNZ-UHFFFAOYSA-N	-1	0	347.399	3.995	50	0		EHAARM
Cc1ccc(C[C@H](CC(=O)Nc2cc(C)ccc2C)C(=O)[O-])cc1	ZINC000071405918	564175014	/nfs/dbraw/zinc/17/50/14/564175014.db2.gz	OGNCYTBJYAERQZ-QGZVFWFLSA-N	-1	0	325.408	3.884	50	0		EHAARM
O=C([O-])CCC/C(=C/c1csnn1)c1nc2ccccc2s1	ZINC000071798837	564175466	/nfs/dbraw/zinc/17/54/66/564175466.db2.gz	UEFRMKRCLFUEDZ-NTMALXAHSA-N	-1	0	331.422	3.943	50	0		EHAARM
O=C([O-])c1cccc(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)n1	ZINC000262417469	599852749	/nfs/dbraw/zinc/85/27/49/599852749.db2.gz	PLYJRGJDPGXFPO-GOSISDBHSA-N	-1	0	349.390	3.629	50	0		EHAARM
C[C@H]1Cc2c(nc3ccccc3c2C(=O)[O-])/C(=C\c2cnn(C)c2)C1	ZINC000014177484	1038600395	/nfs/dbraw/zinc/60/03/95/1038600395.db2.gz	FLVSEHUZATYUBW-OJLMPMFISA-N	-1	0	333.391	3.789	50	0		EHAARM
Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@@H](C)C(=O)[O-]	ZINC000563128864	1130650735	/nfs/dbraw/zinc/65/07/35/1130650735.db2.gz	WUAWOZFEUXJSKO-KGLIPLIRSA-N	-1	0	327.380	3.794	50	0		EHAARM
COc1ccccc1NC(=O)[C@@H](CC(=O)[O-])Cc1cc(C)cc(C)c1	ZINC000004713302	210256641	/nfs/dbraw/zinc/25/66/41/210256641.db2.gz	MOGPUHILORRIEV-MRXNPFEDSA-N	-1	0	341.407	3.584	50	0		EHAARM
Cc1ccc(C(C)C)cc1S(=O)(=O)Nc1cccc(C(=O)[O-])c1	ZINC000053944083	214205776	/nfs/dbraw/zinc/20/57/76/214205776.db2.gz	KBFMGCMQWBCRLM-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
CC(C)(CC(=O)[O-])CC(=O)N[C@@H](CC(F)(F)F)c1ccccc1	ZINC000055151168	214279473	/nfs/dbraw/zinc/27/94/73/214279473.db2.gz	WVUMZXVKIZFWPC-LBPRGKRZSA-N	-1	0	331.334	3.687	50	0		EHAARM
CCCn1c2ccccc2c([O-])c(C(=O)Nc2ccc(C)cc2)c1=O	ZINC000100705269	219105071	/nfs/dbraw/zinc/10/50/71/219105071.db2.gz	XJTPOXQXFOPMQA-UHFFFAOYSA-N	-1	0	336.391	3.678	50	0		EHAARM
CCCCN(C)c1ccc(NC(=O)c2ccccc2)c(C(=O)[O-])c1	ZINC000064589020	214794685	/nfs/dbraw/zinc/79/46/85/214794685.db2.gz	YXQYKUWCEWTSIP-UHFFFAOYSA-N	-1	0	326.396	3.873	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@]1(C/C=C/c1ccccc1)C(=O)[O-]	ZINC000004241182	210149353	/nfs/dbraw/zinc/14/93/53/210149353.db2.gz	ZBMUTXFJZDGZLP-BQHJZSHBSA-N	-1	0	331.412	3.944	50	0		EHAARM
CCCCc1ccc(NC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1	ZINC000067190017	215121711	/nfs/dbraw/zinc/12/17/11/215121711.db2.gz	RXXMCJOVODAYOF-UHFFFAOYSA-N	-1	0	346.452	3.653	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])Cc1ccccc1C(F)(F)F	ZINC000002575650	209870194	/nfs/dbraw/zinc/87/01/94/209870194.db2.gz	YQJFIZXCXGBMPB-NSHDSACASA-N	-1	0	347.333	3.616	50	0		EHAARM
O=C([O-])[C@H]1C=C[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000002243685	209833461	/nfs/dbraw/zinc/83/34/61/209833461.db2.gz	IWMUNNGMJRKNSV-UONOGXRCSA-N	-1	0	349.386	3.554	50	0		EHAARM
O=C([O-])[C@]1(CCCc2ccccc2)CCCN(c2nccs2)C1	ZINC000071614713	215789354	/nfs/dbraw/zinc/78/93/54/215789354.db2.gz	MCFKMCQWXWWXIK-GOSISDBHSA-N	-1	0	330.453	3.837	50	0		EHAARM
O=C([O-])c1cccc(C[C@H]2CCN(C(=O)c3ccccc3Cl)C2)c1	ZINC000072133332	216022496	/nfs/dbraw/zinc/02/24/96/216022496.db2.gz	WHWBQIHLXLBDKI-CQSZACIVSA-N	-1	0	343.810	3.743	50	0		EHAARM
O=C([O-])Cc1ccc(NC(=O)c2csc(-c3cccs3)n2)cc1	ZINC000024771373	212439214	/nfs/dbraw/zinc/43/92/14/212439214.db2.gz	DVYVGEKVOHTNPW-UHFFFAOYSA-N	-1	0	344.417	3.751	50	0		EHAARM
CC(C)c1ccc(-c2nc(CN3CCC[C@H]3C(=O)[O-])cs2)cc1	ZINC000236852279	242382390	/nfs/dbraw/zinc/38/23/90/242382390.db2.gz	ZQWAXBCQBAYIPG-INIZCTEOSA-N	-1	0	330.453	3.983	50	0		EHAARM
CC(C)c1ccc(-c2nc(CN3CCC[C@@H]3C(=O)[O-])cs2)cc1	ZINC000236852242	242382965	/nfs/dbraw/zinc/38/29/65/242382965.db2.gz	ZQWAXBCQBAYIPG-MRXNPFEDSA-N	-1	0	330.453	3.983	50	0		EHAARM
C[C@@H](CC(=O)N1CC[C@@](C)(C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237338928	242596313	/nfs/dbraw/zinc/59/63/13/242596313.db2.gz	ZZZMIGYLJPDDQB-MEDUHNTESA-N	-1	0	343.345	3.522	50	0		EHAARM
CC[C@H](C)c1ccc([C@H](CC)NC(=O)c2c(C(=O)[O-])cnn2C)cc1	ZINC000020616516	212155919	/nfs/dbraw/zinc/15/59/19/212155919.db2.gz	OBQVDMOPTVHBGL-LRDDRELGSA-N	-1	0	343.427	3.513	50	0		EHAARM
O=C(Cc1c(=O)oc2ccccc2c1[O-])c1ccc(C(F)(F)F)cc1	ZINC000015919707	211868856	/nfs/dbraw/zinc/86/88/56/211868856.db2.gz	MRLIOQZNRWLXQD-UHFFFAOYSA-N	-1	0	348.276	3.943	50	0		EHAARM
CC(C)n1ncc2c1NC(=O)CS[C@H]2c1ccc(C(=O)[O-])cc1	ZINC000079494819	217234157	/nfs/dbraw/zinc/23/41/57/217234157.db2.gz	UZCXEYKUSMVIDE-AWEZNQCLSA-N	-1	0	331.397	3.586	50	0		EHAARM
O=C([O-])Cn1nc(C2CC2)c2c1nc(-c1ccco1)cc2C(F)F	ZINC000012395316	211367614	/nfs/dbraw/zinc/36/76/14/211367614.db2.gz	FUZNUGNPGICNDI-UHFFFAOYSA-N	-1	0	333.294	3.591	50	0		EHAARM
CC(C)[C@H](NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-])c1ccc(Cl)cc1	ZINC000010827988	211191220	/nfs/dbraw/zinc/19/12/20/211191220.db2.gz	MEHLKVRXOKTCJQ-PMPSAXMXSA-N	-1	0	335.831	3.820	50	0		EHAARM
COc1ccccc1-c1cc(=O)n2[n-]c(C)c(-c3ccccc3)c2n1	ZINC000009483738	211091184	/nfs/dbraw/zinc/09/11/84/211091184.db2.gz	JJLBPRLABPNPCD-UHFFFAOYSA-N	-1	0	331.375	3.674	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2O)cc1Cl	ZINC000095349110	218283867	/nfs/dbraw/zinc/28/38/67/218283867.db2.gz	AVVRUTZOJUTWBC-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
Cc1cccc(OCCCCC(=O)Nc2ccccc2CC(=O)[O-])c1	ZINC000095424892	218367021	/nfs/dbraw/zinc/36/70/21/218367021.db2.gz	DALJMVDSPMHYJX-UHFFFAOYSA-N	-1	0	341.407	3.810	50	0		EHAARM
CC(C)OC(=O)[C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1C(=O)[O-]	ZINC000005002938	210356770	/nfs/dbraw/zinc/35/67/70/210356770.db2.gz	OSMMTMKDUSZPCL-BTRQGYIVSA-N	-1	0	336.387	3.546	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)N[C@@H](C)CCc2ccccc2)[C@H](C(=O)[O-])C1	ZINC000004902225	210317276	/nfs/dbraw/zinc/31/72/76/210317276.db2.gz	JAECESZJDZEUAG-RYQLBKOJSA-N	-1	0	329.440	3.571	50	0		EHAARM
Cc1ccc(-c2csc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])n2)cc1	ZINC000000996315	258048995	/nfs/dbraw/zinc/04/89/95/258048995.db2.gz	XSFUUEIBDYMQJY-UONOGXRCSA-N	-1	0	342.420	3.724	50	0		EHAARM
O=C([O-])c1nn2c(c1Cl)N[C@@H](c1ccccc1)C[C@@H]2C(F)(F)F	ZINC000000226826	563263046	/nfs/dbraw/zinc/26/30/46/563263046.db2.gz	RQMWBEVLHVOEIT-RKDXNWHRSA-N	-1	0	345.708	3.895	50	0		EHAARM
O=C([O-])c1cc(-c2ccncc2)nc2ccc(Br)cc21	ZINC000000392586	563304492	/nfs/dbraw/zinc/30/44/92/563304492.db2.gz	PQSWWAOGYQHXAJ-UHFFFAOYSA-N	-1	0	329.153	3.758	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(C)c(Cl)c1	ZINC000000583254	563351501	/nfs/dbraw/zinc/35/15/01/563351501.db2.gz	QKWGFEZCOOJFEH-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CCc1cccc(CC)c1[N-]S(=O)(=O)c1cc(C)ccc1OC	ZINC000000583267	563351829	/nfs/dbraw/zinc/35/18/29/563351829.db2.gz	NUURWKSNZYQHRX-UHFFFAOYSA-N	-1	0	333.453	3.929	50	0		EHAARM
CCC(CC)c1nnc([N-]S(=O)(=O)c2ccc(C)cc2)s1	ZINC000000617137	563359170	/nfs/dbraw/zinc/35/91/70/563359170.db2.gz	DVLOFWGQZSYZKC-UHFFFAOYSA-N	-1	0	325.459	3.551	50	0		EHAARM
O=C([O-])[C@H](Cc1ccc2ccccc2c1)NC(=O)OCc1ccccc1	ZINC000002597008	563443798	/nfs/dbraw/zinc/44/37/98/563443798.db2.gz	XBRPIBMAJOTVHG-IBGZPJMESA-N	-1	0	349.386	3.762	50	0		EHAARM
O=C([O-])c1ccccc1SCC(=O)c1ccc(OC(F)F)cc1	ZINC000003223072	563477280	/nfs/dbraw/zinc/47/72/80/563477280.db2.gz	JUFOBBFGDYGQBK-UHFFFAOYSA-N	-1	0	338.331	3.961	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(Br)s2)c(C)c1	ZINC000006368707	563566005	/nfs/dbraw/zinc/56/60/05/563566005.db2.gz	GTDZFMYHSVQFKB-UHFFFAOYSA-N	-1	0	346.271	3.928	50	0		EHAARM
CCOc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1cccc(C)n1	ZINC000012560768	563663213	/nfs/dbraw/zinc/66/32/13/563663213.db2.gz	BQMUDLHYXSDHKL-UHFFFAOYSA-N	-1	0	348.468	3.887	50	0		EHAARM
O=c1c2cc(-c3ccccc3)sc2[n-]c(=S)n1C[C@H]1CCCO1	ZINC000017071905	563835327	/nfs/dbraw/zinc/83/53/27/563835327.db2.gz	QFOXULJUQLOQQJ-GFCCVEGCSA-N	-1	0	344.461	3.967	50	0		EHAARM
O=S(=O)([N-]c1nnc(C2CCCCC2)o1)c1ccc(Cl)cc1	ZINC000071770870	563965671	/nfs/dbraw/zinc/96/56/71/563965671.db2.gz	WEEIRBVNPBVCAR-UHFFFAOYSA-N	-1	0	341.820	3.572	50	0		EHAARM
O=C(/C=C/c1ccco1)Nc1sc2c(c1C(=O)[O-])CCCCC2	ZINC000000038141	563968566	/nfs/dbraw/zinc/96/85/66/563968566.db2.gz	OBEFKLGRNKGNHE-CMDGGOBGSA-N	-1	0	331.393	3.960	50	0		EHAARM
CC(=O)NCC[C@@H]1CCCCN1Cc1c(Cl)ccc([O-])c1Cl	ZINC000077425612	563969598	/nfs/dbraw/zinc/96/95/98/563969598.db2.gz	LHMDXDZFRBBGBZ-LBPRGKRZSA-N	-1	0	345.270	3.580	50	0		EHAARM
CC(C)(C)OC(=O)N1CC[C@@H](Cc2ccc(Cl)cc2)[C@@H]1C(=O)[O-]	ZINC000072233774	563986054	/nfs/dbraw/zinc/98/60/54/563986054.db2.gz	WGOZBWNNXCXPKD-GXTWGEPZSA-N	-1	0	339.819	3.593	50	0		EHAARM
O=C([O-])c1ccccc1C(=O)N1CCS[C@@H]1c1ccc(Cl)cc1	ZINC000000194556	563988097	/nfs/dbraw/zinc/98/80/97/563988097.db2.gz	WBMUDYPJDDBFRN-MRXNPFEDSA-N	-1	0	347.823	3.926	50	0		EHAARM
C[C@H](CC(=O)N1CCC[C@H](C(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000136151047	564001283	/nfs/dbraw/zinc/00/12/83/564001283.db2.gz	GOUMWXQOENSYKM-NEPJUHHUSA-N	-1	0	343.345	3.522	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000000268428	564012292	/nfs/dbraw/zinc/01/22/92/564012292.db2.gz	GLTIFAPRQURZFG-KBPBESRZSA-N	-1	0	331.412	3.598	50	0		EHAARM
O=C(N=C([O-])C(F)(F)F)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000001891125	564013159	/nfs/dbraw/zinc/01/31/59/564013159.db2.gz	JUYGHFKNDRYHNU-UHFFFAOYSA-N	-1	0	334.603	3.569	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1NC(=O)[C@H]1CCCC[C@@H]1C(=O)[O-]	ZINC000005383800	564013997	/nfs/dbraw/zinc/01/39/97/564013997.db2.gz	UWWCJMRSYZRTMP-KBPBESRZSA-N	-1	0	333.428	3.822	50	0		EHAARM
COC(=O)c1ccc(Oc2cc(C)nc(-c3ccccc3[O-])n2)cc1	ZINC000000519984	564020571	/nfs/dbraw/zinc/02/05/71/564020571.db2.gz	IENBMBPZUKQZFH-UHFFFAOYSA-N	-1	0	336.347	3.737	50	0		EHAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1ccc(Oc2ccccc2)cc1	ZINC000016101595	564024537	/nfs/dbraw/zinc/02/45/37/564024537.db2.gz	HBHKBHKXAPZXDR-UHFFFAOYSA-N	-1	0	343.408	3.620	50	0		EHAARM
Cc1cc(C)c(S(=O)(=O)Nc2ccccc2C(C)C)cc1C(=O)[O-]	ZINC000045946644	564028954	/nfs/dbraw/zinc/02/89/54/564028954.db2.gz	MZQMGRHMOZMAAR-UHFFFAOYSA-N	-1	0	347.436	3.926	50	0		EHAARM
C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@H](O)CC[C@@]43C)[C@H]1CC[C@@]2(O)CC(=O)[O-]	ZINC000257346213	564055900	/nfs/dbraw/zinc/05/59/00/564055900.db2.gz	VAPBKEAUXQVFHX-JLHGIXDNSA-N	-1	0	348.483	3.516	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000005983641	564057412	/nfs/dbraw/zinc/05/74/12/564057412.db2.gz	JDMZIQXMNPJMIL-UHFFFAOYSA-N	-1	0	331.437	3.988	50	0		EHAARM
O=S(=O)([N-]c1ccc(OC2CCCC2)cc1)c1ccccc1F	ZINC000012536021	564058365	/nfs/dbraw/zinc/05/83/65/564058365.db2.gz	BZIZZNUJDRLMKW-UHFFFAOYSA-N	-1	0	335.400	3.948	50	0		EHAARM
CCOc1cc2c(cc1[N-]S(=O)(=O)c1ccc(C)cc1)O[C@@H](C)C2	ZINC000012560896	564059586	/nfs/dbraw/zinc/05/95/86/564059586.db2.gz	UMPCYDIVLARGCE-ZDUSSCGKSA-N	-1	0	347.436	3.518	50	0		EHAARM
Cc1cc(C(F)(F)F)nc(S[C@H](C(=O)[O-])c2ccccc2)n1	ZINC000006189380	564080653	/nfs/dbraw/zinc/08/06/53/564080653.db2.gz	NLCGGGYQUYNZFR-NSHDSACASA-N	-1	0	328.315	3.722	50	0		EHAARM
CC[C@H](NC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-])C12CC3CC(CC(C3)C1)C2	ZINC000239433190	564088146	/nfs/dbraw/zinc/08/81/46/564088146.db2.gz	XIKYNLRAQBQZED-UCUUCWMCSA-N	-1	0	345.483	3.765	50	0		EHAARM
N#CC(=NNc1ccccc1C(=O)[O-])C(=O)c1ccc2ccccc2c1	ZINC000252634993	564090737	/nfs/dbraw/zinc/09/07/37/564090737.db2.gz	WSTYJWFOILOGPD-UHFFFAOYSA-N	-1	0	343.342	3.712	50	0		EHAARM
O=C(NC1(c2ccc(F)cc2)CCOCC1)c1ccc([O-])c(Cl)c1	ZINC000192662418	564092678	/nfs/dbraw/zinc/09/26/78/564092678.db2.gz	BYUXKJUIFOAFNJ-UHFFFAOYSA-N	-1	0	349.789	3.620	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3C)o2)c1C	ZINC000064958521	564098528	/nfs/dbraw/zinc/09/85/28/564098528.db2.gz	ZJZZYXKUVRIMOU-UHFFFAOYSA-N	-1	0	346.408	3.969	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)cs2)c1C	ZINC000065112312	564101284	/nfs/dbraw/zinc/10/12/84/564101284.db2.gz	LBPRAIKNQICHNX-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c2cccnc21	ZINC000065242253	564103427	/nfs/dbraw/zinc/10/34/27/564103427.db2.gz	PSLFCPAQLATUIU-UHFFFAOYSA-N	-1	0	349.843	3.901	50	0		EHAARM
COc1ccc([C@H](C)n2c(=O)c3ccccc3[n-]c2=S)cc1OC	ZINC000007276861	564106341	/nfs/dbraw/zinc/10/63/41/564106341.db2.gz	GVPUVVKEOLFUIC-NSHDSACASA-N	-1	0	342.420	3.686	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)C[C@H]1CCCc2ccccc21)c1ccccc1	ZINC000237937395	564117788	/nfs/dbraw/zinc/11/77/88/564117788.db2.gz	MDCJHWGHEMBBKT-MJGOQNOKSA-N	-1	0	337.419	3.829	50	0		EHAARM
Cc1nc(-c2ccc([N-]S(=O)(=O)c3c(C)noc3C)cc2)cs1	ZINC000007726343	564122307	/nfs/dbraw/zinc/12/23/07/564122307.db2.gz	GBGLOLBDQVVVRX-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
O=C(c1ccccc1)c1ccc2c(c1[O-])[C@H](c1ccco1)CC(=O)O2	ZINC000253402037	564130595	/nfs/dbraw/zinc/13/05/95/564130595.db2.gz	FZNZVYLCBYHDJO-AWEZNQCLSA-N	-1	0	334.327	3.657	50	0	biogenic	EHAARM
O=C([O-])[C@@H](Cc1ccccc1)NC(=O)Nc1cccc2ccccc21	ZINC000002290805	564131556	/nfs/dbraw/zinc/13/15/56/564131556.db2.gz	UIANVCANHHQYOC-GOSISDBHSA-N	-1	0	334.375	3.657	50	0		EHAARM
O=C([O-])C1CCC(Nc2ccc(C(=O)N3CCCCCC3)cc2)CC1	ZINC000263439705	564161976	/nfs/dbraw/zinc/16/19/76/564161976.db2.gz	VYEBDJBIBQNQQC-UHFFFAOYSA-N	-1	0	344.455	3.758	50	0		EHAARM
C[C@H](Oc1ccccc1)c1nc(C2CC2)nn1-c1ccccc1C(=O)[O-]	ZINC000670473801	564167156	/nfs/dbraw/zinc/16/71/56/564167156.db2.gz	JZIHBVXIYLXCBX-ZDUSSCGKSA-N	-1	0	349.390	3.983	50	0		EHAARM
CC(C)(C)[C@H]1OCC[C@H]1CNC(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000073770165	564176426	/nfs/dbraw/zinc/17/64/26/564176426.db2.gz	AZIOGUDSZUDKHS-FZMZJTMJSA-N	-1	0	334.441	3.671	50	0		EHAARM
CC(C)c1cccc(NS(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000024102224	601318890	/nfs/dbraw/zinc/31/88/90/601318890.db2.gz	KCMNIWKLLBCIKC-DHZHZOJOSA-N	-1	0	345.420	3.709	50	0		EHAARM
CC(C)(C)OC(=O)N[C@](C)(C(=O)[O-])c1cc(Cl)cc(Cl)c1	ZINC000395313837	939137801	/nfs/dbraw/zinc/13/78/01/939137801.db2.gz	XRUHHIRUUARMLC-AWEZNQCLSA-N	-1	0	334.199	3.818	50	0		EHAARM
O=C([O-])[C@@H](CC(F)F)NC(=O)c1ccc(C2CCCCC2)cc1	ZINC000262982240	962071946	/nfs/dbraw/zinc/07/19/46/962071946.db2.gz	KVXSXIYDMRQOCN-CQSZACIVSA-N	-1	0	325.355	3.573	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)cc1	ZINC000630327397	1137354254	/nfs/dbraw/zinc/35/42/54/1137354254.db2.gz	GBEBGZADEYHDGI-VSZNYVQBSA-N	-1	0	339.366	3.756	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(F)cc1	ZINC000004743865	210267638	/nfs/dbraw/zinc/26/76/38/210267638.db2.gz	PYMZRPHJOLGKPA-ANCGMVAHSA-N	-1	0	345.414	3.674	50	0		EHAARM
CCOC(=O)Nc1ccc(NC(=O)c2ccc([O-])c(Cl)c2)cc1	ZINC000053466035	214184618	/nfs/dbraw/zinc/18/46/18/214184618.db2.gz	QXZGWAATUDOBMG-UHFFFAOYSA-N	-1	0	334.759	3.866	50	0		EHAARM
O=C([O-])c1ccc2[nH]c(-c3c[nH]nc3-c3ccc(Cl)cc3)nc2c1	ZINC000055120564	214276517	/nfs/dbraw/zinc/27/65/17/214276517.db2.gz	YEKSGBXMZWDHBX-UHFFFAOYSA-N	-1	0	338.754	3.972	50	0		EHAARM
COc1cccc(-c2nc3cc(C)c(C)cc3[nH]2)c1O[C@H](C)C(=O)[O-]	ZINC000055386850	214315176	/nfs/dbraw/zinc/31/51/76/214315176.db2.gz	MHQYERXYKVLYJB-GFCCVEGCSA-N	-1	0	340.379	3.707	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)c2ccccc2C)cc1C(=O)[O-]	ZINC000058065135	214475375	/nfs/dbraw/zinc/47/53/75/214475375.db2.gz	GFBRFPBWKUWPNV-UHFFFAOYSA-N	-1	0	326.396	3.792	50	0		EHAARM
CCCc1c(C)nc2[n-]c(SCc3ccc(Cl)cc3)nn2c1=O	ZINC000100133782	219092250	/nfs/dbraw/zinc/09/22/50/219092250.db2.gz	VZIJPOKYFYYAFB-UHFFFAOYSA-N	-1	0	348.859	3.624	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cc1OC(F)(F)F)C(F)(F)F	ZINC000004390114	210185842	/nfs/dbraw/zinc/18/58/42/210185842.db2.gz	MCNZIQBKNOEAAV-UHFFFAOYSA-N	-1	0	343.632	3.500	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3ccccc3C)o2)c1C	ZINC000064958548	214815593	/nfs/dbraw/zinc/81/55/93/214815593.db2.gz	OSBPVWMHRUZDTC-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cccc(C)c3C)o2)on1	ZINC000064958413	214816025	/nfs/dbraw/zinc/81/60/25/214816025.db2.gz	CDYRFRNTJTTYSY-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
COP(=O)(OC)[C@H](Nc1ccccc1C(=O)[O-])c1ccccc1	ZINC000002311967	209839653	/nfs/dbraw/zinc/83/96/53/209839653.db2.gz	ZJMNFDOLPMKZGS-HNNXBMFYSA-N	-1	0	335.296	3.981	50	0		EHAARM
O=C([O-])c1ccccc1[C@H]1CCN(C(=O)Nc2ccc(F)c(F)c2)C1	ZINC000072156767	216045579	/nfs/dbraw/zinc/04/55/79/216045579.db2.gz	IUVOADUYMRCRLL-NSHDSACASA-N	-1	0	346.333	3.684	50	0		EHAARM
O=C([O-])c1ccccc1[C@H]1CCN(C(=O)c2cccc3cccnc32)C1	ZINC000072164531	216053364	/nfs/dbraw/zinc/05/33/64/216053364.db2.gz	QMRKIIIJXWHOAR-HNNXBMFYSA-N	-1	0	346.386	3.563	50	0		EHAARM
COc1ccc(NC(=O)[C@H](CC(=O)[O-])Cc2ccc(Cl)cc2)cc1	ZINC000000249097	209503622	/nfs/dbraw/zinc/50/36/22/209503622.db2.gz	OKUYZTFCXVVBKQ-ZDUSSCGKSA-N	-1	0	347.798	3.621	50	0		EHAARM
Cc1cccc(CSc2ncc(Br)c(C(=O)[O-])n2)c1	ZINC000028291922	212613995	/nfs/dbraw/zinc/61/39/95/212613995.db2.gz	DAXWEJCYTJWTQW-UHFFFAOYSA-N	-1	0	339.214	3.538	50	0		EHAARM
Cc1nc2sc([C@@H](c3ccccc3F)N3CCCCC3)c([O-])n2n1	ZINC000022626006	212313133	/nfs/dbraw/zinc/31/31/33/212313133.db2.gz	SJECKRWLPFLEJE-CQSZACIVSA-N	-1	0	346.431	3.519	50	0		EHAARM
COc1ccc(/C=C(/NC(=O)c2cccc3ccccc32)C(=O)[O-])cc1	ZINC000022478494	212300280	/nfs/dbraw/zinc/30/02/80/212300280.db2.gz	CKHCMZNOXCOJFO-CPNJWEJPSA-N	-1	0	347.370	3.704	50	0		EHAARM
CSc1ccc([C@@H]2[C@@H](C(=O)[O-])CC(=O)N2Cc2ccccc2)cc1	ZINC000022129925	212278174	/nfs/dbraw/zinc/27/81/74/212278174.db2.gz	UJHRKLBHWDTEQV-FUHWJXTLSA-N	-1	0	341.432	3.583	50	0		EHAARM
C[C@H]1Cc2c(nc3ccccc3c2C(=O)[O-])/C(=C/c2cnn(C)c2)C1	ZINC000021956954	212266446	/nfs/dbraw/zinc/26/64/46/212266446.db2.gz	FLVSEHUZATYUBW-ZMTLZGASSA-N	-1	0	333.391	3.789	50	0		EHAARM
Cc1nn(CC(=O)[O-])c2nc(-c3ccc(C)cc3)cc(C(F)(F)F)c12	ZINC000020349733	212121705	/nfs/dbraw/zinc/12/17/05/212121705.db2.gz	QTPRZUPRJWFLEF-UHFFFAOYSA-N	-1	0	349.312	3.819	50	0		EHAARM
CC(C)C[C@H](Nc1nc(C(F)(F)F)nc2ccccc21)C(=O)[O-]	ZINC000011990430	211276211	/nfs/dbraw/zinc/27/62/11/211276211.db2.gz	XJGFREGMJLZEQG-NSHDSACASA-N	-1	0	327.306	3.560	50	0		EHAARM
O=C([O-])c1ccc(-n2nc3c4c(cccc4c2=O)-c2ccccc2-3)cc1	ZINC000010272338	211160015	/nfs/dbraw/zinc/16/00/15/211160015.db2.gz	VUNDRHJYBWXHKR-UHFFFAOYSA-N	-1	0	340.338	3.731	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2Cl)c(O)c1	ZINC000009467974	211087185	/nfs/dbraw/zinc/08/71/85/211087185.db2.gz	NDJNRKSFHDFPCS-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)CCc3cccs3)C2)cc1	ZINC000095366319	218299506	/nfs/dbraw/zinc/29/95/06/218299506.db2.gz	VSOGPQQPXQOXBP-MRXNPFEDSA-N	-1	0	343.448	3.785	50	0		EHAARM
C[C@H](Nc1nc(=O)c(Cc2ccc(Cl)cc2)n[n-]1)c1ccccc1	ZINC000008914645	211016992	/nfs/dbraw/zinc/01/69/92/211016992.db2.gz	KDTMQYLYJJDRTE-LBPRGKRZSA-N	-1	0	340.814	3.582	50	0		EHAARM
CCc1nc2sc3c([n-]cnc3=O)c2c2c1CSC(C)(C)C2	ZINC000008770596	211003807	/nfs/dbraw/zinc/00/38/07/211003807.db2.gz	LSKKMLROJYDKDT-UHFFFAOYSA-N	-1	0	331.466	3.663	50	0		EHAARM
COc1ccc([C@@H](CC(C)=O)c2c([O-])c3ccccc3oc2=O)cc1	ZINC000006614270	210663384	/nfs/dbraw/zinc/66/33/84/210663384.db2.gz	XWWHEKHACHXGCR-MRXNPFEDSA-N	-1	0	338.359	3.618	50	0		EHAARM
CC(C)CC(=O)Nc1ccc(NC(=O)c2cc(F)c([O-])c(F)c2)cc1	ZINC000177021208	257953901	/nfs/dbraw/zinc/95/39/01/257953901.db2.gz	HYCASDYXNLXVJK-UHFFFAOYSA-N	-1	0	348.349	3.907	50	0		EHAARM
O=C([O-])CCC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	ZINC000000259879	563268019	/nfs/dbraw/zinc/26/80/19/563268019.db2.gz	ONPQPXOMIXEADB-UHFFFAOYSA-N	-1	0	326.377	3.767	50	0		EHAARM
O=C1[N-]C(=O)/C(=C\c2ccc(Sc3ccc(Cl)cc3)s2)N1	ZINC000000563003	563347617	/nfs/dbraw/zinc/34/76/17/563347617.db2.gz	CFYYSADLPYCMGW-YRNVUSSQSA-N	-1	0	336.825	3.733	50	0		EHAARM
O=C([O-])c1ccc(Cl)cc1NC(=O)c1ccc(Br)o1	ZINC000000619648	563361359	/nfs/dbraw/zinc/36/13/59/563361359.db2.gz	KIXRPMSINYWTGR-UHFFFAOYSA-N	-1	0	344.548	3.646	50	0		EHAARM
O=C1CCCCC1=C([O-])c1cn(-c2ccc(Cl)c(Cl)c2)nn1	ZINC000001395101	563386366	/nfs/dbraw/zinc/38/63/66/563386366.db2.gz	YYUFYBCDRIIAEY-JTQLQIEISA-N	-1	0	338.194	3.516	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])c1ccc(C(F)(F)F)cc1	ZINC000002597327	563443834	/nfs/dbraw/zinc/44/38/34/563443834.db2.gz	WJMVMQYNFZQHGW-NSHDSACASA-N	-1	0	333.306	3.746	50	0		EHAARM
COc1ccccc1[C@@H]1[C@H](C(=O)[O-])CCC(=O)N1c1ccc(C)cc1	ZINC000004200323	563497496	/nfs/dbraw/zinc/49/74/96/563497496.db2.gz	MSAZOYMMVYAYHB-VQIMIIECSA-N	-1	0	339.391	3.573	50	0		EHAARM
O=C(c1ccc(Cl)cc1)n1c(=S)[n-]nc1NCc1ccccc1	ZINC000005999237	563556596	/nfs/dbraw/zinc/55/65/96/563556596.db2.gz	OHQOPWVMOVQLSE-UHFFFAOYSA-N	-1	0	344.827	3.895	50	0		EHAARM
O=C(Nc1cccc(Cl)c1)c1c[n-]c2cc(F)cc(F)c2c1=O	ZINC000032608168	563662357	/nfs/dbraw/zinc/66/23/57/563662357.db2.gz	ZYMQZCUKWABOHD-UHFFFAOYSA-N	-1	0	334.709	3.712	50	0		EHAARM
CC(=O)c1ccc(NC(=O)[C@@H](C)Sc2ccccc2C(=O)[O-])cc1	ZINC000012978271	563680915	/nfs/dbraw/zinc/68/09/15/563680915.db2.gz	PTXYYIIPGYMZPQ-GFCCVEGCSA-N	-1	0	343.404	3.707	50	0		EHAARM
Cc1ccccc1CCN[C@H](c1ccccc1Cl)[P@@](=O)([O-])O	ZINC000012997442	563683798	/nfs/dbraw/zinc/68/37/98/563683798.db2.gz	RMHZHKACKWDSFJ-INIZCTEOSA-N	-1	0	339.759	3.657	50	0		EHAARM
C[C@@H]1CN(c2nc(-c3ccccc3[O-])nc3ccccc32)C[C@H](C)O1	ZINC000013662073	563707568	/nfs/dbraw/zinc/70/75/68/563707568.db2.gz	SSGBQDDFWFXNHS-OKILXGFUSA-N	-1	0	335.407	3.616	50	0		EHAARM
O=C([O-])C1Oc2ccc(Cl)cc2Cc2cc(Cl)ccc2O1	ZINC000071767455	563965579	/nfs/dbraw/zinc/96/55/79/563965579.db2.gz	NRFDKEMIVBHNIH-UHFFFAOYSA-N	-1	0	325.147	3.766	50	0		EHAARM
Cc1ccccc1C[C@H]1CCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)[O-]	ZINC000221032992	563989611	/nfs/dbraw/zinc/98/96/11/563989611.db2.gz	VEISDHRYJDNLDB-HZPDHXFCSA-N	-1	0	333.428	3.638	50	0		EHAARM
CCOc1nc([N-]c2nc(-c3ccccc3)cs2)nc(OCC)n1	ZINC000000322543	563991208	/nfs/dbraw/zinc/99/12/08/563991208.db2.gz	RUSQPOINGIQRTF-UHFFFAOYSA-N	-1	0	343.412	3.536	50	0		EHAARM
Cc1cccc(O)c1[N-]S(=O)(=O)c1ccc(F)c(C(F)(F)F)c1	ZINC000075106920	564000269	/nfs/dbraw/zinc/00/02/69/564000269.db2.gz	MARQEMCTCHLDOR-UHFFFAOYSA-N	-1	0	349.305	3.659	50	0		EHAARM
O=C([O-])CC1(CC(=O)Nc2ccc3c(c2)OCCCO3)CCCCC1	ZINC000000129747	564012125	/nfs/dbraw/zinc/01/21/25/564012125.db2.gz	PTBVGJSQXBTRLJ-UHFFFAOYSA-N	-1	0	347.411	3.602	50	0		EHAARM
O=C(CSc1nc2ccccc2s1)Nc1ccccc1C(=O)[O-]	ZINC000000181623	564012173	/nfs/dbraw/zinc/01/21/73/564012173.db2.gz	UTFPIMQLNWVOEQ-UHFFFAOYSA-N	-1	0	344.417	3.725	50	0		EHAARM
O=c1c2oc3ccc(Cl)cc3c2[n-]c(=S)n1Cc1cccnc1	ZINC000101270642	564024940	/nfs/dbraw/zinc/02/49/40/564024940.db2.gz	OWMIKEZHXXTECH-UHFFFAOYSA-N	-1	0	343.795	3.902	50	0		EHAARM
O=C(NCc1cc(Br)cs1)c1ccc([O-])c(Cl)c1	ZINC000048356563	564031376	/nfs/dbraw/zinc/03/13/76/564031376.db2.gz	DHCVZSIPTYOPTL-UHFFFAOYSA-N	-1	0	346.633	3.800	50	0		EHAARM
C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@@H](OCC(=O)[O-])CC[C@@]43C)[C@H]1CCC2=O	ZINC000257356406	564055922	/nfs/dbraw/zinc/05/59/22/564055922.db2.gz	HVGDJTBADGQHHZ-YBCKDWFCSA-N	-1	0	346.467	3.988	50	0		EHAARM
CCCC[C@](CNC(=O)c1ccccc1)(C(=O)[O-])c1ccccc1	ZINC000005951726	564057288	/nfs/dbraw/zinc/05/72/88/564057288.db2.gz	YPYKAHPEDRNLRD-HXUWFJFHSA-N	-1	0	325.408	3.629	50	0		EHAARM
O=C([O-])CC1(c2ccc(Cl)cc2Cl)C(=O)c2ccccc2C1=O	ZINC000022014949	564084947	/nfs/dbraw/zinc/08/49/47/564084947.db2.gz	VKHKXIAHIFBNAN-UHFFFAOYSA-N	-1	0	349.169	3.785	50	0		EHAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)c1	ZINC000065031122	564099789	/nfs/dbraw/zinc/09/97/89/564099789.db2.gz	ONILIPVDYMMMIQ-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000007056403	564103968	/nfs/dbraw/zinc/10/39/68/564103968.db2.gz	FGAJQGJXDHQUDB-UHFFFAOYSA-N	-1	0	345.342	3.823	50	0		EHAARM
CC[C@@H](C)c1ccccc1NS(=O)(=O)c1cccc(C(=O)[O-])c1	ZINC000007057656	564103975	/nfs/dbraw/zinc/10/39/75/564103975.db2.gz	LHHDKRDUKMEJKJ-GFCCVEGCSA-N	-1	0	333.409	3.699	50	0		EHAARM
Cc1cccc([C@H]2CC(c3ccsc3)=NN2C(=O)CCC(=O)[O-])c1	ZINC000170091750	564105482	/nfs/dbraw/zinc/10/54/82/564105482.db2.gz	LDLDMLNEJFWGQM-MRXNPFEDSA-N	-1	0	342.420	3.599	50	0		EHAARM
Cn1cc(/C=C(/CCCC(=O)[O-])c2nc3ccccc3s2)cn1	ZINC000071793307	564111092	/nfs/dbraw/zinc/11/10/92/564111092.db2.gz	OHHGYUGIPNJZDX-LCYFTJDESA-N	-1	0	327.409	3.825	50	0		EHAARM
Cc1nnc(SCc2cc(=O)oc3cc([O-])c(Cl)cc23)s1	ZINC000071794540	564111130	/nfs/dbraw/zinc/11/11/30/564111130.db2.gz	UDZZPHBJSIQJAW-UHFFFAOYSA-N	-1	0	340.813	3.604	50	0		EHAARM
O=C([O-])C[C@H](/N=C/c1cc(Br)ccc1O)c1ccccc1	ZINC000075249459	564121271	/nfs/dbraw/zinc/12/12/71/564121271.db2.gz	CUSYDOOHCWEMBN-XKYMITNMSA-N	-1	0	348.196	3.790	50	0		EHAARM
O=C([O-])c1cnn(-c2nccc(-c3cc4ccccc4o3)n2)c1C1CC1	ZINC000118283050	564129533	/nfs/dbraw/zinc/12/95/33/564129533.db2.gz	GEKRIUZXBJGSQJ-UHFFFAOYSA-N	-1	0	346.346	3.651	50	0		EHAARM
O=C(c1ccccc1)c1ccc2c(c1[O-])[C@@H](c1ccco1)CC(=O)O2	ZINC000253402041	564130591	/nfs/dbraw/zinc/13/05/91/564130591.db2.gz	FZNZVYLCBYHDJO-CQSZACIVSA-N	-1	0	334.327	3.657	50	0	biogenic	EHAARM
CC(C)c1nc(/C=C/c2ccnn2-c2ccccc2)ncc1C(=O)[O-]	ZINC000390835305	564139009	/nfs/dbraw/zinc/13/90/09/564139009.db2.gz	JZJOJSXZPDRUJS-CMDGGOBGSA-N	-1	0	334.379	3.654	50	0		EHAARM
O=C([O-])c1ccccc1CCC(=O)Nc1ccccc1N1CCCC1	ZINC000097039151	564149251	/nfs/dbraw/zinc/14/92/51/564149251.db2.gz	IAEBMTHVSXMIBQ-UHFFFAOYSA-N	-1	0	338.407	3.556	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)c1ccc(-c2ccccc2)[nH]1	ZINC000262191839	564152795	/nfs/dbraw/zinc/15/27/95/564152795.db2.gz	IAWNHGKKYHPIHB-HNNXBMFYSA-N	-1	0	326.396	3.541	50	0		EHAARM
CC[C@@H](C)NC(=O)CCCCCn1c(=O)c2ccccc2[n-]c1=S	ZINC000002970312	564153905	/nfs/dbraw/zinc/15/39/05/564153905.db2.gz	SBVYOUPJRRHLPM-CYBMUJFWSA-N	-1	0	347.484	3.534	50	0		EHAARM
O=C([O-])c1ccccc1-c1nnc(-c2cccc(Br)c2)o1	ZINC000163328123	564177309	/nfs/dbraw/zinc/17/73/09/564177309.db2.gz	KEYPXONABZVKAN-UHFFFAOYSA-N	-1	0	345.152	3.864	50	0		EHAARM
O=C([O-])CCC(=O)N1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1	ZINC000566755581	601739556	/nfs/dbraw/zinc/73/95/56/601739556.db2.gz	QOTXRYOMJJWRLZ-QGZVFWFLSA-N	-1	0	343.810	3.831	50	0		EHAARM
COc1ccccc1-c1csc(NC(=O)[C@H](C(=O)[O-])C(C)(C)C)n1	ZINC000656848613	954307066	/nfs/dbraw/zinc/30/70/66/954307066.db2.gz	GFVZJYZMXHRUCT-CYBMUJFWSA-N	-1	0	348.424	3.504	50	0		EHAARM
COc1ccc(C=NNc2ccc(Cl)c(C(=O)[O-])c2)c(OC)c1	ZINC000263621962	1037991763	/nfs/dbraw/zinc/99/17/63/1037991763.db2.gz	WCMHRMKMNMCCGG-UHFFFAOYSA-N	-1	0	334.759	3.501	50	0		EHAARM
COc1cc(-c2cc(F)ccc2OC[C@@H]2CCOC2)ccc1C(=O)[O-]	ZINC000565237871	1130751034	/nfs/dbraw/zinc/75/10/34/1130751034.db2.gz	LSXHPKMQGXWCMK-GFCCVEGCSA-N	-1	0	346.354	3.615	50	0		EHAARM
Cc1ccc([C@@H]2CCN(C(=O)C[C@H](C(=O)[O-])c3ccccc3)C2)cc1	ZINC000634944180	1137481031	/nfs/dbraw/zinc/48/10/31/1137481031.db2.gz	QFRKYIIWAJWXRS-MOPGFXCFSA-N	-1	0	337.419	3.569	50	0		EHAARM
O=C(NCc1cc(-c2ccccc2)no1)c1ccc([O-])c(Cl)c1	ZINC000052989610	214158289	/nfs/dbraw/zinc/15/82/89/214158289.db2.gz	QKUHRPRSCCTYDP-UHFFFAOYSA-N	-1	0	328.755	3.631	50	0		EHAARM
O=c1nc(CN(Cc2ccccc2F)C2CC2)[n-]c2ccsc21	ZINC000056681674	214383514	/nfs/dbraw/zinc/38/35/14/214383514.db2.gz	WYAPCVJIXNTBDI-UHFFFAOYSA-N	-1	0	329.400	3.701	50	0		EHAARM
CCCn1c(=O)c(C(=O)Nc2cccc(F)c2)c([O-])c2ccccc21	ZINC000100504398	219101495	/nfs/dbraw/zinc/10/14/95/219101495.db2.gz	BNWZOGXGHCDGQU-UHFFFAOYSA-N	-1	0	340.354	3.509	50	0		EHAARM
O=C([O-])c1cccc(Nc2c(-c3ccccc3)nc3cnccn32)c1	ZINC000065322802	214871438	/nfs/dbraw/zinc/87/14/38/214871438.db2.gz	XVHKNWKBDPFESY-UHFFFAOYSA-N	-1	0	330.347	3.838	50	0		EHAARM
O=C([O-])[C@H](CC(=O)c1ccccc1)Nc1ccc(Br)cc1	ZINC000002819223	209922688	/nfs/dbraw/zinc/92/26/88/209922688.db2.gz	XMGNQAJSAZVAPS-AWEZNQCLSA-N	-1	0	348.196	3.587	50	0		EHAARM
Cc1c(Cl)cccc1NC(=O)C[C@H](Cc1ccccc1)C(=O)[O-]	ZINC000000266832	209511093	/nfs/dbraw/zinc/51/10/93/209511093.db2.gz	COZVUYJGDRAAMY-AWEZNQCLSA-N	-1	0	331.799	3.921	50	0		EHAARM
CC1(C)[C@H](C(=O)Nc2nc3ccccc3s2)CC[C@@]1(C)C(=O)[O-]	ZINC000000191665	209475779	/nfs/dbraw/zinc/47/57/79/209475779.db2.gz	MUKSDTCHANCPAN-BTDLBPIBSA-N	-1	0	332.425	3.762	50	0		EHAARM
O=C([O-])c1ccc(C[C@@H]2CCN(C(=O)c3ccccc3Cl)C2)cc1	ZINC000072448221	216239080	/nfs/dbraw/zinc/23/90/80/216239080.db2.gz	WNCSQVCHYAIYJX-AWEZNQCLSA-N	-1	0	343.810	3.743	50	0		EHAARM
Cc1c(C(=O)[O-])sc2ncnc(NCCc3ccc(C)cc3)c12	ZINC000021715890	212243171	/nfs/dbraw/zinc/24/31/71/212243171.db2.gz	IZPSNPAVUJZTAY-UHFFFAOYSA-N	-1	0	327.409	3.661	50	0		EHAARM
O=C([O-])c1ccc([C@H]2SCC(=O)N2Cc2ccc(Cl)cc2)cc1	ZINC000226087236	242089135	/nfs/dbraw/zinc/08/91/35/242089135.db2.gz	YCSWEQCXFBJTJV-MRXNPFEDSA-N	-1	0	347.823	3.812	50	0		EHAARM
O=C([O-])Cc1ccccc1NC(=O)[C@H]1C[C@]12CCCc1ccccc12	ZINC000238087734	242927597	/nfs/dbraw/zinc/92/75/97/242927597.db2.gz	LLSCCVUOCFYHFJ-UTKZUKDTSA-N	-1	0	335.403	3.546	50	0		EHAARM
C[C@H](NC(=O)c1cc(F)cc(Cl)c1[O-])c1nc2ccccc2[nH]1	ZINC000078995486	217168631	/nfs/dbraw/zinc/16/86/31/217168631.db2.gz	DQPDEQUBUCHJDT-QMMMGPOBSA-N	-1	0	333.750	3.552	50	0		EHAARM
Cc1ccc(NC(=O)CC(C)(C)CC(=O)[O-])c(Br)c1	ZINC000016478197	211908452	/nfs/dbraw/zinc/90/84/52/211908452.db2.gz	SUGJPFDCUSFUDN-UHFFFAOYSA-N	-1	0	328.206	3.587	50	0		EHAARM
CN(C)c1cc(C(F)(F)F)cc(-c2cccc(/C=C/C(=O)[O-])c2)n1	ZINC000091695395	218050102	/nfs/dbraw/zinc/05/01/02/218050102.db2.gz	CFKDZXAQCOSXJR-VOTSOKGWSA-N	-1	0	336.313	3.931	50	0		EHAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1	ZINC000004783851	210277024	/nfs/dbraw/zinc/27/70/24/210277024.db2.gz	YJXIKGRBMSCAMY-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
Cc1ncc(-c2ccc(S(=O)(=O)[N-]c3ccccc3F)s2)o1	ZINC000065003795	258062351	/nfs/dbraw/zinc/06/23/51/258062351.db2.gz	LAHWNMSXDZQUNS-UHFFFAOYSA-N	-1	0	338.385	3.651	50	0		EHAARM
CCOc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1ccccc1O	ZINC000170623994	258071571	/nfs/dbraw/zinc/07/15/71/258071571.db2.gz	LVSAMOMJNVHPLN-UHFFFAOYSA-N	-1	0	349.452	3.889	50	0		EHAARM
CC(C)OC1CCC(NC(=O)c2ccc3[n-]c(=S)oc3c2)CC1	ZINC000159297591	527886062	/nfs/dbraw/zinc/88/60/62/527886062.db2.gz	DEUABRYDLWOIRF-UHFFFAOYSA-N	-1	0	334.441	3.583	50	0		EHAARM
O=S(=O)([N-]c1cccc(C(F)(F)F)c1)c1cc(F)cc(F)c1	ZINC000016101407	563803611	/nfs/dbraw/zinc/80/36/11/563803611.db2.gz	YFZCWTFPDFZYQK-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
O=C([O-])c1cc(O)ccc1NC(=O)C(c1ccccc1)c1ccccc1	ZINC000000510035	563339706	/nfs/dbraw/zinc/33/97/06/563339706.db2.gz	QWYMRYCHPFRXHZ-UHFFFAOYSA-N	-1	0	347.370	3.861	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1ccc(Cl)cc1Cl	ZINC000002385855	563430960	/nfs/dbraw/zinc/43/09/60/563430960.db2.gz	HGGWEUIYPYFHNX-LLVKDONJSA-N	-1	0	348.226	3.904	50	0		EHAARM
CCOC(=O)c1ccccc1[N-]S(=O)(=O)c1c(C)cc(C)cc1C	ZINC000005979502	563556797	/nfs/dbraw/zinc/55/67/97/563556797.db2.gz	RCBIDLXBWWCZCG-UHFFFAOYSA-N	-1	0	347.436	3.589	50	0		EHAARM
COc1ccccc1CNCc1ccc(-c2cccc(C(=O)[O-])c2)o1	ZINC000013690189	563712223	/nfs/dbraw/zinc/71/22/23/563712223.db2.gz	PQMJHXSPBBGMPD-UHFFFAOYSA-N	-1	0	337.375	3.943	50	0		EHAARM
CCCCOc1cc(Br)c(/C=C/C(=O)[O-])cc1OC	ZINC000013747531	563720806	/nfs/dbraw/zinc/72/08/06/563720806.db2.gz	UIAHRTVEKMIQPJ-AATRIKPKSA-N	-1	0	329.190	3.734	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000016087323	563803145	/nfs/dbraw/zinc/80/31/45/563803145.db2.gz	CCPOLNKJWRNYRQ-SSDOTTSWSA-N	-1	0	349.239	3.638	50	0		EHAARM
O=S(=O)([N-]c1ccc(C(F)(F)F)cc1)c1cc(F)cc(F)c1	ZINC000016130127	563804299	/nfs/dbraw/zinc/80/42/99/563804299.db2.gz	RMRIAQTZDQEWPE-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
COc1cc(S(=O)(=O)[N-]c2cnc3ccccc3c2)ccc1Cl	ZINC000016225906	563805994	/nfs/dbraw/zinc/80/59/94/563805994.db2.gz	USQBYSWGPIHTOU-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
COc1ccc(CCn2c(=O)c3cc(C)sc3[n-]c2=S)cc1	ZINC000017068449	563832434	/nfs/dbraw/zinc/83/24/34/563832434.db2.gz	XLWMAEUWNVOYRP-UHFFFAOYSA-N	-1	0	332.450	3.680	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cccc2cc(C)cnc21	ZINC000024250201	563870225	/nfs/dbraw/zinc/87/02/25/563870225.db2.gz	HSNNCUFRXNXNJU-UHFFFAOYSA-N	-1	0	342.420	3.743	50	0		EHAARM
O=c1nc(Nc2ccc(C(F)(F)F)cc2)[n-]nc1-c1ccccc1	ZINC000027300888	563895105	/nfs/dbraw/zinc/89/51/05/563895105.db2.gz	XSFMBAQIMOTAIX-UHFFFAOYSA-N	-1	0	332.285	3.594	50	0		EHAARM
CC1(C)[C@@]2(C(=O)[O-])CC[C@]1(C)[C@H](OC(=O)C(Cl)(Cl)Cl)C2	ZINC000239302620	563898101	/nfs/dbraw/zinc/89/81/01/563898101.db2.gz	FMKGPXSVDZSZAP-HFKOZYHYSA-N	-1	0	343.634	3.569	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1O	ZINC000032627056	563914173	/nfs/dbraw/zinc/91/41/73/563914173.db2.gz	DPALKUVXVQDMCR-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
Cc1ccc(C(C)C)cc1S(=O)(=O)Nc1ccccc1C(=O)[O-]	ZINC000095945909	563977826	/nfs/dbraw/zinc/97/78/26/563977826.db2.gz	AWEDFOFFZLQIOV-UHFFFAOYSA-N	-1	0	333.409	3.617	50	0		EHAARM
O=c1c2ccc(Cl)cc2nc(-c2cccc(C(F)(F)F)c2)n1[O-]	ZINC000005428077	564003872	/nfs/dbraw/zinc/00/38/72/564003872.db2.gz	WLMYZFDFXUHTHH-UHFFFAOYSA-N	-1	0	340.688	3.973	50	0	aggregator	EHAARM
CC(C)OCc1ccc(C(=O)N[C@H](CC(=O)[O-])c2ccccc2)cc1	ZINC000013225108	564019635	/nfs/dbraw/zinc/01/96/35/564019635.db2.gz	QGEWNUIKBHEIAR-GOSISDBHSA-N	-1	0	341.407	3.557	50	0		EHAARM
COc1ccc(NC(=O)C[C@H](C(=O)[O-])[C@H](C)c2ccccc2)cc1	ZINC000000535123	564022066	/nfs/dbraw/zinc/02/20/66/564022066.db2.gz	ZJYVULGZOQUTOO-DYVFJYSZSA-N	-1	0	327.380	3.528	50	0		EHAARM
COc1ccccc1NC(=O)C[C@H](Cc1cc(C)cc(C)c1)C(=O)[O-]	ZINC000005724805	564024101	/nfs/dbraw/zinc/02/41/01/564024101.db2.gz	DYUHVHMVVQNFKA-INIZCTEOSA-N	-1	0	341.407	3.584	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)s1	ZINC000069572886	564031980	/nfs/dbraw/zinc/03/19/80/564031980.db2.gz	IRGYSXZCDAWOOC-UHFFFAOYSA-N	-1	0	336.482	3.848	50	0	in-vitro	EHAARM
O=C([O-])Cc1ccccc1NC(=O)[C@@H]1C[C@@]12CCCc1ccccc12	ZINC000238082912	564051499	/nfs/dbraw/zinc/05/14/99/564051499.db2.gz	LLSCCVUOCFYHFJ-LAUBAEHRSA-N	-1	0	335.403	3.546	50	0		EHAARM
CC(C)CCO[C@@H]1CCN(C(=O)c2ccc3[n-]c(=S)oc3c2)C1	ZINC000083010554	564060277	/nfs/dbraw/zinc/06/02/77/564060277.db2.gz	INWWAGXDKHJRQZ-CYBMUJFWSA-N	-1	0	334.441	3.768	50	0		EHAARM
CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)CCc1ccc(C(=O)[O-])cc1	ZINC000263578890	564060630	/nfs/dbraw/zinc/06/06/30/564060630.db2.gz	TXZSAXWIKQQVBK-ZDUSSCGKSA-N	-1	0	343.345	3.507	50	0		EHAARM
CCc1cccc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c1	ZINC000075351854	564082045	/nfs/dbraw/zinc/08/20/45/564082045.db2.gz	NNOSXYWUXZDXBY-UHFFFAOYSA-N	-1	0	333.438	3.501	50	0		EHAARM
O=S(=O)([N-]c1cccc(Br)c1)c1ccccc1Cl	ZINC000006315667	564084528	/nfs/dbraw/zinc/08/45/28/564084528.db2.gz	CTIGESNASIAEBD-UHFFFAOYSA-N	-1	0	346.633	3.903	50	0		EHAARM
Cc1ccc(C)c(-c2noc(-c3c([O-])c4cc(C)ccc4[nH]c3=O)n2)c1	ZINC000075536689	564087933	/nfs/dbraw/zinc/08/79/33/564087933.db2.gz	ONDRRVVVJIXNBY-UHFFFAOYSA-N	-1	0	347.374	3.876	50	0		EHAARM
Cc1cccc(C(=O)Nc2ccc(N3CCCCC3)cc2C(=O)[O-])c1	ZINC000064588871	564092533	/nfs/dbraw/zinc/09/25/33/564092533.db2.gz	KBQAMCJBAAYLTB-UHFFFAOYSA-N	-1	0	338.407	3.936	50	0		EHAARM
Cc1sc(C)c(S(=O)(=O)[N-]c2ccccc2)c1-c1ccno1	ZINC000064845265	564096858	/nfs/dbraw/zinc/09/68/58/564096858.db2.gz	GBKMTIXHUGWHNA-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3c(C)cccc3C)o2)on1	ZINC000064958415	564098491	/nfs/dbraw/zinc/09/84/91/564098491.db2.gz	RUZQIEYSWPDTFT-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cn(C(C)C)c3ncccc23)cc1	ZINC000065242189	564103368	/nfs/dbraw/zinc/10/33/68/564103368.db2.gz	REGZGRILBXIOKJ-UHFFFAOYSA-N	-1	0	329.425	3.726	50	0		EHAARM
COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)c(F)c1	ZINC000252480848	564119229	/nfs/dbraw/zinc/11/92/29/564119229.db2.gz	CEVUNKNZHYPLRN-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
Cc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)c(S(=O)(=O)[O-])c1	ZINC000002061724	564125015	/nfs/dbraw/zinc/12/50/15/564125015.db2.gz	WWSNDRPGKVZCTQ-UHFFFAOYSA-N	-1	0	347.436	3.792	50	0		EHAARM
Cc1cc(C(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)nn1C(C)(C)C	ZINC000096479722	564148560	/nfs/dbraw/zinc/14/85/60/564148560.db2.gz	JXLBDGLYBRGBJP-UHFFFAOYSA-N	-1	0	335.791	3.550	50	0		EHAARM
O=C([O-])C1CCN(C(=O)Nc2ccccc2Oc2ccccc2)CC1	ZINC000261773876	564149064	/nfs/dbraw/zinc/14/90/64/564149064.db2.gz	XEVMVCZDNDXUPE-UHFFFAOYSA-N	-1	0	340.379	3.807	50	0		EHAARM
CC(=O)c1cccc([N-]S(=O)(=O)c2cccc(Cl)c2Cl)c1	ZINC000002726556	564152304	/nfs/dbraw/zinc/15/23/04/564152304.db2.gz	WDYZBGMTWXNCER-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1cccc(Cl)c1Cl	ZINC000003128517	564155319	/nfs/dbraw/zinc/15/53/19/564155319.db2.gz	WLHGVGYEUCQFHI-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)Nc2ccccc2C(C)C)cc1	ZINC000003258649	564156673	/nfs/dbraw/zinc/15/66/73/564156673.db2.gz	JIUXZTJAEAKLGQ-UHFFFAOYSA-N	-1	0	332.425	3.629	50	0		EHAARM
COc1ccc(CN(C(=O)c2ccc([O-])c(Cl)c2)C2CC2)cc1	ZINC000039980619	564167772	/nfs/dbraw/zinc/16/77/72/564167772.db2.gz	YXPGWUQARNICDZ-UHFFFAOYSA-N	-1	0	331.799	3.859	50	0		EHAARM
COc1ccc(-c2cc(F)ccc2OC[C@@H]2CCOC2)cc1C(=O)[O-]	ZINC000516088712	564177453	/nfs/dbraw/zinc/17/74/53/564177453.db2.gz	JMRLODVRUSURNM-GFCCVEGCSA-N	-1	0	346.354	3.615	50	0		EHAARM
CC(C)c1ccc(NS(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1	ZINC000013345655	601317664	/nfs/dbraw/zinc/31/76/64/601317664.db2.gz	FJQOJYSQWHCAKT-LFYBBSHMSA-N	-1	0	345.420	3.709	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000261841418	967806508	/nfs/dbraw/zinc/80/65/08/967806508.db2.gz	ITKGYNWGAMAILF-UPJWGTAASA-N	-1	0	335.366	3.601	50	0		EHAARM
CC(C)c1nc(/C=C\c2nccn2-c2ccccc2)ncc1C(=O)[O-]	ZINC000519609132	1030326108	/nfs/dbraw/zinc/32/61/08/1030326108.db2.gz	TYCCWODPHYHOSO-HJWRWDBZSA-N	-1	0	334.379	3.654	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)cc1	ZINC000630327398	1137354173	/nfs/dbraw/zinc/35/41/73/1137354173.db2.gz	GBEBGZADEYHDGI-WNRNVDISSA-N	-1	0	339.366	3.756	50	0		EHAARM
CC(C)c1nn(C)c(Cl)c1C(=O)Nc1ccc(/C=C\C(=O)[O-])cc1	ZINC000221915915	1138223439	/nfs/dbraw/zinc/22/34/39/1138223439.db2.gz	IGHRNRIKTFTYNN-TWGQIWQCSA-N	-1	0	347.802	3.547	50	0		EHAARM
Cc1ccc(-n2c([O-])cc(=O)n(-c3ccccc3)c2=S)cc1Cl	ZINC000101150492	219117635	/nfs/dbraw/zinc/11/76/35/219117635.db2.gz	IKNFJADFBUCXOU-UHFFFAOYSA-N	-1	0	344.823	3.703	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@@]1(Cc1ccc(Cl)cc1)C(=O)[O-]	ZINC000004240991	210150274	/nfs/dbraw/zinc/15/02/74/210150274.db2.gz	ITYZUJACZSDOIE-QGZVFWFLSA-N	-1	0	339.819	3.737	50	0		EHAARM
Cc1ccc(C)c(-c2noc(-c3c([O-])c4ccccc4n(C)c3=O)n2)c1	ZINC000101725736	219159102	/nfs/dbraw/zinc/15/91/02/219159102.db2.gz	ADOADACZMMUQJD-UHFFFAOYSA-N	-1	0	347.374	3.578	50	0		EHAARM
CCOc1c(Cl)cccc1NC(=O)CC(CC)(CC)C(=O)[O-]	ZINC000067456195	215148029	/nfs/dbraw/zinc/14/80/29/215148029.db2.gz	TWUIPJMQZFHRMH-UHFFFAOYSA-N	-1	0	327.808	3.958	50	0		EHAARM
CC(C)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000001576238	209761968	/nfs/dbraw/zinc/76/19/68/209761968.db2.gz	UGNIYGNGCNXHTR-GOSISDBHSA-N	-1	0	339.391	3.634	50	0		EHAARM
COc1ccc(NC(=O)C[C@@H](C(=O)[O-])[C@@H](C)c2ccccc2)cc1	ZINC000000535120	209654316	/nfs/dbraw/zinc/65/43/16/209654316.db2.gz	ZJYVULGZOQUTOO-SUMWQHHRSA-N	-1	0	327.380	3.528	50	0		EHAARM
CC[C@@](C)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000036914694	213126506	/nfs/dbraw/zinc/12/65/06/213126506.db2.gz	DZSLHAJXIQCMLR-HXUWFJFHSA-N	-1	0	339.391	3.778	50	0		EHAARM
O=C([O-])[C@@]1(Cc2cccc(Cl)c2)CCCN(c2nccs2)C1	ZINC000071439622	215775870	/nfs/dbraw/zinc/77/58/70/215775870.db2.gz	RZWONPLADZLIAJ-MRXNPFEDSA-N	-1	0	336.844	3.710	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cn2)c(C)c1C	ZINC000000384698	209563909	/nfs/dbraw/zinc/56/39/09/209563909.db2.gz	PRMAUWZBWDVHQK-UHFFFAOYSA-N	-1	0	340.832	3.551	50	0		EHAARM
O=C([O-])/C=C/C(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1	ZINC000000375768	209558861	/nfs/dbraw/zinc/55/88/61/209558861.db2.gz	KWWHTIAWNRGNTM-ONEGZZNKSA-N	-1	0	343.191	3.696	50	0		EHAARM
CCOc1ccc(C)cc1S(=O)(=O)[N-]c1cnc2ccccc2c1	ZINC000072414289	216205038	/nfs/dbraw/zinc/20/50/38/216205038.db2.gz	PPHKISFMXAXHFS-UHFFFAOYSA-N	-1	0	342.420	3.743	50	0		EHAARM
C[C@@H](Oc1ccc2c(c1)occ(-c1ccc(Cl)cc1)c2=O)C(=O)[O-]	ZINC000000065013	209396589	/nfs/dbraw/zinc/39/65/89/209396589.db2.gz	CTMABIYOLDOKQE-SNVBAGLBSA-N	-1	0	344.750	3.965	50	0		EHAARM
CC(C)CC(=O)Nc1ccccc1C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000000053010	209392304	/nfs/dbraw/zinc/39/23/04/209392304.db2.gz	ZHANSMIDARKXBN-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)C[C@@H]2CCCc3ccccc32)C1	ZINC000237958990	242871492	/nfs/dbraw/zinc/87/14/92/242871492.db2.gz	CBKLKLLLLIEKNL-RDJZCZTQSA-N	-1	0	329.440	3.600	50	0		EHAARM
CCOc1ccc(Nc2ncnc3sc(C(=O)[O-])c(C)c32)cc1	ZINC000020328264	212119837	/nfs/dbraw/zinc/11/98/37/212119837.db2.gz	MNIMZVZAVGJJQU-UHFFFAOYSA-N	-1	0	329.381	3.840	50	0		EHAARM
Cc1sc2nc(C)nc(NCc3ccc(C(=O)[O-])cc3)c2c1C	ZINC000020315698	212118686	/nfs/dbraw/zinc/11/86/86/212118686.db2.gz	XGJWYXULROLVAV-UHFFFAOYSA-N	-1	0	327.409	3.927	50	0		EHAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1nc2ccc(C)cc2s1	ZINC000011615533	211226453	/nfs/dbraw/zinc/22/64/53/211226453.db2.gz	KPGDYOUDVRHVEQ-UHFFFAOYSA-N	-1	0	348.449	3.723	50	0		EHAARM
CC(C)CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])cc1	ZINC000009259200	211060195	/nfs/dbraw/zinc/06/01/95/211060195.db2.gz	XXBHSYDLVRHPPG-HZPDHXFCSA-N	-1	0	346.427	3.501	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)C[C@@](C)(C(=O)[O-])c1ccccc1	ZINC000008746172	210998679	/nfs/dbraw/zinc/99/86/79/210998679.db2.gz	DPWAJKNLIJOZRK-GOSISDBHSA-N	-1	0	347.798	3.720	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2cccc(C)n2)c2ccccc12	ZINC000008714952	210986726	/nfs/dbraw/zinc/98/67/26/210986726.db2.gz	AHAJIHVGRWGFMW-UHFFFAOYSA-N	-1	0	342.420	3.743	50	0		EHAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000005051000	210375748	/nfs/dbraw/zinc/37/57/48/210375748.db2.gz	ZPEGVHYKAQIESV-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CC1=C(C)C[C@@H](C(=O)Nc2ccc(F)c(Cl)c2)[C@H](C(=O)[O-])C1	ZINC000004892879	210314930	/nfs/dbraw/zinc/31/49/30/210314930.db2.gz	ZSCYJINYFFACSA-VXGBXAGGSA-N	-1	0	325.767	3.865	50	0		EHAARM
COCc1[n-]n2c(nc(Cc3ccccc3)cc2=O)c1-c1ccccc1	ZINC000102803206	258069743	/nfs/dbraw/zinc/06/97/43/258069743.db2.gz	OJXCXBQJQGGTPG-UHFFFAOYSA-N	-1	0	345.402	3.839	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC000043589641	563913557	/nfs/dbraw/zinc/91/35/57/563913557.db2.gz	PIIMGGRNLYUBAY-JTQLQIEISA-N	-1	0	330.211	3.710	50	0		EHAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2cccc3ccccc32)c1	ZINC000000081701	563218478	/nfs/dbraw/zinc/21/84/78/563218478.db2.gz	GHKSAXKKOIYBOE-UHFFFAOYSA-N	-1	0	343.404	3.658	50	0		EHAARM
O=c1[n-]c(=S)c(SCc2cccc(Oc3ccccc3)c2)n[nH]1	ZINC000000083927	563219784	/nfs/dbraw/zinc/21/97/84/563219784.db2.gz	BFQPTGRBCMFXOK-UHFFFAOYSA-N	-1	0	343.433	3.912	50	0		EHAARM
O=C([O-])c1cc2cc(Br)ccc2c(Br)c1O	ZINC000000156603	563248033	/nfs/dbraw/zinc/24/80/33/563248033.db2.gz	WNMKUIQCIRAXBN-UHFFFAOYSA-N	-1	0	345.974	3.769	50	0		EHAARM
Cc1ccc2nc(C(F)(F)F)cc(N3CCC(C(=O)[O-])CC3)c2c1	ZINC000000171509	563251562	/nfs/dbraw/zinc/25/15/62/563251562.db2.gz	FGKADKFNTDBPEL-UHFFFAOYSA-N	-1	0	338.329	3.863	50	0		EHAARM
O=C([O-])c1ccc2c(c1)C(=O)N(c1ccccc1-c1ccccc1)C2=O	ZINC000000474580	563333520	/nfs/dbraw/zinc/33/35/20/563333520.db2.gz	DZDKMAYGXIAYMZ-UHFFFAOYSA-N	-1	0	343.338	3.852	50	0		EHAARM
Cc1cccc(C(=O)[O-])c1NC(=O)COc1ccc2ccccc2c1	ZINC000001163473	563376599	/nfs/dbraw/zinc/37/65/99/563376599.db2.gz	HPUHNKAYIUJGHB-UHFFFAOYSA-N	-1	0	335.359	3.864	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(OC)c1	ZINC000002985595	563466884	/nfs/dbraw/zinc/46/68/84/563466884.db2.gz	BXINRAIGATXEMP-UHFFFAOYSA-N	-1	0	341.816	3.548	50	0		EHAARM
Cc1c2oc3c(c2cc2c(C)c(CC(=O)[O-])c(=O)oc12)CCCC3	ZINC000005235541	563523700	/nfs/dbraw/zinc/52/37/00/563523700.db2.gz	FWJCITRYQDXYPE-UHFFFAOYSA-N	-1	0	326.348	3.662	50	0		EHAARM
O=c1cc(-c2ccccc2)nc2[n-]c(SCc3ccccc3)nn21	ZINC000008673141	563634981	/nfs/dbraw/zinc/63/49/81/563634981.db2.gz	WGSHEMHWSHZPNU-UHFFFAOYSA-N	-1	0	334.404	3.789	50	0		EHAARM
O=S(=O)(Cc1ccccc1F)[N-]c1ccccc1C(F)(F)F	ZINC000016577291	563814881	/nfs/dbraw/zinc/81/48/81/563814881.db2.gz	JBDWVBLVDRIOHE-UHFFFAOYSA-N	-1	0	333.306	3.786	50	0		EHAARM
CCc1cc2c([n-]c(=S)n(CCc3ccc(OC)cc3)c2=O)s1	ZINC000017072162	563835672	/nfs/dbraw/zinc/83/56/72/563835672.db2.gz	IASVZGKXPFURSM-UHFFFAOYSA-N	-1	0	346.477	3.934	50	0		EHAARM
O=C([O-])C[C@@H](CNC(=O)OCc1ccccc1)c1ccc(Cl)cc1	ZINC000064038028	563956614	/nfs/dbraw/zinc/95/66/14/563956614.db2.gz	SFFATUNMKIFTNL-HNNXBMFYSA-N	-1	0	347.798	3.825	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2ccc(-c3ccccc3F)o2)C1	ZINC000238020140	563962203	/nfs/dbraw/zinc/96/22/03/563962203.db2.gz	HDPUGYLJFWOYGC-CYBMUJFWSA-N	-1	0	345.370	3.803	50	0		EHAARM
Cc1nccc(N2CCC[C@@](C/C=C/c3ccccc3)(C(=O)[O-])C2)n1	ZINC000071767696	563965581	/nfs/dbraw/zinc/96/55/81/563965581.db2.gz	QSKBYULSADLCEJ-MVHVFESUSA-N	-1	0	337.423	3.560	50	0		EHAARM
C[C@H](C(=O)[O-])[C@@H](NC(=O)c1cccc(F)c1Cl)c1ccccc1	ZINC000097018251	563971004	/nfs/dbraw/zinc/97/10/04/563971004.db2.gz	VKTHABRYKXGGHC-ZUZCIYMTSA-N	-1	0	335.762	3.671	50	0		EHAARM
COc1ccc(OCc2oc3ccc(OC)cc3c2C(=O)[O-])cc1	ZINC000000118659	563986716	/nfs/dbraw/zinc/98/67/16/563986716.db2.gz	LUKHXNMIVRBLQT-UHFFFAOYSA-N	-1	0	328.320	3.727	50	0		EHAARM
CCOc1ccc2nc([N-]S(=O)(=O)c3cccc(C)c3)sc2c1	ZINC000033707576	563993891	/nfs/dbraw/zinc/99/38/91/563993891.db2.gz	JWVBHIVGIJGAAL-UHFFFAOYSA-N	-1	0	348.449	3.804	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC000238018597	563994402	/nfs/dbraw/zinc/99/44/02/563994402.db2.gz	XYBXGNSUMAKHOY-LLVKDONJSA-N	-1	0	335.787	3.803	50	0		EHAARM
O=C([O-])C1CCN(C(=O)c2cc(-c3ccccc3)ccc2Cl)CC1	ZINC000238033981	563994440	/nfs/dbraw/zinc/99/44/40/563994440.db2.gz	PWWDWLLPYDYYPG-UHFFFAOYSA-N	-1	0	343.810	3.944	50	0		EHAARM
CCOc1cc2[n-]c(=S)n(CCC(C)C)c(=O)c2cc1OCC	ZINC000000425113	563998576	/nfs/dbraw/zinc/99/85/76/563998576.db2.gz	RIFNMZMPDSNVRR-UHFFFAOYSA-N	-1	0	336.457	3.903	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000000484061	564012457	/nfs/dbraw/zinc/01/24/57/564012457.db2.gz	QWHZBNHBBJIOFC-NXEZZACHSA-N	-1	0	338.816	3.779	50	0		EHAARM
COc1ccc(C([O-])=CS(=O)(=O)c2ccc3ccccc3c2)cc1	ZINC000000617806	564012901	/nfs/dbraw/zinc/01/29/01/564012901.db2.gz	ONULOLRSJBLZFQ-UHFFFAOYSA-N	-1	0	340.400	3.505	50	0		EHAARM
COc1ccc(Cc2nnc(Nc3cccc(Cl)c3)[n-]c2=O)cc1	ZINC000018206559	564018813	/nfs/dbraw/zinc/01/88/13/564018813.db2.gz	RONMSECKSMCLKG-UHFFFAOYSA-N	-1	0	342.786	3.574	50	0		EHAARM
Cc1nc2[n-]c(CCc3ccccc3)nn2c(=O)c1Cc1ccccc1	ZINC000018219921	564018872	/nfs/dbraw/zinc/01/88/72/564018872.db2.gz	YJZDCNOQJQLOAD-UHFFFAOYSA-N	-1	0	344.418	3.514	50	0		EHAARM
O=C(Nc1cccc(C(F)(F)F)c1)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102728296	564020488	/nfs/dbraw/zinc/02/04/88/564020488.db2.gz	HSQISIYJPMQELC-BUHFOSPRSA-N	-1	0	348.280	3.565	50	0		EHAARM
Cn1nccc1/C=C(\CCCC(=O)[O-])c1nc2ccccc2s1	ZINC000045111072	564028159	/nfs/dbraw/zinc/02/81/59/564028159.db2.gz	MOECLDFKDYSZJS-VAWYXSNFSA-N	-1	0	327.409	3.825	50	0		EHAARM
CSc1ccc(/C=C\C(=O)c2cccc(OCC(=O)[O-])c2)cc1	ZINC000096032386	564045911	/nfs/dbraw/zinc/04/59/11/564045911.db2.gz	TVDWECQLLXDOTH-YFHOEESVSA-N	-1	0	328.389	3.768	50	0		EHAARM
O=C([O-])c1cc(-c2cccnc2)nn1-c1cccc(C(F)(F)F)c1	ZINC000005783248	564051240	/nfs/dbraw/zinc/05/12/40/564051240.db2.gz	IRPIGRIVLMLCIQ-UHFFFAOYSA-N	-1	0	333.269	3.651	50	0		EHAARM
O=C([O-])C1CCC(NC(=O)Nc2ccc(-c3nccs3)cc2)CC1	ZINC000263487888	564056378	/nfs/dbraw/zinc/05/63/78/564056378.db2.gz	NMHHUAKBRNDXTD-UHFFFAOYSA-N	-1	0	345.424	3.575	50	0		EHAARM
Cc1c(CC(=O)[O-])c2cc(O)ccc2n1C(=O)c1ccc(Cl)cc1	ZINC000006068955	564079302	/nfs/dbraw/zinc/07/93/02/564079302.db2.gz	KMLNWQPYFBIALN-UHFFFAOYSA-N	-1	0	343.766	3.624	50	0	world	EHAARM
Cc1ccc2oc(-c3ccccc3Cl)c(OCC(=O)[O-])c(=O)c2c1	ZINC000001941978	564090315	/nfs/dbraw/zinc/09/03/15/564090315.db2.gz	ITTHUPDPXUOBLQ-UHFFFAOYSA-N	-1	0	344.750	3.885	50	0		EHAARM
CCn1nccc1-c1csc(S(=O)(=O)[N-]c2ccc(C)cc2)c1	ZINC000065112438	564101282	/nfs/dbraw/zinc/10/12/82/564101282.db2.gz	YDDBBUYIQJTBFI-UHFFFAOYSA-N	-1	0	347.465	3.741	50	0		EHAARM
O=C([O-])c1cccc(Nc2ncc(F)c(Nc3ccc(O)cc3)n2)c1	ZINC000170621835	564110238	/nfs/dbraw/zinc/11/02/38/564110238.db2.gz	MUCJXTRCUZYBGR-UHFFFAOYSA-N	-1	0	340.314	3.507	50	0		EHAARM
CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1n[nH]c2ccccc21	ZINC000076061723	564115192	/nfs/dbraw/zinc/11/51/92/564115192.db2.gz	HUDRWCKFJMRBSK-UHFFFAOYSA-N	-1	0	329.425	3.661	50	0		EHAARM
CCc1ccc(NC(=O)CSc2nc(=O)c3sccc3[n-]2)cc1	ZINC000057477622	564154441	/nfs/dbraw/zinc/15/44/41/564154441.db2.gz	BTOVYDQQKDGCMI-UHFFFAOYSA-N	-1	0	345.449	3.690	50	0		EHAARM
CC(C)c1ccc(/C=C/C(=O)Nc2ccc(O)c(C(=O)[O-])c2)cc1	ZINC000003196368	564155858	/nfs/dbraw/zinc/15/58/58/564155858.db2.gz	VMLORMLJLIAXRK-BJMVGYQFSA-N	-1	0	325.364	3.866	50	0		EHAARM
CCN(CC)c1ccc(NC(=O)c2ccc(C)cc2)cc1C(=O)[O-]	ZINC000058065115	564157387	/nfs/dbraw/zinc/15/73/87/564157387.db2.gz	GCSHAPOUCNEGCT-UHFFFAOYSA-N	-1	0	326.396	3.792	50	0		EHAARM
Cc1cc(C)n(-c2ccccc2[N-]S(=O)(=O)c2ccc(C)s2)n1	ZINC000032086728	564160623	/nfs/dbraw/zinc/16/06/23/564160623.db2.gz	MLOZDMHSVJWXLE-UHFFFAOYSA-N	-1	0	347.465	3.660	50	0		EHAARM
CC(C)N(CC(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000070915500	564174498	/nfs/dbraw/zinc/17/44/98/564174498.db2.gz	PMFFZLSLIXEBNG-UHFFFAOYSA-N	-1	0	339.391	3.731	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N(Cc2ccc(F)cc2)CC2CC2)s1	ZINC000237965330	600621637	/nfs/dbraw/zinc/62/16/37/600621637.db2.gz	WSZNRJNMCZHBIA-UHFFFAOYSA-N	-1	0	333.384	3.638	50	0		EHAARM
O=C([O-])c1ccccc1NN=Cc1c(F)c(F)c(F)c(F)c1F	ZINC000254287123	605097544	/nfs/dbraw/zinc/09/75/44/605097544.db2.gz	KAVZBQFODLIOHR-UHFFFAOYSA-N	-1	0	330.212	3.526	50	0		EHAARM
Cc1ccc(CN(C(=O)c2ccc(C(=O)[O-])cc2F)C(C)C)s1	ZINC000262418913	961709778	/nfs/dbraw/zinc/70/97/78/961709778.db2.gz	QFVKPSLJDBDCRV-UHFFFAOYSA-N	-1	0	335.400	3.945	50	0		EHAARM
C[C@@H]1C[C@H]1c1ccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)[O-])cc2)o1	ZINC000170595362	1033285039	/nfs/dbraw/zinc/28/50/39/1033285039.db2.gz	QBPSNAIFROBBJO-FPODFMBDSA-N	-1	0	336.347	3.647	50	0		EHAARM
Cc1cc(Cl)ccc1C=Cc1nc(C)c(CCC(=O)[O-])c(=O)[nH]1	ZINC000342255568	1028516077	/nfs/dbraw/zinc/51/60/77/1028516077.db2.gz	BFNMSGJEQISPLG-DAXSKMNVSA-N	-1	0	332.787	3.640	50	0		EHAARM
O=C([O-])c1cn2c(n1)[C@@H](c1ccccc1)N(CC1CCCCC1)CC2	ZINC000675013695	1039850565	/nfs/dbraw/zinc/85/05/65/1039850565.db2.gz	BGMJUKFQEKCPCT-GOSISDBHSA-N	-1	0	339.439	3.567	50	0		EHAARM
CC(C)c1ncc(Cl)c(C(=O)Nc2ccc(/C=C\C(=O)[O-])cc2)n1	ZINC000324453761	1121890062	/nfs/dbraw/zinc/89/00/62/1121890062.db2.gz	WKJRWYKVWBOJMH-YVMONPNESA-N	-1	0	345.786	3.604	50	0		EHAARM
CC(C)OCc1ccc(CNC(=O)c2ccc([O-])c(Cl)c2)cc1	ZINC000053799748	214198527	/nfs/dbraw/zinc/19/85/27/214198527.db2.gz	MBIKWYFXKMFIMC-UHFFFAOYSA-N	-1	0	333.815	3.901	50	0		EHAARM
O=C(C[C@H]1CC[C@H](C(=O)[O-])CC1)c1cccc(Br)c1	ZINC000100449822	219099953	/nfs/dbraw/zinc/09/99/53/219099953.db2.gz	COTXSNAGEWJUML-PHIMTYICSA-N	-1	0	325.202	3.913	50	0		EHAARM
C[C@@H](NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O)c1cccc(F)c1	ZINC000047054370	213829222	/nfs/dbraw/zinc/82/92/22/213829222.db2.gz	QWOAPIIJAJTSDP-SECBINFHSA-N	-1	0	343.383	3.628	50	0		EHAARM
O=C(Nc1cc(Cl)ccc1O)c1snnc1-c1ccccc1	ZINC000004050405	210107160	/nfs/dbraw/zinc/10/71/60/210107160.db2.gz	SPSPOWPZVGSPNH-UHFFFAOYSA-N	-1	0	331.784	3.816	50	0		EHAARM
O=C([O-])c1cn(-c2cccc(C(F)(F)F)c2)nc1-c1ccncc1	ZINC000004051546	210109373	/nfs/dbraw/zinc/10/93/73/210109373.db2.gz	UMVIVXCLJKIXTC-UHFFFAOYSA-N	-1	0	333.269	3.651	50	0		EHAARM
CSc1ccc(/C=C/c2nc(N)nc(-c3ccccc3[O-])n2)cc1	ZINC000003906353	210090081	/nfs/dbraw/zinc/09/00/81/210090081.db2.gz	OCTUFSNAQJJJMK-DHZHZOJOSA-N	-1	0	336.420	3.719	50	0		EHAARM
Cc1cc(OCc2ccc(C(=O)[O-])o2)c2c(C)c(C)c(=O)oc2c1	ZINC000040310318	213291049	/nfs/dbraw/zinc/29/10/49/213291049.db2.gz	OKUGFHVUQJMROA-UHFFFAOYSA-N	-1	0	328.320	3.588	50	0	biogenic	EHAARM
CC[C@@H](C)Sc1nc2ccc(NC(=O)/C=C/C(=O)[O-])cc2s1	ZINC000001573708	209759819	/nfs/dbraw/zinc/75/98/19/209759819.db2.gz	ZYNLXGWOIYOXPN-XCODYQFDSA-N	-1	0	336.438	3.766	50	0		EHAARM
Cc1cc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)c(C)s1	ZINC000040158018	213275520	/nfs/dbraw/zinc/27/55/20/213275520.db2.gz	OLFORPSPDCCPCI-UHFFFAOYSA-N	-1	0	345.829	3.517	50	0		EHAARM
Cc1ccc([C@H]([N-]S(=O)(=O)c2ccc(C)cc2)C(F)(F)F)cc1	ZINC000040155821	213274481	/nfs/dbraw/zinc/27/44/81/213274481.db2.gz	KNFOOSXEQQDMCJ-HNNXBMFYSA-N	-1	0	343.370	3.885	50	0		EHAARM
CC(C)(C)OC(=O)N1[C@@H](C(=O)[O-])CS[C@H]1c1ccc(Cl)cc1	ZINC000001406899	209742974	/nfs/dbraw/zinc/74/29/74/209742974.db2.gz	MCVPXTHCXZFQMW-NEPJUHHUSA-N	-1	0	343.832	3.776	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cc1)c1ccc(-c2ccno2)s1	ZINC000036360628	213090831	/nfs/dbraw/zinc/09/08/31/213090831.db2.gz	QQTXRPXXLVYEBL-UHFFFAOYSA-N	-1	0	340.813	3.857	50	0		EHAARM
Cc1ccc(C2(C(=O)N3CC[C@@H](c4ccccc4C(=O)[O-])C3)CC2)cc1	ZINC000072129111	216018963	/nfs/dbraw/zinc/01/89/63/216018963.db2.gz	NZJJOIDUZWPSOO-MRXNPFEDSA-N	-1	0	349.430	3.741	50	0		EHAARM
O=C([O-])c1cccc(-c2cc(NCc3ccccn3)nc3[nH]ccc32)c1	ZINC000072162059	216050760	/nfs/dbraw/zinc/05/07/60/216050760.db2.gz	QGKNOJASWSJFBH-UHFFFAOYSA-N	-1	0	344.374	3.935	50	0		EHAARM
O=C([O-])c1nn2c(c1Cl)N[C@H](c1ccccc1)C[C@@H]2C(F)(F)F	ZINC000000226828	209497278	/nfs/dbraw/zinc/49/72/78/209497278.db2.gz	RQMWBEVLHVOEIT-DTWKUNHWSA-N	-1	0	345.708	3.895	50	0		EHAARM
O=C([O-])c1cnn2c1N[C@@H](c1ccc(Cl)cc1)C[C@@H]2C(F)(F)F	ZINC000020616580	212156421	/nfs/dbraw/zinc/15/64/21/212156421.db2.gz	ITJQPWGJQGPSCV-GHMZBOCLSA-N	-1	0	345.708	3.895	50	0		EHAARM
O=S(=O)(C=C([O-])c1ccc2c(c1)Cc1ccccc1-2)c1ccccc1	ZINC000019854874	212076809	/nfs/dbraw/zinc/07/68/09/212076809.db2.gz	DPIXLKMLQGDVMQ-UHFFFAOYSA-N	-1	0	348.423	3.914	50	0		EHAARM
COc1cc(C(=O)[O-])ccc1OCc1ccc(Br)s1	ZINC000019427451	212027610	/nfs/dbraw/zinc/02/76/10/212027610.db2.gz	GJPTXIFDAOSQGJ-UHFFFAOYSA-N	-1	0	343.198	3.796	50	0		EHAARM
Cc1cc(N[C@H](C)c2nnc(C(C)C)o2)nc(-c2ccccc2[O-])n1	ZINC000091391451	218001453	/nfs/dbraw/zinc/00/14/53/218001453.db2.gz	APQFPDDNJAYZJZ-GFCCVEGCSA-N	-1	0	339.399	3.837	50	0		EHAARM
O=C([O-])c1cc(-c2cccc(O)c2)nc2[nH]c(-c3ccccc3)nc21	ZINC000011694707	211236661	/nfs/dbraw/zinc/23/66/61/211236661.db2.gz	JWXWIUQVEARTJJ-UHFFFAOYSA-N	-1	0	331.331	3.696	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3cc(C)ccc3C)s2)n[nH]1	ZINC000009686483	211114103	/nfs/dbraw/zinc/11/41/03/211114103.db2.gz	CTKFFRHAHKCLGI-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
O=C([O-])c1nc(-c2ccccc2)n(-c2ccc(Cl)c(Cl)c2)n1	ZINC000008730870	210993715	/nfs/dbraw/zinc/99/37/15/210993715.db2.gz	NBMHFHYCEONBKN-UHFFFAOYSA-N	-1	0	334.162	3.939	50	0		EHAARM
O=C([O-])c1ccc(Cl)cc1NC(=O)COc1ccc(Cl)cc1	ZINC000005649550	210508658	/nfs/dbraw/zinc/50/86/58/210508658.db2.gz	VBGQKQYRWFJVKQ-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
CC(C)(C(=O)[O-])c1ccc(NC(=O)Cc2cc(F)ccc2F)cc1	ZINC000097018973	218916262	/nfs/dbraw/zinc/91/62/62/218916262.db2.gz	WZFHVTFAGOPQOB-UHFFFAOYSA-N	-1	0	333.334	3.508	50	0		EHAARM
CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000005008213	210359773	/nfs/dbraw/zinc/35/97/73/210359773.db2.gz	PIPHJIAVRSNMCM-ZYHUDNBSSA-N	-1	0	328.195	3.915	50	0		EHAARM
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1cccc(C(=O)[O-])c1	ZINC000004808945	210282218	/nfs/dbraw/zinc/28/22/18/210282218.db2.gz	RKLWOIGJWSKHRT-NSHDSACASA-N	-1	0	333.771	3.753	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc2oc3c(c2c1)CCCC3	ZINC000004788688	210278422	/nfs/dbraw/zinc/27/84/22/210278422.db2.gz	VLLLKBSANCJDDA-CABCVRRESA-N	-1	0	339.391	3.917	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)C[C@@H]1CCCc2ccccc21)c1ccccc1	ZINC000237936101	257944010	/nfs/dbraw/zinc/94/40/10/257944010.db2.gz	MDCJHWGHEMBBKT-HKUYNNGSSA-N	-1	0	337.419	3.829	50	0		EHAARM
Cc1oc(CN(C)C(=O)C2(c3ccc(F)cc3)CCC2)cc1C(=O)[O-]	ZINC000299749269	258007753	/nfs/dbraw/zinc/00/77/53/258007753.db2.gz	JTROUPWKKKMITH-UHFFFAOYSA-N	-1	0	345.370	3.506	50	0		EHAARM
Cc1ccc([C@@H]2C[C@@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1	ZINC000000226864	563263142	/nfs/dbraw/zinc/26/31/42/563263142.db2.gz	BRZQPRHKSQMCSZ-RYUDHWBXSA-N	-1	0	325.290	3.550	50	0		EHAARM
CCCCCCc1cc2c3c(c(=O)oc2cc1OCC(=O)[O-])CCC3	ZINC000002062433	563420407	/nfs/dbraw/zinc/42/04/07/563420407.db2.gz	XZGWETNMPTWLIL-UHFFFAOYSA-N	-1	0	344.407	3.868	50	0		EHAARM
CCc1ccccc1NS(=O)(=O)c1ccc(Br)cc1	ZINC000003196107	563476475	/nfs/dbraw/zinc/47/64/75/563476475.db2.gz	BYRYLLGCFCTYAB-UHFFFAOYSA-N	-1	0	340.242	3.812	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccccc2Br)c1	ZINC000007052668	563594285	/nfs/dbraw/zinc/59/42/85/563594285.db2.gz	IAQMLNLFGBSGMP-UHFFFAOYSA-N	-1	0	326.215	3.558	50	0		EHAARM
Cc1cccc(-c2nc3ccc(NC(=O)CCCC(=O)[O-])cc3o2)c1	ZINC000013955178	563732852	/nfs/dbraw/zinc/73/28/52/563732852.db2.gz	YRZMLJLYPMANSZ-UHFFFAOYSA-N	-1	0	338.363	3.997	50	0		EHAARM
Cc1cc(C(=O)[O-])ccc1-c1ccc(/C=C2\SC(=O)N(C)C2=O)o1	ZINC000015799625	563792668	/nfs/dbraw/zinc/79/26/68/563792668.db2.gz	RXGXTXPZYDROQY-ZSOIEALJSA-N	-1	0	343.360	3.619	50	0		EHAARM
CC(C)(C)c1nnc(Nc2ccc(Nc3ccccc3)cc2)[n-]c1=O	ZINC000016777031	563822938	/nfs/dbraw/zinc/82/29/38/563822938.db2.gz	TVMKVKCMHKSCBC-UHFFFAOYSA-N	-1	0	335.411	3.950	50	0		EHAARM
Cc1cccc2sc(NC(=O)CC3(CC(=O)[O-])CCCC3)nc21	ZINC000017068367	563832394	/nfs/dbraw/zinc/83/23/94/563832394.db2.gz	DVOLIZWSCVJKSO-UHFFFAOYSA-N	-1	0	332.425	3.968	50	0		EHAARM
Cc1nn(-c2ccc(F)cc2)c2nc(C)c(CCC(=O)[O-])c(C)c12	ZINC000026421234	563891803	/nfs/dbraw/zinc/89/18/03/563891803.db2.gz	WCQDBBYWDVLGJC-UHFFFAOYSA-N	-1	0	327.359	3.502	50	0		EHAARM
C[C@]1(C(=O)[O-])CCN(C(=O)c2ccc(-c3ccccc3Cl)o2)C1	ZINC000269022393	563913341	/nfs/dbraw/zinc/91/33/41/563913341.db2.gz	IUWIMUHPHFNBRA-KRWDZBQOSA-N	-1	0	333.771	3.537	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1ccc(C)c(C)c1	ZINC000032971318	563920083	/nfs/dbraw/zinc/92/00/83/563920083.db2.gz	ACACXQSXRFXWEH-UHFFFAOYSA-N	-1	0	332.381	3.661	50	0		EHAARM
O=S(=O)([O-])c1cccc(Nc2ccnc3cc(Cl)ccc32)c1	ZINC000071770821	563965646	/nfs/dbraw/zinc/96/56/46/563965646.db2.gz	NZSGUYZDIYULJR-UHFFFAOYSA-N	-1	0	334.784	3.879	50	0		EHAARM
Cc1ccc(NC(=O)c2nc[n-]c2C(=O)Nc2ccc(C)cc2)cc1	ZINC000000187838	563987996	/nfs/dbraw/zinc/98/79/96/563987996.db2.gz	GCAIHYMXLHPWPZ-UHFFFAOYSA-N	-1	0	334.379	3.531	50	0		EHAARM
O=C([O-])CCC(=O)Nc1ccc(-c2nc3ccc(Cl)cc3o2)cc1	ZINC000000226979	563988936	/nfs/dbraw/zinc/98/89/36/563988936.db2.gz	JEZZLWZUEPOHPR-UHFFFAOYSA-N	-1	0	344.754	3.952	50	0		EHAARM
Cc1nc2sc3c(c2c(N[C@H](CC(C)C)C(=O)[O-])n1)CCCC3	ZINC000000237042	563989062	/nfs/dbraw/zinc/98/90/62/563989062.db2.gz	AHUGUMBYIFEESI-GFCCVEGCSA-N	-1	0	333.457	3.790	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2OC)cc1	ZINC000000479536	564013382	/nfs/dbraw/zinc/01/33/82/564013382.db2.gz	GOXLUATZKAFRAJ-UHFFFAOYSA-N	-1	0	341.816	3.548	50	0		EHAARM
CCc1cc2c(cc1[O-])oc(C)c(-c1ccc3c(c1)OCCO3)c2=O	ZINC000005686748	564018744	/nfs/dbraw/zinc/01/87/44/564018744.db2.gz	LMITXBAIZCENSG-UHFFFAOYSA-N	-1	0	338.359	3.808	50	0	biogenic	EHAARM
COc1ccc(CSCc2nc(=O)c3sccc3[n-]2)cc1F	ZINC000012569688	564059841	/nfs/dbraw/zinc/05/98/41/564059841.db2.gz	IMEUWWKAIKVJSN-UHFFFAOYSA-N	-1	0	336.413	3.566	50	0		EHAARM
COc1cc(OC)cc(-c2n[nH]c(=S)n2CCc2ccccc2)c1	ZINC000001246959	564062696	/nfs/dbraw/zinc/06/26/96/564062696.db2.gz	ZYSWAFQRTWGEHE-UHFFFAOYSA-N	-1	0	341.436	3.868	50	0		EHAARM
O=C([O-])[C@H](CC(=O)Nc1cccc(Br)c1)c1ccccc1	ZINC000012696622	564063395	/nfs/dbraw/zinc/06/33/95/564063395.db2.gz	NUAKBFXQQQRJDZ-CQSZACIVSA-N	-1	0	348.196	3.646	50	0		EHAARM
CCc1ccc([C@@H]([NH2+]CCc2ccccc2C)P(=O)([O-])[O-])cc1	ZINC000012949471	564079819	/nfs/dbraw/zinc/07/98/19/564079819.db2.gz	ARCMVNIYOPROKV-SFHVURJKSA-N	-1	0	333.368	3.566	50	0		EHAARM
COc1ccc(OC)c(-c2noc([N-]c3ccc(F)cc3F)n2)c1	ZINC000075403063	564084003	/nfs/dbraw/zinc/08/40/03/564084003.db2.gz	KXKYWFORTZSIEV-UHFFFAOYSA-N	-1	0	333.294	3.776	50	0		EHAARM
CC(C)(C)N(Cc1ccc(Cl)cc1Cl)C(=O)/C=C/C(=O)[O-]	ZINC000001951065	564090365	/nfs/dbraw/zinc/09/03/65/564090365.db2.gz	XOVLUCLWQARXCB-VOTSOKGWSA-N	-1	0	330.211	3.761	50	0		EHAARM
Cc1nnc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)c(C)c3)s2)o1	ZINC000064920025	564097688	/nfs/dbraw/zinc/09/76/88/564097688.db2.gz	BQNNZIACNLEJIQ-UHFFFAOYSA-N	-1	0	349.437	3.524	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2cn(CC(C)C)c3ncccc23)cc1	ZINC000065242284	564103413	/nfs/dbraw/zinc/10/34/13/564103413.db2.gz	DWHXGCYHAAGWPY-UHFFFAOYSA-N	-1	0	343.452	3.802	50	0		EHAARM
CN(CCCn1c(=O)c2ccccc2[n-]c1=S)c1ccccc1	ZINC000007047150	564103605	/nfs/dbraw/zinc/10/36/05/564103605.db2.gz	LXGBGEUMLQJUPQ-UHFFFAOYSA-N	-1	0	325.437	3.586	50	0		EHAARM
Cc1ccc(-c2[nH]nc([N-]S(=O)(=O)c3cc(C)ccc3C)c2C)o1	ZINC000089624108	564112791	/nfs/dbraw/zinc/11/27/91/564112791.db2.gz	WHAWMLFMADAGQH-UHFFFAOYSA-N	-1	0	345.424	3.704	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1	ZINC000225457956	564134972	/nfs/dbraw/zinc/13/49/72/564134972.db2.gz	QACNYQXWKWFVLQ-GOSISDBHSA-N	-1	0	341.382	3.820	50	0		EHAARM
O=C([O-])c1cccn1C1CCN(C(=O)c2ccc3ccccc3c2)CC1	ZINC000095958436	564142597	/nfs/dbraw/zinc/14/25/97/564142597.db2.gz	ZHNDFRUKTROVKU-UHFFFAOYSA-N	-1	0	348.402	3.817	50	0		EHAARM
COc1ccccc1S(=O)(=O)[N-]c1nc2c(cc(C)cc2C)s1	ZINC000002638134	564151600	/nfs/dbraw/zinc/15/16/00/564151600.db2.gz	SYWCFNLPYQLCSN-UHFFFAOYSA-N	-1	0	348.449	3.723	50	0		EHAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000003138914	564155417	/nfs/dbraw/zinc/15/54/17/564155417.db2.gz	WUKLUOSTPCFFMO-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
CC[C@H](C)c1ccc(Cn2c3ccccc3nc2S(=O)(=O)[O-])cc1	ZINC000031903433	564160156	/nfs/dbraw/zinc/16/01/56/564160156.db2.gz	VBPMUPGCOFGSTM-ZDUSSCGKSA-N	-1	0	344.436	3.845	50	0		EHAARM
O=S(=O)([N-]c1ccccc1C(F)(F)F)c1ccc(F)cc1F	ZINC000008195492	564163528	/nfs/dbraw/zinc/16/35/28/564163528.db2.gz	QMVXFJSHKXKFJT-UHFFFAOYSA-N	-1	0	337.269	3.784	50	0		EHAARM
Cc1ccc(C)c([C@@H](C)NC(=O)C[C@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000008388748	564164887	/nfs/dbraw/zinc/16/48/87/564164887.db2.gz	FEUVPANUXSVSBS-IERDGZPVSA-N	-1	0	339.435	3.913	50	0		EHAARM
O=S(=O)([N-]c1nc2c(cccc2F)s1)c1ccc(Cl)cc1	ZINC000008864668	564167506	/nfs/dbraw/zinc/16/75/06/564167506.db2.gz	GXSZDGMLIZJOMF-UHFFFAOYSA-N	-1	0	342.804	3.890	50	0		EHAARM
CC(C)n1ncc2cc(/C=C/c3ncc(C(=O)[O-])s3)c(Cl)nc21	ZINC000095959437	599907508	/nfs/dbraw/zinc/90/75/08/599907508.db2.gz	QFSZGLLFCLPDOR-ONEGZZNKSA-N	-1	0	348.815	3.991	50	0		EHAARM
CCCOc1cccc(C(=O)N2CC[C@H](C(=O)[O-])c3ccccc32)c1	ZINC000327542361	951115972	/nfs/dbraw/zinc/11/59/72/951115972.db2.gz	VPQFUICDXKQZHA-KRWDZBQOSA-N	-1	0	339.391	3.694	50	0		EHAARM
CCc1ccc([C@H]2CCCN2C(=O)N=c2nc(C(C)(C)C)[n-]s2)o1	ZINC000331694540	1041070688	/nfs/dbraw/zinc/07/06/88/1041070688.db2.gz	YSIQTMRMWSFODN-GFCCVEGCSA-N	-1	0	348.472	3.782	50	0		EHAARM
COc1ccccc1-c1ccc([C@H](C)NC(=O)C(C)(C)C(=O)[O-])cc1	ZINC000579957081	1132116423	/nfs/dbraw/zinc/11/64/23/1132116423.db2.gz	XPWMFLMPPVECNF-ZDUSSCGKSA-N	-1	0	341.407	3.650	50	0		EHAARM
O=C([O-])[C@@H](CNC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)C1CCCCC1	ZINC000630266010	1137352585	/nfs/dbraw/zinc/35/25/85/1137352585.db2.gz	XLYCYYMGZBFDHN-MJBXVCDLSA-N	-1	0	349.393	3.752	50	0		EHAARM
CCCOc1ccc([C@@H](CC(=O)[O-])NC(=O)c2cccc(C)c2)cc1	ZINC000003623650	210068554	/nfs/dbraw/zinc/06/85/54/210068554.db2.gz	ALORHDQVCRIEBJ-GOSISDBHSA-N	-1	0	341.407	3.730	50	0		EHAARM
O=C([O-])c1ccc(-c2csc(-n3nccc3C(F)(F)F)n2)cc1	ZINC000044676284	213641064	/nfs/dbraw/zinc/64/10/64/213641064.db2.gz	BYGBEBYGFUYDOF-UHFFFAOYSA-N	-1	0	339.298	3.713	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000002747129	209900388	/nfs/dbraw/zinc/90/03/88/209900388.db2.gz	LLRZMGIWYNSYSC-QWHCGFSZSA-N	-1	0	346.383	3.555	50	0		EHAARM
O=C([O-])CCC(=O)CNc1cn(Cc2ccccc2)c2ccccc12	ZINC000002262598	209835562	/nfs/dbraw/zinc/83/55/62/209835562.db2.gz	RKLIFVHOJDXYKA-UHFFFAOYSA-N	-1	0	336.391	3.535	50	0		EHAARM
Cc1ccc(/C=C/c2nc3ccccc3c(=O)n2CCC(=O)[O-])cc1C	ZINC000040139850	213271156	/nfs/dbraw/zinc/27/11/56/213271156.db2.gz	MMBKVYRYRRMLKN-MDZDMXLPSA-N	-1	0	348.402	3.658	50	0		EHAARM
O=C1CCCc2oc3ccc([N-]S(=O)(=O)c4cccs4)cc3c21	ZINC000000793395	209686604	/nfs/dbraw/zinc/68/66/04/209686604.db2.gz	AKCIYYAZTIKGOL-UHFFFAOYSA-N	-1	0	347.417	3.814	50	0		EHAARM
CC(C)(C(=O)N1CC[C@H](c2ccccc2C(=O)[O-])C1)c1ccccc1	ZINC000072123907	216016657	/nfs/dbraw/zinc/01/66/57/216016657.db2.gz	ONDIDBNZMPISDT-HNNXBMFYSA-N	-1	0	337.419	3.679	50	0		EHAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(Cc2ccccc2)C12CCCC2	ZINC000030822672	212711138	/nfs/dbraw/zinc/71/11/38/212711138.db2.gz	MOWXAAQSBVCOGG-GOSISDBHSA-N	-1	0	335.403	3.824	50	0		EHAARM
Cc1cc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])ccc1Br	ZINC000000402029	209569674	/nfs/dbraw/zinc/56/96/74/209569674.db2.gz	GBXVFMOXCSZQBR-NEPJUHHUSA-N	-1	0	340.217	3.587	50	0		EHAARM
CCC(=O)Nc1cc(C(=O)[O-])ccc1Sc1ccc(OC)cc1	ZINC000000257735	209506972	/nfs/dbraw/zinc/50/69/72/209506972.db2.gz	JVCLWBLSBXUFEL-UHFFFAOYSA-N	-1	0	331.393	3.893	50	0		EHAARM
Cc1sc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204908	209483173	/nfs/dbraw/zinc/48/31/73/209483173.db2.gz	OAJOTIZEIAAZEE-ZIAGYGMSSA-N	-1	0	344.436	3.948	50	0		EHAARM
O=C([O-])c1cn2c(ccc3c(C(F)(F)F)cc(C(F)(F)F)nc32)n1	ZINC000000167468	209460500	/nfs/dbraw/zinc/46/05/00/209460500.db2.gz	WUPWHEKPOBYAMX-UHFFFAOYSA-N	-1	0	349.190	3.618	50	0		EHAARM
CCOC(=O)c1cnc2ccccc2c1Nc1cccc(C(=O)[O-])c1	ZINC000000090642	209413930	/nfs/dbraw/zinc/41/39/30/209413930.db2.gz	XUYVGJFQQIITNE-UHFFFAOYSA-N	-1	0	336.347	3.853	50	0		EHAARM
O=C([O-])c1ccc(-c2cc(NCc3ccccn3)nc3[nH]ccc32)cc1	ZINC000072478754	216256702	/nfs/dbraw/zinc/25/67/02/216256702.db2.gz	IQTQTESFKUSNSA-UHFFFAOYSA-N	-1	0	344.374	3.935	50	0		EHAARM
C[C@@H](NC(=O)c1ccc([O-])c(Cl)c1)c1ccc(-n2ccnc2)cc1	ZINC000023563382	212382927	/nfs/dbraw/zinc/38/29/27/212382927.db2.gz	AOYARPBXZBSTNA-GFCCVEGCSA-N	-1	0	341.798	3.722	50	0		EHAARM
CCN(CCNc1cc(C(=O)[O-])c2ccccc2n1)c1ccccc1	ZINC000021715331	212242174	/nfs/dbraw/zinc/24/21/74/212242174.db2.gz	GBVFNOSZFFVWTN-UHFFFAOYSA-N	-1	0	335.407	3.871	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)CCCc1c[nH]c2ccccc12	ZINC000237921888	242855778	/nfs/dbraw/zinc/85/57/78/242855778.db2.gz	FYRBYTHTGLBJNP-INIZCTEOSA-N	-1	0	342.439	3.737	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000013021855	211514015	/nfs/dbraw/zinc/51/40/15/211514015.db2.gz	RXRPOEJOFUHQDK-MOPGFXCFSA-N	-1	0	333.387	3.863	50	0		EHAARM
Cc1ccc(-c2cc(C(F)(F)F)n3nc(C(=O)[O-])cc3n2)cc1C	ZINC000011920590	211269375	/nfs/dbraw/zinc/26/93/75/211269375.db2.gz	BZBLGRDYDFDPRW-UHFFFAOYSA-N	-1	0	335.285	3.730	50	0		EHAARM
COc1ccc(C(=O)[O-])cc1OCc1ccc(Br)cc1	ZINC000011833403	211254740	/nfs/dbraw/zinc/25/47/40/211254740.db2.gz	IMIUNCVNLAFITH-UHFFFAOYSA-N	-1	0	337.169	3.735	50	0		EHAARM
Cc1ccc(N2CCN([C@H](C(=O)[O-])c3ccc(Cl)cc3)CC2)cc1	ZINC000091690225	218047995	/nfs/dbraw/zinc/04/79/95/218047995.db2.gz	HYRZKSBDSAVAIS-SFHVURJKSA-N	-1	0	344.842	3.596	50	0		EHAARM
Cc1[nH]nc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3)s2)c1C	ZINC000009686839	211113230	/nfs/dbraw/zinc/11/32/30/211113230.db2.gz	UOTFHCGKIOGEMU-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
COc1ccc(-c2cc(=O)n3[n-]c(C)c(-c4ccccc4)c3n2)cc1	ZINC000009331785	211069549	/nfs/dbraw/zinc/06/95/49/211069549.db2.gz	CHQLXSWIWKMWSK-UHFFFAOYSA-N	-1	0	331.375	3.674	50	0		EHAARM
Cc1ccc(SCC(=O)Nc2ccc(CCC(=O)[O-])cc2)cc1	ZINC000095482100	218412869	/nfs/dbraw/zinc/41/28/69/218412869.db2.gz	IOUDWOPUSXGCJV-UHFFFAOYSA-N	-1	0	329.421	3.743	50	0		EHAARM
O=C([O-])c1cc(N2C(=S)N=NC2c2cccs2)ccc1Cl	ZINC000006659221	210672574	/nfs/dbraw/zinc/67/25/74/210672574.db2.gz	AUGWILIBUFHYRM-UHFFFAOYSA-N	-1	0	337.813	3.636	50	0		EHAARM
COCc1ccccc1[N-]S(=O)(=O)c1cccc2ccccc21	ZINC000096460513	218843349	/nfs/dbraw/zinc/84/33/49/218843349.db2.gz	PHDONXPTUBXSAK-UHFFFAOYSA-N	-1	0	327.405	3.787	50	0		EHAARM
CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)Nc1ccccc1C(=O)[O-]	ZINC000000041899	208555767	/nfs/dbraw/zinc/55/57/67/208555767.db2.gz	BRFXGVVYPHCOTN-CABZTGNLSA-N	-1	0	328.195	3.915	50	0		EHAARM
CC(=O)Oc1cc(C)c(C)cc1C([O-])(C(F)(F)F)C(F)(F)F	ZINC000000118767	258047577	/nfs/dbraw/zinc/04/75/77/258047577.db2.gz	QGPYHSRQPTYQSO-UHFFFAOYSA-N	-1	0	330.224	3.541	50	0		EHAARM
Cc1ncc(-c2ccc(S(=O)(=O)[N-]c3ccc(C)cc3)s2)o1	ZINC000065003947	258062516	/nfs/dbraw/zinc/06/25/16/258062516.db2.gz	WSEWXBVAJPMXHI-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
Cc1ccccc1CSc1ncc(Br)c(C(=O)[O-])n1	ZINC000028403363	563902760	/nfs/dbraw/zinc/90/27/60/563902760.db2.gz	YRVVKIZHPJFKSQ-UHFFFAOYSA-N	-1	0	339.214	3.538	50	0		EHAARM
Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(Br)s1	ZINC000000469493	563330192	/nfs/dbraw/zinc/33/01/92/563330192.db2.gz	MKNXTAUUGCJGMA-UHFFFAOYSA-N	-1	0	346.271	3.928	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c(OC)c1	ZINC000000566922	563348112	/nfs/dbraw/zinc/34/81/12/563348112.db2.gz	PRQCVLOVGRHUPH-UHFFFAOYSA-N	-1	0	343.404	3.658	50	0		EHAARM
O=C([O-])CCCCCC(=O)c1ccc(I)cc1	ZINC000002579891	563442862	/nfs/dbraw/zinc/44/28/62/563442862.db2.gz	IHHPNNBIZNAQEF-UHFFFAOYSA-N	-1	0	346.164	3.509	50	0		EHAARM
Cc1nn(Cc2c(Cl)cccc2Cl)c(C)c1/C=C/C(=O)[O-]	ZINC000002650199	563445221	/nfs/dbraw/zinc/44/52/21/563445221.db2.gz	QOLFZGMSYKAKPT-VOTSOKGWSA-N	-1	0	325.195	3.953	50	0		EHAARM
CC(C)CC(=O)Nc1cccc(NC(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000002880681	563460672	/nfs/dbraw/zinc/46/06/72/563460672.db2.gz	KIHGMUHUHNCXDL-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
CCOc1ccc(NC(=O)CSCc2ccc(C(=O)[O-])cc2)cc1	ZINC000002887374	563461790	/nfs/dbraw/zinc/46/17/90/563461790.db2.gz	NCDNXEBOPFLFQO-UHFFFAOYSA-N	-1	0	345.420	3.655	50	0		EHAARM
O=C([O-])c1ccc(CSCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000002887360	563461791	/nfs/dbraw/zinc/46/17/91/563461791.db2.gz	WKYAJBDQRAVERI-UHFFFAOYSA-N	-1	0	335.812	3.910	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000003128525	563473456	/nfs/dbraw/zinc/47/34/56/563473456.db2.gz	DYFTYCDJLYVHJF-UHFFFAOYSA-N	-1	0	343.326	3.709	50	0		EHAARM
Cc1ccc(CSC(=O)N[C@@H](Cc2ccccc2)C(=O)[O-])cc1	ZINC000006070878	563558695	/nfs/dbraw/zinc/55/86/95/563558695.db2.gz	VZGFBWQZOIKMRJ-INIZCTEOSA-N	-1	0	329.421	3.634	50	0		EHAARM
CCOc1ccc(C(C)C)cc1S(=O)(=O)[N-]c1ccccc1O	ZINC000006706924	563581283	/nfs/dbraw/zinc/58/12/83/563581283.db2.gz	BLUCYQWHBDPYST-UHFFFAOYSA-N	-1	0	335.425	3.715	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cc1)c1ccccc1Br	ZINC000007402488	563601182	/nfs/dbraw/zinc/60/11/82/563601182.db2.gz	SCXGDUKAWQPIKB-UHFFFAOYSA-N	-1	0	346.633	3.903	50	0		EHAARM
O=C([O-])c1ccc(N2N=C(c3ccc(Cl)s3)CCC2=O)cc1	ZINC000013060473	563686869	/nfs/dbraw/zinc/68/68/69/563686869.db2.gz	OQSQGNVRRVBWFN-UHFFFAOYSA-N	-1	0	334.784	3.631	50	0		EHAARM
O=c1nc(Nc2ccc(Cl)c(Cl)c2)[n-]nc1-c1ccccc1	ZINC000016806937	563824411	/nfs/dbraw/zinc/82/44/11/563824411.db2.gz	UOJGRPZSAXBMAD-UHFFFAOYSA-N	-1	0	333.178	3.882	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2ccccc2O)c2ccccc12	ZINC000032601979	563914086	/nfs/dbraw/zinc/91/40/86/563914086.db2.gz	BTCZXMHWGZCQKQ-UHFFFAOYSA-N	-1	0	343.404	3.745	50	0		EHAARM
CSc1ccc([N-]S(=O)(=O)c2ccc(Cl)nc2Cl)cc1	ZINC000058202208	563939751	/nfs/dbraw/zinc/93/97/51/563939751.db2.gz	RZACIMQTWZJKKC-UHFFFAOYSA-N	-1	0	349.264	3.911	50	0		EHAARM
Cc1cc2cc(C(=O)N[C@@H](C(=O)[O-])c3ccc(F)cc3F)ccc2o1	ZINC000095520574	563977369	/nfs/dbraw/zinc/97/73/69/563977369.db2.gz	IDBJFALVVWQCNJ-MRXNPFEDSA-N	-1	0	345.301	3.575	50	0		EHAARM
CC(C)[C@H](NC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-])c1ccc(Cl)cc1	ZINC000248234864	563995595	/nfs/dbraw/zinc/99/55/95/563995595.db2.gz	MEHLKVRXOKTCJQ-XHSDSOJGSA-N	-1	0	335.831	3.820	50	0		EHAARM
CC(C)c1nc(/C=C/c2nccn2-c2ccccc2)ncc1C(=O)[O-]	ZINC000191302775	564001889	/nfs/dbraw/zinc/00/18/89/564001889.db2.gz	TYCCWODPHYHOSO-CMDGGOBGSA-N	-1	0	334.379	3.654	50	0		EHAARM
O=C([O-])C1(CC(=O)Nc2ccc(OC(F)(F)F)cc2)CCCC1	ZINC000013252171	564019654	/nfs/dbraw/zinc/01/96/54/564019654.db2.gz	MUXDEYJZSWOULC-UHFFFAOYSA-N	-1	0	331.290	3.559	50	0		EHAARM
COc1ccc(NC(=O)C[C@H](C(=O)[O-])[C@@H](C)c2ccccc2)cc1	ZINC000000535122	564022083	/nfs/dbraw/zinc/02/20/83/564022083.db2.gz	ZJYVULGZOQUTOO-GUYCJALGSA-N	-1	0	327.380	3.528	50	0		EHAARM
CC(C)(Oc1ccc2c(c1)CC/C(=C/c1cccnc1)C2=O)C(=O)[O-]	ZINC000096297170	564049713	/nfs/dbraw/zinc/04/97/13/564049713.db2.gz	PHFGQSKQSKPLPW-GDNBJRDFSA-N	-1	0	337.375	3.536	50	0		EHAARM
O=C([O-])Cc1ccccc1NC(=O)[C@H]1C[C@@]12CCCc1ccccc12	ZINC000238086954	564051489	/nfs/dbraw/zinc/05/14/89/564051489.db2.gz	LLSCCVUOCFYHFJ-DYESRHJHSA-N	-1	0	335.403	3.546	50	0		EHAARM
C[C@H](Sc1ccccc1C(=O)[O-])C(=O)Nc1ccc(F)c(F)c1	ZINC000012759192	564067308	/nfs/dbraw/zinc/06/73/08/564067308.db2.gz	NXVDHEIVTMGJGV-VIFPVBQESA-N	-1	0	337.347	3.782	50	0		EHAARM
Cc1ccc([C@H](NC(=O)OCc2ccccc2)[P@](C)(=O)[O-])cc1	ZINC000075261144	564081252	/nfs/dbraw/zinc/08/12/52/564081252.db2.gz	IMNIQEWIEGJEEH-MRXNPFEDSA-N	-1	0	333.324	3.820	50	0		EHAARM
Cc1cc([O-])cc2oc(C(F)(F)F)c(-c3cscn3)c(=O)c12	ZINC000006404178	564085477	/nfs/dbraw/zinc/08/54/77/564085477.db2.gz	XKJJSTBPLSBBIJ-UHFFFAOYSA-N	-1	0	327.283	3.949	50	0		EHAARM
C[C@@H]1CCCN(c2ccc(NC(=O)c3ccccc3)c(C(=O)[O-])c2)C1	ZINC000064589022	564092560	/nfs/dbraw/zinc/09/25/60/564092560.db2.gz	CFSSKRKXULZXPN-CQSZACIVSA-N	-1	0	338.407	3.873	50	0		EHAARM
C[C@H]1CCCN(c2ccc(NC(=O)C3CCCC3)c(C(=O)[O-])c2)C1	ZINC000064589248	564092563	/nfs/dbraw/zinc/09/25/63/564092563.db2.gz	PMZAXQJBLXNOAJ-ZDUSSCGKSA-N	-1	0	330.428	3.750	50	0		EHAARM
Cc1cc(C)nc([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c1	ZINC000005925085	564093390	/nfs/dbraw/zinc/09/33/90/564093390.db2.gz	FRXASFXHBSURIO-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
Cc1noc(-c2ccc(S(=O)(=O)[N-]c3ccccc3)s2)c1C	ZINC000065031389	564099771	/nfs/dbraw/zinc/09/97/71/564099771.db2.gz	OUULRFYVTWFNRJ-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2cn(C(C)C)c3ncccc23)c1	ZINC000065242191	564103341	/nfs/dbraw/zinc/10/33/41/564103341.db2.gz	IZXJXEDGKLUMIT-UHFFFAOYSA-N	-1	0	329.425	3.726	50	0		EHAARM
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000007409010	564108078	/nfs/dbraw/zinc/10/80/78/564108078.db2.gz	QAGJOKKWBDWEGT-UHFFFAOYSA-N	-1	0	335.734	3.867	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2ccccc2Cl)C1	ZINC000252486996	564119358	/nfs/dbraw/zinc/11/93/58/564119358.db2.gz	RCKGLMJLSQQWLG-QEJZJMRPSA-N	-1	0	335.831	3.547	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000000548608	564133421	/nfs/dbraw/zinc/13/34/21/564133421.db2.gz	MMLMUEBHVMHOEP-QZTJIDSGSA-N	-1	0	337.419	3.783	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@@H](c2ccc(Cl)cc2)[C@H]1C(=O)[O-]	ZINC000139784513	564133608	/nfs/dbraw/zinc/13/36/08/564133608.db2.gz	WOCFNKDQXQVEJM-KBPBESRZSA-N	-1	0	339.819	3.908	50	0		EHAARM
Cc1cc(Br)c(C(=O)[O-])cc1NC(=O)[C@@H]1CC=CCC1	ZINC000312352933	564134416	/nfs/dbraw/zinc/13/44/16/564134416.db2.gz	XZXUNCKDHOYJNF-SNVBAGLBSA-N	-1	0	338.201	3.751	50	0		EHAARM
C[C@H](CC(=O)N1CCC[C@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000095969521	564143410	/nfs/dbraw/zinc/14/34/10/564143410.db2.gz	GWLAJJZILZHZKA-YPMHNXCESA-N	-1	0	343.345	3.522	50	0		EHAARM
C[C@@H](CC(=O)N1CCC[C@H](C(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000096479544	564148577	/nfs/dbraw/zinc/14/85/77/564148577.db2.gz	DKGQWQJBIAJJCW-AAEUAGOBSA-N	-1	0	343.345	3.522	50	0		EHAARM
O=C([O-])c1ccccc1N(Cc1ccccc1)C(=O)c1ccccc1O	ZINC000003267936	564156799	/nfs/dbraw/zinc/15/67/99/564156799.db2.gz	QGDGIUKHQZBUNW-UHFFFAOYSA-N	-1	0	347.370	3.937	50	0		EHAARM
CC[C@@H](C)c1ccc(Cn2c3ccccc3nc2S(=O)(=O)[O-])cc1	ZINC000031903432	564160169	/nfs/dbraw/zinc/16/01/69/564160169.db2.gz	VBPMUPGCOFGSTM-CYBMUJFWSA-N	-1	0	344.436	3.845	50	0		EHAARM
Cc1ccc([C@@H]2[C@H](C(=O)[O-])CCC(=O)N2CCc2cccs2)s1	ZINC000069664813	564171362	/nfs/dbraw/zinc/17/13/62/564171362.db2.gz	OUKBJPIOKYHCDC-CJNGLKHVSA-N	-1	0	349.477	3.725	50	0		EHAARM
C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)C3(C(=O)[O-])CC3)c2)C1	ZINC000154836405	959039456	/nfs/dbraw/zinc/03/94/56/959039456.db2.gz	CBECHBJZNDQVJE-CZUORRHYSA-N	-1	0	331.412	3.585	50	0		EHAARM
Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C1(C(=O)[O-])CC1	ZINC000118963704	1018110648	/nfs/dbraw/zinc/11/06/48/1018110648.db2.gz	VMOOGFWDBNWUKU-CQSZACIVSA-N	-1	0	339.391	3.938	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N2CCC[C@@H](Cc3ccccc3)C2)c(F)c1	ZINC000263553419	1037125589	/nfs/dbraw/zinc/12/55/89/1037125589.db2.gz	XPUKOYPIJNQPEW-HNNXBMFYSA-N	-1	0	341.382	3.619	50	0		EHAARM
O=C([O-])CSc1nc2c(nc3c(c2-c2ccco2)CCCC3)o1	ZINC000004839989	1042508650	/nfs/dbraw/zinc/50/86/50/1042508650.db2.gz	GEBYUWQCWFEQOP-UHFFFAOYSA-N	-1	0	330.365	3.538	50	0		EHAARM
O=C(N[C@H]1CCCOc2ccc(F)cc21)c1ccc([O-])c(Cl)c1	ZINC000054283416	214229390	/nfs/dbraw/zinc/22/93/90/214229390.db2.gz	YKENJPUTGREMGI-AWEZNQCLSA-N	-1	0	335.762	3.828	50	0		EHAARM
C[C@@H](c1ccco1)n1cc(Oc2ccccc2)c(=O)c(C(=O)[O-])c1	ZINC000055310160	214305242	/nfs/dbraw/zinc/30/52/42/214305242.db2.gz	DIYNWRTXCHUJOK-LBPRGKRZSA-N	-1	0	325.320	3.541	50	0		EHAARM
Cc1cc(=O)n2[n-]c(C(F)(F)F)c(-c3ccc(Cl)cc3)c2n1	ZINC000101110823	219116354	/nfs/dbraw/zinc/11/63/54/219116354.db2.gz	IUVANITUCXCBJY-UHFFFAOYSA-N	-1	0	327.693	3.670	50	0		EHAARM
O=C([O-])c1ccc(N2CCCC2)c(NC(=O)c2cccc(Cl)c2)c1	ZINC000064820744	214807926	/nfs/dbraw/zinc/80/79/26/214807926.db2.gz	ZNKDZADGIWWITB-UHFFFAOYSA-N	-1	0	344.798	3.891	50	0		EHAARM
CCCc1[nH]nc2c1[C@H](c1cc(Cl)cc(Cl)c1[O-])CC(=O)N2	ZINC000067696144	215189224	/nfs/dbraw/zinc/18/92/24/215189224.db2.gz	CXMZPFXZLXVLGL-QMMMGPOBSA-N	-1	0	340.210	3.849	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1ccc2ccccc2c1	ZINC000002572730	209870497	/nfs/dbraw/zinc/87/04/97/209870497.db2.gz	RKULNBHGHIPRGC-MRXNPFEDSA-N	-1	0	329.396	3.750	50	0		EHAARM
Cc1ccc(-c2ccc(NC(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C(=O)[O-])cc2)o1	ZINC000002208752	209831193	/nfs/dbraw/zinc/83/11/93/209831193.db2.gz	FKSLNBYCLBTOCK-IHETXDGRSA-N	-1	0	337.375	3.716	50	0		EHAARM
O=C([O-])c1ccc(-c2cc3cccnc3c(Br)n2)cc1	ZINC000036056250	213057461	/nfs/dbraw/zinc/05/74/61/213057461.db2.gz	ICUFIIGJRIOKNY-UHFFFAOYSA-N	-1	0	329.153	3.758	50	0		EHAARM
CCOc1ccc(C)cc1S(=O)(=O)[N-]c1cc(Cl)ccc1O	ZINC000035592602	213039892	/nfs/dbraw/zinc/03/98/92/213039892.db2.gz	ZCNQVZDOWLMSQG-UHFFFAOYSA-N	-1	0	341.816	3.554	50	0		EHAARM
Cc1cc(Cl)ccc1NC(=O)c1ccc(O[C@H](C)C(=O)[O-])cc1	ZINC000000148416	209452581	/nfs/dbraw/zinc/45/25/81/209452581.db2.gz	HEFAXWHJDHPLEJ-LLVKDONJSA-N	-1	0	333.771	3.753	50	0		EHAARM
Cc1oc2cc(O[C@H](C)C(=O)[O-])ccc2c(=O)c1Oc1ccccc1	ZINC000000123799	209436740	/nfs/dbraw/zinc/43/67/40/209436740.db2.gz	FYIKHLLVPYVBTH-GFCCVEGCSA-N	-1	0	340.331	3.746	50	0	biogenic	EHAARM
Cc1nc2sc([C@@H](c3ccccc3Cl)N3CCCC3)c([O-])n2n1	ZINC000022625959	212313885	/nfs/dbraw/zinc/31/38/85/212313885.db2.gz	OQKAMORHWQCKGD-CYBMUJFWSA-N	-1	0	348.859	3.643	50	0		EHAARM
O=C(Nc1nnc(C(F)F)s1)c1c([O-])cc(Cl)cc1Cl	ZINC000079026263	217177438	/nfs/dbraw/zinc/17/74/38/217177438.db2.gz	ZGHWYOCHGZCPEF-UHFFFAOYSA-N	-1	0	340.138	3.740	50	0		EHAARM
COc1ccc(-c2nnc(CSc3ccccc3C(=O)[O-])o2)cc1	ZINC000012978327	211497200	/nfs/dbraw/zinc/49/72/00/211497200.db2.gz	VFRCOTBSTQRKLG-UHFFFAOYSA-N	-1	0	342.376	3.736	50	0		EHAARM
O=S(=O)([N-]c1ccccc1OC(F)(F)F)c1ccccc1F	ZINC000012525800	211399454	/nfs/dbraw/zinc/39/94/54/211399454.db2.gz	YCZKCUZMDWWJBO-UHFFFAOYSA-N	-1	0	335.278	3.525	50	0		EHAARM
Cc1ccc(CSC2=Nc3ccc(F)cc3S(=O)(=O)[N-]2)cc1	ZINC000012361112	211355746	/nfs/dbraw/zinc/35/57/46/211355746.db2.gz	PZQDVACPNJQWET-UHFFFAOYSA-N	-1	0	336.413	3.538	50	0		EHAARM
CC[C@@](C)(CC(=O)[O-])CC(=O)Nc1ccc(Br)cc1F	ZINC000009386811	211079749	/nfs/dbraw/zinc/07/97/49/211079749.db2.gz	CRVWIGDTWSOHGX-CQSZACIVSA-N	-1	0	346.196	3.808	50	0		EHAARM
Cc1nc([N-]c2nc3ccccc3o2)ncc1C(=O)Nc1ccccc1	ZINC000009009963	211029195	/nfs/dbraw/zinc/02/91/95/211029195.db2.gz	XIUJUXHXMQPIAO-UHFFFAOYSA-N	-1	0	345.362	3.922	50	0		EHAARM
COc1ccc(OC)c(-c2cc(C(=O)[O-])c3c(n2)onc3C(C)C)c1	ZINC000008394168	210948028	/nfs/dbraw/zinc/94/80/28/210948028.db2.gz	BJQDDDTXWSMCLF-UHFFFAOYSA-N	-1	0	342.351	3.729	50	0		EHAARM
CCc1ccc(/C=C\c2nc3cc(C(=O)[O-])ccc3n(CC)c2=O)cc1	ZINC000096891609	218896736	/nfs/dbraw/zinc/89/67/36/218896736.db2.gz	QENXJDAXHPGLIN-LUAWRHEFSA-N	-1	0	348.402	3.847	50	0		EHAARM
CCCOc1cc(S(=O)(=O)[N-]c2ncccc2C)ccc1Cl	ZINC000004970552	210343373	/nfs/dbraw/zinc/34/33/73/210343373.db2.gz	CAESTNLVTNXMPF-UHFFFAOYSA-N	-1	0	340.832	3.633	50	0		EHAARM
CCOc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1ccccn1	ZINC000004913665	210320361	/nfs/dbraw/zinc/32/03/61/210320361.db2.gz	LGAZCMSPNARRHQ-UHFFFAOYSA-N	-1	0	334.441	3.579	50	0		EHAARM
Cc1cccc(CSC2=Nc3ccc(F)cc3S(=O)(=O)[N-]2)c1	ZINC000004853692	210300044	/nfs/dbraw/zinc/30/00/44/210300044.db2.gz	WGWDCLATTCTZRE-UHFFFAOYSA-N	-1	0	336.413	3.538	50	0		EHAARM
Cc1cc(NC(=O)Cc2coc(-c3ccccc3)n2)ccc1C(=O)[O-]	ZINC000170045521	226601181	/nfs/dbraw/zinc/60/11/81/226601181.db2.gz	SOTPHABVGHBWID-UHFFFAOYSA-N	-1	0	336.347	3.529	50	0		EHAARM
CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000132592725	528070748	/nfs/dbraw/zinc/07/07/48/528070748.db2.gz	XVSQKNWXZXUTIU-CABCVRRESA-N	-1	0	346.452	3.536	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(Cl)cc1	ZINC000000101264	563226009	/nfs/dbraw/zinc/22/60/09/563226009.db2.gz	SXWMTCDPIWGDBX-UHFFFAOYSA-N	-1	0	332.208	3.803	50	0		EHAARM
O=C([O-])[C@@H]1CC[C@H]1C(=O)Nc1nc(-c2ccc(Cl)s2)cs1	ZINC000000117967	563232920	/nfs/dbraw/zinc/23/29/20/563232920.db2.gz	OIDOYFPJSCJXLV-RNFRBKRXSA-N	-1	0	342.829	3.574	50	0		EHAARM
Cc1sc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204918	563259386	/nfs/dbraw/zinc/25/93/86/563259386.db2.gz	WBTSRBHBHLSUHT-UONOGXRCSA-N	-1	0	342.420	3.724	50	0		EHAARM
O=C(Nc1cc2c(cc1Cl)OCCO2)c1cc(Cl)ccc1[O-]	ZINC000000344732	563287290	/nfs/dbraw/zinc/28/72/90/563287290.db2.gz	LEEHBDFESBGVSU-UHFFFAOYSA-N	-1	0	340.162	3.723	50	0		EHAARM
O=C1CCCCC1=C([O-])c1cn(-c2ccc(Cl)c(Cl)c2)nn1	ZINC000001395102	563386447	/nfs/dbraw/zinc/38/64/47/563386447.db2.gz	YYUFYBCDRIIAEY-SNVBAGLBSA-N	-1	0	338.194	3.516	50	0		EHAARM
O=C([O-])CCSc1nnc(-c2cccs2)n1-c1ccccc1	ZINC000002709017	563603578	/nfs/dbraw/zinc/60/35/78/563603578.db2.gz	KUFGEUNEAYCZEN-UHFFFAOYSA-N	-1	0	331.422	3.563	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)[O-])c2ccccc12	ZINC000012291092	563657275	/nfs/dbraw/zinc/65/72/75/563657275.db2.gz	UONZLJYEMPSDOR-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
CCCCCOc1cc(C)ccc1S(=O)(=O)[N-]c1ccccn1	ZINC000012552655	563662715	/nfs/dbraw/zinc/66/27/15/563662715.db2.gz	QMSOTSHQOJFUMT-UHFFFAOYSA-N	-1	0	334.441	3.760	50	0		EHAARM
CCCCc1nnc([N-]C(=O)c2cc(-c3cccc(F)c3)no2)s1	ZINC000032922793	563824901	/nfs/dbraw/zinc/82/49/01/563824901.db2.gz	FDRXOZOOSKVKKS-UHFFFAOYSA-N	-1	0	346.387	3.927	50	0		EHAARM
O=c1c2c[n-]c3c(cccc3C(F)(F)F)c-2nn1-c1ccccc1	ZINC000034925908	563919945	/nfs/dbraw/zinc/91/99/45/563919945.db2.gz	WLXUUNPYYJFGRI-UHFFFAOYSA-N	-1	0	329.281	3.886	50	0		EHAARM
CCCC[C@H](CC(=O)[O-])NC(=O)c1oc2cc(OC)ccc2c1C	ZINC000095523986	563977416	/nfs/dbraw/zinc/97/74/16/563977416.db2.gz	RTLYCXRKJKONQV-GFCCVEGCSA-N	-1	0	333.384	3.513	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC[C@@H](c2ccc(Cl)cc2)[C@@H]1C(=O)[O-]	ZINC000072233775	563986061	/nfs/dbraw/zinc/98/60/61/563986061.db2.gz	WOCFNKDQXQVEJM-UONOGXRCSA-N	-1	0	339.819	3.908	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000000371865	563991776	/nfs/dbraw/zinc/99/17/76/563991776.db2.gz	MARQLAAGKDNADO-UHFFFAOYSA-N	-1	0	337.416	3.933	50	0		EHAARM
O=C([N-]C1(c2csc([C@H]3CCCO3)n2)CCCCC1)C(F)(F)F	ZINC000408524397	563993269	/nfs/dbraw/zinc/99/32/69/563993269.db2.gz	TZAFVXLYIVCVFP-SNVBAGLBSA-N	-1	0	348.390	3.833	50	0		EHAARM
Cc1cc(C)c2oc(-c3ccco3)c(O[C@H](C)C(=O)[O-])c(=O)c2c1	ZINC000005556481	564005310	/nfs/dbraw/zinc/00/53/10/564005310.db2.gz	VSWLSLBZCRISTF-LLVKDONJSA-N	-1	0	328.320	3.522	50	0		EHAARM
O=C([O-])Cc1ccc(NC(=O)Nc2ccc(Br)cc2)cc1	ZINC000006729571	564015040	/nfs/dbraw/zinc/01/50/40/564015040.db2.gz	WTDUYDWTJAAWJO-UHFFFAOYSA-N	-1	0	349.184	3.720	50	0		EHAARM
O=C1[N-]C(=O)/C(=C\c2ccc(OCc3ccc4ccccc4c3)cc2)N1	ZINC000000573870	564023997	/nfs/dbraw/zinc/02/39/97/564023997.db2.gz	ITNAIMGCBNEHHZ-XDHOZWIPSA-N	-1	0	344.370	3.599	50	0		EHAARM
C[C@@H]([C@H]1CCCO1)n1c(=O)c2c([n-]c1=S)sc1c2CCCC1	ZINC000017070774	564024866	/nfs/dbraw/zinc/02/48/66/564024866.db2.gz	YSISXRAGZZJPCJ-GXSJLCMTSA-N	-1	0	336.482	3.739	50	0		EHAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1cccc(Cl)c1	ZINC000032971259	564036355	/nfs/dbraw/zinc/03/63/55/564036355.db2.gz	ZEVSKRGXSWEGFZ-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
COC(=O)c1ccc(NC(=O)c2cc(-c3cccc(F)c3)no2)s1	ZINC000033161909	564036596	/nfs/dbraw/zinc/03/65/96/564036596.db2.gz	QPVBBNUPMXFYDE-UHFFFAOYSA-N	-1	0	346.339	3.581	50	0		EHAARM
CC(C)(C)c1nnc(Nc2ccc(Cl)c(C(F)(F)F)c2)[n-]c1=O	ZINC000005856252	564056640	/nfs/dbraw/zinc/05/66/40/564056640.db2.gz	NKZPMGVDJPOGLJ-UHFFFAOYSA-N	-1	0	346.740	3.878	50	0		EHAARM
Cn1cccc1Cc1n[n-]c(=S)n1-c1cccc(C(F)(F)F)c1	ZINC000005902938	564056851	/nfs/dbraw/zinc/05/68/51/564056851.db2.gz	JOJQVGCIFQVISI-UHFFFAOYSA-N	-1	0	338.358	3.878	50	0		EHAARM
CCCc1ccc(N[C@@H](c2cccc(OC)c2)[P@@](=O)([O-])O)cc1	ZINC000012540639	564058674	/nfs/dbraw/zinc/05/86/74/564058674.db2.gz	JHYHBCRIYQEHLQ-QGZVFWFLSA-N	-1	0	335.340	3.936	50	0		EHAARM
O=C(Nc1cnn(CC(F)(F)F)c1)c1ccc2[n-]c(=S)oc2c1	ZINC000073799385	564062124	/nfs/dbraw/zinc/06/21/24/564062124.db2.gz	JEGLDMCRPRXSLF-UHFFFAOYSA-N	-1	0	342.302	3.501	50	0		EHAARM
O=c1[nH]c(C=Cc2cc(Br)ccc2O)nc2ccccc12	ZINC000083327696	564063147	/nfs/dbraw/zinc/06/31/47/564063147.db2.gz	DCKGDPBQJCLLFT-YVMONPNESA-N	-1	0	343.180	3.562	50	0		EHAARM
CCc1ccccc1NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000063809418	564077242	/nfs/dbraw/zinc/07/72/42/564077242.db2.gz	DMSNYCZTQBGBFS-UHFFFAOYSA-N	-1	0	325.393	3.813	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2cc[nH]n2)s1	ZINC000075351826	564082037	/nfs/dbraw/zinc/08/20/37/564082037.db2.gz	HHANISNQBIEQAP-UHFFFAOYSA-N	-1	0	333.438	3.501	50	0		EHAARM
CC(C)Oc1nc(N=NC(C(=O)[O-])C(C)C)c(Cl)cc1Cl	ZINC000252595011	564090622	/nfs/dbraw/zinc/09/06/22/564090622.db2.gz	BXFLNQAXIHSWAP-UHFFFAOYSA-N	-1	0	334.203	3.684	50	0		EHAARM
O=S(=O)([N-]c1cc(-c2ccoc2)no1)c1ccc(F)c(Cl)c1	ZINC000065153481	564102063	/nfs/dbraw/zinc/10/20/63/564102063.db2.gz	NIGCXLVHPLDEIE-UHFFFAOYSA-N	-1	0	342.735	3.528	50	0		EHAARM
Cc1cccc(-c2noc(-c3c([O-])c4cc(C)ccc4[nH]c3=O)n2)c1	ZINC000065248632	564103337	/nfs/dbraw/zinc/10/33/37/564103337.db2.gz	YSSFNDKXOAWJLF-UHFFFAOYSA-N	-1	0	333.347	3.568	50	0		EHAARM
CC(C)Cn1cc(S(=O)(=O)[N-]c2cccc(F)c2)c2cccnc21	ZINC000065242300	564103401	/nfs/dbraw/zinc/10/34/01/564103401.db2.gz	BNYVYLKOJMWFTH-UHFFFAOYSA-N	-1	0	347.415	3.632	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2ccc(F)cc2C)c2cccnc21	ZINC000065242251	564103405	/nfs/dbraw/zinc/10/34/05/564103405.db2.gz	JOWNEWNPDYOLGX-UHFFFAOYSA-N	-1	0	347.415	3.695	50	0		EHAARM
CC(C)(C)c1nc2cc([N-]S(=O)(=O)c3cccs3)ccc2[nH]1	ZINC000071283609	564110846	/nfs/dbraw/zinc/11/08/46/564110846.db2.gz	FTTLEEPNEBQCJC-UHFFFAOYSA-N	-1	0	335.454	3.723	50	0		EHAARM
Cc1c(NS(=O)(=O)c2ccc3ccccc3c2)cccc1C(=O)[O-]	ZINC000065844443	564121665	/nfs/dbraw/zinc/12/16/65/564121665.db2.gz	YCUIGXIOUBLBGX-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
Cc1ccnc(-c2ccc(NC(=O)c3s[n-]c(=O)c3Cl)cc2)n1	ZINC000253404425	564130622	/nfs/dbraw/zinc/13/06/22/564130622.db2.gz	KUCPXKPKNCQXHZ-UHFFFAOYSA-N	-1	0	346.799	3.520	50	0		EHAARM
Cc1ccc(-c2ccc(C(=O)N3CCC(C(=O)[O-])CC3)c(F)c2)cc1	ZINC000225455982	564134927	/nfs/dbraw/zinc/13/49/27/564134927.db2.gz	OQTAGCSIDITDQX-UHFFFAOYSA-N	-1	0	341.382	3.738	50	0		EHAARM
CCOc1ccc(S(=O)(=O)[N-]c2nc3c(cccc3C)s2)cc1	ZINC000002726558	564152296	/nfs/dbraw/zinc/15/22/96/564152296.db2.gz	MCHANUXTGCBHHR-UHFFFAOYSA-N	-1	0	348.449	3.804	50	0		EHAARM
CC[C@H](C)NC(=O)CCCCCn1c(=O)c2ccccc2[n-]c1=S	ZINC000002970313	564153927	/nfs/dbraw/zinc/15/39/27/564153927.db2.gz	SBVYOUPJRRHLPM-ZDUSSCGKSA-N	-1	0	347.484	3.534	50	0		EHAARM
CCCCC(=O)Nc1cccc(C(=O)Nc2ccccc2C(=O)[O-])c1	ZINC000003005685	564154314	/nfs/dbraw/zinc/15/43/14/564154314.db2.gz	AMAKPQJFDNUCFH-UHFFFAOYSA-N	-1	0	340.379	3.766	50	0		EHAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1	ZINC000003128526	564155313	/nfs/dbraw/zinc/15/53/13/564155313.db2.gz	AMJQJEJOUVXYCX-UHFFFAOYSA-N	-1	0	343.326	3.709	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@@H]1CCC[C@H](C)[C@H]1C)c2=O	ZINC000003912005	564159694	/nfs/dbraw/zinc/15/96/94/564159694.db2.gz	VBIHYWPJMKUNNZ-FIXISWKDSA-N	-1	0	346.452	3.843	50	0		EHAARM
Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)c1c(C)coc1CC(=O)[O-]	ZINC000263478066	564162324	/nfs/dbraw/zinc/16/23/24/564162324.db2.gz	ZQUVMBMGQVLRJV-CYBMUJFWSA-N	-1	0	345.395	3.560	50	0		EHAARM
O=C([O-])[C@@H](C(=O)Nc1ccc(-c2nccs2)cc1)C1CCCC1	ZINC000663031433	939850579	/nfs/dbraw/zinc/85/05/79/939850579.db2.gz	WIYKMOONHHSSEW-CQSZACIVSA-N	-1	0	330.409	3.640	50	0		EHAARM
O=C([O-])[C@H]1CCN(C(=O)C[C@H]2CCc3ccccc32)c2ccccc21	ZINC000669435065	976002084	/nfs/dbraw/zinc/00/20/84/976002084.db2.gz	SDMIKRKJWMDCKR-QAPCUYQASA-N	-1	0	335.403	3.712	50	0		EHAARM
CC(C)(C)OC(=O)Nc1ccc(Br)c(F)c1C(=O)[O-]	ZINC000306763904	1021531385	/nfs/dbraw/zinc/53/13/85/1021531385.db2.gz	JPYFWHHDDFYOFK-UHFFFAOYSA-N	-1	0	334.141	3.633	50	0		EHAARM
O=C([O-])c1cc(Cl)c(Cl)cc1C(=O)Nc1cccc(O)c1	ZINC000023633888	1036909663	/nfs/dbraw/zinc/90/96/63/1036909663.db2.gz	VZLOIANYYLRPTN-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
COc1ccc(-c2c(Cc3ccccc3)[n-]n3c2nc(C)cc3=O)cc1	ZINC000006682006	1043972809	/nfs/dbraw/zinc/97/28/09/1043972809.db2.gz	NFMOXJBOZVGPRN-UHFFFAOYSA-N	-1	0	345.402	3.597	50	0		EHAARM
C[C@@H]1CCC[C@H](C(=O)[O-])N1Cc1csc(-c2ccc(F)cc2)n1	ZINC000826595270	1131327833	/nfs/dbraw/zinc/32/78/33/1131327833.db2.gz	BQIKAXCXRRKLRZ-IAQYHMDHSA-N	-1	0	334.416	3.777	50	0		EHAARM
Cc1cc(Br)c(NC(=O)OC(C)(C)C)c(C(=O)[O-])c1	ZINC000002582907	1135384302	/nfs/dbraw/zinc/38/43/02/1135384302.db2.gz	WAMPGAOJNJJIHY-UHFFFAOYSA-N	-1	0	330.178	3.803	50	0		EHAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)cc1	ZINC000630327400	1137354169	/nfs/dbraw/zinc/35/41/69/1137354169.db2.gz	GBEBGZADEYHDGI-XMTFNYHQSA-N	-1	0	339.366	3.756	50	0		EHAARM
O=C([O-])c1ccc(CNC(=O)CC2CCC(C(F)(F)F)CC2)cc1	ZINC000192415090	1137455516	/nfs/dbraw/zinc/45/55/16/1137455516.db2.gz	AVWVTPQOKUEHQY-UHFFFAOYSA-N	-1	0	343.345	3.760	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)CCCc1ccccc1)c1ccc(Cl)cc1	ZINC000004689765	210249137	/nfs/dbraw/zinc/24/91/37/210249137.db2.gz	IVGXJSCHQKQFOR-QGZVFWFLSA-N	-1	0	345.826	3.995	50	0		EHAARM
O=C([O-])c1cnc(/C=C/c2cc(Cl)c3c(c2)OCCCO3)s1	ZINC000058407607	214576799	/nfs/dbraw/zinc/57/67/99/214576799.db2.gz	OITIHZNKHLBRGQ-NSCUHMNNSA-N	-1	0	337.784	3.826	50	0		EHAARM
O=C([O-])[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)c1ccccc1	ZINC000098031704	219071882	/nfs/dbraw/zinc/07/18/82/219071882.db2.gz	TUEBEFJSLZPNJI-FQEVSTJZSA-N	-1	0	345.398	3.761	50	0		EHAARM
O=C(C[C@H]1CC[C@H](C(=O)[O-])CC1)c1ccccc1Br	ZINC000100449795	219099918	/nfs/dbraw/zinc/09/99/18/219099918.db2.gz	ALNIXWJGPRLYLB-PHIMTYICSA-N	-1	0	325.202	3.913	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2ccc(C)cc2C)c1=O	ZINC000100498443	219100356	/nfs/dbraw/zinc/10/03/56/219100356.db2.gz	BHXQXFDXVQRDKM-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
Cn1nccc1/C=C(/CCCC(=O)[O-])c1nc2ccccc2s1	ZINC000045111074	213707876	/nfs/dbraw/zinc/70/78/76/213707876.db2.gz	MOECLDFKDYSZJS-QXMHVHEDSA-N	-1	0	327.409	3.825	50	0		EHAARM
Cc1ccc(C2=NN(C(=O)CCC(=O)[O-])[C@@H](c3cccs3)C2)cc1	ZINC000000554145	209661861	/nfs/dbraw/zinc/66/18/61/209661861.db2.gz	OLDALRBCNWTBHP-OAHLLOKOSA-N	-1	0	342.420	3.599	50	0		EHAARM
COc1ccc(NC(=O)[C@H](C)[C@H](Cc2ccc(C)cc2)C(=O)[O-])cc1	ZINC000035142035	213008891	/nfs/dbraw/zinc/00/88/91/213008891.db2.gz	UVUBRMPGPVRXGS-KDOFPFPSSA-N	-1	0	341.407	3.522	50	0		EHAARM
O=C([O-])c1ccc2c(=O)[nH]c(C(Cl)=Cc3ccsc3)nc2c1	ZINC000033499288	212943394	/nfs/dbraw/zinc/94/33/94/212943394.db2.gz	RTMKUEYSOCLAFO-VZUCSPMQSA-N	-1	0	332.768	3.832	50	0		EHAARM
CCOC(=O)C=C([O-])c1cc(C(C)=O)c(Nc2ccccc2)s1	ZINC000000323808	209537644	/nfs/dbraw/zinc/53/76/44/209537644.db2.gz	XDAFXFSKSBODOV-UHFFFAOYSA-N	-1	0	331.393	3.830	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2cnc3ccccc3c2)ccc1Cl	ZINC000072414265	216205308	/nfs/dbraw/zinc/20/53/08/216205308.db2.gz	LOTDITRVZPVXOR-UHFFFAOYSA-N	-1	0	332.812	3.997	50	0		EHAARM
COc1cc(CNc2cccc(C(=O)[O-])c2C)cc(Cl)c1OC	ZINC000020881255	212181196	/nfs/dbraw/zinc/18/11/96/212181196.db2.gz	VDLGTFZEPYPTNS-UHFFFAOYSA-N	-1	0	335.787	3.976	50	0		EHAARM
COc1ccc(-c2c/c(=N\CC(=O)[O-])c3cc(C)cc(C)c3o2)cc1	ZINC000019793971	212068946	/nfs/dbraw/zinc/06/89/46/212068946.db2.gz	KKQHPVMEDKEIMY-HEHNFIMWSA-N	-1	0	337.375	3.711	50	0		EHAARM
O=C([O-])[C@H](Oc1ccc(F)cc1Br)c1ccccc1	ZINC000011825493	211254781	/nfs/dbraw/zinc/25/47/81/211254781.db2.gz	SDIOMWCKQMZSMJ-CYBMUJFWSA-N	-1	0	325.133	3.793	50	0		EHAARM
CC(C)[C@H](NC(=O)[C@H]1CC=CC[C@@H]1C(=O)[O-])c1ccc(Cl)cc1	ZINC000010827998	211191411	/nfs/dbraw/zinc/19/14/11/211191411.db2.gz	MEHLKVRXOKTCJQ-JYJNAYRXSA-N	-1	0	335.831	3.820	50	0		EHAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1C	ZINC000010301927	211161570	/nfs/dbraw/zinc/16/15/70/211161570.db2.gz	JLYVONZUUWGBBA-UHFFFAOYSA-N	-1	0	329.780	3.597	50	0		EHAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1cccc2ccccc21	ZINC000010301877	211160912	/nfs/dbraw/zinc/16/09/12/211160912.db2.gz	MUICNJILZMJBQR-UHFFFAOYSA-N	-1	0	331.368	3.788	50	0		EHAARM
O=c1cc([O-])c2sc3nc(-c4ccc(F)cc4F)ccc3c2[nH]1	ZINC000008783372	211006060	/nfs/dbraw/zinc/00/60/60/211006060.db2.gz	QYDPQIDZOUEOOK-UHFFFAOYSA-N	-1	0	330.315	3.789	50	0		EHAARM
Cc1cc(/C=C\[N+](=O)[O-])c(C)n1-c1sc2c(c1C(=O)[O-])CCCC2	ZINC000005050141	210374539	/nfs/dbraw/zinc/37/45/39/210374539.db2.gz	ZIDNLMGLHKDSJN-FPLPWBNLSA-N	-1	0	346.408	3.980	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)Nc2ccc(F)c(Cl)c2)C1	ZINC000004892877	210315076	/nfs/dbraw/zinc/31/50/76/210315076.db2.gz	ZSCYJINYFFACSA-NEPJUHHUSA-N	-1	0	325.767	3.865	50	0		EHAARM
COc1c(Cl)cc(C(=O)Nc2ccc(C(=O)[O-])cc2)cc1Cl	ZINC000004832513	210290428	/nfs/dbraw/zinc/29/04/28/210290428.db2.gz	GHEJAAXZTTXGRW-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc2oc3c(c2c1)CCCC3	ZINC000004788700	210278697	/nfs/dbraw/zinc/27/86/97/210278697.db2.gz	VLLLKBSANCJDDA-LSDHHAIUSA-N	-1	0	339.391	3.917	50	0		EHAARM
Cc1oc(CN(C)C(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)cc1C(=O)[O-]	ZINC000299748165	258007903	/nfs/dbraw/zinc/00/79/03/258007903.db2.gz	GHGMAQACQYORRR-HOTGVXAUSA-N	-1	0	347.798	3.702	50	0		EHAARM
CC(C)(C)c1ccccc1OCC(=O)Nc1ccccc1C(=O)[O-]	ZINC000000133627	563239457	/nfs/dbraw/zinc/23/94/57/563239457.db2.gz	KLZLLEJYZREVKV-UHFFFAOYSA-N	-1	0	327.380	3.700	50	0		EHAARM
O=C([O-])c1cc(-c2ccccn2)nc2ccc(Br)cc21	ZINC000000224947	563263022	/nfs/dbraw/zinc/26/30/22/563263022.db2.gz	WNXWWXFTFGLCEC-UHFFFAOYSA-N	-1	0	329.153	3.758	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2nnc(C3CCCCC3)s2)cc1	ZINC000000268440	563269316	/nfs/dbraw/zinc/26/93/16/563269316.db2.gz	NABRORLWEBSSIT-UHFFFAOYSA-N	-1	0	337.470	3.695	50	0		EHAARM
Cc1ccc(S(=O)(=O)C=C([O-])c2ccc(C(C)(C)C)cc2)cc1	ZINC000000386134	563302864	/nfs/dbraw/zinc/30/28/64/563302864.db2.gz	UDXUPPXSVWQVKV-UHFFFAOYSA-N	-1	0	330.449	3.949	50	0		EHAARM
Cc1c(NC(=O)COc2cccc3ccccc32)cccc1C(=O)[O-]	ZINC000000618736	563360721	/nfs/dbraw/zinc/36/07/21/563360721.db2.gz	QYDDDUVLALRHNZ-UHFFFAOYSA-N	-1	0	335.359	3.864	50	0		EHAARM
O=C([O-])CS[C@@H](C(=O)Nc1ccc(Cl)cc1)c1ccccc1	ZINC000001397039	563386750	/nfs/dbraw/zinc/38/67/50/563386750.db2.gz	QEYOHPDHFPXPHI-OAHLLOKOSA-N	-1	0	335.812	3.838	50	0		EHAARM
O=C(Nc1ccc(Cl)c(Cl)c1)c1c(=O)[nH]c2ccccc2c1[O-]	ZINC000006446926	563568379	/nfs/dbraw/zinc/56/83/79/563568379.db2.gz	LICKNTZJZPUSJI-UHFFFAOYSA-N	-1	0	349.173	3.793	50	0		EHAARM
O=S(=O)([N-]c1cccc(Cl)c1)c1ccccc1Br	ZINC000007402261	563601295	/nfs/dbraw/zinc/60/12/95/563601295.db2.gz	PLOMPDGDEVPBQP-UHFFFAOYSA-N	-1	0	346.633	3.903	50	0		EHAARM
O=c1cc(C(F)(F)F)nc(SCc2c(F)cccc2Cl)[n-]1	ZINC000008648021	563634236	/nfs/dbraw/zinc/63/42/36/563634236.db2.gz	JDRVKSGIROGCGB-UHFFFAOYSA-N	-1	0	338.713	3.874	50	0		EHAARM
CCCOc1cc(C)c(C)cc1S(=O)(=O)[N-]c1cccc(C)n1	ZINC000012560779	563663076	/nfs/dbraw/zinc/66/30/76/563663076.db2.gz	MIUOIOBPZULMSS-UHFFFAOYSA-N	-1	0	334.441	3.596	50	0		EHAARM
Cc1ccccc1C(=O)Nc1ccc(Br)cc1C(=O)[O-]	ZINC000013177711	563691686	/nfs/dbraw/zinc/69/16/86/563691686.db2.gz	SUMDOFCOFQAFBB-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
O=C([O-])CCNc1ncnc2cc(-c3ccc(Cl)cc3)sc21	ZINC000032717249	563700274	/nfs/dbraw/zinc/70/02/74/563700274.db2.gz	BUVQZDOCALCVOK-UHFFFAOYSA-N	-1	0	333.800	3.898	50	0		EHAARM
CC(C)(CC(=O)[O-])CC(=O)Nc1cccc(CCc2ccncc2)c1	ZINC000015108807	563778323	/nfs/dbraw/zinc/77/83/23/563778323.db2.gz	FVKDHPRLZPDOIL-UHFFFAOYSA-N	-1	0	340.423	3.696	50	0		EHAARM
Cc1cccc(Nc2nc(=O)c(Cc3ccc(Cl)cc3)n[n-]2)c1C	ZINC000016777336	563823318	/nfs/dbraw/zinc/82/33/18/563823318.db2.gz	XLXORUCJTLZXEZ-UHFFFAOYSA-N	-1	0	340.814	3.770	50	0		EHAARM
COc1cc([N-]S(=O)(=O)c2ccc(C)s2)c(OC)cc1Cl	ZINC000024070805	563869037	/nfs/dbraw/zinc/86/90/37/563869037.db2.gz	ZWDSAFWNLZSWQU-UHFFFAOYSA-N	-1	0	347.845	3.528	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)/C=C/c2ccc(Cl)s2)C1	ZINC000043584275	563912988	/nfs/dbraw/zinc/91/29/88/563912988.db2.gz	YDTCJJHASGYGEY-OKPNEXGHSA-N	-1	0	327.833	3.518	50	0		EHAARM
O=C([O-])C1(Cc2ccccc2Cl)CCN(c2ncccc2F)CC1	ZINC000071765196	563965507	/nfs/dbraw/zinc/96/55/07/563965507.db2.gz	IZJFCNPDQNXWOB-UHFFFAOYSA-N	-1	0	348.805	3.788	50	0		EHAARM
O=C([O-])[C@@]1(C/C=C/c2ccccc2)CCCN(C(=O)C2CCC2)C1	ZINC000071767641	563965552	/nfs/dbraw/zinc/96/55/52/563965552.db2.gz	IMTBWCJAICSPFM-MRSBXDGLSA-N	-1	0	327.424	3.583	50	0		EHAARM
O=C([O-])c1ccc(F)c(NC(=O)c2cnc(-c3ccsc3)s2)c1	ZINC000097036160	563966947	/nfs/dbraw/zinc/96/69/47/563966947.db2.gz	JUMQZAOSLGYDCC-UHFFFAOYSA-N	-1	0	348.380	3.961	50	0		EHAARM
O=C([N-]C1(c2csc(-c3ccncc3)n2)CCCC1)C(F)(F)F	ZINC000408519649	563993097	/nfs/dbraw/zinc/99/30/97/563993097.db2.gz	LNSASZVHQPFPNN-UHFFFAOYSA-N	-1	0	341.358	3.653	50	0		EHAARM
O=c1c2cc3c(cc2[n-]c(=S)n1CCC1=CCCCC1)OCO3	ZINC000000425080	563998496	/nfs/dbraw/zinc/99/84/96/563998496.db2.gz	ITUHJOXUGRLAGW-UHFFFAOYSA-N	-1	0	330.409	3.678	50	0		EHAARM
CCOc1ccc2nc([N-]S(=O)(=O)c3ccccc3C)sc2c1	ZINC000000363799	564012436	/nfs/dbraw/zinc/01/24/36/564012436.db2.gz	UOWOQWNZOMDIDR-UHFFFAOYSA-N	-1	0	348.449	3.804	50	0		EHAARM
Cc1ccc(S(=O)(=O)C=C([O-])c2ccc(Cl)c(Cl)c2)cc1	ZINC000000556265	564012707	/nfs/dbraw/zinc/01/27/07/564012707.db2.gz	ZMNBNNWDCXJRRV-UHFFFAOYSA-N	-1	0	343.231	3.958	50	0		EHAARM
Cc1coc(CC(=O)[O-])c1C(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000262880946	564052405	/nfs/dbraw/zinc/05/24/05/564052405.db2.gz	HATXZJRIGQHLJI-LBPRGKRZSA-N	-1	0	341.363	3.761	50	0		EHAARM
C[C@H](O)[C@@H]1CC[C@@H]2[C@@H]3CCC(=O)[C@](C)(CCC(=O)[O-])[C@@H]3CC[C@]12C	ZINC000248378468	564053157	/nfs/dbraw/zinc/05/31/57/564053157.db2.gz	JPPQYWISPXWYPP-HHJVODNISA-N	-1	0	336.472	3.660	50	0		EHAARM
CC1(C)Cc2c(sc3[n-]c(=S)n(Cc4ccco4)c(=O)c23)CO1	ZINC000000985955	564053879	/nfs/dbraw/zinc/05/38/79/564053879.db2.gz	LZPBQQIJFBFTPN-UHFFFAOYSA-N	-1	0	348.449	3.613	50	0		EHAARM
O=S(=O)([N-]c1ccc2c[nH]nc2c1)c1cccc(Cl)c1Cl	ZINC000005827282	564056528	/nfs/dbraw/zinc/05/65/28/564056528.db2.gz	WBTVQSWVXWEBLO-UHFFFAOYSA-N	-1	0	342.207	3.671	50	0		EHAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2cc(C)ccc2C)c1=O	ZINC000001248160	564062684	/nfs/dbraw/zinc/06/26/84/564062684.db2.gz	IMYMXAKREUEIAI-UHFFFAOYSA-N	-1	0	336.391	3.596	50	0		EHAARM
O=C([N-]CCc1nc(-c2ccc(Cl)cc2)cs1)C(F)(F)F	ZINC000001415160	564065905	/nfs/dbraw/zinc/06/59/05/564065905.db2.gz	GCMVFOVGEAZTNP-UHFFFAOYSA-N	-1	0	334.750	3.685	50	0		EHAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000012771501	564068945	/nfs/dbraw/zinc/06/89/45/564068945.db2.gz	WDMPOGMAJNACJB-UHFFFAOYSA-N	-1	0	343.810	3.599	50	0		EHAARM
S=c1[nH]c(-c2ccccc2)nn1CN1CCc2sccc2C1	ZINC000012924455	564078448	/nfs/dbraw/zinc/07/84/48/564078448.db2.gz	DPLBXEMRLZAGQF-UHFFFAOYSA-N	-1	0	328.466	3.685	50	0		EHAARM
CCCCN(CC)C(=O)CCn1c(-c2ccc(C)cc2)n[nH]c1=S	ZINC000012945462	564079720	/nfs/dbraw/zinc/07/97/20/564079720.db2.gz	YDWXTUSNOKLRSA-UHFFFAOYSA-N	-1	0	346.500	3.955	50	0		EHAARM
O=S(=O)([N-]c1cccc(Cl)c1)c1ccc(-c2cc[nH]n2)s1	ZINC000075351816	564082027	/nfs/dbraw/zinc/08/20/27/564082027.db2.gz	HNBXGHFFRMKYOQ-UHFFFAOYSA-N	-1	0	339.829	3.592	50	0		EHAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000089351076	564089788	/nfs/dbraw/zinc/08/97/88/564089788.db2.gz	MZPRIWZQWQHZIF-UONOGXRCSA-N	-1	0	343.345	3.712	50	0		EHAARM
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(-c2ccno2)o1	ZINC000064958660	564098539	/nfs/dbraw/zinc/09/85/39/564098539.db2.gz	JLYXLZCNJZIPOE-UHFFFAOYSA-N	-1	0	338.772	3.697	50	0		EHAARM
O=S(=O)([N-]c1ccc(Cl)cc1)c1cc(-c2cc[nH]n2)cs1	ZINC000065112310	564101279	/nfs/dbraw/zinc/10/12/79/564101279.db2.gz	FTKSHTVMFDXATE-UHFFFAOYSA-N	-1	0	339.829	3.592	50	0		EHAARM
CN1C(=O)[C@@H]2CCCC[C@@]2(C(=O)[O-])[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000252590578	564120862	/nfs/dbraw/zinc/12/08/62/564120862.db2.gz	ATIVYQLDEAUSKI-ZENOOKHLSA-N	-1	0	342.222	3.768	50	0		EHAARM
Cc1ccsc1[C@@H]1C[C@H]1C(=O)N[C@@H](CC(=O)[O-])c1cccs1	ZINC000095989359	564144112	/nfs/dbraw/zinc/14/41/12/564144112.db2.gz	GFMAPRHJICAGKC-UTUOFQBUSA-N	-1	0	335.450	3.554	50	0		EHAARM
Cc1noc(-c2ccsc2NC(=O)c2nc3ccccc3s2)n1	ZINC000225659444	564150147	/nfs/dbraw/zinc/15/01/47/564150147.db2.gz	IANVSTMWQJBKNN-UHFFFAOYSA-N	-1	0	342.405	3.969	50	0		EHAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1ncc(-c2ccc(F)cc2)o1	ZINC000299743278	564150554	/nfs/dbraw/zinc/15/05/54/564150554.db2.gz	MWHSQLHZWGXSFM-IMJJTQAJSA-N	-1	0	344.386	3.698	50	0		EHAARM
Cc1ccc(NC(=O)c2nc[n-]c2C(=O)Nc2ccc(C)cc2C)cc1	ZINC000008662581	564166257	/nfs/dbraw/zinc/16/62/57/564166257.db2.gz	YIACXDJAYHXHHZ-UHFFFAOYSA-N	-1	0	348.406	3.840	50	0		EHAARM
CC(C)(C)[C@H]1OCC[C@@H]1CNC(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000073770169	564176412	/nfs/dbraw/zinc/17/64/12/564176412.db2.gz	AZIOGUDSZUDKHS-RISCZKNCSA-N	-1	0	334.441	3.671	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC000261841422	967806717	/nfs/dbraw/zinc/80/67/17/967806717.db2.gz	ITKGYNWGAMAILF-XQQFMLRXSA-N	-1	0	335.366	3.601	50	0		EHAARM
CC[C@@](C)(CC(=O)[O-])CC(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000006847344	1040147611	/nfs/dbraw/zinc/14/76/11/1040147611.db2.gz	RTMSNKDNGNSQJC-MRXNPFEDSA-N	-1	0	343.807	3.577	50	0		EHAARM
O=C([O-])CCN1C(=S)S/C(=C\c2cccc(Cl)c2)C1=S	ZINC000032929460	1122211669	/nfs/dbraw/zinc/21/16/69/1122211669.db2.gz	XIXJTVGSLQDSEU-YFHOEESVSA-N	-1	0	343.882	3.817	50	0		EHAARM
C[C@H](CC(=O)[O-])CC(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000004691212	210248925	/nfs/dbraw/zinc/24/89/25/210248925.db2.gz	GZBJSQGSPLUVTF-AWEZNQCLSA-N	-1	0	327.380	3.705	50	0		EHAARM
CCOc1cc(Cl)c(S(=O)(=O)[N-]c2ccccn2)cc1Cl	ZINC000004660781	210239854	/nfs/dbraw/zinc/23/98/54/210239854.db2.gz	NLAWVMDKQPBJPC-UHFFFAOYSA-N	-1	0	347.223	3.588	50	0		EHAARM
CC(C)(C)c1ccc([C@@H](CC(=O)[O-])NC(=O)c2cccs2)cc1	ZINC000004600858	210231161	/nfs/dbraw/zinc/23/11/61/210231161.db2.gz	RKQYFXQZQGKKLW-CQSZACIVSA-N	-1	0	331.437	3.991	50	0		EHAARM
O=C(C[C@H]1CC[C@H](C(=O)[O-])CC1)c1ccc(Br)cc1	ZINC000100449833	219099887	/nfs/dbraw/zinc/09/98/87/219099887.db2.gz	UQBNQQLWXYCNJS-KLPPZKSPSA-N	-1	0	325.202	3.913	50	0		EHAARM
CCCn1cc(S(=O)(=O)[N-]c2ccccc2C)c2cccnc21	ZINC000065242234	214851599	/nfs/dbraw/zinc/85/15/99/214851599.db2.gz	OPSHFJNXYGHINP-UHFFFAOYSA-N	-1	0	329.425	3.556	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1Nc1ncnc2sc3c(c21)CCC3	ZINC000003418663	210034495	/nfs/dbraw/zinc/03/44/95/210034495.db2.gz	MVPPYRVKJXTDNB-UHFFFAOYSA-N	-1	0	325.393	3.930	50	0		EHAARM
COc1cccc(-c2nccn2C2CCCC2)c1O[C@@H](C)C(=O)[O-]	ZINC000067588757	215165493	/nfs/dbraw/zinc/16/54/93/215165493.db2.gz	KHLFKRIYDCJWAT-LBPRGKRZSA-N	-1	0	330.384	3.526	50	0		EHAARM
CC[C@@H](C)c1ccccc1OCC(=O)Nc1cccc(C(=O)[O-])c1	ZINC000000469708	209621373	/nfs/dbraw/zinc/62/13/73/209621373.db2.gz	LMBXEPRXLSRWDK-CYBMUJFWSA-N	-1	0	327.380	3.916	50	0		EHAARM
CCOc1ccc(NC(=O)[C@@H](CC(=O)[O-])[C@H](C)c2ccccc2)cc1	ZINC000000231646	209496455	/nfs/dbraw/zinc/49/64/55/209496455.db2.gz	VZJPWEDEZGGGAM-KDOFPFPSSA-N	-1	0	341.407	3.918	50	0		EHAARM
O=S(=O)([N-]c1cc(F)cc(F)c1)c1cccc(Br)c1	ZINC000028781227	212635862	/nfs/dbraw/zinc/63/58/62/212635862.db2.gz	AXHGRANGOHDFQX-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
CC(C)Oc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccccc2F)cc1	ZINC000000104982	209422683	/nfs/dbraw/zinc/42/26/83/209422683.db2.gz	OUVUSWOWYVJWJI-KRWDZBQOSA-N	-1	0	345.370	3.559	50	0		EHAARM
CC1=C(C)C[C@@H](C(=O)NCc2csc3ccccc23)[C@H](C(=O)[O-])C1	ZINC000000069833	209399967	/nfs/dbraw/zinc/39/99/67/209399967.db2.gz	VWDPEQJAESBSCA-HZPDHXFCSA-N	-1	0	343.448	3.965	50	0		EHAARM
CC(C)C(=O)Nc1ccc(NC(=O)c2cc(Cl)ccc2[O-])cc1	ZINC000022067820	212275715	/nfs/dbraw/zinc/27/57/15/212275715.db2.gz	QXMWYAGKGMRQPD-UHFFFAOYSA-N	-1	0	332.787	3.892	50	0		EHAARM
O=C(c1ccc([O-])c(Cl)c1)N1CCc2[nH]c3ccccc3c2C1	ZINC000021469061	212224923	/nfs/dbraw/zinc/22/49/23/212224923.db2.gz	RQACCDAUOHWUBY-UHFFFAOYSA-N	-1	0	326.783	3.725	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)N[C@H](C)CCc2ccccc2)[C@@H](C(=O)[O-])C1	ZINC000013153644	211531987	/nfs/dbraw/zinc/53/19/87/211531987.db2.gz	JAECESZJDZEUAG-NJAFHUGGSA-N	-1	0	329.440	3.571	50	0		EHAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(F)(F)F)cc1Cl	ZINC000012773569	211452811	/nfs/dbraw/zinc/45/28/11/211452811.db2.gz	LVVQTXAAIVLYMP-VHSXEESVSA-N	-1	0	347.720	3.964	50	0		EHAARM
C[C@@H](Sc1ccccc1C(=O)[O-])C(=O)Nc1ccc(F)c(F)c1	ZINC000012759187	211447747	/nfs/dbraw/zinc/44/77/47/211447747.db2.gz	NXVDHEIVTMGJGV-SECBINFHSA-N	-1	0	337.347	3.782	50	0		EHAARM
CCc1cccc(NC(=O)c2c([O-])c3ccccc3n(CC)c2=O)c1	ZINC000012414620	211373564	/nfs/dbraw/zinc/37/35/64/211373564.db2.gz	BBCVGQXZZMPJJB-UHFFFAOYSA-N	-1	0	336.391	3.542	50	0		EHAARM
Cc1c(C(=O)Nc2ccccc2C(=O)[O-])oc2c1[C@H](O)CC(C)(C)C2	ZINC000009548014	211100837	/nfs/dbraw/zinc/10/08/37/211100837.db2.gz	HAPAVTRQHOXCFX-CYBMUJFWSA-N	-1	0	343.379	3.544	50	0		EHAARM
O=C([O-])c1cc(Br)ccc1NC(=O)CCc1ccccc1	ZINC000009435043	211082395	/nfs/dbraw/zinc/08/23/95/211082395.db2.gz	BSRFCROCELMSLQ-UHFFFAOYSA-N	-1	0	348.196	3.719	50	0		EHAARM
O=C([O-])COc1cccc(NC(=O)c2cccc(Cl)c2Cl)c1	ZINC000095363287	218295504	/nfs/dbraw/zinc/29/55/04/218295504.db2.gz	FXTYZWUKPOUGFP-UHFFFAOYSA-N	-1	0	340.162	3.709	50	0		EHAARM
O=C([O-])c1cccc([C@H]2CCCN(C(=O)c3cccc(F)c3)C2)c1	ZINC000095363325	218295941	/nfs/dbraw/zinc/29/59/41/218295941.db2.gz	BSPYVXNORHOBQJ-INIZCTEOSA-N	-1	0	327.355	3.544	50	0		EHAARM
Cc1cccc(Nc2nnc(Cc3ccc(Cl)cc3)c(=O)[n-]2)c1	ZINC000008914278	211016856	/nfs/dbraw/zinc/01/68/56/211016856.db2.gz	BBBWZCNWNLUQGL-UHFFFAOYSA-N	-1	0	326.787	3.873	50	0		EHAARM
Cc1ccc(/C=C2\CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)c(C)c1	ZINC000008394781	210948868	/nfs/dbraw/zinc/94/88/68/210948868.db2.gz	ISBHLCBIOOSSAN-XNTDXEJSSA-N	-1	0	346.386	3.656	50	0		EHAARM
Cc1oc(CNC(=O)c2sccc2SC(F)F)cc1C(=O)[O-]	ZINC000095970442	218475425	/nfs/dbraw/zinc/47/54/25/218475425.db2.gz	CBHOGHSHOSKZJM-UHFFFAOYSA-N	-1	0	347.364	3.592	50	0		EHAARM
Cc1nc2cc(-c3ccc(Cl)cc3)nn2c(C)c1CCC(=O)[O-]	ZINC000004992137	210352717	/nfs/dbraw/zinc/35/27/17/210352717.db2.gz	JVFXNRDRZPORIC-UHFFFAOYSA-N	-1	0	329.787	3.684	50	0		EHAARM
Cc1ccc(C[C@H](CC(=O)[O-])C(=O)Nc2cc(C)ccc2C)cc1	ZINC000004756052	210271638	/nfs/dbraw/zinc/27/16/38/210271638.db2.gz	USFQIVBCTNVHKY-QGZVFWFLSA-N	-1	0	325.408	3.884	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)NCc2c(F)cccc2Cl)C1	ZINC000000119100	258047460	/nfs/dbraw/zinc/04/74/60/258047460.db2.gz	GMZWWZZYRIUHQM-NEPJUHHUSA-N	-1	0	339.794	3.543	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N2CCC[C@@H]2c2cccs2)cc1	ZINC000299748297	258007950	/nfs/dbraw/zinc/00/79/50/258007950.db2.gz	GTQAYYPGBAJOEK-OAHLLOKOSA-N	-1	0	329.421	3.743	50	0		EHAARM
Cc1cc(C)c(C(=O)Nc2cccnc2)c(CC(C)(C)C(=O)[O-])c1	ZINC000000138637	563241286	/nfs/dbraw/zinc/24/12/86/563241286.db2.gz	OKPWSZBPWBDCAY-UHFFFAOYSA-N	-1	0	326.396	3.604	50	0		EHAARM
COc1ccccc1C(=O)Nc1sc2c(c1C(=O)[O-])CCCC2	ZINC000000240945	563264947	/nfs/dbraw/zinc/26/49/47/563264947.db2.gz	ZMEXXPATMLXQNQ-UHFFFAOYSA-N	-1	0	331.393	3.586	50	0		EHAARM
COc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1ccc(F)cc1	ZINC000000384724	563301604	/nfs/dbraw/zinc/30/16/04/563301604.db2.gz	UQARISAAXFELHZ-UHFFFAOYSA-N	-1	0	337.416	3.933	50	0		EHAARM
[O-]c1c(Br)cc(Br)cc1Br	ZINC000000388234	563303783	/nfs/dbraw/zinc/30/37/83/563303783.db2.gz	BSWWXRFVMJHFBN-UHFFFAOYSA-N	-1	0	330.801	3.680	50	0	endogenous,in-man	EHAARM
O=C([O-])CC1C(=O)C(=O)N(c2ccccc2)[C@H]1c1ccc(Cl)cc1	ZINC000000548213	563344527	/nfs/dbraw/zinc/34/45/27/563344527.db2.gz	NIDKBNQBLXAVOC-INIZCTEOSA-N	-1	0	343.766	3.715	50	0		EHAARM
Cc1ccccc1C(=O)Nc1c2ccccc2ccc1S(=O)(=O)[O-]	ZINC000002057773	563420307	/nfs/dbraw/zinc/42/03/07/563420307.db2.gz	LBUDXORKYQJSGX-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])Cc1ccc(Cl)c(Cl)c1	ZINC000002385862	563430930	/nfs/dbraw/zinc/43/09/30/563430930.db2.gz	WJEUUKADFJNOHW-SNVBAGLBSA-N	-1	0	348.226	3.904	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])c1ccccc1C(F)(F)F	ZINC000002585829	563443610	/nfs/dbraw/zinc/44/36/10/563443610.db2.gz	DYZRXQICSTZZKP-NSHDSACASA-N	-1	0	333.306	3.746	50	0		EHAARM
Cc1cc(Br)ccc1NC(=O)[C@@H]1CCCC[C@H]1C(=O)[O-]	ZINC000000242515	563594704	/nfs/dbraw/zinc/59/47/04/563594704.db2.gz	SIXQASFELNQYLR-VXGBXAGGSA-N	-1	0	340.217	3.587	50	0		EHAARM
COc1ccc(Cl)cc1NC(=O)C[C@@H](C(=O)[O-])c1ccccc1	ZINC000013250263	563692998	/nfs/dbraw/zinc/69/29/98/563692998.db2.gz	FYQUYGFSNNNGQX-CYBMUJFWSA-N	-1	0	333.771	3.546	50	0		EHAARM
O=C([O-])[C@H](CC(=O)Nc1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC000013253260	563693055	/nfs/dbraw/zinc/69/30/55/563693055.db2.gz	TWDJFDFNBCGLGO-CQSZACIVSA-N	-1	0	337.297	3.902	50	0		EHAARM
O=S(=O)([N-]c1ccc(Br)cc1)c1cc(F)cc(F)c1	ZINC000016100029	563803579	/nfs/dbraw/zinc/80/35/79/563803579.db2.gz	BUKSLWOGIPFICL-UHFFFAOYSA-N	-1	0	348.168	3.528	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccccc1Br	ZINC000016095618	563803621	/nfs/dbraw/zinc/80/36/21/563803621.db2.gz	IDLLFQYMVDEPAQ-UHFFFAOYSA-N	-1	0	340.242	3.812	50	0		EHAARM
CCCc1cc(=O)n2nc(SCc3ccc(Cl)cc3)[n-]c2n1	ZINC000018240912	563851223	/nfs/dbraw/zinc/85/12/23/563851223.db2.gz	OZLHLFVPLRVYCG-UHFFFAOYSA-N	-1	0	334.832	3.728	50	0		EHAARM
O=C([O-])[C@@H](CC(=O)Nc1ccc2c(c1)CCC2)c1ccc(F)cc1	ZINC000025206558	563882228	/nfs/dbraw/zinc/88/22/28/563882228.db2.gz	QAPWJYZHBIOITB-KRWDZBQOSA-N	-1	0	327.355	3.511	50	0		EHAARM
O=S(=O)([N-]c1cccc(OC2CCCC2)c1)c1ccccc1F	ZINC000028259983	563901924	/nfs/dbraw/zinc/90/19/24/563901924.db2.gz	OPVBUPTWVNCLLA-UHFFFAOYSA-N	-1	0	335.400	3.948	50	0		EHAARM
O=C([O-])[C@]1(C/C=C/c2ccccc2)CCCN(c2ncccc2F)C1	ZINC000071403948	563964232	/nfs/dbraw/zinc/96/42/32/563964232.db2.gz	QRESSYFZCAOLTK-CWFIWJMMSA-N	-1	0	340.398	3.995	50	0		EHAARM
CCOC(=O)Nc1cccc(NC(=O)CC2(C(=O)[O-])CCCC2)c1C	ZINC000060511810	563964428	/nfs/dbraw/zinc/96/44/28/563964428.db2.gz	BQUKTUBPCJJMHF-UHFFFAOYSA-N	-1	0	348.399	3.537	50	0		EHAARM
C[C@@H](C(=O)N1CCC[C@H](CCC(=O)[O-])C1)c1cc2ccccc2o1	ZINC000097039520	563966920	/nfs/dbraw/zinc/96/69/20/563966920.db2.gz	XHEYQPURYRSSIK-ZIAGYGMSSA-N	-1	0	329.396	3.640	50	0		EHAARM
CC[C@@]1(C(=O)[O-])CCCN(C(=O)c2cccc(-c3ccc(C)o3)c2)C1	ZINC000091326994	563975305	/nfs/dbraw/zinc/97/53/05/563975305.db2.gz	NVMVJWNJXJQVKT-HXUWFJFHSA-N	-1	0	341.407	3.972	50	0		EHAARM
Cc1cc(C)c([C@H]2CCN(C(=O)OC(C)(C)C)[C@H]2C(=O)[O-])cc1C	ZINC000221032796	563989621	/nfs/dbraw/zinc/98/96/21/563989621.db2.gz	MRDDWYJJPJNRBG-GDBMZVCRSA-N	-1	0	333.428	3.789	50	0		EHAARM
CC(C)[C@@H]1CN(C(=O)c2cc(=O)c3ccccc3[n-]2)c2ccccc21	ZINC000408514953	563992953	/nfs/dbraw/zinc/99/29/53/563992953.db2.gz	IQTWSWYYZFUOPS-INIZCTEOSA-N	-1	0	332.403	3.928	50	0		EHAARM
Cn1c2ccccc2c(Cl)c1C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000237712842	563993728	/nfs/dbraw/zinc/99/37/28/563993728.db2.gz	IEOVTFMDKGKKCB-GFCCVEGCSA-N	-1	0	348.830	3.549	50	0		EHAARM
Cc1nc2cc(F)ccc2cc1C(=O)N1CCCC[C@H]1CCC(=O)[O-]	ZINC000237745352	563993760	/nfs/dbraw/zinc/99/37/60/563993760.db2.gz	HFAIRAMCNAZVNZ-HNNXBMFYSA-N	-1	0	344.386	3.542	50	0		EHAARM
CCN(CCCn1c(=O)c2ccccc2[n-]c1=S)c1ccccc1	ZINC000000425029	563998514	/nfs/dbraw/zinc/99/85/14/563998514.db2.gz	LLFVLDQJHICYAH-UHFFFAOYSA-N	-1	0	339.464	3.976	50	0		EHAARM
CCCOC(=O)[C@@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1C(=O)[O-]	ZINC000002496192	564003832	/nfs/dbraw/zinc/00/38/32/564003832.db2.gz	AXMPLSTZNMYFSE-WZOJCFFYSA-N	-1	0	336.387	3.548	50	0		EHAARM
Cc1ccc2[nH]c(-c3ccccc3NC(=O)CCCC(=O)[O-])nc2c1	ZINC000008709962	564007100	/nfs/dbraw/zinc/00/71/00/564007100.db2.gz	RCGOYAXTZZIBFB-UHFFFAOYSA-N	-1	0	337.379	3.732	50	0		EHAARM
O=C([O-])c1cccnc1SCc1c(F)c(F)c(F)c(F)c1F	ZINC000005670975	564017773	/nfs/dbraw/zinc/01/77/73/564017773.db2.gz	APSPDYKUMHWEJV-UHFFFAOYSA-N	-1	0	335.253	3.768	50	0		EHAARM
Cc1ccc(S(=O)(=O)Nc2cccc3ccccc32)cc1C(=O)[O-]	ZINC000013348714	564019684	/nfs/dbraw/zinc/01/96/84/564019684.db2.gz	AOULAYMFWBQORK-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
O=C([O-])c1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCC4)cc1	ZINC000046703256	564020461	/nfs/dbraw/zinc/02/04/61/564020461.db2.gz	PSWJRKMAEZCHCQ-UHFFFAOYSA-N	-1	0	340.404	3.619	50	0		EHAARM
Cc1cc(C(=O)[O-])c(NC(=O)c2ccc(Br)cc2)s1	ZINC000000548876	564022915	/nfs/dbraw/zinc/02/29/15/564022915.db2.gz	APPBTJVYSHZPAX-UHFFFAOYSA-N	-1	0	340.198	3.770	50	0		EHAARM
CC(=O)Nc1cc(NC(=O)CC2(CC(=O)[O-])CCCCC2)ccc1C	ZINC000048383605	564031738	/nfs/dbraw/zinc/03/17/38/564031738.db2.gz	RGWGCOCOOXWLOR-UHFFFAOYSA-N	-1	0	346.427	3.707	50	0		EHAARM
CSCc1cc(C(=O)N2CCCC[C@H]2CCC(=O)[O-])ccc1F	ZINC000237380104	564074101	/nfs/dbraw/zinc/07/41/01/564074101.db2.gz	AGTRQECEBDTVSZ-AWEZNQCLSA-N	-1	0	339.432	3.548	50	0		EHAARM
CCCCOc1ccccc1NC(=O)c1cc(=O)c2ccccc2[n-]1	ZINC000056133795	564084334	/nfs/dbraw/zinc/08/43/34/564084334.db2.gz	WSEXYJZBRNMRDN-UHFFFAOYSA-N	-1	0	336.391	3.959	50	0		EHAARM
O=C([O-])COc1ccc(NC(=O)C2CCC(F)(F)CC2)cc1Cl	ZINC000191102961	564084819	/nfs/dbraw/zinc/08/48/19/564084819.db2.gz	JHFWCRJAIHHKFE-UHFFFAOYSA-N	-1	0	347.745	3.567	50	0		EHAARM
CCCC(=O)Nc1cccc(NC(=O)c2ccc(F)cc2[O-])c1C	ZINC000123523775	564086543	/nfs/dbraw/zinc/08/65/43/564086543.db2.gz	DDHCCJIYDNKXMB-UHFFFAOYSA-N	-1	0	330.359	3.831	50	0		EHAARM
O=S(=O)([N-]c1ccc(F)cc1)c1cccnc1Nc1ccccc1	ZINC000064757594	564096031	/nfs/dbraw/zinc/09/60/31/564096031.db2.gz	ISPQMPPRHKRJAL-UHFFFAOYSA-N	-1	0	343.383	3.765	50	0		EHAARM
Cc1ccc(C)c(CSC2=Nc3ccccc3S(=O)(=O)[N-]2)c1	ZINC000006918535	564101367	/nfs/dbraw/zinc/10/13/67/564101367.db2.gz	HXLAPMLGIBQFBK-UHFFFAOYSA-N	-1	0	332.450	3.707	50	0		EHAARM
O=S1(=O)[N-]C(SCc2ccccc2Cl)=Nc2ccccc21	ZINC000006918542	564101381	/nfs/dbraw/zinc/10/13/81/564101381.db2.gz	FYIXCDFZXWZLQQ-UHFFFAOYSA-N	-1	0	338.841	3.744	50	0		EHAARM
CCn1nc(C)c([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)c1C	ZINC000014227581	564112371	/nfs/dbraw/zinc/11/23/71/564112371.db2.gz	QHWUHICYFFAXFZ-UHFFFAOYSA-N	-1	0	348.255	3.627	50	0		EHAARM
CCCO[C@H]1CCCN(C(=O)c2ccc3[n-]c(=S)oc3c2)CC1	ZINC000170647604	564120305	/nfs/dbraw/zinc/12/03/05/564120305.db2.gz	SIXMSLKQRKCEED-ZDUSSCGKSA-N	-1	0	334.441	3.538	50	0		EHAARM
O=C([O-])c1ccc(CCC(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000225457373	564134929	/nfs/dbraw/zinc/13/49/29/564134929.db2.gz	ICILTTWIPMCECT-KBPBESRZSA-N	-1	0	343.345	3.555	50	0		EHAARM
O=C(CCc1ncc(-c2ccccc2Cl)o1)Nc1ncccc1O	ZINC000096936874	564149028	/nfs/dbraw/zinc/14/90/28/564149028.db2.gz	CANCQTAXOFDUTR-UHFFFAOYSA-N	-1	0	343.770	3.667	50	0		EHAARM
CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)CCc1ccccc1C(=O)[O-]	ZINC000263565221	564164231	/nfs/dbraw/zinc/16/42/31/564164231.db2.gz	FIVOWTHNAITWGA-ZDUSSCGKSA-N	-1	0	343.345	3.507	50	0		EHAARM
C[C@H](NC(=O)C[C@](C)(C(=O)[O-])c1ccccc1)c1ccc(F)c(F)c1	ZINC000008388753	564164888	/nfs/dbraw/zinc/16/48/88/564164888.db2.gz	MEOFPPTVRMCKOQ-BUXKBTBVSA-N	-1	0	347.361	3.575	50	0		EHAARM
Cc1ncc(CN(C)C(=O)c2ccc(Cl)c(Cl)c2[O-])s1	ZINC000069812507	564172311	/nfs/dbraw/zinc/17/23/11/564172311.db2.gz	IXJWRJOKMUJIKC-UHFFFAOYSA-N	-1	0	331.224	3.736	50	0		EHAARM
CCCCN(C)c1ccc(NC(=O)Cc2cccs2)c(C(=O)[O-])c1	ZINC000045967572	564177290	/nfs/dbraw/zinc/17/72/90/564177290.db2.gz	WBUMZGGWSZPDJZ-UHFFFAOYSA-N	-1	0	346.452	3.864	50	0		EHAARM
CCc1cc2c(cc1[O-])occ(-c1cnn(-c3ccccc3)c1)c2=O	ZINC000006519584	568414805	/nfs/dbraw/zinc/41/48/05/568414805.db2.gz	PZNBYJKQNRMPNZ-UHFFFAOYSA-N	-1	0	332.359	3.914	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)ns2)C1	ZINC000263103490	950266248	/nfs/dbraw/zinc/26/62/48/950266248.db2.gz	JBLPOXIWBSPNCD-ZDUSSCGKSA-N	-1	0	344.436	3.527	50	0		EHAARM
Cc1c(Br)ccc(NC(=O)OC(C)(C)C)c1C(=O)[O-]	ZINC000148530222	1027383593	/nfs/dbraw/zinc/38/35/93/1027383593.db2.gz	JNHCXHHHNXWBCC-UHFFFAOYSA-N	-1	0	330.178	3.803	50	0		EHAARM
CC(C)c1ncc(Cl)c(C(=O)Nc2ccc(/C=C/C(=O)[O-])cc2)n1	ZINC000170602309	1033306673	/nfs/dbraw/zinc/30/66/73/1033306673.db2.gz	WKJRWYKVWBOJMH-VMPITWQZSA-N	-1	0	345.786	3.604	50	0		EHAARM
C[C@@H](CC(=O)[O-])CC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000565550197	1130767358	/nfs/dbraw/zinc/76/73/58/1130767358.db2.gz	VBXGCRVYJJQGGI-DNVCBOLYSA-N	-1	0	337.419	3.814	50	0		EHAARM
O=C([O-])[C@H]1CCCCN1C(=O)c1ccc(-c2cccc(F)c2)cc1	ZINC000952969738	1137484048	/nfs/dbraw/zinc/48/40/48/1137484048.db2.gz	MXZJXCXHFIBTQF-QGZVFWFLSA-N	-1	0	327.355	3.572	50	0		EHAARM
O=c1nc(CN(Cc2ccco2)C2CCCC2)[n-]c2ccsc21	ZINC000053140093	214166123	/nfs/dbraw/zinc/16/61/23/214166123.db2.gz	JQFITKQMJCXZSS-UHFFFAOYSA-N	-1	0	329.425	3.935	50	0		EHAARM
O=C([O-])c1cccc(C(=O)N(Cc2c(F)cccc2Cl)C2CC2)c1	ZINC000097698617	219049369	/nfs/dbraw/zinc/04/93/69/219049369.db2.gz	ODCBKZRAVOGGHL-UHFFFAOYSA-N	-1	0	347.773	3.982	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)c1ccco1)c1ccc(OC2CCCC2)cc1	ZINC000004689302	210249505	/nfs/dbraw/zinc/24/95/05/210249505.db2.gz	LNQQHZDUSZDTOV-INIZCTEOSA-N	-1	0	343.379	3.547	50	0		EHAARM
CC(C)CC(=O)n1c(=O)c2cc(Cl)cc(Cl)c2[n-]c1=S	ZINC000100016101	219088054	/nfs/dbraw/zinc/08/80/54/219088054.db2.gz	VMMNRLBTWRTKBG-UHFFFAOYSA-N	-1	0	331.224	3.678	50	0		EHAARM
COc1cccc(C(=O)N[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1	ZINC000004089477	210117852	/nfs/dbraw/zinc/11/78/52/210117852.db2.gz	OBBKXDRLZIHHQZ-GOSISDBHSA-N	-1	0	341.407	3.764	50	0		EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CC2)[C@@H]1c1ccc(Cl)cc1	ZINC000045923064	213766382	/nfs/dbraw/zinc/76/63/82/213766382.db2.gz	PRNVLCNPBOLZHG-IAGOWNOFSA-N	-1	0	341.794	3.868	50	0		EHAARM
CCOc1cccc(=O)c2c(C)n(-c3ccc(C(=O)[O-])cc3)c(C)c21	ZINC000003999908	210096918	/nfs/dbraw/zinc/09/69/18/210096918.db2.gz	CRUYZMAOBHSDEY-UHFFFAOYSA-N	-1	0	337.375	3.704	50	0	biogenic	EHAARM
O=C([O-])[C@@H]1CS[C@@H](c2cccc(OCc3ccc(Cl)cc3)c2)N1	ZINC000003642579	210069999	/nfs/dbraw/zinc/06/99/99/210069999.db2.gz	MTJOHDVAHGAFOD-HOTGVXAUSA-N	-1	0	349.839	3.707	50	0		EHAARM
O=C([O-])[C@H]1CS[C@@H](c2cccc(OCc3ccc(Cl)cc3)c2)N1	ZINC000003642576	210069889	/nfs/dbraw/zinc/06/98/89/210069889.db2.gz	MTJOHDVAHGAFOD-CVEARBPZSA-N	-1	0	349.839	3.707	50	0		EHAARM
Cc1ccc(C(=O)N[C@@H](CC(=O)[O-])c2ccc(Cl)cc2)cc1C	ZINC000003399306	210028488	/nfs/dbraw/zinc/02/84/88/210028488.db2.gz	PKGWONIMZIWQNJ-INIZCTEOSA-N	-1	0	331.799	3.903	50	0		EHAARM
O=C([O-])[C@@H]1CCCC[C@H]1CC(=O)c1ccc(Br)cc1	ZINC000043879384	213600681	/nfs/dbraw/zinc/60/06/81/213600681.db2.gz	OKDDEYGDICYAOL-WCQYABFASA-N	-1	0	325.202	3.913	50	0		EHAARM
O=C([O-])[C@@H](Cc1ccc2ccccc2c1)NC(=O)OCc1ccccc1	ZINC000002555633	209867209	/nfs/dbraw/zinc/86/72/09/209867209.db2.gz	XBRPIBMAJOTVHG-LJQANCHMSA-N	-1	0	349.386	3.762	50	0		EHAARM
O=C([O-])c1ccccc1CC(=O)Nc1nc(-c2cccs2)cs1	ZINC000071284673	215752675	/nfs/dbraw/zinc/75/26/75/215752675.db2.gz	RWAXULKUNKDINI-UHFFFAOYSA-N	-1	0	344.417	3.751	50	0		EHAARM
O=C([O-])[C@@H](Cc1ccco1)n1ccnc1-c1coc(-c2ccccc2)n1	ZINC000071754102	215812104	/nfs/dbraw/zinc/81/21/04/215812104.db2.gz	WJXYFUHSZPMWLT-MRXNPFEDSA-N	-1	0	349.346	3.667	50	0		EHAARM
CC(C)(C(=O)N1CC[C@@H](c2ccccc2C(=O)[O-])C1)c1ccccc1	ZINC000072123908	216016925	/nfs/dbraw/zinc/01/69/25/216016925.db2.gz	ONDIDBNZMPISDT-OAHLLOKOSA-N	-1	0	337.419	3.679	50	0		EHAARM
Cc1ccc(Cl)cc1C(=O)N1CC[C@H](c2ccccc2C(=O)[O-])C1	ZINC000072150969	216039731	/nfs/dbraw/zinc/03/97/31/216039731.db2.gz	YSMCDUBCWZWXMN-ZDUSSCGKSA-N	-1	0	343.810	3.976	50	0		EHAARM
O=C([O-])c1ccccc1[C@H]1CCN(C(=O)c2cccc3ncccc32)C1	ZINC000072157925	216048212	/nfs/dbraw/zinc/04/82/12/216048212.db2.gz	VAMGGSVYNUZFHJ-AWEZNQCLSA-N	-1	0	346.386	3.563	50	0		EHAARM
CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2ccccc2C(=O)[O-])cc1	ZINC000000258715	209507078	/nfs/dbraw/zinc/50/70/78/209507078.db2.gz	OMBPMRUTJZQUMN-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
C[C@H](Oc1ccc2c(c1)occ(-c1ccc(Cl)cc1)c2=O)C(=O)[O-]	ZINC000000065011	209396686	/nfs/dbraw/zinc/39/66/86/209396686.db2.gz	CTMABIYOLDOKQE-JTQLQIEISA-N	-1	0	344.750	3.965	50	0		EHAARM
Cc1ccc([C@@H]2C[C@H](C(F)(F)F)n3ncc(C(=O)[O-])c3N2)cc1C	ZINC000020616887	212156353	/nfs/dbraw/zinc/15/63/53/212156353.db2.gz	OGLOQIHCRMSYSJ-QWHCGFSZSA-N	-1	0	339.317	3.858	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)NC(c1ccccc1)c1ccccc1	ZINC000020509586	212141396	/nfs/dbraw/zinc/14/13/96/212141396.db2.gz	PSHSPWLMOCXLJN-ROUUACIJSA-N	-1	0	335.403	3.559	50	0		EHAARM
O=C([O-])C[C@@H](CC(=O)NCc1ccc(Cl)cc1)c1ccccc1	ZINC000145943054	223722437	/nfs/dbraw/zinc/72/24/37/223722437.db2.gz	LZTCVBOTFNGCPQ-OAHLLOKOSA-N	-1	0	331.799	3.605	50	0		EHAARM
O=C([O-])c1ccc(Cl)c(NC(=O)CSCc2ccccc2)c1	ZINC000013167785	211533051	/nfs/dbraw/zinc/53/30/51/211533051.db2.gz	XIOOJCLQLMBYLS-UHFFFAOYSA-N	-1	0	335.812	3.910	50	0		EHAARM
Cc1nn(CC(=O)[O-])c2nc(-c3cccs3)cc(C(F)(F)F)c12	ZINC000012395240	211367413	/nfs/dbraw/zinc/36/74/13/211367413.db2.gz	UGOXRWCMROTIHW-UHFFFAOYSA-N	-1	0	341.314	3.572	50	0		EHAARM
O=C([O-])[C@H](NC(=O)C(c1ccccc1)c1ccccc1)c1ccccc1	ZINC000011767308	211246581	/nfs/dbraw/zinc/24/65/81/211246581.db2.gz	TUEBEFJSLZPNJI-HXUWFJFHSA-N	-1	0	345.398	3.761	50	0		EHAARM
Cn1c2ccc(Cl)cc2nc1C(=O)/C=C\c1ccc(C(=O)[O-])cc1	ZINC000096055547	218545932	/nfs/dbraw/zinc/54/59/32/218545932.db2.gz	CIQBQTZYWLZSKQ-WTKPLQERSA-N	-1	0	340.766	3.821	50	0		EHAARM
CC1=C(C)C[C@H](C(=O)Nc2ccc(F)c(Cl)c2)[C@@H](C(=O)[O-])C1	ZINC000004892882	210314137	/nfs/dbraw/zinc/31/41/37/210314137.db2.gz	ZSCYJINYFFACSA-RYUDHWBXSA-N	-1	0	325.767	3.865	50	0		EHAARM
CCCOc1ccc(S(=O)(=O)[N-]c2cccnc2)cc1C(C)C	ZINC000011565837	258054362	/nfs/dbraw/zinc/05/43/62/258054362.db2.gz	LRWDGPYXPYEKIE-UHFFFAOYSA-N	-1	0	334.441	3.795	50	0		EHAARM
COc1cc2cc(C(=O)c3cc(Cl)ccc3[O-])cnc2cc1OC	ZINC000020086303	258057209	/nfs/dbraw/zinc/05/72/09/258057209.db2.gz	WTLFRGZNYJNNHS-UHFFFAOYSA-N	-1	0	343.766	3.842	50	0		EHAARM
Cc1cc2cc(C(=O)N3CCC[C@H](CCC(=O)[O-])C3)oc2cc1C	ZINC000097045109	258068215	/nfs/dbraw/zinc/06/82/15/258068215.db2.gz	YQHHIZOZPBXJPL-CQSZACIVSA-N	-1	0	329.396	3.767	50	0		EHAARM
CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc3[n-]c(=S)oc3c2)C12CCC2	ZINC000132592085	527901275	/nfs/dbraw/zinc/90/12/75/527901275.db2.gz	XVSQKNWXZXUTIU-LSDHHAIUSA-N	-1	0	346.452	3.536	50	0		EHAARM
COc1cc(C(=O)[O-])c(NC(=O)OC(C)(C)C)cc1Br	ZINC000536959468	564091781	/nfs/dbraw/zinc/09/17/81/564091781.db2.gz	NRISPOKGYFRFRW-UHFFFAOYSA-N	-1	0	346.177	3.503	50	0		EHAARM
O=S(=O)(C=C([O-])c1c(F)cccc1Cl)c1ccc(Cl)cc1	ZINC000000076720	563217234	/nfs/dbraw/zinc/21/72/34/563217234.db2.gz	VWKQQBIYJOHXRW-UHFFFAOYSA-N	-1	0	347.194	3.789	50	0		EHAARM
O=C([O-])[C@H]1CC[C@H]1C(=O)Nc1nc(-c2ccc(Cl)s2)cs1	ZINC000000117976	563232912	/nfs/dbraw/zinc/23/29/12/563232912.db2.gz	OIDOYFPJSCJXLV-RQJHMYQMSA-N	-1	0	342.829	3.574	50	0		EHAARM
CCC(=O)N1[C@@H](C(=O)[O-])Cc2c3ccccc3[nH]c2[C@@H]1CC(C)C	ZINC000005296782	563525579	/nfs/dbraw/zinc/52/55/79/563525579.db2.gz	FVEKIDYDEYCOKO-JKSUJKDBSA-N	-1	0	328.412	3.503	50	0		EHAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2ccc(Br)s2)c1	ZINC000007056386	563594602	/nfs/dbraw/zinc/59/46/02/563594602.db2.gz	DDLODHYYWBOLLN-UHFFFAOYSA-N	-1	0	346.271	3.928	50	0		EHAARM
COc1ccc(Nc2nnc(Cc3ccc(Cl)cc3)c(=O)[n-]2)cc1	ZINC000008743646	563638837	/nfs/dbraw/zinc/63/88/37/563638837.db2.gz	BUTUPRCCCOHJRM-UHFFFAOYSA-N	-1	0	342.786	3.574	50	0		EHAARM
COc1ccc2cc(C(=O)NCCCCCCC(=O)[O-])ccc2c1	ZINC000012998812	563684106	/nfs/dbraw/zinc/68/41/06/563684106.db2.gz	JHBUZCNLYJXUSW-UHFFFAOYSA-N	-1	0	329.396	3.613	50	0		EHAARM
O=C([O-])c1ccc(/C=C2\C(=O)Nc3ccc(Br)cc32)cc1	ZINC000015016131	563772321	/nfs/dbraw/zinc/77/23/21/563772321.db2.gz	FJJOERDWQBCVAB-QPEQYQDCSA-N	-1	0	344.164	3.640	50	0		EHAARM
COc1ccc(C)cc1[N-]c1nc(-c2ccc(OC)c(OC)c2)no1	ZINC000071928087	563805658	/nfs/dbraw/zinc/80/56/58/563805658.db2.gz	RSQDTTYVZMEKDQ-UHFFFAOYSA-N	-1	0	341.367	3.814	50	0		EHAARM
COc1cccc(Nc2nnc(Cc3ccccc3Cl)c(=O)[n-]2)c1	ZINC000016777347	563823343	/nfs/dbraw/zinc/82/33/43/563823343.db2.gz	BHPIQNNTIRFPGO-UHFFFAOYSA-N	-1	0	342.786	3.574	50	0		EHAARM
CC[C@@H](c1ccc2cc(OC)ccc2c1)[C@@H](CC(=O)[O-])C(=O)OC	ZINC000000393190	563842281	/nfs/dbraw/zinc/84/22/81/563842281.db2.gz	UCKVSTWLDCKQLF-DLBZAZTESA-N	-1	0	330.380	3.606	50	0		EHAARM
O=C1[N-]C(=S)N(c2ccc(F)cc2)C(=O)C1=Cc1cccc(F)c1	ZINC000000478884	563844342	/nfs/dbraw/zinc/84/43/42/563844342.db2.gz	ASLAQJMAAYLSAV-NTEUORMPSA-N	-1	0	344.342	3.636	50	0		EHAARM
Cc1cc(-c2c(C)[n-]n(-c3ccccc3)c2=O)n(-c2ccccc2)n1	ZINC000018031382	563847469	/nfs/dbraw/zinc/84/74/69/563847469.db2.gz	WYVQTSJWCZXENQ-LJQANCHMSA-N	-1	0	330.391	3.687	50	0		EHAARM
O=C([O-])c1ccc(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)o1	ZINC000238012658	563962184	/nfs/dbraw/zinc/96/21/84/563962184.db2.gz	VGXIVBLCFHMLMS-HNNXBMFYSA-N	-1	0	338.363	3.827	50	0		EHAARM
O=C([O-])c1ccc(C(=O)Nc2ccc(COC3CCCC3)cc2)o1	ZINC000238046438	563962254	/nfs/dbraw/zinc/96/22/54/563962254.db2.gz	PBGIUFNLXZMMPV-UHFFFAOYSA-N	-1	0	329.352	3.689	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CC(=O)Nc3c2cnn3C2CCCC2)cc1	ZINC000071283732	563964123	/nfs/dbraw/zinc/96/41/23/563964123.db2.gz	ARJSCAVEUJGGSR-CQSZACIVSA-N	-1	0	325.368	3.820	50	0		EHAARM
CC(C)n1ccc(CC(=O)Nc2ccc3sc(C(=O)[O-])cc3c2)n1	ZINC000097018474	563966773	/nfs/dbraw/zinc/96/67/73/563966773.db2.gz	JFOSYISOGFQNTJ-UHFFFAOYSA-N	-1	0	343.408	3.558	50	0		EHAARM
CC(C(=O)[O-])=C1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000725240418	563973687	/nfs/dbraw/zinc/97/36/87/563973687.db2.gz	DJUAUYXNYUTHIY-UHFFFAOYSA-N	-1	0	349.386	3.652	50	0		EHAARM
CCOc1ccc(NC(=O)[C@@H](CC(=O)[O-])[C@@H](C)c2ccccc2)cc1	ZINC000000231643	563989026	/nfs/dbraw/zinc/98/90/26/563989026.db2.gz	VZJPWEDEZGGGAM-KSSFIOAISA-N	-1	0	341.407	3.918	50	0		EHAARM
COc1cccc2c1N1C(=O)c3c(cccc3C(=O)[O-])[C@@H]1CC2(C)C	ZINC000000235509	563989058	/nfs/dbraw/zinc/98/90/58/563989058.db2.gz	XZPACUICPVWESN-AWEZNQCLSA-N	-1	0	337.375	3.776	50	0	biogenic	EHAARM
COc1ccc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)c(OC)c1	ZINC000000270126	563990026	/nfs/dbraw/zinc/99/00/26/563990026.db2.gz	FOXYYWVCLHUHOW-UHFFFAOYSA-N	-1	0	349.452	3.703	50	0		EHAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n([C@@H]1CCCC[C@@H]1C)c2=O	ZINC000000425243	563998926	/nfs/dbraw/zinc/99/89/26/563998926.db2.gz	ISKIQBBLHZBAII-IINYFYTJSA-N	-1	0	332.425	3.597	50	0		EHAARM
CC(=O)Nc1cc(NC(=O)CC2(C(=O)[O-])CCCCCC2)ccc1C	ZINC000048383603	564031717	/nfs/dbraw/zinc/03/17/17/564031717.db2.gz	INOHHUCUCVJVQS-UHFFFAOYSA-N	-1	0	346.427	3.707	50	0		EHAARM
CCc1ccc(NC2=NC(=O)[C@H](Cc3ccc(OC)cc3)S2)cc1	ZINC000005809638	564033138	/nfs/dbraw/zinc/03/31/38/564033138.db2.gz	NOFQLRCPBFPDLE-KRWDZBQOSA-N	-1	0	340.448	3.910	50	0		EHAARM
O=c1nc(-c2nc3ccccc3o2)[n-]c2sc3c(c21)CCCS3	ZINC000225517678	564047485	/nfs/dbraw/zinc/04/74/85/564047485.db2.gz	HZMHXIXGAAJURA-UHFFFAOYSA-N	-1	0	341.417	3.831	50	0		EHAARM
O=C([O-])c1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)s1	ZINC000096308925	564049722	/nfs/dbraw/zinc/04/97/22/564049722.db2.gz	XNKIFUZXHHCKFC-SREVYHEPSA-N	-1	0	336.372	3.799	50	0		EHAARM
C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@@H](O)CC[C@@]43C)[C@H]1CC[C@@]2(O)CC(=O)[O-]	ZINC000257346215	564055881	/nfs/dbraw/zinc/05/58/81/564055881.db2.gz	VAPBKEAUXQVFHX-PTAHHKKXSA-N	-1	0	348.483	3.516	50	0		EHAARM
O=S(=O)(C=C([O-])c1ccc(Cl)cc1Cl)c1ccc(F)cc1	ZINC000001396914	564064926	/nfs/dbraw/zinc/06/49/26/564064926.db2.gz	YNJFHQYVPKZOKU-UHFFFAOYSA-N	-1	0	347.194	3.789	50	0		EHAARM
COc1cccc([N-]c2nc(-c3cc(OC)ccc3OC)no2)c1	ZINC000015680425	564070723	/nfs/dbraw/zinc/07/07/23/564070723.db2.gz	WEGNCYITYLRVRZ-UHFFFAOYSA-N	-1	0	327.340	3.506	50	0		EHAARM
C[C@H](CC(=O)N1CCC(C(=O)[O-])CC1)c1cccc(C(F)(F)F)c1	ZINC000237519268	564082985	/nfs/dbraw/zinc/08/29/85/564082985.db2.gz	HFHGFWWUMKEJLZ-LLVKDONJSA-N	-1	0	343.345	3.522	50	0		EHAARM
CCCc1cc(=O)[nH]c(SCC(=O)C23CC4CC(CC(C4)C2)C3)n1	ZINC000006311382	564084455	/nfs/dbraw/zinc/08/44/55/564084455.db2.gz	YNEKCLZBTFZCAY-UHFFFAOYSA-N	-1	0	346.496	3.600	50	0		EHAARM
CC(C)(C)c1ccc(S(=O)(=O)Nc2ccc3c[nH]nc3c2)cc1	ZINC000006415555	564085606	/nfs/dbraw/zinc/08/56/06/564085606.db2.gz	GRYNWVAHVBUBEH-UHFFFAOYSA-N	-1	0	329.425	3.661	50	0		EHAARM
Cc1ccccc1C(=O)Nc1ccc(N2CCCCC2)cc1C(=O)[O-]	ZINC000064588841	564092558	/nfs/dbraw/zinc/09/25/58/564092558.db2.gz	ZLSWSKWNTDKEON-UHFFFAOYSA-N	-1	0	338.407	3.936	50	0		EHAARM
CCCn1nccc1-c1csc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000065112624	564101298	/nfs/dbraw/zinc/10/12/98/564101298.db2.gz	UQQPQJNSTARAHT-UHFFFAOYSA-N	-1	0	347.465	3.822	50	0		EHAARM
Cc1c(NC(=O)c2cnn(C3CCCCC3)c2)cccc1C(=O)[O-]	ZINC000170044312	564105010	/nfs/dbraw/zinc/10/50/10/564105010.db2.gz	YYIHAHRTZFITNQ-UHFFFAOYSA-N	-1	0	327.384	3.647	50	0		EHAARM
Cc1ccc(-c2ccc(NC(=O)[C@@H]3[C@H]4C=C[C@H](C4)[C@@H]3C(=O)[O-])cc2)o1	ZINC000002208754	564121222	/nfs/dbraw/zinc/12/12/22/564121222.db2.gz	FKSLNBYCLBTOCK-JFTQMJAMSA-N	-1	0	337.375	3.716	50	0		EHAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc2ccccc21	ZINC000007708230	564122131	/nfs/dbraw/zinc/12/21/31/564122131.db2.gz	BDXPOUAOZSQGGS-UHFFFAOYSA-N	-1	0	341.388	3.647	50	0		EHAARM
O=C([O-])Cc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F	ZINC000195542617	564123664	/nfs/dbraw/zinc/12/36/64/564123664.db2.gz	LYZWKGLAFXJYMD-UHFFFAOYSA-N	-1	0	337.297	3.514	50	0		EHAARM
O=C([N-]C1=NCCCC1=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000019894178	564129078	/nfs/dbraw/zinc/12/90/78/564129078.db2.gz	ZMYYQGIYJPBLCT-UHFFFAOYSA-N	-1	0	333.697	3.724	50	0		EHAARM
O=C(Cc1csc(Nc2ncnc3ncccc32)n1)c1ccccc1	ZINC000095434835	564140405	/nfs/dbraw/zinc/14/04/05/564140405.db2.gz	JTDNIQFLFHSJPN-UHFFFAOYSA-N	-1	0	347.403	3.650	50	0		EHAARM
C[C@]([N-]S(=O)(=O)c1cccc(F)c1)(c1ccccc1)C(F)(F)F	ZINC000095944113	564142150	/nfs/dbraw/zinc/14/21/50/564142150.db2.gz	AATOHMHVIMHSRX-AWEZNQCLSA-N	-1	0	347.333	3.582	50	0		EHAARM
O=C([O-])c1ccc(CNC(=O)c2cc3cc(F)ccc3s2)cc1	ZINC000008392054	564164992	/nfs/dbraw/zinc/16/49/92/564164992.db2.gz	XTYNWJVGAXMFNY-UHFFFAOYSA-N	-1	0	329.352	3.669	50	0		EHAARM
COc1cc([N+](=O)[O-])cc(/C=C2\Sc3ccccc3C2=O)c1[O-]	ZINC000036237500	564177550	/nfs/dbraw/zinc/17/75/50/564177550.db2.gz	URFXSYJLFDDPRT-AUWJEWJLSA-N	-1	0	329.333	3.639	50	0		EHAARM
O=c1cc(C(F)F)nc(-c2ncc(C(F)(F)F)cc2Cl)[n-]1	ZINC000261494849	1019372909	/nfs/dbraw/zinc/37/29/09/1019372909.db2.gz	MDKAAAXZLPHZLW-UHFFFAOYSA-N	-1	0	325.624	3.854	50	0		EHAARM
Cc1nn(C)c([N-]S(=O)(=O)c2ccc(C3CCCCC3)cc2)c1C	ZINC000107037145	1027726276	/nfs/dbraw/zinc/72/62/76/1027726276.db2.gz	LICSSJKLIISLAF-UHFFFAOYSA-N	-1	0	347.484	3.885	50	0		EHAARM
Cc1csc(S(=O)(=O)[N-]c2cc(C3CCCCC3)nn2C)c1	ZINC000333744185	1041731923	/nfs/dbraw/zinc/73/19/23/1041731923.db2.gz	WJWQKWVEUWODJR-UHFFFAOYSA-N	-1	0	339.486	3.639	50	0		EHAARM
O=C(Nc1ccccc1N1CCCC1)c1cc(F)c(F)c([O-])c1F	ZINC000183356042	1131410575	/nfs/dbraw/zinc/41/05/75/1131410575.db2.gz	UVSZPMOLZGKYQT-UHFFFAOYSA-N	-1	0	336.313	3.662	50	0		EHAARM
CCc1nn(C)cc1/C=C\c1cc(C(=O)[O-])c2ccc(F)cc2n1	ZINC000222097155	1138244283	/nfs/dbraw/zinc/24/42/83/1138244283.db2.gz	CQSZWGIRCBTJGK-XQRVVYSFSA-N	-1	0	325.343	3.538	50	0		EHAARM
CCOc1cc(CO)cc(Cl)c1OCc1cccc(C(=O)[O-])c1	ZINC000004739248	210266263	/nfs/dbraw/zinc/26/62/63/210266263.db2.gz	VOAZHRNLSGBBJN-UHFFFAOYSA-N	-1	0	336.771	3.508	50	0		EHAARM
Cc1ccc(/C=C2/CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)c(C)c1	ZINC000097993528	219066471	/nfs/dbraw/zinc/06/64/71/219066471.db2.gz	ISBHLCBIOOSSAN-GDNBJRDFSA-N	-1	0	346.386	3.656	50	0		EHAARM
CC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(=O)[O-])cc1	ZINC000004546761	210218646	/nfs/dbraw/zinc/21/86/46/210218646.db2.gz	RZQIBGXCHZEONC-UHFFFAOYSA-N	-1	0	327.380	3.700	50	0	in-vivo	EHAARM
CCn1c(=O)c(C(=O)Nc2cccc(Cl)c2)c([O-])c2ccccc21	ZINC000100534635	219101517	/nfs/dbraw/zinc/10/15/17/219101517.db2.gz	BCCMYOOPOBFBRI-UHFFFAOYSA-N	-1	0	342.782	3.633	50	0		EHAARM
Cc1ccc(Oc2ccc(N3C[C@@H](C(=O)[O-])CC3=O)cc2)cc1C	ZINC000004385069	210185407	/nfs/dbraw/zinc/18/54/07/210185407.db2.gz	HSLLPRNNVWFBGE-AWEZNQCLSA-N	-1	0	325.364	3.533	50	0		EHAARM
O=C([O-])c1c(NC(=O)CCc2ccccc2)sc2c1CCCC2	ZINC000004155096	210133566	/nfs/dbraw/zinc/13/35/66/210133566.db2.gz	KHACIRHRQWTWII-UHFFFAOYSA-N	-1	0	329.421	3.896	50	0		EHAARM
Cc1ccc(NC(=O)Cc2c3ccccc3n(C)c2C(=O)[O-])cc1F	ZINC000003660265	210072545	/nfs/dbraw/zinc/07/25/45/210072545.db2.gz	LFQFDAAQUMZZGO-UHFFFAOYSA-N	-1	0	340.354	3.505	50	0		EHAARM
Cc1ccc(S(=O)(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)cc1C	ZINC000067340583	215135233	/nfs/dbraw/zinc/13/52/33/215135233.db2.gz	VOSZQKPSAQKMFP-UHFFFAOYSA-N	-1	0	349.358	3.668	50	0		EHAARM
O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)c1cc(Cl)ccc1[O-]	ZINC000036739616	213114302	/nfs/dbraw/zinc/11/43/02/213114302.db2.gz	DODRLOIGTPYILC-HNNXBMFYSA-N	-1	0	347.798	3.856	50	0		EHAARM
COc1ccc(NC(=O)[C@@H](C)[C@@H](Cc2ccc(C)cc2)C(=O)[O-])cc1	ZINC000035142044	213009200	/nfs/dbraw/zinc/00/92/00/213009200.db2.gz	UVUBRMPGPVRXGS-KBXCAEBGSA-N	-1	0	341.407	3.522	50	0		EHAARM
CCOc1ccc(NC(=O)C[C@@H](C(=O)[O-])[C@@H](C)c2ccccc2)cc1	ZINC000035142200	213009844	/nfs/dbraw/zinc/00/98/44/213009844.db2.gz	BALWTZPZJNFWNG-KBXCAEBGSA-N	-1	0	341.407	3.918	50	0		EHAARM
O=C([O-])c1ccccc1[C@@H]1CCN(C(=O)c2cccc3cccnc32)C1	ZINC000072164530	216052830	/nfs/dbraw/zinc/05/28/30/216052830.db2.gz	QMRKIIIJXWHOAR-OAHLLOKOSA-N	-1	0	346.386	3.563	50	0		EHAARM
O=C([O-])/C=C/C(=O)Nc1nc2c(s1)CCCCCCCCCC2	ZINC000072334034	216156458	/nfs/dbraw/zinc/15/64/58/216156458.db2.gz	QKHVFRDVGBPZQX-VAWYXSNFSA-N	-1	0	336.457	3.942	50	0		EHAARM
Cc1sc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])nc1-c1ccccc1	ZINC000000204919	209483234	/nfs/dbraw/zinc/48/32/34/209483234.db2.gz	WBTSRBHBHLSUHT-ZIAGYGMSSA-N	-1	0	342.420	3.724	50	0		EHAARM
C[C@H](NC(=O)c1ccc([O-])c(Cl)c1)c1ccc(-n2ccnc2)cc1	ZINC000023563387	212383283	/nfs/dbraw/zinc/38/32/83/212383283.db2.gz	AOYARPBXZBSTNA-LBPRGKRZSA-N	-1	0	341.798	3.722	50	0		EHAARM
CCc1nc2sc([C@@H](c3cccs3)N3CCCCC3)c([O-])n2n1	ZINC000022853156	212329383	/nfs/dbraw/zinc/32/93/83/212329383.db2.gz	DRPHTTUZPPPRLI-CYBMUJFWSA-N	-1	0	348.497	3.696	50	0		EHAARM
Cc1nn(C(C)C)c(C)c1NC(=O)C[C@H](CC(=O)[O-])c1ccccc1	ZINC000226750040	242113692	/nfs/dbraw/zinc/11/36/92/242113692.db2.gz	HTBBXKSBLMHJGZ-MRXNPFEDSA-N	-1	0	343.427	3.668	50	0		EHAARM
Cc1nn(CC(=O)[O-])c2nc(-c3ccccc3)cc(C(F)(F)F)c12	ZINC000020349731	212121733	/nfs/dbraw/zinc/12/17/33/212121733.db2.gz	IPLLGBHELDDWIQ-UHFFFAOYSA-N	-1	0	335.285	3.510	50	0		EHAARM
Cc1sc2ncnc(NCCCC(=O)[O-])c2c1-c1ccccc1	ZINC000020278894	212115536	/nfs/dbraw/zinc/11/55/36/212115536.db2.gz	FRFRTRVJGOCUFO-UHFFFAOYSA-N	-1	0	327.409	3.943	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CCC(=O)c2ccc(Cl)cc2)cc1	ZINC000019809357	212071122	/nfs/dbraw/zinc/07/11/22/212071122.db2.gz	ZTBRYJNBMJZMDI-UHFFFAOYSA-N	-1	0	331.755	3.640	50	0		EHAARM
COc1ccc(-c2cc(C(=O)[O-])c3c(n2)onc3C(C)C)cc1OC	ZINC000008394167	210947772	/nfs/dbraw/zinc/94/77/72/210947772.db2.gz	WLLMHMUOGPHKJG-UHFFFAOYSA-N	-1	0	342.351	3.729	50	0		EHAARM
CC(C)NC(=O)[N-]P(=O)(Oc1ccccc1)Oc1ccccc1	ZINC000005230822	210417753	/nfs/dbraw/zinc/41/77/53/210417753.db2.gz	CSUCTQKNDLUULJ-UHFFFAOYSA-N	-1	0	334.312	3.960	50	0		EHAARM
O=C(c1cc(F)c(F)c([O-])c1F)N1CC[C@@H](c2ccc(F)cc2)C1	ZINC000328587481	258045998	/nfs/dbraw/zinc/04/59/98/258045998.db2.gz	ZRAIZOSYAYOPJW-SNVBAGLBSA-N	-1	0	339.288	3.578	50	0		EHAARM
Cc1cc2c(ncn2C)c([N-]S(=O)(=O)c2ccc(Cl)cc2)c1C	ZINC000001385928	258049112	/nfs/dbraw/zinc/04/91/12/258049112.db2.gz	OWPNIDAIRMJQDN-UHFFFAOYSA-N	-1	0	349.843	3.644	50	0		EHAARM
CC1CCN(c2ccc(NC(=O)c3ccccc3)cc2C(=O)[O-])CC1	ZINC000046053350	132421541	/nfs/dbraw/zinc/42/15/41/132421541.db2.gz	RAYLIIPMJQUDID-UHFFFAOYSA-N	-1	0	338.407	3.873	50	0		EHAARM
CCOc1ccc(C)cc1S(=O)(=O)[N-]c1cccc2cccnc21	ZINC000214077798	535711884	/nfs/dbraw/zinc/71/18/84/535711884.db2.gz	MSSLYCOSKYEJIL-UHFFFAOYSA-N	-1	0	342.420	3.743	50	0		EHAARM
O=C([O-])[C@@H]1Cc2c3ccccc3[nH]c2[C@@H](c2ccccc2Cl)N1	ZINC000000188032	563255547	/nfs/dbraw/zinc/25/55/47/563255547.db2.gz	JNLXAXOXLWSEML-JKSUJKDBSA-N	-1	0	326.783	3.510	50	0	biogenic	EHAARM
Cc1ccc(C[C@H](CC(=O)[O-])C(=O)Nc2ccc(Cl)cc2)cc1	ZINC000000249111	563266494	/nfs/dbraw/zinc/26/64/94/563266494.db2.gz	IKWJFAZZSCWTDM-CQSZACIVSA-N	-1	0	331.799	3.921	50	0		EHAARM
Cc1ccc(C2=NN(C(=O)CCCC(=O)[O-])[C@@H](c3ccco3)C2)cc1	ZINC000000376069	563299124	/nfs/dbraw/zinc/29/91/24/563299124.db2.gz	JRWDDCGBZKBHNN-MRXNPFEDSA-N	-1	0	340.379	3.521	50	0		EHAARM
Cc1ccc(C(=O)CSc2nc3ccccc3c(C(=O)[O-])n2)cc1	ZINC000000390675	563304208	/nfs/dbraw/zinc/30/42/08/563304208.db2.gz	DSUHEWNAJDQTKH-UHFFFAOYSA-N	-1	0	338.388	3.611	50	0		EHAARM
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)[O-]	ZINC000002564715	563441910	/nfs/dbraw/zinc/44/19/10/563441910.db2.gz	UGZIQCCPEDCGGN-NSHDSACASA-N	-1	0	334.199	3.514	50	0		EHAARM
O=C([O-])c1nc(-c2ccccc2)n(-c2cccc(C(F)(F)F)c2)n1	ZINC000003277655	563478851	/nfs/dbraw/zinc/47/88/51/563478851.db2.gz	CDDQIXKYTYICSM-UHFFFAOYSA-N	-1	0	333.269	3.651	50	0		EHAARM
Cc1ccccc1[N-]S(=O)(=O)c1ccccc1Br	ZINC000007052943	563594258	/nfs/dbraw/zinc/59/42/58/563594258.db2.gz	QPMMBAWTXXJTBC-UHFFFAOYSA-N	-1	0	326.215	3.558	50	0		EHAARM
Cc1cc(Br)ccc1NC(=O)[C@H]1CCCC[C@H]1C(=O)[O-]	ZINC000000242513	563594696	/nfs/dbraw/zinc/59/46/96/563594696.db2.gz	SIXQASFELNQYLR-NWDGAFQWSA-N	-1	0	340.217	3.587	50	0		EHAARM
COc1cc(C)c(C)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1	ZINC000008132615	563622120	/nfs/dbraw/zinc/62/21/20/563622120.db2.gz	DHGOEQIFOBSLTF-UHFFFAOYSA-N	-1	0	325.817	3.766	50	0		EHAARM
CCCOc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccccn1	ZINC000008714752	563636761	/nfs/dbraw/zinc/63/67/61/563636761.db2.gz	VUBMQSCUIVESTP-UHFFFAOYSA-N	-1	0	340.832	3.633	50	0		EHAARM
Cc1noc(C)c1S(=O)(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000016087324	563803189	/nfs/dbraw/zinc/80/31/89/563803189.db2.gz	CCPOLNKJWRNYRQ-ZETCQYMHSA-N	-1	0	349.239	3.638	50	0		EHAARM
COc1ccc(-c2c(C)[n-]n3c2nc(-c2ccccc2)cc3=O)cc1	ZINC000018149310	563849706	/nfs/dbraw/zinc/84/97/06/563849706.db2.gz	DJBYOAASOJYAIY-UHFFFAOYSA-N	-1	0	331.375	3.674	50	0		EHAARM
CCN(C(=O)c1n[n-]c2ccccc2c1=O)[C@@H](C)c1ccc(F)cc1	ZINC000096411199	563950603	/nfs/dbraw/zinc/95/06/03/563950603.db2.gz	GESKNOHYFPDOQP-LBPRGKRZSA-N	-1	0	339.370	3.698	50	0		EHAARM
COc1ccc(Nc2nccc(Nc3cccc(C(=O)[O-])c3)n2)cc1	ZINC000096693898	563962193	/nfs/dbraw/zinc/96/21/93/563962193.db2.gz	LYULDTTVWMMWBJ-UHFFFAOYSA-N	-1	0	336.351	3.671	50	0		EHAARM
CCOc1cc(C=NNc2ccccc2Cl)ccc1OCC(=O)[O-]	ZINC000004646880	563963283	/nfs/dbraw/zinc/96/32/83/563963283.db2.gz	CLULTQBTYJWINS-UHFFFAOYSA-N	-1	0	348.786	3.648	50	0		EHAARM
C[C@@H](C(=O)[O-])[C@@H](NC(=O)c1cccc(F)c1Cl)c1ccccc1	ZINC000097018253	563971023	/nfs/dbraw/zinc/97/10/23/563971023.db2.gz	VKTHABRYKXGGHC-MEBBXXQBSA-N	-1	0	335.762	3.671	50	0		EHAARM
O=c1cc(C(F)(F)F)nc(-c2ncc(C(F)(F)F)cc2Cl)[n-]1	ZINC000096179487	563980040	/nfs/dbraw/zinc/98/00/40/563980040.db2.gz	HOVODPVJCPDQCY-UHFFFAOYSA-N	-1	0	343.614	3.935	50	0		EHAARM
CCCCOc1ccc(C)cc1S(=O)(=O)[N-]c1ncccc1C	ZINC000096305758	563980716	/nfs/dbraw/zinc/98/07/16/563980716.db2.gz	MMXRRAMEIVXXLW-UHFFFAOYSA-N	-1	0	334.441	3.678	50	0		EHAARM
Cc1cccc(N2C(=O)c3cccc4c(C(=O)[O-])ccc(c43)C2=O)c1	ZINC000004839522	563984249	/nfs/dbraw/zinc/98/42/49/563984249.db2.gz	JIWVDTJRVPAHIQ-UHFFFAOYSA-N	-1	0	331.327	3.647	50	0		EHAARM
Cc1cc2nc([N-]c3ncc4c(n3)CCCC4=O)nc(C)c2cc1C	ZINC000000200145	563988299	/nfs/dbraw/zinc/98/82/99/563988299.db2.gz	RSVPIPATRYLLIS-UHFFFAOYSA-N	-1	0	333.395	3.608	50	0		EHAARM
COc1cccc(S(=O)(=O)[N-]c2ccccc2C(F)(F)F)c1	ZINC000074934533	564000256	/nfs/dbraw/zinc/00/02/56/564000256.db2.gz	UJBDUQYXZDIKFG-UHFFFAOYSA-N	-1	0	331.315	3.515	50	0		EHAARM
COc1ccccc1Nc1n[n-]c(=S)n1-c1ccccc1OC	ZINC000002471430	564003934	/nfs/dbraw/zinc/00/39/34/564003934.db2.gz	VQKGAJYBHSEWII-UHFFFAOYSA-N	-1	0	328.397	3.691	50	0		EHAARM
Cc1ccc(-c2noc(-c3c([O-])c4ccccc4n(C)c3=O)n2)cc1C	ZINC000101725732	564019541	/nfs/dbraw/zinc/01/95/41/564019541.db2.gz	OHEYPLBZSNCFRQ-UHFFFAOYSA-N	-1	0	347.374	3.578	50	0		EHAARM
O=C([O-])c1ccc(CCNC(=O)c2c(Cl)cccc2Cl)cc1	ZINC000013442647	564020000	/nfs/dbraw/zinc/02/00/00/564020000.db2.gz	IAXRYRIVDPIBBF-UHFFFAOYSA-N	-1	0	338.190	3.664	50	0		EHAARM
Cc1ccc(-c2cccc(NC(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@@H]3C(=O)[O-])c2)o1	ZINC000000510427	564020085	/nfs/dbraw/zinc/02/00/85/564020085.db2.gz	VAMWDEDFRKPIHI-DACLVMHWSA-N	-1	0	337.375	3.716	50	0		EHAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CC2)[C@H]1c1ccc(Cl)cc1	ZINC000045923056	564028912	/nfs/dbraw/zinc/02/89/12/564028912.db2.gz	PRNVLCNPBOLZHG-SJORKVTESA-N	-1	0	341.794	3.868	50	0		EHAARM
COc1ccc(/C=C\C(=O)Nc2sc3c(c2C(=O)[O-])CCC3)cc1	ZINC000005907482	564056938	/nfs/dbraw/zinc/05/69/38/564056938.db2.gz	UGYVGIJEUITCSZ-YFHOEESVSA-N	-1	0	343.404	3.596	50	0		EHAARM
Cc1cc2c(ncn2C)c([N-]S(=O)(=O)c2ccccc2Cl)c1C	ZINC000001385953	564064192	/nfs/dbraw/zinc/06/41/92/564064192.db2.gz	VNHAQLKYWFXVLS-UHFFFAOYSA-N	-1	0	349.843	3.644	50	0		EHAARM
COc1ccc(C(=O)[O-])cc1-c1cc(F)ccc1OC[C@@H]1CCOC1	ZINC000564584399	564079012	/nfs/dbraw/zinc/07/90/12/564079012.db2.gz	DSLCWORRRMDIND-GFCCVEGCSA-N	-1	0	346.354	3.615	50	0		EHAARM
COc1cc(C)c([N-]S(=O)(=O)c2ccc(Cl)s2)cc1OC	ZINC000007988475	564082173	/nfs/dbraw/zinc/08/21/73/564082173.db2.gz	ONOJNPMDEBHVMV-UHFFFAOYSA-N	-1	0	347.845	3.528	50	0		EHAARM
Cc1[nH]c2ccc(C(=O)N3CCC[C@H](CCC(=O)[O-])C3)cc2c1C	ZINC000237726405	564085447	/nfs/dbraw/zinc/08/54/47/564085447.db2.gz	HLDBBHSSFLLFCO-CQSZACIVSA-N	-1	0	328.412	3.502	50	0		EHAARM
COc1ccc(-n2c(COc3cccc(C)c3)n[n-]c2=S)cc1	ZINC000005687814	564093273	/nfs/dbraw/zinc/09/32/73/564093273.db2.gz	HDOHNPZUXROXCK-UHFFFAOYSA-N	-1	0	327.409	3.826	50	0		EHAARM
CC1CCN(c2ccc(C(=O)[O-])cc2NC(=O)c2cccs2)CC1	ZINC000064820557	564096591	/nfs/dbraw/zinc/09/65/91/564096591.db2.gz	GCKMZYCHWTUFRM-UHFFFAOYSA-N	-1	0	344.436	3.935	50	0		EHAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)c(C)c1	ZINC000065031108	564099740	/nfs/dbraw/zinc/09/97/40/564099740.db2.gz	CJIKVRJXARJWAS-UHFFFAOYSA-N	-1	0	334.422	3.821	50	0		EHAARM
C[C@@](CC(=O)[O-])(C(=O)Nc1ccc2c[nH]nc2c1)C1CCCCC1	ZINC000169975481	564104122	/nfs/dbraw/zinc/10/41/22/564104122.db2.gz	JMIZWBYTMAHJEU-SFHVURJKSA-N	-1	0	329.400	3.563	50	0		EHAARM
CC[C@](NC(=O)[C@@H](C)Sc1ccccc1)(C(=O)[O-])c1ccccc1	ZINC000170592053	564108817	/nfs/dbraw/zinc/10/88/17/564108817.db2.gz	VWQPJNOOJVNPKT-AUUYWEPGSA-N	-1	0	343.448	3.674	50	0		EHAARM
Cc1cnc(NC(=O)c2nn(-c3cccc(C(C)C)c3)cc2[O-])s1	ZINC000170639231	564117610	/nfs/dbraw/zinc/11/76/10/564117610.db2.gz	VWPSEEAOYVUSJD-UHFFFAOYSA-N	-1	0	342.424	3.719	50	0		EHAARM
CC(C)[C@H]1SCC(=O)Nc2c1cnn2-c1ccc(C(=O)[O-])cc1	ZINC000095475199	564141394	/nfs/dbraw/zinc/14/13/94/564141394.db2.gz	ZYPMIJQCHGALLP-CQSZACIVSA-N	-1	0	331.397	3.602	50	0		EHAARM
Cc1cc(C(=O)Nc2cc(C(=O)[O-])ccc2F)c(Cl)cc1F	ZINC000095989573	564144095	/nfs/dbraw/zinc/14/40/95/564144095.db2.gz	FHZDVZKRHXUQDO-UHFFFAOYSA-N	-1	0	325.698	3.877	50	0		EHAARM
Cc1ccc(C)c(NC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@H](C)C4)c1	ZINC000299738291	564150490	/nfs/dbraw/zinc/15/04/90/564150490.db2.gz	RCJRUMXOMWXLBM-CYBMUJFWSA-N	-1	0	348.402	3.693	50	0		EHAARM
Cc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@@H](C)C4)c(C)c1	ZINC000299738138	564150511	/nfs/dbraw/zinc/15/05/11/564150511.db2.gz	BADOKBLEVNPBGC-ZDUSSCGKSA-N	-1	0	348.402	3.693	50	0		EHAARM
O=C(Cc1ccc2c(c1)CCCC2)Nc1ccc(-c2nc(=O)o[n-]2)cc1	ZINC000058434052	564159146	/nfs/dbraw/zinc/15/91/46/564159146.db2.gz	KWJUBIUSODCHDW-UHFFFAOYSA-N	-1	0	349.390	3.502	50	0		EHAARM
Cc1noc(C)c1[N-]S(=O)(=O)Cc1ccc(Cl)c(Cl)c1	ZINC000069657535	564171295	/nfs/dbraw/zinc/17/12/95/564171295.db2.gz	LCJCCKZHLIJPFU-UHFFFAOYSA-N	-1	0	335.212	3.540	50	0		EHAARM
COc1ccc([C@@H]2C[C@H]2C(=O)Nc2cccc([C@H](C)C(=O)[O-])c2)cc1	ZINC000659160509	975759416	/nfs/dbraw/zinc/75/94/16/975759416.db2.gz	KBZFATJIJLDWRJ-UYHISHBKSA-N	-1	0	339.391	3.626	50	0		EHAARM
CC(C)OCc1cccc(-c2nc(C(F)(F)F)c(C(=O)[O-])o2)c1	ZINC000874969876	1123270190	/nfs/dbraw/zinc/27/01/90/1123270190.db2.gz	HEBFVYNLXWJKBD-UHFFFAOYSA-N	-1	0	329.274	3.984	50	0		EHAARM
C[C@@H]1CCC[C@H](C(=O)[O-])N1Cc1coc(-c2cccc(Cl)c2)n1	ZINC000952847907	1137482793	/nfs/dbraw/zinc/48/27/93/1137482793.db2.gz	LEDWVQYKGAUWGU-IAQYHMDHSA-N	-1	0	334.803	3.823	50	0		EHAARM
COc1cc(/C=C\c2cc(C(=O)[O-])c3ccc(F)cc3n2)ccc1O	ZINC000222076692	1138242502	/nfs/dbraw/zinc/24/25/02/1138242502.db2.gz	FEAUZWWWPJRDBP-DJWKRKHSSA-N	-1	0	339.322	3.957	50	0		EHAARM
C[C@H](c1ccco1)n1cc(Oc2ccccc2)c(=O)c(C(=O)[O-])c1	ZINC000055310161	214305761	/nfs/dbraw/zinc/30/57/61/214305761.db2.gz	DIYNWRTXCHUJOK-GFCCVEGCSA-N	-1	0	325.320	3.541	50	0		EHAARM
O=c1c2oc3ccccc3c2[n-]c(=S)n1Cc1ccc(F)cc1	ZINC000100892750	219110396	/nfs/dbraw/zinc/11/03/96/219110396.db2.gz	NCAZPQCGZUDTRP-UHFFFAOYSA-N	-1	0	326.352	3.993	50	0		EHAARM
O=C([O-])[C@H]1C=C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000004284294	210161356	/nfs/dbraw/zinc/16/13/56/210161356.db2.gz	IWMUNNGMJRKNSV-KBPBESRZSA-N	-1	0	349.386	3.554	50	0		EHAARM
O=C([O-])[C@@H]1C=C[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000004284293	210160469	/nfs/dbraw/zinc/16/04/69/210160469.db2.gz	IWMUNNGMJRKNSV-ZIAGYGMSSA-N	-1	0	349.386	3.554	50	0		EHAARM
CCSc1ccccc1[N-]S(=O)(=O)c1cc(F)ccc1OC	ZINC000065363281	214875150	/nfs/dbraw/zinc/87/51/50/214875150.db2.gz	MSHCXDGMDNPYDX-UHFFFAOYSA-N	-1	0	341.429	3.747	50	0		EHAARM
C[C@H](NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O)c1cccc(F)c1	ZINC000047054368	213829410	/nfs/dbraw/zinc/82/94/10/213829410.db2.gz	QWOAPIIJAJTSDP-VIFPVBQESA-N	-1	0	343.383	3.628	50	0		EHAARM
O=S(=O)([N-]c1cccc(Cl)c1)c1cc(-c2ccno2)cs1	ZINC000044902873	213667950	/nfs/dbraw/zinc/66/79/50/213667950.db2.gz	XRYKMWXCGKMFDU-UHFFFAOYSA-N	-1	0	340.813	3.857	50	0		EHAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc2nc(C3CC3)sc2c1	ZINC000069158235	215365352	/nfs/dbraw/zinc/36/53/52/215365352.db2.gz	GEAOKMRNZRGOMW-STQMWFEESA-N	-1	0	342.420	3.779	50	0		EHAARM
CC1=CC[C@@H](C(=O)[O-])[C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)C1	ZINC000039632468	213240345	/nfs/dbraw/zinc/24/03/45/213240345.db2.gz	QVKSDHWLOJFLMX-OLZOCXBDSA-N	-1	0	328.195	3.989	50	0		EHAARM
O=C(Nc1cccc(OC[C@H]2CCCO2)c1)c1cc(Cl)ccc1[O-]	ZINC000036739617	213114337	/nfs/dbraw/zinc/11/43/37/213114337.db2.gz	DODRLOIGTPYILC-OAHLLOKOSA-N	-1	0	347.798	3.856	50	0		EHAARM
CCC(=O)Nc1ccc(N(CC)Cc2ccccc2)c(C(=O)[O-])c1	ZINC000035510948	213035515	/nfs/dbraw/zinc/03/55/15/213035515.db2.gz	LVVJJQXICXJBOR-UHFFFAOYSA-N	-1	0	326.396	3.760	50	0		EHAARM
COc1ccc(NC(=O)[C@H](C)[C@@H](Cc2ccc(C)cc2)C(=O)[O-])cc1	ZINC000035142038	213010045	/nfs/dbraw/zinc/01/00/45/213010045.db2.gz	UVUBRMPGPVRXGS-RDTXWAMCSA-N	-1	0	341.407	3.522	50	0		EHAARM
O=C([O-])c1cc(Cl)c(Cl)cc1C(=O)Nc1ccccc1O	ZINC000000332920	209538805	/nfs/dbraw/zinc/53/88/05/209538805.db2.gz	WFQXGYFLTOVFCA-UHFFFAOYSA-N	-1	0	326.135	3.650	50	0		EHAARM
Cc1nc2sc([C@H](c3ccccc3Cl)N3CCCC3)c([O-])n2n1	ZINC000022625954	212313170	/nfs/dbraw/zinc/31/31/70/212313170.db2.gz	OQKAMORHWQCKGD-ZDUSSCGKSA-N	-1	0	348.859	3.643	50	0		EHAARM
Cc1ccc(S(=O)(=O)[N-]c2nc(C(C)(C)C)co2)c(Cl)c1	ZINC000225393007	241839630	/nfs/dbraw/zinc/83/96/30/241839630.db2.gz	JACIWJSHBCKFDA-UHFFFAOYSA-N	-1	0	328.821	3.735	50	0		EHAARM
CC(C)[C@@H](NC(=O)CC1(C(=O)[O-])CCCCCC1)c1ccccn1	ZINC000225404323	241847089	/nfs/dbraw/zinc/84/70/89/241847089.db2.gz	GQSVSCGUJAFNMS-QGZVFWFLSA-N	-1	0	332.444	3.710	50	0		EHAARM
CC[C@@H](C(=O)N1CCC(C(=O)[O-])CC1)c1cccc(C(F)(F)F)c1	ZINC000236952739	242422757	/nfs/dbraw/zinc/42/27/57/242422757.db2.gz	YATCAWFTNQQCHT-CQSZACIVSA-N	-1	0	343.345	3.522	50	0		EHAARM
CC(C)c1ccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)cc1	ZINC000014632504	211749139	/nfs/dbraw/zinc/74/91/39/211749139.db2.gz	UOBWQSSBKHDJFL-HOTGVXAUSA-N	-1	0	349.427	3.651	50	0		EHAARM
CC(C)OCc1ccc(C(=O)N[C@@H](CC(=O)[O-])c2ccccc2)cc1	ZINC000013225107	211537123	/nfs/dbraw/zinc/53/71/23/211537123.db2.gz	QGEWNUIKBHEIAR-SFHVURJKSA-N	-1	0	341.407	3.557	50	0		EHAARM
Cc1[nH]nc(-c2ccc(S(=O)(=O)[N-]c3ccccc3C)s2)c1C	ZINC000009686715	211113682	/nfs/dbraw/zinc/11/36/82/211113682.db2.gz	YNMPOQWGDSDFSC-UHFFFAOYSA-N	-1	0	347.465	3.864	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3ccccc3C)s2)n[nH]1	ZINC000009686474	211112987	/nfs/dbraw/zinc/11/29/87/211112987.db2.gz	WHVYHIIMZBBNAT-UHFFFAOYSA-N	-1	0	333.438	3.556	50	0		EHAARM
O=C([O-])c1ccc(C=C(Cl)c2nc3ccccc3c(=O)[nH]2)cc1	ZINC000095351096	218286372	/nfs/dbraw/zinc/28/63/72/218286372.db2.gz	COVQQJNYECOMBF-LCYFTJDESA-N	-1	0	326.739	3.771	50	0		EHAARM
CC[C@@H](C(=O)Nc1cc(OC)c(OC)cc1C(=O)[O-])c1ccccc1	ZINC000005059947	210378968	/nfs/dbraw/zinc/37/89/68/210378968.db2.gz	CVVOJOJMQDCUFQ-CYBMUJFWSA-N	-1	0	343.379	3.534	50	0		EHAARM
C[C@H](c1ccon1)N(C)Cc1ccc(-c2ccc(C(=O)[O-])cc2)o1	ZINC000097259359	219006487	/nfs/dbraw/zinc/00/64/87/219006487.db2.gz	GRDHPSWGBZWFFJ-GFCCVEGCSA-N	-1	0	326.352	3.826	50	0		EHAARM
Nc1cc(S(=O)(=O)[O-])ccc1Oc1ccc(Cl)cc1Cl	ZINC000002165018	563424776	/nfs/dbraw/zinc/42/47/76/563424776.db2.gz	YFJRUQCCODZCCC-UHFFFAOYSA-N	-1	0	334.180	3.615	50	0		EHAARM
CC1(C)[C@@H](C(=O)Nc2nc3ccccc3s2)CC[C@@]1(C)C(=O)[O-]	ZINC000000191662	563256962	/nfs/dbraw/zinc/25/69/62/563256962.db2.gz	MUKSDTCHANCPAN-QGHHPUGFSA-N	-1	0	332.425	3.762	50	0		EHAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(C(C)C)cc2)c1	ZINC000000270151	563269478	/nfs/dbraw/zinc/26/94/78/563269478.db2.gz	USNPQGXWHJDZPN-UHFFFAOYSA-N	-1	0	335.425	3.628	50	0		EHAARM
Cc1ccc(C[C@H](C(=O)[O-])[C@@H](C)C(=O)Nc2ccc(F)cc2)cc1	ZINC000000350632	563289415	/nfs/dbraw/zinc/28/94/15/563289415.db2.gz	VZVZQCSDNMAZDA-DYVFJYSZSA-N	-1	0	329.371	3.652	50	0		EHAARM
COc1ccc(COc2ccc(CC(=O)[O-])cc2Cl)cc1OC	ZINC000000392284	563304467	/nfs/dbraw/zinc/30/44/67/563304467.db2.gz	GFSDMJUENYBTBP-UHFFFAOYSA-N	-1	0	336.771	3.563	50	0		EHAARM
CCOc1ccc([C@@H]2[C@@H](C(=O)[O-])CCC(=O)N2C2CCCCC2)cc1	ZINC000001394557	563386399	/nfs/dbraw/zinc/38/63/99/563386399.db2.gz	IGAXLNWFPCVKLI-PKOBYXMFSA-N	-1	0	345.439	3.782	50	0		EHAARM
CCOc1ccc2nc([N-]S(=O)(=O)Cc3ccccc3)sc2c1	ZINC000002851837	563455592	/nfs/dbraw/zinc/45/55/92/563455592.db2.gz	ICAYLWPSUVTAEL-UHFFFAOYSA-N	-1	0	348.449	3.637	50	0		EHAARM
O=C([O-])COc1ccccc1[C@H]1CC(=O)Nc2ccc3ccccc3c21	ZINC000002886486	563461766	/nfs/dbraw/zinc/46/17/66/563461766.db2.gz	LCMAXLRPWMKKOM-MRXNPFEDSA-N	-1	0	347.370	3.777	50	0		EHAARM
CC(C)(C)c1cc([N-]S(=O)(=O)c2ccc3ccccc3c2)no1	ZINC000013948471	563732784	/nfs/dbraw/zinc/73/27/84/563732784.db2.gz	SZJMZPWYHGRKQV-UHFFFAOYSA-N	-1	0	330.409	3.926	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2c(Cl)cccc2Cl)C1	ZINC000043589656	563913565	/nfs/dbraw/zinc/91/35/65/563913565.db2.gz	QAZRERKRWGBZLN-SNVBAGLBSA-N	-1	0	330.211	3.710	50	0		EHAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC2(C1)CCCCCC2	ZINC000119898200	563983851	/nfs/dbraw/zinc/98/38/51/563983851.db2.gz	LMEGUUIPTVECBK-UHFFFAOYSA-N	-1	0	346.452	3.682	50	0		EHAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc2cccnc21	ZINC000000423526	563998332	/nfs/dbraw/zinc/99/83/32/563998332.db2.gz	RZPHYYCOWQAPOY-UHFFFAOYSA-N	-1	0	348.811	3.698	50	0		EHAARM
CCOP(=O)(OCC)[C@@H]([N-]C(=O)C(F)(F)F)c1ccccc1	ZINC000003213948	564004210	/nfs/dbraw/zinc/00/42/10/564004210.db2.gz	SQAKCZLJLSFTAY-LLVKDONJSA-N	-1	0	339.250	3.630	50	0		EHAARM
CC(C)c1nc2cc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])ccc2o1	ZINC000046834810	564025421	/nfs/dbraw/zinc/02/54/21/564025421.db2.gz	JLBYQXXZLIBVSW-OLZOCXBDSA-N	-1	0	328.368	3.557	50	0		EHAARM
Cc1cc(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)c(C)s1	ZINC000048332680	564031053	/nfs/dbraw/zinc/03/10/53/564031053.db2.gz	IOXDPYZBZJIMDA-UHFFFAOYSA-N	-1	0	333.381	3.767	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc3cc(F)ccc3s2)C1	ZINC000261846398	564045705	/nfs/dbraw/zinc/04/57/05/564045705.db2.gz	ZIWCBFYRNUUUMY-NSHDSACASA-N	-1	0	335.400	3.757	50	0		EHAARM
CCc1nc(/C(C#N)=C/c2cccc(O[C@H](C)C(=O)[O-])c2)sc1C	ZINC000096291709	564049731	/nfs/dbraw/zinc/04/97/31/564049731.db2.gz	FCYJCNVQEYXYTJ-GYBQTFJISA-N	-1	0	342.420	3.930	50	0		EHAARM
C[C@]12CC(=O)[C@@H]3[C@H](CC[C@H]4C[C@H](O)CC[C@@]34C)[C@@H]1CC=C2CC(=O)[O-]	ZINC000257358879	564055993	/nfs/dbraw/zinc/05/59/93/564055993.db2.gz	WXRCQADVBJRAON-IANKGOGOSA-N	-1	0	346.467	3.580	50	0		EHAARM
CCOC(=O)c1ccc(Oc2c(C)oc3cc([O-])ccc3c2=O)cc1	ZINC000005905847	564056919	/nfs/dbraw/zinc/05/69/19/564056919.db2.gz	QBAIPIAYUJSVLZ-UHFFFAOYSA-N	-1	0	340.331	3.776	50	0	biogenic	EHAARM
O=C(Nc1ccc2c(c1)OC(F)(F)O2)c1ccc([O-])c(Cl)c1	ZINC000084340988	564067850	/nfs/dbraw/zinc/06/78/50/564067850.db2.gz	ZFKVVKZDTWVMQP-UHFFFAOYSA-N	-1	0	327.670	3.619	50	0		EHAARM
O=C(Nc1ccc(-c2nc(=O)o[n-]2)cc1)c1cccc2ccccc21	ZINC000084598281	564068974	/nfs/dbraw/zinc/06/89/74/564068974.db2.gz	BFDNPHATOSIWSR-UHFFFAOYSA-N	-1	0	331.331	3.848	50	0		EHAARM
C[S@@](=O)c1ccc(NC(=O)Nc2ccc(O)c(Cl)c2)cc1F	ZINC000192221849	564090067	/nfs/dbraw/zinc/09/00/67/564090067.db2.gz	HIBGBJGHKJPEFS-JOCHJYFZSA-N	-1	0	342.779	3.566	50	0		EHAARM
CC(C)n1cc(S(=O)(=O)[N-]c2ccc(F)cc2)c2cccnc21	ZINC000065242199	564103356	/nfs/dbraw/zinc/10/33/56/564103356.db2.gz	DMGJTRXICIJXBS-UHFFFAOYSA-N	-1	0	333.388	3.557	50	0		EHAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000007057417	564103955	/nfs/dbraw/zinc/10/39/55/564103955.db2.gz	GREZTVBARZKFDF-UHFFFAOYSA-N	-1	0	345.342	3.905	50	0		EHAARM
Cc1ccc([C@@H](C)C(=O)Nc2ccc(C)c(O[C@@H](C)C(=O)[O-])c2)cc1	ZINC000170067791	564105168	/nfs/dbraw/zinc/10/51/68/564105168.db2.gz	IOUHBHZLGHKSOZ-CABCVRRESA-N	-1	0	341.407	3.898	50	0		EHAARM
O=C([O-])[C@H](Cc1ccccc1)NC(=O)Nc1cccc2ccccc21	ZINC000002290804	564131552	/nfs/dbraw/zinc/13/15/52/564131552.db2.gz	UIANVCANHHQYOC-SFHVURJKSA-N	-1	0	334.375	3.657	50	0		EHAARM
CC[C@H](C)[C@H](NC(=O)c1cc(F)c(F)c([O-])c1F)C(F)(F)F	ZINC000278223734	564138288	/nfs/dbraw/zinc/13/82/88/564138288.db2.gz	UQXHEBFDAIOSLM-DYEAUMGKSA-N	-1	0	329.240	3.516	50	0		EHAARM
Cc1nccn1CCCC(=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000095943484	564142084	/nfs/dbraw/zinc/14/20/84/564142084.db2.gz	TVKYZQSHDQYAMC-UHFFFAOYSA-N	-1	0	328.199	3.623	50	0		EHAARM
Cn1cc(/C=C(\CCCC(=O)[O-])c2nc3ccccc3s2)cn1	ZINC000096295775	564146551	/nfs/dbraw/zinc/14/65/51/564146551.db2.gz	OHHGYUGIPNJZDX-UKTHLTGXSA-N	-1	0	327.409	3.825	50	0		EHAARM
O=C([O-])C1CCN(C(=O)CC2CCC(c3ccccc3)CC2)CC1	ZINC000096479442	564148567	/nfs/dbraw/zinc/14/85/67/564148567.db2.gz	PCFNVGMHEUOMBJ-UHFFFAOYSA-N	-1	0	329.440	3.674	50	0		EHAARM
CC(=O)c1cccc(S(=O)(=O)[N-]c2cc(C(C)(C)C)ccc2O)c1	ZINC000002663849	564152112	/nfs/dbraw/zinc/15/21/12/564152112.db2.gz	QDTDQHZZYVVDLZ-UHFFFAOYSA-N	-1	0	347.436	3.693	50	0		EHAARM
CC(=O)c1cccc([N-]S(=O)(=O)c2ccc(Cl)cc2Cl)c1	ZINC000003049270	564154699	/nfs/dbraw/zinc/15/46/99/564154699.db2.gz	WKTVCUZJFUNTKD-UHFFFAOYSA-N	-1	0	344.219	3.997	50	0		EHAARM
Cc1cccc(C(C)C)c1NC(=O)CSc1ncccc1C(=O)[O-]	ZINC000003287545	564157016	/nfs/dbraw/zinc/15/70/16/564157016.db2.gz	XTSQGBVXZWHRIJ-UHFFFAOYSA-N	-1	0	344.436	3.942	50	0		EHAARM
O=C([O-])c1ccc([C@H]2CC(=O)Nc3c2ncn3-c2ccccc2)cc1	ZINC000031820678	564159987	/nfs/dbraw/zinc/15/99/87/564159987.db2.gz	WREQTDXRORIXQC-OAHLLOKOSA-N	-1	0	333.347	3.694	50	0		EHAARM
O=C([O-])c1csc(NC(=O)c2ccc(C3CCOCC3)cc2)c1	ZINC000630162465	975137431	/nfs/dbraw/zinc/13/74/31/975137431.db2.gz	LOUTXWRUOMXEBN-UHFFFAOYSA-N	-1	0	331.393	3.593	50	0		EHAARM
Cc1cc(C(=O)Nc2ccc(O[C@H](C)C(=O)[O-])c(F)c2)sc1C	ZINC000630259228	975202950	/nfs/dbraw/zinc/20/29/50/975202950.db2.gz	LOYAIKHCOQCKJG-SECBINFHSA-N	-1	0	337.372	3.608	50	0		EHAARM
O=C([O-])C[C@@H](NC(=O)CC12CC3CC(CC(C3)C1)C2)c1ccccc1	ZINC000327294067	1028453504	/nfs/dbraw/zinc/45/35/04/1028453504.db2.gz	NUFXOAUAQCJNRU-DIKOGFFKSA-N	-1	0	341.451	3.925	50	0		EHAARM
CCOc1ccc([N-]S(=O)(=O)c2ccc(C(F)F)o2)c(C)c1	ZINC000585119211	1137009883	/nfs/dbraw/zinc/00/98/83/1137009883.db2.gz	XEHQQHSQSOCXAF-UHFFFAOYSA-N	-1	0	331.340	3.725	50	0		EHAARM
O=C([O-])c1ccc(C=Cc2nc(=O)c3c4c(sc3[nH]2)CCC4)cc1	ZINC000006161197	1138982954	/nfs/dbraw/zinc/98/29/54/1138982954.db2.gz	GUDAQLHHLPJDRZ-RMKNXTFCSA-N	-1	0	338.388	3.754	50	0		EHAARM
O=C([O-])C[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)c1ccc(F)cc1	ZINC000004743872	210267108	/nfs/dbraw/zinc/26/71/08/210267108.db2.gz	PYMZRPHJOLGKPA-UTNBAMHJSA-N	-1	0	345.414	3.674	50	0		EHAARM
Cc1cc(-c2ccc(OCCC(C)C)cc2)nc2cc(C(=O)[O-])nn21	ZINC000004656434	210240558	/nfs/dbraw/zinc/24/05/58/210240558.db2.gz	JBFUVPKIUXBBCM-UHFFFAOYSA-N	-1	0	339.395	3.828	50	0		EHAARM
COc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cc1C(=O)[O-]	ZINC000004649206	210236766	/nfs/dbraw/zinc/23/67/66/210236766.db2.gz	QWCABGLFMSZSGN-UHFFFAOYSA-N	-1	0	340.162	3.953	50	0		EHAARM
CCCn1c2ccccc2c([O-])c(C(=O)Nc2ccccc2C)c1=O	ZINC000100447910	219099779	/nfs/dbraw/zinc/09/97/79/219099779.db2.gz	IQXRVKPAGTURSD-UHFFFAOYSA-N	-1	0	336.391	3.678	50	0		EHAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2onc(C)c2C)o1	ZINC000064958525	214815729	/nfs/dbraw/zinc/81/57/29/214815729.db2.gz	DNUSSJGJYHTRIA-UHFFFAOYSA-N	-1	0	346.408	3.915	50	0		EHAARM
CC(C)(C)c1csc([N-]S(=O)(=O)c2cccc(Cl)c2)n1	ZINC000003997619	210097697	/nfs/dbraw/zinc/09/76/97/210097697.db2.gz	IHYMPPITTSFBJV-UHFFFAOYSA-N	-1	0	330.862	3.895	50	0		EHAARM
Cc1nn(-c2ccc(C)cc2)c2nc(-c3cccnc3)cc(C(=O)[O-])c12	ZINC000003298710	210000645	/nfs/dbraw/zinc/00/06/45/210000645.db2.gz	PLTYTLHQVOXBOK-UHFFFAOYSA-N	-1	0	344.374	3.798	50	0		EHAARM
O=C([O-])c1cc2nc(-c3ccc(F)cc3)cc(C(F)(F)Cl)n2n1	ZINC000002771153	209907547	/nfs/dbraw/zinc/90/75/47/209907547.db2.gz	XIJJQXFLTICNJR-UHFFFAOYSA-N	-1	0	341.676	3.522	50	0		EHAARM
CC(C)(C)OC(=O)N1CCC(C(=O)[O-])(c2ccc(Cl)cc2)CC1	ZINC000002553933	209867374	/nfs/dbraw/zinc/86/73/74/209867374.db2.gz	UVPSYFHQUVHQJE-UHFFFAOYSA-N	-1	0	339.819	3.693	50	0		EHAARM
O=C([O-])[C@H]1CCC[C@@H](CC(=O)c2ccccc2Br)C1	ZINC000002378428	209844212	/nfs/dbraw/zinc/84/42/12/209844212.db2.gz	WWBDHSIOGABKMI-MNOVXSKESA-N	-1	0	325.202	3.913	50	0		EHAARM
O=C([O-])CC[C@H]1CCCN(C(=O)C[C@H]2CCCc3ccccc32)C1	ZINC000238008898	242895439	/nfs/dbraw/zinc/89/54/39/242895439.db2.gz	CBKLKLLLLIEKNL-NVXWUHKLSA-N	-1	0	329.440	3.600	50	0		EHAARM
Cc1sc2ncn(CCC(=O)[O-])c(=O)c2c1-c1ccc(Cl)cc1	ZINC000019954495	212089923	/nfs/dbraw/zinc/08/99/23/212089923.db2.gz	IITVXDZEXHXXCJ-UHFFFAOYSA-N	-1	0	348.811	3.562	50	0		EHAARM
Cc1sc2ncn(CCC(=O)[O-])c(=O)c2c1-c1ccc(C)c(C)c1	ZINC000019954499	212089458	/nfs/dbraw/zinc/08/94/58/212089458.db2.gz	DYWONFBQZLSTIO-UHFFFAOYSA-N	-1	0	342.420	3.525	50	0		EHAARM
O=C([O-])c1ccc(/C=C2\SC(=O)N(c3ccc(F)cc3)C2=O)cc1	ZINC000015745868	211849283	/nfs/dbraw/zinc/84/92/83/211849283.db2.gz	DTKMBEAPTVFZKT-ZROIWOOFSA-N	-1	0	343.335	3.765	50	0		EHAARM
CC(=O)c1ccc(NC(=O)[C@H](C)Sc2ccccc2C(=O)[O-])cc1	ZINC000012978273	211496838	/nfs/dbraw/zinc/49/68/38/211496838.db2.gz	PTXYYIIPGYMZPQ-LBPRGKRZSA-N	-1	0	343.404	3.707	50	0		EHAARM
O=C([O-])CCCNC(=O)c1ccc(-c2cccc(Cl)c2Cl)o1	ZINC000012940876	211490420	/nfs/dbraw/zinc/49/04/20/211490420.db2.gz	DYJRVPBEJMHEEC-UHFFFAOYSA-N	-1	0	342.178	3.848	50	0		EHAARM
COc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1C(=O)[O-]	ZINC000012811990	211462640	/nfs/dbraw/zinc/46/26/40/211462640.db2.gz	OZIWZPINOGYNTH-LLVKDONJSA-N	-1	0	331.393	3.513	50	0		EHAARM
CC(C)c1cc(C(F)(F)F)c2c(C3CC3)nn(CC(=O)[O-])c2n1	ZINC000012397027	211367670	/nfs/dbraw/zinc/36/76/70/211367670.db2.gz	HZAYSKLDMAVKLR-UHFFFAOYSA-N	-1	0	327.306	3.536	50	0		EHAARM
O=C([O-])c1ccc(NC(=O)CSc2cccc3cccnc32)cc1	ZINC000012173278	211310225	/nfs/dbraw/zinc/31/02/25/211310225.db2.gz	XSLNGBPHYISYCS-UHFFFAOYSA-N	-1	0	338.388	3.664	50	0		EHAARM
O=c1oc2cc(O)ccc2c([O-])c1-c1ccc(Br)cc1	ZINC000011865286	211260951	/nfs/dbraw/zinc/26/09/51/211260951.db2.gz	GTKLFBQCPQSNKT-UHFFFAOYSA-N	-1	0	333.137	3.634	50	0		EHAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1	ZINC000010301976	211160810	/nfs/dbraw/zinc/16/08/10/211160810.db2.gz	GVJFUBIYTMOUDG-UHFFFAOYSA-N	-1	0	349.305	3.654	50	0		EHAARM
CC(C)CC(=O)Nc1ccc(NC(=O)c2ccccc2C(=O)[O-])cc1	ZINC000009259102	211060411	/nfs/dbraw/zinc/06/04/11/211060411.db2.gz	UOYWKADBWIMCEI-UHFFFAOYSA-N	-1	0	340.379	3.622	50	0		EHAARM
Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cc(Cl)ccc1O	ZINC000095349108	218283698	/nfs/dbraw/zinc/28/36/98/218283698.db2.gz	SOSGJVSTSDZCAE-UHFFFAOYSA-N	-1	0	332.208	3.808	50	0		EHAARM
CC[C@@H](NC(=O)[C@@H](C)c1ccc(-c2ccccc2)c(F)c1)C(=O)[O-]	ZINC000006760089	210704007	/nfs/dbraw/zinc/70/40/07/210704007.db2.gz	ZQADHETUQGSDGN-YVEFUNNKSA-N	-1	0	329.371	3.576	50	0		EHAARM
CC(C)c1ccc(OCC(=O)c2c([O-])c3ccccc3oc2=O)cc1	ZINC000005686023	210516072	/nfs/dbraw/zinc/51/60/72/210516072.db2.gz	CJPRVLJBOMUHSJ-UHFFFAOYSA-N	-1	0	338.359	3.884	50	0	biogenic	EHAARM
O=S(=O)([N-]c1cc(C(F)(F)F)ccn1)c1ccc(Cl)cc1	ZINC000097235894	219001867	/nfs/dbraw/zinc/00/18/67/219001867.db2.gz	DHZJXFKIWAUFNF-UHFFFAOYSA-N	-1	0	336.722	3.555	50	0		EHAARM
Cc1cc(OCc2ccccc2)c2c(C)c(CC(=O)[O-])c(=O)oc2c1	ZINC000004749293	210269044	/nfs/dbraw/zinc/26/90/44/210269044.db2.gz	VNMPNELTFUQHGL-UHFFFAOYSA-N	-1	0	338.359	3.616	50	0		EHAARM
CC(C)c1ccc(-c2ccc(N3CCC(C(=O)[O-])CC3)nn2)cc1	ZINC000011567997	535370327	/nfs/dbraw/zinc/37/03/27/535370327.db2.gz	ROJFTASUWZWFPR-UHFFFAOYSA-N	-1	0	325.412	3.568	50	0		EHAARM
COC(=S)[N-]c1c(Br)cc(C)cc1Br	ZINC000000172802	563252008	/nfs/dbraw/zinc/25/20/08/563252008.db2.gz	IQWGAYQPTAXQNI-UHFFFAOYSA-N	-1	0	339.052	3.863	50	0		EHAARM
Cc1ccc(C[C@H](C(=O)[O-])[C@H](C)C(=O)Nc2ccc(F)cc2)cc1	ZINC000000350634	563289427	/nfs/dbraw/zinc/28/94/27/563289427.db2.gz	VZVZQCSDNMAZDA-GUYCJALGSA-N	-1	0	329.371	3.652	50	0		EHAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1	ZINC000000362444	563294377	/nfs/dbraw/zinc/29/43/77/563294377.db2.gz	IIJCBSUHNMHWTQ-UHFFFAOYSA-N	-1	0	349.452	3.802	50	0		EHAARM
CC(C)(C)OC(=O)N[C@H](CC(=O)[O-])c1ccccc1C(F)(F)F	ZINC000002585857	563443614	/nfs/dbraw/zinc/44/36/14/563443614.db2.gz	DYZRXQICSTZZKP-LLVKDONJSA-N	-1	0	333.306	3.746	50	0		EHAARM
Cc1cc(NC(=O)c2ccccc2C(=O)[O-])ccc1Br	ZINC000003122549	563472728	/nfs/dbraw/zinc/47/27/28/563472728.db2.gz	LDXWLHFTIVKWNU-UHFFFAOYSA-N	-1	0	334.169	3.708	50	0		EHAARM
CCCCc1ccc(-c2csc(NC(=O)CCC(=O)[O-])n2)cc1	ZINC000006727003	563583084	/nfs/dbraw/zinc/58/30/84/563583084.db2.gz	JRTPFAIUCPWXEW-UHFFFAOYSA-N	-1	0	332.425	3.956	50	0		EHAARM
Cc1cccc(C)c1[N-]S(=O)(=O)c1ccccc1Br	ZINC000007409070	563601576	/nfs/dbraw/zinc/60/15/76/563601576.db2.gz	NVLKXFDZNGROOA-UHFFFAOYSA-N	-1	0	340.242	3.867	50	0		EHAARM
Cc1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])c(Br)c1	ZINC000002744407	563611186	/nfs/dbraw/zinc/61/11/86/563611186.db2.gz	OQGQWGTZRYVECK-WDEREUQCSA-N	-1	0	340.217	3.587	50	0		EHAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2Cl)n1	ZINC000012552664	563662736	/nfs/dbraw/zinc/66/27/36/563662736.db2.gz	IAKDABOQVYNYIL-UHFFFAOYSA-N	-1	0	331.224	3.806	50	0		EHAARM
CCOC(=O)N1CCc2c(sc3[n-]c(=S)[nH]c(=S)c32)C1	ZINC000013658388	563707469	/nfs/dbraw/zinc/70/74/69/563707469.db2.gz	LEXVZKDZCWMBLR-UHFFFAOYSA-N	-1	0	327.456	3.531	50	0		EHAARM
C[C@H](c1cccs1)N(C)C(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000058417517	563945533	/nfs/dbraw/zinc/94/55/33/563945533.db2.gz	BJHQSJKKMKBSBU-SECBINFHSA-N	-1	0	345.449	3.893	50	0		EHAARM
O=C([O-])c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F	ZINC000060276636	563949761	/nfs/dbraw/zinc/94/97/61/563949761.db2.gz	FEFBGLUZCKPGJA-UHFFFAOYSA-N	-1	0	341.623	3.575	50	0		EHAARM
O=C([O-])[C@@H](Nc1nc(C(F)(F)F)nc2ccccc21)c1ccccc1	ZINC000000151342	563987397	/nfs/dbraw/zinc/98/73/97/563987397.db2.gz	ZPSCGBCFUMEHEO-ZDUSSCGKSA-N	-1	0	347.296	3.886	50	0		EHAARM
CCOC(=O)NC1([N-]c2cccc(Cl)c2)Oc2ccccc2O1	ZINC000000239672	563989089	/nfs/dbraw/zinc/98/90/89/563989089.db2.gz	QREAJHCTKAQKPY-UHFFFAOYSA-N	-1	0	334.759	3.581	50	0		EHAARM
COc1ccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c(OC)c1	ZINC000005383899	564003278	/nfs/dbraw/zinc/00/32/78/564003278.db2.gz	WFYHEBWGSHQRMD-UHFFFAOYSA-N	-1	0	349.452	3.802	50	0		EHAARM
COc1ccc(NC(=O)[C@@H](Cc2ccc(C)cc2)[C@@H](C)C(=O)[O-])cc1	ZINC000005413980	564003708	/nfs/dbraw/zinc/00/37/08/564003708.db2.gz	ZRKOPNCQBPMWIZ-KDOFPFPSSA-N	-1	0	341.407	3.522	50	0		EHAARM
CCSC(=S)N1[C@H](C(=O)[O-])CS[C@@H]1c1ccc(C)cc1	ZINC000005528906	564005059	/nfs/dbraw/zinc/00/50/59/564005059.db2.gz	RJKSJDQJAMUIJW-NWDGAFQWSA-N	-1	0	327.496	3.534	50	0		EHAARM
O=S(=O)([N-]c1ccccc1-n1cccn1)c1ccc2ccccc2c1	ZINC000047991806	564029797	/nfs/dbraw/zinc/02/97/97/564029797.db2.gz	KNIASHXPTVVNEG-UHFFFAOYSA-N	-1	0	349.415	3.826	50	0		EHAARM
O=C([O-])C1=CC[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000685944990	564051406	/nfs/dbraw/zinc/05/14/06/564051406.db2.gz	NCPGXDCNFMQHSH-CQSZACIVSA-N	-1	0	349.386	3.699	50	0		EHAARM
C[C@]12CC[C@@H]3[C@H](CC=C4C[C@H](OCC(=O)[O-])CC[C@@]43C)[C@H]1CCC2=O	ZINC000257356405	564055924	/nfs/dbraw/zinc/05/59/24/564055924.db2.gz	HVGDJTBADGQHHZ-LKTQXZJLSA-N	-1	0	346.467	3.988	50	0		EHAARM
CCc1ccc(C=Cc2nc(=O)c3c(C)c(C(=O)[O-])sc3[nH]2)cc1	ZINC000005901526	564056905	/nfs/dbraw/zinc/05/69/05/564056905.db2.gz	PHNQJVJDAFFDHI-CMDGGOBGSA-N	-1	0	340.404	3.724	50	0		EHAARM
Cc1nn(C)c(C)c1[N-]S(=O)(=O)c1c(C)cc(C(C)(C)C)cc1C	ZINC000012557226	564059380	/nfs/dbraw/zinc/05/93/80/564059380.db2.gz	AYRMDMXSSQNCIA-UHFFFAOYSA-N	-1	0	349.500	3.752	50	0		EHAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)cc1	ZINC000075351827	564082015	/nfs/dbraw/zinc/08/20/15/564082015.db2.gz	DSVONDFTIJYAEI-UHFFFAOYSA-N	-1	0	333.438	3.501	50	0		EHAARM
O=C([O-])C1(NC(=O)c2cc(-c3ccccn3)ccc2Cl)CCCC1	ZINC000190580101	564083181	/nfs/dbraw/zinc/08/31/81/564083181.db2.gz	PWAAKLOZJPEMTD-UHFFFAOYSA-N	-1	0	344.798	3.529	50	0		EHAARM
CCCOc1ccc([C@@H](Nc2ccc(F)cc2)[P@@](=O)([O-])O)cc1	ZINC000012998741	564086240	/nfs/dbraw/zinc/08/62/40/564086240.db2.gz	BVDFKGZAZOPFGX-INIZCTEOSA-N	-1	0	339.303	3.903	50	0		EHAARM
COc1cc(C(C)=NNc2ccccc2C(=O)[O-])ccc1SC	ZINC000252507156	564090317	/nfs/dbraw/zinc/09/03/17/564090317.db2.gz	ZWCZLJHAVPAZQF-UHFFFAOYSA-N	-1	0	330.409	3.951	50	0		EHAARM
COC(=O)c1ccc(C)c(NC(=O)CC2(CC(=O)[O-])CCCCC2)c1	ZINC000024150422	564092231	/nfs/dbraw/zinc/09/22/31/564092231.db2.gz	NEZYJGGCHVSKMC-UHFFFAOYSA-N	-1	0	347.411	3.535	50	0		EHAARM
Cc1cc(-c2ccc(S(=O)(=O)[N-]c3c(C)cc(C)cc3C)o2)on1	ZINC000064958468	564098530	/nfs/dbraw/zinc/09/85/30/564098530.db2.gz	CMHKNFFALFPTDA-UHFFFAOYSA-N	-1	0	346.408	3.969	50	0		EHAARM
CC(C)n1nccc1-c1csc(S(=O)(=O)[N-]c2ccccc2)c1	ZINC000065112535	564101288	/nfs/dbraw/zinc/10/12/88/564101288.db2.gz	YPYOCEFVLXPNTA-UHFFFAOYSA-N	-1	0	347.465	3.993	50	0		EHAARM
Cc1cc(Nc2ccccc2C(=O)[O-])nc(Nc2cccc(O)c2)n1	ZINC000170621825	564110226	/nfs/dbraw/zinc/11/02/26/564110226.db2.gz	QCRWJYLGIRIICG-UHFFFAOYSA-N	-1	0	336.351	3.676	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)C1	ZINC000195552070	564123696	/nfs/dbraw/zinc/12/36/96/564123696.db2.gz	UYFZCNMOEGGLPX-MAZHCROVSA-N	-1	0	335.831	3.547	50	0		EHAARM
CC(C)C[C@@H](C(=O)[O-])[C@H](C)CC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000002272714	564125592	/nfs/dbraw/zinc/12/55/92/564125592.db2.gz	DFNZDMUCEFEEPF-GDBMZVCRSA-N	-1	0	343.427	3.584	50	0		EHAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC000253371015	564130369	/nfs/dbraw/zinc/13/03/69/564130369.db2.gz	ZMKQHAOCSWUPGS-VBNZEHGJSA-N	-1	0	335.831	3.547	50	0		EHAARM
COc1cccc(-c2[nH]nc3nc(-c4ccccc4)cc(C(=O)[O-])c32)c1	ZINC000013363565	564136271	/nfs/dbraw/zinc/13/62/71/564136271.db2.gz	CMEXAVOVQZNYGI-UHFFFAOYSA-N	-1	0	345.358	3.999	50	0		EHAARM
Cc1ccccc1/C=C1\Sc2ccccc2N(CC(=O)[O-])C1=O	ZINC000020665423	564141773	/nfs/dbraw/zinc/14/17/73/564141773.db2.gz	JTXDVZBAWDXHNB-YBEGLDIGSA-N	-1	0	325.389	3.559	50	0		EHAARM
Cc1ccc(NC(=O)Cc2csc(-c3ccoc3)n2)cc1C(=O)[O-]	ZINC000095970800	564143425	/nfs/dbraw/zinc/14/34/25/564143425.db2.gz	BUBRLPJVPSUAOB-UHFFFAOYSA-N	-1	0	342.376	3.591	50	0		EHAARM
Cc1cccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@H](C)C4)c1C	ZINC000299738139	564150471	/nfs/dbraw/zinc/15/04/71/564150471.db2.gz	BCRGUORXTRLXDA-GFCCVEGCSA-N	-1	0	348.402	3.693	50	0		EHAARM
O=C([O-])[C@H]1CCCN(c2ncnc3scc(-c4ccccc4)c32)C1	ZINC000003391615	564157864	/nfs/dbraw/zinc/15/78/64/564157864.db2.gz	OBEBZEFOZOHARH-ZDUSSCGKSA-N	-1	0	339.420	3.659	50	0		EHAARM
O=C(C=Cc1ccc(Cl)cc1)N1CCC(c2n[n-]c(=S)o2)CC1	ZINC000069442871	564169533	/nfs/dbraw/zinc/16/95/33/564169533.db2.gz	IAQWHVZISLRDAN-ZZXKWVIFSA-N	-1	0	349.843	3.805	50	0		EHAARM
COC(=O)C[C@H](c1c([O-])c2ccccc2oc1=O)C1CCCCC1	ZINC000143357032	564174241	/nfs/dbraw/zinc/17/42/41/564174241.db2.gz	KSDRQDDHRLICSE-AWEZNQCLSA-N	-1	0	330.380	3.726	50	0	biogenic	EHAARM
O=C([O-])c1cc(NC(=O)c2ccnn2C2CCCC2)ccc1Cl	ZINC000683313297	602182666	/nfs/dbraw/zinc/18/26/66/602182666.db2.gz	PBHHPLJGGZWIQP-UHFFFAOYSA-N	-1	0	333.775	3.602	50	0		EHAARM