smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc(N2C(=O)/C(=C/c3ccccc3OCC(=O)[O-])SC2=S)c1	ZINC000210431889	856566389	/nfs/dbraw/zinc/56/63/89/856566389.db2.gz	QPAXBCKWJGYZDN-YBEGLDIGSA-N	-1	0	385.466	3.864	40	10		GHCBRM
Cc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2ccc(N3CCCCCC3)o2)C1=O	ZINC000006083650	204164896	/nfs/dbraw/zinc/16/48/96/204164896.db2.gz	JLCFNJIEZHVBIQ-VKAVYKQESA-N	-1	0	393.443	3.635	40	10		GHCBRM
O=C([O-])c1ccc(N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1O	ZINC000005374170	204129322	/nfs/dbraw/zinc/12/93/22/204129322.db2.gz	PMNDYASYYXMQDV-AUWJEWJLSA-N	-1	0	375.402	3.635	40	10		GHCBRM
O=C([O-])c1ccc(N2C(=O)/C(=C/c3ccccc3F)SC2=S)cc1O	ZINC000005374134	204129884	/nfs/dbraw/zinc/12/98/84/204129884.db2.gz	HOZBMZMCRJRMST-AUWJEWJLSA-N	-1	0	375.402	3.635	40	10		GHCBRM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000223644286	206005115	/nfs/dbraw/zinc/00/51/15/206005115.db2.gz	CTEJYINAIUQBMG-UHFFFAOYSA-N	-1	0	396.424	3.935	40	10		GHCBRM
Cc1cc(C=C2SC(=O)NC2=O)c(C)n1-c1ccc(Cl)c(C(=O)[O-])c1	ZINC000096475660	206123701	/nfs/dbraw/zinc/12/37/01/206123701.db2.gz	DXTUXIZELWWQPC-NSIKDUERSA-N	-1	0	376.821	3.770	40	10		GHCBRM
O=C1[N-]C(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2)o1	ZINC000002210878	206212049	/nfs/dbraw/zinc/21/20/49/206212049.db2.gz	GMMISOORLXTWLH-MHWRWJLKSA-N	-1	0	396.786	3.855	40	10		GHCBRM
COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(=O)[O-])cc1	ZINC000408894642	533267877	/nfs/dbraw/zinc/26/78/77/533267877.db2.gz	SAMDFINCNUHHTC-PDGQHHTCSA-N	-1	0	377.396	3.570	40	10		GHCBRM
Cc1ccc(Cl)cc1N1C(=O)[N-]C(=O)C(=Cc2ccc(Cl)cc2)C1=O	ZINC000409209455	534146960	/nfs/dbraw/zinc/14/69/60/534146960.db2.gz	BSKHELFIRRWEED-RIYZIHGNSA-N	-1	0	375.211	3.968	40	10		GHCBRM
CC[C@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccncc3)C2=O)cc1Cl	ZINC000409389157	529191982	/nfs/dbraw/zinc/19/19/82/529191982.db2.gz	ANCHMWRKBSNESF-XBUHWIKASA-N	-1	0	399.834	3.579	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccccc2F)C(=O)C1=Cc1ccc(Br)o1	ZINC000033785497	570646492	/nfs/dbraw/zinc/64/64/92/570646492.db2.gz	MYEGASLIUCPBEO-VQHVLOKHSA-N	-1	0	395.209	3.853	40	10		GHCBRM
Cc1ccc(-n2cccc2/C=C2/SC(=S)N(CC(=O)[O-])C2=O)cc1Cl	ZINC000409008875	570694119	/nfs/dbraw/zinc/69/41/19/570694119.db2.gz	OBVRJPLBESZWBG-RIYZIHGNSA-N	-1	0	392.889	3.725	40	10		GHCBRM
Cc1cccc(-n2cccc2/C=C2/C(=O)[N-]C(=O)N(C3CCCCC3)C2=O)c1	ZINC000015013874	570871837	/nfs/dbraw/zinc/87/18/37/570871837.db2.gz	BUDXHUZGHISUJY-RGEXLXHISA-N	-1	0	377.444	3.580	40	10		GHCBRM
O=C([O-])c1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000113830667	231022494	/nfs/dbraw/zinc/02/24/94/231022494.db2.gz	UMZRWAXWEUZORD-NTEUORMPSA-N	-1	0	386.410	3.699	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(N2CCCC2)cc1	ZINC000408961699	231135996	/nfs/dbraw/zinc/13/59/96/231135996.db2.gz	URTVOGZQGZPSPK-LDADJPATSA-N	-1	0	395.846	3.607	40	10		GHCBRM
Cc1c(Cl)cccc1N1C(=O)[N-]C(=O)C(=Cc2cn(C)c3ccccc23)C1=O	ZINC000409239601	231185389	/nfs/dbraw/zinc/18/53/89/231185389.db2.gz	HPKUCUUSVKDSKH-XNTDXEJSSA-N	-1	0	393.830	3.807	40	10		GHCBRM
O=C([O-])c1ccc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1	ZINC000409335017	231192051	/nfs/dbraw/zinc/19/20/51/231192051.db2.gz	XHDJQHDPKLYAOM-RIYZIHGNSA-N	-1	0	386.410	3.699	40	10		GHCBRM
O=C([N-]N1C(=O)/C(=C\c2c[nH]c3ccccc23)SC1=S)c1cccs1	ZINC000409348857	231193676	/nfs/dbraw/zinc/19/36/76/231193676.db2.gz	SWAGXSVZRYMUGX-RIYZIHGNSA-N	-1	0	385.495	3.776	40	10		GHCBRM
COc1ccc(/C=C2/SC(=S)N(c3ccc(C(=O)[O-])c(O)c3)C2=O)cc1	ZINC000027530362	203784869	/nfs/dbraw/zinc/78/48/69/203784869.db2.gz	UTODQUACKLHOJH-OVCLIPMQSA-N	-1	0	387.438	3.505	40	10		GHCBRM
Cc1ccc(-c2ccc(/C=C3/C(=O)[N-]N(c4ccccc4)C3=O)o2)c([N+](=O)[O-])c1	ZINC000033320005	206097199	/nfs/dbraw/zinc/09/71/99/206097199.db2.gz	JEOSHHADGPASFG-ATVHPVEESA-N	-1	0	389.367	3.625	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cccn1-c1ccc(O)cc1	ZINC000033928556	206099987	/nfs/dbraw/zinc/09/99/87/206099987.db2.gz	ZKIVMTMFDDZJNS-LDADJPATSA-N	-1	0	391.358	3.829	40	10		GHCBRM
CCN(CC)c1cccc([N-]S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000255190220	206150392	/nfs/dbraw/zinc/15/03/92/206150392.db2.gz	VSGSFMSJZDFDJQ-UHFFFAOYSA-N	-1	0	383.857	3.895	40	10		GHCBRM
COc1cc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc([N+](=O)[O-])c1[O-]	ZINC000113834994	533473522	/nfs/dbraw/zinc/47/35/22/533473522.db2.gz	VFSAKXXVRBFOLU-NTEUORMPSA-N	-1	0	394.474	3.843	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)c(C)c3)C2=O)cc1	ZINC000408817918	528641125	/nfs/dbraw/zinc/64/11/25/528641125.db2.gz	WOXIKJLMKFJHHA-CPNJWEJPSA-N	-1	0	378.428	3.759	40	10		GHCBRM
CCc1cccc(CC)c1NC=C1C(=O)[N-]C(=S)N(c2ccccc2)C1=O	ZINC000006198374	535877351	/nfs/dbraw/zinc/87/73/51/535877351.db2.gz	NWEAWEOIEXVYHL-LGMDPLHJSA-N	-1	0	379.485	3.555	40	10		GHCBRM
Cc1ccc(N2[N-]C(=O)/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1	ZINC000004866355	570641470	/nfs/dbraw/zinc/64/14/70/570641470.db2.gz	YPMUKGGDCGLBHG-LDADJPATSA-N	-1	0	389.367	3.625	40	10		GHCBRM
COc1cc(C=C2C(=O)[N-]C(=O)NC2=O)cc(Cl)c1OCc1ccccc1	ZINC000058822986	570648859	/nfs/dbraw/zinc/64/88/59/570648859.db2.gz	KRNUMOMZMUUFPD-UHFFFAOYSA-N	-1	0	386.791	3.517	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(C3CCCCC3)C2=O)c2ccccc12	ZINC000001177699	570713389	/nfs/dbraw/zinc/71/33/89/570713389.db2.gz	RKANHWWVUGDTAJ-QGOAFFKASA-N	-1	0	378.428	3.643	40	10		GHCBRM
CCOc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000209584859	856566303	/nfs/dbraw/zinc/56/63/03/856566303.db2.gz	PZIOMVPYZSVPFI-RVDMUPIBSA-N	-1	0	384.819	3.714	40	10		GHCBRM
O=C([O-])c1ccccc1NC1=NC(=O)C(=Cc2ccc(Br)o2)S1	ZINC000020226956	919619504	/nfs/dbraw/zinc/61/95/04/919619504.db2.gz	XAQULFCBWJGGIG-YRNVUSSQSA-N	-1	0	393.218	3.823	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(C(F)(F)F)cc1	ZINC000408912234	231129702	/nfs/dbraw/zinc/12/97/02/231129702.db2.gz	QBSKWICBZUVDSZ-RIYZIHGNSA-N	-1	0	378.281	3.511	40	10		GHCBRM
Cc1cc(C=C2C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)c(C)n1C(C)(C)C	ZINC000408963145	231136012	/nfs/dbraw/zinc/13/60/12/231136012.db2.gz	AHCYUWAWPUSTAH-LDADJPATSA-N	-1	0	379.460	3.835	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cc(Cl)ccc3O)C2=O)cc1Cl	ZINC000408984566	231141826	/nfs/dbraw/zinc/14/18/26/231141826.db2.gz	JAFLYCOYMANHBT-QPEQYQDCSA-N	-1	0	391.210	3.674	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=O)N(C)C2=O)c(C)n1-c1ccc(-c2ccccc2)cc1	ZINC000409000354	231144724	/nfs/dbraw/zinc/14/47/24/231144724.db2.gz	YQZSVJBJCKTALO-KGENOOAVSA-N	-1	0	399.450	3.853	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(Cl)cc3)C2=O)c1C	ZINC000409095184	231159200	/nfs/dbraw/zinc/15/92/00/231159200.db2.gz	HKGUWRBQYIJLGT-MHWRWJLKSA-N	-1	0	387.892	3.610	40	10		GHCBRM
Cc1c(Cl)cccc1N1C(=O)[N-]C(=O)C(=Cc2c[nH]c3ccccc23)C1=O	ZINC000409244779	231186931	/nfs/dbraw/zinc/18/69/31/231186931.db2.gz	IPTMLUCQUIEHAO-NTEUORMPSA-N	-1	0	379.803	3.796	40	10		GHCBRM
Cc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C(C)C)cc3)C2=O)cc1[N+](=O)[O-]	ZINC000005754036	204149964	/nfs/dbraw/zinc/14/99/64/204149964.db2.gz	VCOKSRVCAIJYKL-LICLKQGHSA-N	-1	0	393.399	3.693	40	10		GHCBRM
CCCC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(OCC)cc2)SC1=S	ZINC000005372282	204129164	/nfs/dbraw/zinc/12/91/64/204129164.db2.gz	NMCSLMCZSUMVJB-ADVGAGMGSA-N	-1	0	379.503	3.930	40	10		GHCBRM
COc1ccc(OC)c(N=C(C)c2c(C)[n-]n(-c3ccc([N+](=O)[O-])cc3)c2=O)c1	ZINC000112124338	532966233	/nfs/dbraw/zinc/96/62/33/532966233.db2.gz	RSJLHAZDGTWURE-UNOMPAQXSA-N	-1	0	396.403	3.721	40	10		GHCBRM
CCOc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(CC)cc3)C2=O)c1	ZINC000408867389	528289105	/nfs/dbraw/zinc/28/91/05/528289105.db2.gz	KQKJQRSKJAWOOG-WOJGMQOQSA-N	-1	0	398.846	3.968	40	10		GHCBRM
COCCn1c(C)cc(C=C2C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)c1C	ZINC000059087187	570649396	/nfs/dbraw/zinc/64/93/96/570649396.db2.gz	AUCAKQVGNQMITQ-LDADJPATSA-N	-1	0	381.432	3.566	40	10		GHCBRM
CCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCC4)o3)C2=O)cc1	ZINC000059138517	570650650	/nfs/dbraw/zinc/65/06/50/570650650.db2.gz	RHAOKWSEXNRGMN-GHRIWEEISA-N	-1	0	395.415	3.785	40	10		GHCBRM
COC(=O)c1ccccc1N=C(C)c1c(C)[n-]n(-c2ccc(OC)cc2)c1=O	ZINC000013173973	570749860	/nfs/dbraw/zinc/74/98/60/570749860.db2.gz	SYCCLQDFQXHPLK-CPNJWEJPSA-N	-1	0	379.416	3.590	40	10		GHCBRM
COc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cc(C)c(O)c(C)c3)C2=O)c(OC)c1	ZINC000038173695	856551940	/nfs/dbraw/zinc/55/19/40/856551940.db2.gz	HCGHAWJDDMHABF-OQLLNIDSSA-N	-1	0	396.399	3.533	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(O)c(Cl)c1	ZINC000226086944	856568012	/nfs/dbraw/zinc/56/80/12/856568012.db2.gz	LJWZNGNRASYYGV-KPKJPENVSA-N	-1	0	393.251	3.530	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/C=C/c1ccco1	ZINC000409233100	231184698	/nfs/dbraw/zinc/18/46/98/231184698.db2.gz	KEBKQVMXRZDKSX-BOAPOFAJSA-N	-1	0	392.358	3.686	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C(C)C)cc3)C2=O)cc1	ZINC000409249739	231187764	/nfs/dbraw/zinc/18/77/64/231187764.db2.gz	VLWBRWAQTGAKFN-LDADJPATSA-N	-1	0	380.469	3.650	40	10		GHCBRM
Cc1cccc(COc2ccc(/C=C3\SC(=S)N(CC(=O)[O-])C3=O)cc2)c1	ZINC000409337997	231191962	/nfs/dbraw/zinc/19/19/62/231191962.db2.gz	BAWDXQRZKCUHEG-YVLHZVERSA-N	-1	0	399.493	3.860	40	10		GHCBRM
CCOc1ccccc1/C=C1/SC(=S)N([N-]C(=O)c2cccs2)C1=O	ZINC000409347675	231193758	/nfs/dbraw/zinc/19/37/58/231193758.db2.gz	QSKDLZBISFOAEN-GXDHUFHOSA-N	-1	0	390.511	3.693	40	10		GHCBRM
O=C1[N-]N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(N2CCCCC2)cc1	ZINC000005394786	204130942	/nfs/dbraw/zinc/13/09/42/204130942.db2.gz	SHSUEGBYZSGXMW-UYRXBGFRSA-N	-1	0	381.863	3.792	40	10		GHCBRM
CCOc1ccc(C=C2SC(Nc3ccccc3C(=O)[O-])=NC2=O)cc1OC	ZINC000020226925	204708985	/nfs/dbraw/zinc/70/89/85/204708985.db2.gz	SANFOIZJBOHSDC-BOPFTXTBSA-N	-1	0	398.440	3.875	40	10		GHCBRM
COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccccc1C(=O)[O-]	ZINC000408797612	533267675	/nfs/dbraw/zinc/26/76/75/533267675.db2.gz	SQGZLKYTDDADAM-PDGQHHTCSA-N	-1	0	377.396	3.570	40	10		GHCBRM
Cc1ccccc1N1C(=O)[N-]C(=O)C(=CNc2ccc(Cl)cc2Cl)C1=O	ZINC000408534505	534821688	/nfs/dbraw/zinc/82/16/88/534821688.db2.gz	VUJFEXWKIFOODX-FMIVXFBMSA-N	-1	0	390.226	3.881	40	10		GHCBRM
O=C([O-])COc1cccc(C=C2SC(Nc3cccc(Cl)c3)=NC2=O)c1	ZINC000016909756	570914986	/nfs/dbraw/zinc/91/49/86/570914986.db2.gz	SLPUMPUMJODLLM-OVCLIPMQSA-N	-1	0	388.832	3.886	40	10		GHCBRM
N#Cc1ccccc1COc1ccccc1/C=C1/C(=O)[N-]N(c2ccccc2)C1=O	ZINC000035112863	856552589	/nfs/dbraw/zinc/55/25/89/856552589.db2.gz	ZEBXDXVKSYMRCS-STZFKDTASA-N	-1	0	395.418	3.599	40	10		GHCBRM
Cc1ccc(NC=C2C(=O)[N-]C(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1	ZINC000408552412	231058164	/nfs/dbraw/zinc/05/81/64/231058164.db2.gz	TUVQPWULOBBXEQ-LCYFTJDESA-N	-1	0	389.839	3.531	40	10		GHCBRM
CCOc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2ccccc2Cl)C1=O	ZINC000409233705	231184090	/nfs/dbraw/zinc/18/40/90/231184090.db2.gz	HLNXKEVNYDKXEO-ACCUITESSA-N	-1	0	386.860	3.570	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2c(O)ccc3ccccc32)C1=O	ZINC000408888352	529586730	/nfs/dbraw/zinc/58/67/30/529586730.db2.gz	UPXPUFCNTVGVPI-AQTBWJFISA-N	-1	0	386.407	3.774	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cc(Cl)cc(OC)c3)C2=O)cc1	ZINC000408875521	529662201	/nfs/dbraw/zinc/66/22/01/529662201.db2.gz	JQFCMDUIHAWZMB-LICLKQGHSA-N	-1	0	384.819	3.577	40	10		GHCBRM
Cc1ccccc1/C=C1\SC(=S)N([C@@H](Cc2ccccc2)C(=O)[O-])C1=O	ZINC000005373429	204129688	/nfs/dbraw/zinc/12/96/88/204129688.db2.gz	IPFTYYJDJFWZSW-BQGMYUGNSA-N	-1	0	383.494	3.892	40	10		GHCBRM
COc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)c2ccccc2)cc1OC	ZINC000223645145	206003946	/nfs/dbraw/zinc/00/39/46/206003946.db2.gz	JHEXSHFXYJDIOP-UHFFFAOYSA-N	-1	0	397.452	3.736	40	10		GHCBRM
COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(C(=O)[O-])cc1	ZINC000408795315	533266454	/nfs/dbraw/zinc/26/64/54/533266454.db2.gz	LZLNCTXPUKCRAJ-RMENWYJGSA-N	-1	0	391.423	3.819	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)[N-]C2=S)c1	ZINC000409244164	533671828	/nfs/dbraw/zinc/67/18/28/533671828.db2.gz	YVBVNWDWNFWGCQ-GZTJUZNOSA-N	-1	0	389.480	3.626	40	10		GHCBRM
Cc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2cccn2-c2ccc(F)cc2)C1=O	ZINC000100992343	136189297	/nfs/dbraw/zinc/18/92/97/136189297.db2.gz	CPSDRLDGLVEPOO-AQTBWJFISA-N	-1	0	389.386	3.591	40	10		GHCBRM
CC(=Nc1cc([N+](=O)[O-])ccc1C)c1c(C)[n-]n(-c2ccc([N+](=O)[O-])cc2)c1=O	ZINC000112123620	527540581	/nfs/dbraw/zinc/54/05/81/527540581.db2.gz	YHQGTNNNQDOYIL-PDGQHHTCSA-N	-1	0	395.375	3.920	40	10		GHCBRM
CC(C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3)C2=O)cc1Cl	ZINC000408803891	528131093	/nfs/dbraw/zinc/13/10/93/528131093.db2.gz	ULEKGAUXMKUSIX-XNTDXEJSSA-N	-1	0	384.819	3.794	40	10		GHCBRM
COc1ccc2ccccc2c1/C=C1\C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000001192707	570256989	/nfs/dbraw/zinc/25/69/89/570256989.db2.gz	NDVDCAQGOMRTMP-CPNJWEJPSA-N	-1	0	386.407	3.823	40	10		GHCBRM
CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(=O)[O-])cc1	ZINC000015188530	570884604	/nfs/dbraw/zinc/88/46/04/570884604.db2.gz	SJHGOZOUDCCWAQ-UYRXBGFRSA-N	-1	0	391.423	3.961	40	10		GHCBRM
O=C([O-])COc1ccccc1C=C1SC(Nc2ccc(Cl)cc2)=NC1=O	ZINC000020429138	570946852	/nfs/dbraw/zinc/94/68/52/570946852.db2.gz	CEKGKGGKKVFPLV-OQLLNIDSSA-N	-1	0	388.832	3.886	40	10		GHCBRM
Cc1cccc(NC=C2C(=O)[N-]C(=S)N(c3ccc(F)c(Cl)c3)C2=O)c1	ZINC000408553399	231058013	/nfs/dbraw/zinc/05/80/13/231058013.db2.gz	YQCYCWFIFIKGMD-LCYFTJDESA-N	-1	0	389.839	3.531	40	10		GHCBRM
Cc1cc(/C=C2\SC(=O)N(CC(=O)[O-])C2=O)c(C)n1-c1ccc(Cl)cc1	ZINC000409135782	231170185	/nfs/dbraw/zinc/17/01/85/231170185.db2.gz	ZWYUPGILYSEWEQ-NVNXTCNLSA-N	-1	0	390.848	3.868	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)[N-]C2=S)c(C)c1	ZINC000409137676	231170320	/nfs/dbraw/zinc/17/03/20/231170320.db2.gz	XWBHJKQPGIPZIS-MHWRWJLKSA-N	-1	0	375.453	3.616	40	10		GHCBRM
Cc1ccc(C(=O)[O-])cc1N1C(=O)/C(=C/c2ccc(C=O)cc2)SC1=S	ZINC000005375094	204129136	/nfs/dbraw/zinc/12/91/36/204129136.db2.gz	NIRHGQVXYFTDRZ-PXNMLYILSA-N	-1	0	383.450	3.912	40	10		GHCBRM
CC(C)COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)cc1	ZINC000408849970	528142221	/nfs/dbraw/zinc/14/22/21/528142221.db2.gz	BXKKXKNVCYYXRO-WOJGMQOQSA-N	-1	0	382.391	3.527	40	10		GHCBRM
CC(C)Oc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000408810258	528164721	/nfs/dbraw/zinc/16/47/21/528164721.db2.gz	PEOFGLFYLWVKNG-LFIBNONCSA-N	-1	0	384.819	3.794	40	10		GHCBRM
CCOc1cc(C=C2C(=O)[N-]C(=S)N(c3ccccc3F)C2=O)ccc1O	ZINC000059135785	570650157	/nfs/dbraw/zinc/65/01/57/570650157.db2.gz	MKISPSABGCRBLC-FMIVXFBMSA-N	-1	0	386.404	3.602	40	10		GHCBRM
Cc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2ccc(N3CCCCC3)cc2)C1=O	ZINC000014133126	570824388	/nfs/dbraw/zinc/82/43/88/570824388.db2.gz	LVCLATWSRQAEOD-XDJHFCHBSA-N	-1	0	389.455	3.652	40	10		GHCBRM
COc1ccc(/C=C/C=C2\C(=O)[N-]C(=S)N(c3cccc(C)c3C)C2=O)cc1	ZINC000409138275	231169782	/nfs/dbraw/zinc/16/97/82/231169782.db2.gz	ZJTYXIJCEYLBTN-FFEFAENFSA-N	-1	0	392.480	3.700	40	10		GHCBRM
O=C([O-])c1cccc(-c2ccc(/C=C3\NC(=O)N(C4CCCCC4)C3=O)o2)c1	ZINC000409090852	231158056	/nfs/dbraw/zinc/15/80/56/231158056.db2.gz	PCVBPHQEXZAWDA-ATVHPVEESA-N	-1	0	380.400	3.870	40	10		GHCBRM
CCc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)[N-]C2=S)cc1	ZINC000408967063	529662292	/nfs/dbraw/zinc/66/22/92/529662292.db2.gz	PQPGALQKSUYIEI-UKTHLTGXSA-N	-1	0	376.890	3.795	40	10		GHCBRM
CCCC[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(OC)cc2OC)SC1=S	ZINC000005371363	204128461	/nfs/dbraw/zinc/12/84/61/204128461.db2.gz	XTWYRRIJMBWDTD-GRRFOWRYSA-N	-1	0	395.502	3.548	40	10		GHCBRM
O=Cc1ccc(/C=C2\SC(=S)N(c3ccc(CC(=O)[O-])cc3)C2=O)cc1	ZINC000005375087	204129624	/nfs/dbraw/zinc/12/96/24/204129624.db2.gz	QQMQWCQKOLZYTL-SXGWCWSVSA-N	-1	0	383.450	3.532	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3Br)C2=O)c1	ZINC000004471732	206215342	/nfs/dbraw/zinc/21/53/42/206215342.db2.gz	PNDRXYBXQGFGIG-GDNBJRDFSA-N	-1	0	399.244	3.732	40	10		GHCBRM
CC(C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3Cl)C2=O)cc1	ZINC000408804251	528131119	/nfs/dbraw/zinc/13/11/19/528131119.db2.gz	DUANNCXEAYQXBB-RVDMUPIBSA-N	-1	0	384.819	3.794	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cc(C)ccc3C)C2=O)o1	ZINC000409242242	528293827	/nfs/dbraw/zinc/29/38/27/528293827.db2.gz	WCRUHBNYBPPCKE-FOWTUZBSSA-N	-1	0	397.500	3.574	40	10		GHCBRM
CCOc1ccc(Cl)cc1/C=C1/C(=O)[N-]C(=O)N(c2ccccc2F)C1=O	ZINC000408878008	528469820	/nfs/dbraw/zinc/46/98/20/528469820.db2.gz	ZZRXTZGONKNRCI-RAXLEYEMSA-N	-1	0	388.782	3.544	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(C)c3C)C2=O)cc1	ZINC000408803255	528641358	/nfs/dbraw/zinc/64/13/58/528641358.db2.gz	MZGLHSNVSAPJPK-QGOAFFKASA-N	-1	0	378.428	3.759	40	10		GHCBRM
CN(C)c1ccc(/C=C2/SC(=S)N(CCCCCC(=O)[O-])C2=O)cc1	ZINC000001870918	570252438	/nfs/dbraw/zinc/25/24/38/570252438.db2.gz	DRIZUSKVXOXVBK-NTCAYCPXSA-N	-1	0	378.519	3.599	40	10		GHCBRM
O=C([O-])c1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(O)cc3)C2=O)cc1	ZINC000408758477	570453545	/nfs/dbraw/zinc/45/35/45/570453545.db2.gz	KQZHUXUSHUXGCK-XSFVSMFZSA-N	-1	0	384.391	3.925	40	10		GHCBRM
CCOc1ccc(OCC)c(N2C(=O)[N-]C(=O)C(=Cc3ccccc3O)C2=O)c1	ZINC000059104676	570649627	/nfs/dbraw/zinc/64/96/27/570649627.db2.gz	OSOCPILNFJDECC-RVDMUPIBSA-N	-1	0	396.399	3.696	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc(Br)c2)C(=O)C1=Cc1ccccc1O	ZINC000059198315	570651673	/nfs/dbraw/zinc/65/16/73/570651673.db2.gz	MXEQVAJGOGOBFI-MDWZMJQESA-N	-1	0	387.189	3.661	40	10		GHCBRM
CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(CC(=O)[O-])C2=O)cc1Cl	ZINC000409011729	570693623	/nfs/dbraw/zinc/69/36/23/570693623.db2.gz	IFKRWGYULXMEGE-MRACZJACSA-N	-1	0	385.894	3.803	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc(C(F)(F)F)c2)C(=O)C1=Cc1ccc([N+](=O)[O-])o1	ZINC000016399236	570924196	/nfs/dbraw/zinc/92/41/96/570924196.db2.gz	KZUJNSKDDIVGCE-XFFZJAGNSA-N	-1	0	395.249	3.713	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c1OC(C)C	ZINC000033696056	856547948	/nfs/dbraw/zinc/54/79/48/856547948.db2.gz	DZKOYKTUOQIMRP-YBEGLDIGSA-N	-1	0	386.835	3.597	40	10		GHCBRM
CCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cc(C)c(O)c(C)c3)C2=O)cc1	ZINC000038176866	856551824	/nfs/dbraw/zinc/55/18/24/856551824.db2.gz	DPYRUDUPRRTVQG-GZTJUZNOSA-N	-1	0	380.400	3.914	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cc(C)ccc3C)C2=O)cc1Cl	ZINC000408806203	231116243	/nfs/dbraw/zinc/11/62/43/231116243.db2.gz	MDWNRVHTDQLRCX-NTEUORMPSA-N	-1	0	384.819	3.632	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)[N-]C2=S)c(C)c1	ZINC000409139190	231169800	/nfs/dbraw/zinc/16/98/00/231169800.db2.gz	BCGTYYQYOFORNZ-LDADJPATSA-N	-1	0	394.496	3.922	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cc(Cl)ccc3C)C2=O)cc1	ZINC000408807384	528369663	/nfs/dbraw/zinc/36/96/63/528369663.db2.gz	CFMARHIEJKTZQI-MHWRWJLKSA-N	-1	0	384.819	3.714	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(C)cc3C)C2=O)c1	ZINC000408935102	570686907	/nfs/dbraw/zinc/68/69/07/570686907.db2.gz	GRVFTCZLMZXQFD-AQTBWJFISA-N	-1	0	378.428	3.759	40	10		GHCBRM
Cc1c(C=C2C(=O)[N-]C(=O)N(c3ccc(C)c(C)c3)C2=O)c2ccccc2n1C	ZINC000408828101	231119877	/nfs/dbraw/zinc/11/98/77/231119877.db2.gz	VSBGYDPQAIRDGX-XDHOZWIPSA-N	-1	0	387.439	3.770	40	10		GHCBRM
Cc1cc(N2CCCC2)ccc1/C=C1\C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000408959585	231135191	/nfs/dbraw/zinc/13/51/91/231135191.db2.gz	BLMDIJIUFVDQHN-XMHGGMMESA-N	-1	0	389.455	3.570	40	10		GHCBRM
CCOc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2ccc(OC(C)C)cc2)C1=O	ZINC000409247628	231187257	/nfs/dbraw/zinc/18/72/57/231187257.db2.gz	DWXGCNHTKFJXRM-GHRIWEEISA-N	-1	0	394.427	3.539	40	10		GHCBRM
O=C([N-]N1C(=O)/C(=C\c2ccc(O)c(Cl)c2)SC1=S)c1cccs1	ZINC000409347308	231193917	/nfs/dbraw/zinc/19/39/17/231193917.db2.gz	PFAVDEPEKGRKGA-KPKJPENVSA-N	-1	0	396.902	3.653	40	10		GHCBRM
Cc1ccsc1/C=C1\C(=O)[N-]C(=S)N(c2cccc(C(F)(F)F)c2)C1=O	ZINC000409238628	534456192	/nfs/dbraw/zinc/45/61/92/534456192.db2.gz	LIBWYIZHZYVZPM-XYOKQWHBSA-N	-1	0	396.415	3.907	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(Cl)cc3)C2=O)cc1	ZINC000408811033	528640585	/nfs/dbraw/zinc/64/05/85/528640585.db2.gz	NGOFVQAZWVWETC-SFQUDFHCSA-N	-1	0	384.819	3.795	40	10		GHCBRM
CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(CC(=O)[O-])C1=O	ZINC000006265126	528730477	/nfs/dbraw/zinc/73/04/77/528730477.db2.gz	JGVQDEHBANIDEY-MHWRWJLKSA-N	-1	0	387.482	3.914	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3cc([N+](=O)[O-])ccc3Cl)C2=O)c1	ZINC000059426647	570656933	/nfs/dbraw/zinc/65/69/33/570656933.db2.gz	JXYWFCPOWIBUGW-OQLLNIDSSA-N	-1	0	399.790	3.531	40	10		GHCBRM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(-n3c(C)ccc3C)cc2)c1	ZINC000006416153	570743246	/nfs/dbraw/zinc/74/32/46/570743246.db2.gz	FLBHJTOGOKNRMO-UHFFFAOYSA-N	-1	0	386.473	3.912	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccccc1	ZINC000408850786	231121804	/nfs/dbraw/zinc/12/18/04/231121804.db2.gz	RDZZRGNNJPAARV-PKNBQFBNSA-N	-1	0	377.252	3.825	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCC4)cc3)C2=O)c1C	ZINC000408860026	231122713	/nfs/dbraw/zinc/12/27/13/231122713.db2.gz	XGGMVYKTDDPHFH-RGEXLXHISA-N	-1	0	389.455	3.570	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OC(C)C)C2=O)cc1	ZINC000408805494	529662091	/nfs/dbraw/zinc/66/20/91/529662091.db2.gz	KSPYHSOVFSERHX-QGOAFFKASA-N	-1	0	378.428	3.703	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(F)cc2)C(=O)C1=CC=Cc1ccccc1[N+](=O)[O-]	ZINC000016448948	136201985	/nfs/dbraw/zinc/20/19/85/136201985.db2.gz	FEEYXBKGLKOBTP-VLVOFSMPSA-N	-1	0	397.387	3.962	40	10		GHCBRM
COc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Cl)c(Cl)c3)C2=O)cc1	ZINC000408740309	533997530	/nfs/dbraw/zinc/99/75/30/533997530.db2.gz	JYGOFRCTYDXLSB-MDWZMJQESA-N	-1	0	391.210	3.668	40	10		GHCBRM
COc1ccc(-n2[n-]c(C)c(C(C)=Nc3ccc(OC)cc3OC)c2=O)cc1	ZINC000112121234	534021092	/nfs/dbraw/zinc/02/10/92/534021092.db2.gz	FGSKHXVVCJJVQG-MOSHPQCFSA-N	-1	0	381.432	3.821	40	10		GHCBRM
Cc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cccc(C(F)(F)F)c3)C2=O)s1	ZINC000409249998	534248004	/nfs/dbraw/zinc/24/80/04/534248004.db2.gz	VQZYGQWYBJRIEV-MDWZMJQESA-N	-1	0	396.415	3.907	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cc(C(F)(F)F)ccc2Cl)C(=O)/C1=C\c1ccco1	ZINC000408942633	534784720	/nfs/dbraw/zinc/78/47/20/534784720.db2.gz	ZUGAQHSJAJKXKE-YFHOEESVSA-N	-1	0	384.697	3.618	40	10		GHCBRM
Cc1ccccc1NC(=O)c1cc(S(=O)(=O)[N-]c2ccc(O)cc2)cs1	ZINC000006681737	570671953	/nfs/dbraw/zinc/67/19/53/570671953.db2.gz	FLIKSCRFZGNZTG-UHFFFAOYSA-N	-1	0	388.470	3.815	40	10		GHCBRM
Cc1ccccc1N1C(=O)/C(=C\c2ccccc2OCC(=O)[O-])SC1=S	ZINC000016909791	570915034	/nfs/dbraw/zinc/91/50/34/570915034.db2.gz	JRPPOZUGADTCAG-MHWRWJLKSA-N	-1	0	385.466	3.864	40	10		GHCBRM
Cc1ccccc1NC1=NC(=O)C(=Cc2ccc(O[C@@H](C)C(=O)[O-])cc2)S1	ZINC000210836510	602095478	/nfs/dbraw/zinc/09/54/78/602095478.db2.gz	ZRPGDHPMTJZZDI-MFVBVHDHSA-N	-1	0	382.441	3.929	40	10		GHCBRM
CC[C@@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(F)c3)C2=O)cc1	ZINC000408914544	529382732	/nfs/dbraw/zinc/38/27/32/529382732.db2.gz	YJQGZSJTJVWHIR-VBEHJTROSA-N	-1	0	382.391	3.669	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OC(C)C)C2=O)cc1C	ZINC000408806384	231116235	/nfs/dbraw/zinc/11/62/35/231116235.db2.gz	MVUJCRGJKNUCAU-LDADJPATSA-N	-1	0	378.428	3.757	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2cccc(Br)c2)C1=O	ZINC000408871273	529586673	/nfs/dbraw/zinc/58/66/73/529586673.db2.gz	ZADKLZYRMLGMLG-PTNGSMBKSA-N	-1	0	399.244	3.678	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccc(C(F)(F)F)c3)C2=O)cc1	ZINC000408981259	529662315	/nfs/dbraw/zinc/66/23/15/529662315.db2.gz	ABFBXBDGMITCJL-WJDWOHSUSA-N	-1	0	388.345	3.934	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3Cl)C2=O)cc1	ZINC000005794877	204151887	/nfs/dbraw/zinc/15/18/87/204151887.db2.gz	FFDCUWZLVLGEAV-DTQAZKPQSA-N	-1	0	397.862	3.853	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N([C@@H](C(=O)[O-])[C@H](C)CC)C2=O)cc1	ZINC000005373647	204129636	/nfs/dbraw/zinc/12/96/36/204129636.db2.gz	CHJJPBZLESNBNE-HVTJSOBYSA-N	-1	0	379.503	3.786	40	10		GHCBRM
O=C(c1ccccc1)c1ccccc1[N-]S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000038934374	205040251	/nfs/dbraw/zinc/04/02/51/205040251.db2.gz	WJGKGSMSRIJCAT-UHFFFAOYSA-N	-1	0	382.397	3.627	40	10		GHCBRM
O=C(c1ccccc1)c1ccccc1[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000223643383	206004922	/nfs/dbraw/zinc/00/49/22/206004922.db2.gz	LANAFBKTVFHWOW-UHFFFAOYSA-N	-1	0	382.397	3.627	40	10		GHCBRM
COc1ccc(NC=C2C(=O)[N-]C(=O)N(c3ccc(C)cc3C)C2=O)cc1Cl	ZINC000408530121	533993973	/nfs/dbraw/zinc/99/39/73/533993973.db2.gz	ISUJAGGHVYROSR-GXDHUFHOSA-N	-1	0	399.834	3.544	40	10		GHCBRM
Cc1ccc(Cl)cc1N1C(=O)[N-]C(=O)C(=Cc2ccc(O)c(Cl)c2)C1=O	ZINC000408888390	534146243	/nfs/dbraw/zinc/14/62/43/534146243.db2.gz	ZMEHVSFEQDKBRG-WUXMJOGZSA-N	-1	0	391.210	3.674	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccc(N2CCCC2)cc1	ZINC000001192635	570256938	/nfs/dbraw/zinc/25/69/38/570256938.db2.gz	QZANPHGZCVRPOS-QGOAFFKASA-N	-1	0	395.846	3.607	40	10		GHCBRM
COc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(Cl)cc3)C2=O)cc1Cl	ZINC000408773397	570682678	/nfs/dbraw/zinc/68/26/78/570682678.db2.gz	IMUQNXAQHWSVFC-JYRVWZFOSA-N	-1	0	391.210	3.668	40	10		GHCBRM
Cc1ccc(-c2csc([N-]S(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000031903717	852793803	/nfs/dbraw/zinc/79/38/03/852793803.db2.gz	LRTUMLPHLBYCSW-UHFFFAOYSA-N	-1	0	375.431	3.828	40	10		GHCBRM
CCOc1cc(C=C2C(=O)[N-]C(=O)N(Cc3ccco3)C2=O)cc(Cl)c1O	ZINC000038172130	856551616	/nfs/dbraw/zinc/55/16/16/856551616.db2.gz	BYILYGDHFQYYAJ-WUXMJOGZSA-N	-1	0	390.779	3.540	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1ccccc1O	ZINC000408722133	231105472	/nfs/dbraw/zinc/10/54/72/231105472.db2.gz	FDJSNCXARXOEBL-YRNVUSSQSA-N	-1	0	393.251	3.530	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=CNc2ccc(F)c(Cl)c2)C1=O	ZINC000408527685	529586097	/nfs/dbraw/zinc/58/60/97/529586097.db2.gz	GFCVHJRKMPSVLV-JLHYYAGUSA-N	-1	0	387.798	3.620	40	10		GHCBRM
COc1ccc(-c2c3cc(O)c([O-])cc3oc3cc(=O)c(O)cc2-3)cc1OC	ZINC000004894301	204086772	/nfs/dbraw/zinc/08/67/72/204086772.db2.gz	JFNMTDANKVJQIM-UHFFFAOYSA-N	-1	0	380.352	3.699	40	10		GHCBRM
CC(=O)c1ccc(N2C(=O)C(=Cc3ccc(C(=O)[O-])cc3)SC2=S)cc1	ZINC000005371690	204128483	/nfs/dbraw/zinc/12/84/83/204128483.db2.gz	CIKLHMIZOIIGKK-YBEGLDIGSA-N	-1	0	383.450	3.993	40	10		GHCBRM
CCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])sc2c1CC[C@@H](C)C2	ZINC000005020619	204103844	/nfs/dbraw/zinc/10/38/44/204103844.db2.gz	UFWMPQNXIXEGJU-AGIUHOORSA-N	-1	0	391.489	3.655	40	10		GHCBRM
CCCC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(O)c(OCC)c2)SC1=S	ZINC000005372105	204127950	/nfs/dbraw/zinc/12/79/50/204127950.db2.gz	UHXLRUIWMIQOJE-DYTQJMLRSA-N	-1	0	395.502	3.636	40	10		GHCBRM
COc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2cc(C)ccc2C)C1=O	ZINC000408803101	533833263	/nfs/dbraw/zinc/83/32/63/533833263.db2.gz	LGHWJDTWFGVVPS-XNTDXEJSSA-N	-1	0	384.819	3.632	40	10		GHCBRM
CC(C)Oc1ccc2ccccc2c1/C=C1\SC(=S)N(CC(=O)[O-])C1=O	ZINC000409348328	528210341	/nfs/dbraw/zinc/21/03/41/528210341.db2.gz	SDNVABIYPVZINP-SXGWCWSVSA-N	-1	0	387.482	3.913	40	10		GHCBRM
CCOc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(C)c3)C2=O)c1	ZINC000408867545	528288822	/nfs/dbraw/zinc/28/88/22/528288822.db2.gz	LLTIPMNECDKYCX-LICLKQGHSA-N	-1	0	384.819	3.714	40	10		GHCBRM
CCCOc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000408810633	528692376	/nfs/dbraw/zinc/69/23/76/528692376.db2.gz	PPHAUOXFASAGLE-FOWTUZBSSA-N	-1	0	384.819	3.795	40	10		GHCBRM
CC[C@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(F)c2)C1=O	ZINC000408913161	529197329	/nfs/dbraw/zinc/19/73/29/529197329.db2.gz	SVOUARLHFGFVKL-HNEYUBDGSA-N	-1	0	382.391	3.669	40	10		GHCBRM
COc1ccc(F)cc1S(=O)(=O)[N-]c1ccccc1C(=O)c1ccccc1	ZINC000223694426	570479252	/nfs/dbraw/zinc/47/92/52/570479252.db2.gz	ZOAMRVSMDXQTFS-UHFFFAOYSA-N	-1	0	385.416	3.866	40	10		GHCBRM
Cc1cc(C=C2C(=O)[N-]C(=O)N(C3CCCCC3)C2=O)c(C)n1C[C@H]1CCCO1	ZINC000059109235	570653891	/nfs/dbraw/zinc/65/38/91/570653891.db2.gz	YPYRTFIMKLXAEV-LSCADSNKSA-N	-1	0	399.491	3.919	40	10		GHCBRM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C\c1ccc(OCc2cccc(F)c2)cc1	ZINC000107823992	856556291	/nfs/dbraw/zinc/55/62/91/856556291.db2.gz	DQDBRJPIXLOYCF-STZFKDTASA-N	-1	0	388.398	3.866	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC(C)C)cc3)C2=O)c(C)c1	ZINC000408813836	231117881	/nfs/dbraw/zinc/11/78/81/231117881.db2.gz	YQNKMHDICWHPQI-LDADJPATSA-N	-1	0	378.428	3.757	40	10		GHCBRM
CCOc1ccccc1/C=C1/C(=O)[N-]C(=O)N(c2ccc(C)c(Cl)c2)C1=O	ZINC000408988422	231141853	/nfs/dbraw/zinc/14/18/53/231141853.db2.gz	HXOOBPQQLCLKMG-GDNBJRDFSA-N	-1	0	384.819	3.714	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2ccc(N3CCCC3)cc2)C1=O	ZINC000408960646	529586419	/nfs/dbraw/zinc/58/64/19/529586419.db2.gz	NKWPOQPIJLPZBQ-XDJHFCHBSA-N	-1	0	389.455	3.516	40	10		GHCBRM
O=C([O-])[C@@H](Cc1ccccc1)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S	ZINC000006061398	204163274	/nfs/dbraw/zinc/16/32/74/204163274.db2.gz	YOXUOPFXFNNIAV-YLQKULKDSA-N	-1	0	387.457	3.723	40	10		GHCBRM
CCn1cc(/C=C2\C(=O)[N-]N(c3ccc(F)c(Cl)c3)C2=O)c2ccccc21	ZINC000226095680	206089611	/nfs/dbraw/zinc/08/96/11/206089611.db2.gz	RVPBXQSJEIHRDO-OQLLNIDSSA-N	-1	0	383.810	3.915	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(Cl)cc3)C2=O)c1	ZINC000408870663	533945188	/nfs/dbraw/zinc/94/51/88/533945188.db2.gz	UEUUHKUCIUCIMW-OVCLIPMQSA-N	-1	0	391.210	3.668	40	10		GHCBRM
COc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(Cl)c2Cl)C1=O	ZINC000409070856	533951784	/nfs/dbraw/zinc/95/17/84/533951784.db2.gz	PDGSHUYGBCTGDM-PKNBQFBNSA-N	-1	0	391.210	3.668	40	10		GHCBRM
CCOC(=O)c1ccc(N=C(C)c2c(C)[n-]n(-c3ccc(OC)cc3)c2=O)cc1	ZINC000112123343	528225228	/nfs/dbraw/zinc/22/52/28/528225228.db2.gz	GIRWSXZMAIOBPI-ZHZULCJRSA-N	-1	0	393.443	3.981	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccccc2F)C(=O)/C1=C/c1cccc(C(F)(F)F)c1	ZINC000005717345	570734372	/nfs/dbraw/zinc/73/43/72/570734372.db2.gz	GKJSHZMWJBHXSC-FMIVXFBMSA-N	-1	0	394.349	3.676	40	10		GHCBRM
CCN1C(=O)[N-]C(=O)C(=Cc2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)C1=O	ZINC000005947718	570736635	/nfs/dbraw/zinc/73/66/35/570736635.db2.gz	RFZVVMIAKYQPFW-MHWRWJLKSA-N	-1	0	396.403	3.633	40	10		GHCBRM
Cc1cccc(C(=O)Oc2ccccc2/C=C2\C(=O)[N-]N(c3ccccc3)C2=O)c1	ZINC000006450613	856543157	/nfs/dbraw/zinc/54/31/57/856543157.db2.gz	TUNNEASSWDYTHL-HMMYKYKNSA-N	-1	0	398.418	3.676	40	10		GHCBRM
CCOc1ccccc1N=C(C)c1c(CC(=O)OC)[n-]n(-c2ccccc2)c1=O	ZINC000112123331	231022101	/nfs/dbraw/zinc/02/21/01/231022101.db2.gz	PQICHWCUKMIYDY-QNGOZBTKSA-N	-1	0	393.443	3.737	40	10		GHCBRM
Cc1ccc(C(=O)[O-])cc1N1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S	ZINC000005372310	204129184	/nfs/dbraw/zinc/12/91/84/204129184.db2.gz	WKZYLLKMSVHMOK-APSNUPSMSA-N	-1	0	399.449	3.828	40	10		GHCBRM
CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C/c1c[n-]n2c1nc1ccccc1c2=O	ZINC000016312072	204594111	/nfs/dbraw/zinc/59/41/11/204594111.db2.gz	URJWUMMGCDBOKQ-YBFXNURJSA-N	-1	0	397.438	3.599	40	10		GHCBRM
O=C(c1ccccc1)c1ccccc1[N-]S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000223650783	206004202	/nfs/dbraw/zinc/00/42/02/206004202.db2.gz	OPPOCHOHOHWJFJ-UHFFFAOYSA-N	-1	0	382.397	3.627	40	10		GHCBRM
COc1cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)cc(Cl)c1OC(C)C	ZINC000409408525	533470366	/nfs/dbraw/zinc/47/03/66/533470366.db2.gz	QZVQOTNASAWCNC-DHDCSXOGSA-N	-1	0	386.835	3.597	40	10		GHCBRM
Cc1ccccc1-n1cccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(F)cc2)C1=O	ZINC000408967577	534793542	/nfs/dbraw/zinc/79/35/42/534793542.db2.gz	VWLLUVCXQVFEMK-QGOAFFKASA-N	-1	0	389.386	3.591	40	10		GHCBRM
CCOc1cccc(/C=C2\SC(=S)N([N-]C(=O)c3cccs3)C2=O)c1	ZINC000409347780	528627498	/nfs/dbraw/zinc/62/74/98/528627498.db2.gz	RGXMXQWEZDUDSX-UVTDQMKNSA-N	-1	0	390.511	3.693	40	10		GHCBRM
O=C1OC2(CCCC2)OC(=O)C1=Cc1cc(Br)cc(Cl)c1[O-]	ZINC000058865910	570648726	/nfs/dbraw/zinc/64/87/26/570648726.db2.gz	IEHYVFAMAAQOOV-UHFFFAOYSA-N	-1	0	387.613	3.562	40	10		GHCBRM
CCOc1cccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCC4)o3)C2=O)c1	ZINC000059138519	570650567	/nfs/dbraw/zinc/65/05/67/570650567.db2.gz	PBQHOAIVVHOPGB-GHRIWEEISA-N	-1	0	395.415	3.785	40	10		GHCBRM
CCOc1cc(/C=C2/SC(=S)N(CC(C)C)C2=O)cc([N+](=O)[O-])c1[O-]	ZINC000036617132	570892940	/nfs/dbraw/zinc/89/29/40/570892940.db2.gz	GHSWPHKVIRLWLU-NTUHNPAUSA-N	-1	0	382.463	3.556	40	10		GHCBRM
CC[C@@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)cc1	ZINC000408903048	529382794	/nfs/dbraw/zinc/38/27/94/529382794.db2.gz	OJZATTZFXAGKTI-RNEAKCBISA-N	-1	0	382.391	3.669	40	10		GHCBRM
Cc1cc(/C=C2/SC(=O)N(CC(=O)[O-])C2=O)c(C)n1-c1c(C)cccc1C	ZINC000409129708	231168354	/nfs/dbraw/zinc/16/83/54/231168354.db2.gz	SCYVVGPSPBABNA-CXUHLZMHSA-N	-1	0	384.457	3.832	40	10		GHCBRM
CCOC(=O)c1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])sc2c1CC[C@@H](C)C2	ZINC000005717930	204149182	/nfs/dbraw/zinc/14/91/82/204149182.db2.gz	KNTLMNCJNFJXAY-FRRDWIJNSA-N	-1	0	393.505	3.879	40	10		GHCBRM
CC(=O)N(c1cccc(C)c1)c1c([O-])cc(O)c2c1C(=O)c1ccccc1C2=O	ZINC000015085923	205357739	/nfs/dbraw/zinc/35/77/39/205357739.db2.gz	XJTZSYKWZHMIJO-UHFFFAOYSA-N	-1	0	387.391	3.866	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC)c(OC)c3)C2=O)cc1	ZINC000041108864	206195126	/nfs/dbraw/zinc/19/51/26/206195126.db2.gz	JKRRMZUHYKSPTO-WJDWOHSUSA-N	-1	0	380.400	3.773	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccccc1O	ZINC000059198139	570651626	/nfs/dbraw/zinc/65/16/26/570651626.db2.gz	VDNSEFMTZSVLPO-UKTHLTGXSA-N	-1	0	387.189	3.661	40	10		GHCBRM
O=C1[N-]N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(N2CCCCC2)cc1	ZINC000059475178	570657890	/nfs/dbraw/zinc/65/78/90/570657890.db2.gz	SHSUEGBYZSGXMW-CPNJWEJPSA-N	-1	0	381.863	3.792	40	10		GHCBRM
CC[C@H](C)Oc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3cccnc3)C2=O)cc1Cl	ZINC000015013734	570871750	/nfs/dbraw/zinc/87/17/50/570871750.db2.gz	ATNCNVASFPJZIE-ZENNRRHLSA-N	-1	0	399.834	3.579	40	10		GHCBRM
Cc1c(Cl)cccc1N1C(=O)[N-]C(=O)C(=Cc2ccc(N3CCCC3)o2)C1=O	ZINC000409235094	231185288	/nfs/dbraw/zinc/18/52/88/231185288.db2.gz	NUMGGCHNAPRXAL-SDNWHVSQSA-N	-1	0	399.834	3.508	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=O)N(c3ccncc3)C2=O)c(C)n1C1CCCCC1	ZINC000409390588	231199098	/nfs/dbraw/zinc/19/90/98/231199098.db2.gz	FZSTVBDZMKZZOB-CPNJWEJPSA-N	-1	0	392.459	3.672	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2cccn2-c2ccccc2)C1=O	ZINC000408847894	529586499	/nfs/dbraw/zinc/58/64/99/529586499.db2.gz	WOZHMPYQZLGSQB-XDJHFCHBSA-N	-1	0	385.423	3.706	40	10		GHCBRM
O=C([O-])CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1F)N2	ZINC000217686140	203789910	/nfs/dbraw/zinc/78/99/10/203789910.db2.gz	RLKOYHOLVHMMLV-PZPWOCDFSA-N	-1	0	398.409	3.996	40	10		GHCBRM
CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)C(=O)[N-]C2=S)cc1	ZINC000005907125	204156720	/nfs/dbraw/zinc/15/67/20/204156720.db2.gz	RNAGMMKYUYYYFQ-WJDWOHSUSA-N	-1	0	386.860	3.570	40	10		GHCBRM
COc1ccc(N=C(C)c2c(C)[n-]n(-c3ccc([N+](=O)[O-])cc3)c2=O)c(OC)c1	ZINC000112124247	533987468	/nfs/dbraw/zinc/98/74/68/533987468.db2.gz	VZKVGWILDBNGTL-UNOMPAQXSA-N	-1	0	396.403	3.721	40	10		GHCBRM
Cc1ccccc1N1C(=O)/C(=C/c2ccc(OC(C)C)cc2)C(=O)[N-]C1=S	ZINC000409244975	534821572	/nfs/dbraw/zinc/82/15/72/534821572.db2.gz	LNVAIOVPDLWJQU-SFQUDFHCSA-N	-1	0	380.469	3.614	40	10		GHCBRM
CC(C)Oc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000408801664	528244679	/nfs/dbraw/zinc/24/46/79/528244679.db2.gz	VDTHCOWOVRYQTA-LFIBNONCSA-N	-1	0	384.819	3.794	40	10		GHCBRM
O=C([O-])CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1F)N2	ZINC000004623745	209121252	/nfs/dbraw/zinc/12/12/52/209121252.db2.gz	RLKOYHOLVHMMLV-VTJXTGGHSA-N	-1	0	398.409	3.996	40	10		GHCBRM
CC1=NN(c2cccc(Cl)c2)C(=O)C1=CNc1ccc2c(c1)oc(=O)n2C	ZINC000016160813	207073417	/nfs/dbraw/zinc/07/34/17/207073417.db2.gz	ARQGHSURVBWXAD-GDNBJRDFSA-N	-1	0	382.807	3.503	40	10		GHCBRM
COc1cc(Cl)cc(C=C2C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)c1O	ZINC000034138242	208996944	/nfs/dbraw/zinc/99/69/44/208996944.db2.gz	NGHWYJPHWGOZDV-RIYZIHGNSA-N	-1	0	386.791	3.869	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)[N-]C2=S)c1	ZINC000409250297	533672104	/nfs/dbraw/zinc/67/21/04/533672104.db2.gz	QKSWNAYYNQGXIG-XYOKQWHBSA-N	-1	0	376.890	3.850	40	10		GHCBRM
CCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC(C)C)cc3)C2=O)cc1	ZINC000408801076	528482346	/nfs/dbraw/zinc/48/23/46/528482346.db2.gz	SLSRDDJYUGGFGO-CPNJWEJPSA-N	-1	0	394.427	3.539	40	10		GHCBRM
CCCOc1ccccc1/C=C1/C(=O)[N-]C(=O)N(c2ccccc2CC)C1=O	ZINC000408877209	528768026	/nfs/dbraw/zinc/76/80/26/528768026.db2.gz	UHNXJEHZGXGRHA-VKAVYKQESA-N	-1	0	378.428	3.704	40	10		GHCBRM
CC[C@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cccc(F)c3)C2=O)cc1	ZINC000409022287	529191782	/nfs/dbraw/zinc/19/17/82/529191782.db2.gz	MBDACTLCMVNFDC-FHXOWUIVSA-N	-1	0	398.459	3.834	40	10		GHCBRM
CC[C@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(F)cc2)C1=O	ZINC000408903654	529197481	/nfs/dbraw/zinc/19/74/81/529197481.db2.gz	VKWHDNCWBDJNAF-VLURKWGBSA-N	-1	0	382.391	3.669	40	10		GHCBRM
COc1ccc(S(=O)(=O)Nc2cc(Cl)c([O-])c(Br)c2)cc1	ZINC000226863259	570462017	/nfs/dbraw/zinc/46/20/17/570462017.db2.gz	GAFVYGQQPHYGAX-UHFFFAOYSA-N	-1	0	392.658	3.618	40	10		GHCBRM
COc1cccc(/C=C2\C(=O)[N-]C(=S)N(c3cccc4ccccc43)C2=O)c1	ZINC000008210242	570524588	/nfs/dbraw/zinc/52/45/88/570524588.db2.gz	BWOBAWCMEQGQIA-QGOAFFKASA-N	-1	0	388.448	3.680	40	10		GHCBRM
CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(CC(=O)[O-])C2=O)cc1Cl	ZINC000409011731	570693524	/nfs/dbraw/zinc/69/35/24/570693524.db2.gz	IFKRWGYULXMEGE-PBJWJZLWSA-N	-1	0	385.894	3.803	40	10		GHCBRM
O=C([O-])COc1ccccc1/C=C1\SC(=S)N(c2cccc(F)c2)C1=O	ZINC000210432294	856566257	/nfs/dbraw/zinc/56/62/57/856566257.db2.gz	COSLWEWTJGNJDC-NVNXTCNLSA-N	-1	0	389.429	3.695	40	10		GHCBRM
Cc1cc(C=C2C(=O)[N-]C(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1C(C)C	ZINC000408966741	231137627	/nfs/dbraw/zinc/13/76/27/231137627.db2.gz	QFSRQHNUOPBNGI-YBFXNURJSA-N	-1	0	379.460	3.969	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccccc2)C(=O)/C1=C/c1cccc(Cl)c1Cl	ZINC000408994334	231143503	/nfs/dbraw/zinc/14/35/03/231143503.db2.gz	YNNUBSPJCLJEMM-FMIVXFBMSA-N	-1	0	377.252	3.825	40	10		GHCBRM
O=C([O-])CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1F)N2	ZINC000004623740	209119793	/nfs/dbraw/zinc/11/97/93/209119793.db2.gz	RLKOYHOLVHMMLV-LRAJWGHMSA-N	-1	0	398.409	3.996	40	10		GHCBRM
O=C1[N-]C(=O)N(Cc2ccccc2)C(=O)/C1=C\c1c(Cl)cccc1Cl	ZINC000005900236	206632968	/nfs/dbraw/zinc/63/29/68/206632968.db2.gz	FXXKXSRCRFXSDN-LCYFTJDESA-N	-1	0	375.211	3.655	40	10		GHCBRM
Cc1ccc(N2C(=O)C(=CNc3ccccc3C(C)C)C(=O)[N-]C2=S)cc1	ZINC000100992481	136189247	/nfs/dbraw/zinc/18/92/47/136189247.db2.gz	QVAYALCRLBPTDF-SFQUDFHCSA-N	-1	0	379.485	3.862	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)C1=CNc1cccc2ccccc21	ZINC000100986887	136189360	/nfs/dbraw/zinc/18/93/60/136189360.db2.gz	DCVQUJDEAZFDOG-ATVHPVEESA-N	-1	0	375.359	3.558	40	10		GHCBRM
COc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000408808946	533952935	/nfs/dbraw/zinc/95/29/35/533952935.db2.gz	GNSDJXGRCDCUNW-XYOKQWHBSA-N	-1	0	391.210	3.668	40	10		GHCBRM
Cc1cccc(-n2cccc2/C=C2\C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)c1	ZINC000408966246	534568882	/nfs/dbraw/zinc/56/88/82/534568882.db2.gz	ODPIOHRXEIKAIM-CPNJWEJPSA-N	-1	0	389.386	3.591	40	10		GHCBRM
O=C([O-])[C@@H](Cc1ccccc1)N1C(=O)/C(=C/c2ccccc2F)SC1=S	ZINC000005374132	570436010	/nfs/dbraw/zinc/43/60/10/570436010.db2.gz	SYUMGYJBXUIHIZ-DFSFMLJYSA-N	-1	0	387.457	3.723	40	10		GHCBRM
O=C([O-])c1cc(NC2=NC(=O)C(=Cc3c[nH]c4ccccc34)S2)ccc1O	ZINC000005374510	570436031	/nfs/dbraw/zinc/43/60/31/570436031.db2.gz	ZSIQTUBVHZSGJV-APSNUPSMSA-N	-1	0	379.397	3.654	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2c(C)n(C)c3ccccc23)C1=O	ZINC000059679079	570660907	/nfs/dbraw/zinc/66/09/07/570660907.db2.gz	DXZPGNIVALOPSG-AQTBWJFISA-N	-1	0	387.439	3.716	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(-c2cccc(F)c2)o1	ZINC000409010949	570693583	/nfs/dbraw/zinc/69/35/83/570693583.db2.gz	DXYFCIBFMSDTEY-SFQUDFHCSA-N	-1	0	376.343	3.752	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccc(Br)c3)C2=O)cc1C	ZINC000408851002	231121529	/nfs/dbraw/zinc/12/15/29/231121529.db2.gz	UEJUGTNBLKVTJB-MHWRWJLKSA-N	-1	0	399.244	3.732	40	10		GHCBRM
Cc1cccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)[N-]C2=S)c1C	ZINC000409135257	231170201	/nfs/dbraw/zinc/17/02/01/231170201.db2.gz	UBFSDNGVOCAWGM-SFQUDFHCSA-N	-1	0	394.496	3.922	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3C)C2=O)c1C	ZINC000409234035	231184712	/nfs/dbraw/zinc/18/47/12/231184712.db2.gz	XZASXKGUSFRUGQ-XNTDXEJSSA-N	-1	0	385.851	3.753	40	10		GHCBRM
C[C@H](C(=O)[O-])N1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S	ZINC000001281937	206371728	/nfs/dbraw/zinc/37/17/28/206371728.db2.gz	IGVIBAJPLLIKGO-GPLLRDDGSA-N	-1	0	399.493	3.940	40	10		GHCBRM
O=C([O-])c1cccc(-c2ccc(/C=C3/NC(=O)N(Cc4ccccc4)C3=O)o2)c1	ZINC000015008983	207039979	/nfs/dbraw/zinc/03/99/79/207039979.db2.gz	TWALHXHOOIFRGH-LDADJPATSA-N	-1	0	388.379	3.738	40	10		GHCBRM
CCOc1cc(Cl)cc(/C=C2/C(=O)[N-]C(=S)N(c3ccccc3)C2=O)c1	ZINC000408864910	528288407	/nfs/dbraw/zinc/28/84/07/528288407.db2.gz	AZGFLRNOPONUJI-YBEGLDIGSA-N	-1	0	386.860	3.570	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3ccccc3Cl)C2=O)c1	ZINC000408942646	528731022	/nfs/dbraw/zinc/73/10/22/528731022.db2.gz	ZVJDQPVDRORMAY-QINSGFPZSA-N	-1	0	384.819	3.795	40	10		GHCBRM
COc1ccc(/C=C2\SC(=O)N([C@H](C(=O)[O-])C(C)C)C2=S)cc1OC	ZINC000005171676	570430611	/nfs/dbraw/zinc/43/06/11/570430611.db2.gz	IETKGPSICQYDQT-MQJVFOOVSA-N	-1	0	381.475	3.650	40	10		GHCBRM
O=C([O-])Cc1ccc(N2C(=O)/C(=C/c3nc4ccccc4[nH]3)SC2=S)cc1	ZINC000005235965	570432148	/nfs/dbraw/zinc/43/21/48/570432148.db2.gz	NJYNJBIGQGJMLJ-GDNBJRDFSA-N	-1	0	395.465	3.596	40	10		GHCBRM
COc1cccc(/C=C2\SC(=S)N(c3ccc(O)c(C(=O)[O-])c3)C2=O)c1	ZINC000005373624	570435971	/nfs/dbraw/zinc/43/59/71/570435971.db2.gz	QQGAEKSROSAUHO-NVNXTCNLSA-N	-1	0	387.438	3.505	40	10		GHCBRM
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2nc(-c3ccccc3)cs2)cc1	ZINC000223273802	570455219	/nfs/dbraw/zinc/45/52/19/570455219.db2.gz	MWQJVWPRTTZZMW-UHFFFAOYSA-N	-1	0	387.486	3.594	40	10		GHCBRM
CC1=NN(c2ccc(S(=O)(=O)[O-])cc2)C(=O)/C1=C/c1ccc(C(C)C)cc1	ZINC000005876767	570459688	/nfs/dbraw/zinc/45/96/88/570459688.db2.gz	IDCDZBGWXYTZGF-XDHOZWIPSA-N	-1	0	384.457	3.863	40	10		GHCBRM
Cc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2cccn2-c2ccccc2F)C1=O	ZINC000009265422	570554231	/nfs/dbraw/zinc/55/42/31/570554231.db2.gz	PMUWPISDPFNBDI-SSZFMOIBSA-N	-1	0	389.386	3.591	40	10		GHCBRM
O=C1c2ccccc2C2=CS(=O)(=O)[N-]c3c(Oc4ccccc4)cc(O)c1c32	ZINC000012376801	835694463	/nfs/dbraw/zinc/69/44/63/835694463.db2.gz	FYIIBTRVVKQPPT-UHFFFAOYSA-N	-1	0	391.404	3.873	40	10		GHCBRM
O=C([O-])COc1ccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1	ZINC000015227557	856545728	/nfs/dbraw/zinc/54/57/28/856545728.db2.gz	RNNDUEBAAWPXSW-DHDCSXOGSA-N	-1	0	388.832	3.886	40	10		GHCBRM
COc1ccc(/C=C/C=C2\C(=O)[N-]C(=O)N(c3cc(C)cc(C)c3)C2=O)cc1	ZINC000408967149	231138078	/nfs/dbraw/zinc/13/80/78/231138078.db2.gz	SPIVPEQXUDIXRB-QZRSKMOPSA-N	-1	0	376.412	3.535	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)[N-]C2=S)cc1C	ZINC000408967434	231138539	/nfs/dbraw/zinc/13/85/39/231138539.db2.gz	RIRHUFXSANZEFA-MDWZMJQESA-N	-1	0	376.890	3.850	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(-c2ccc(F)cc2)o1	ZINC000002262809	136196430	/nfs/dbraw/zinc/19/64/30/136196430.db2.gz	REUFEZWBAIAODS-GZTJUZNOSA-N	-1	0	394.333	3.891	40	10		GHCBRM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C\c1cccc(OCc2cccc(F)c2)c1	ZINC000034890420	570222313	/nfs/dbraw/zinc/22/23/13/570222313.db2.gz	FRUIQFAODWYXKN-STZFKDTASA-N	-1	0	388.398	3.866	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2)C(=O)C1=Cc1cc(Br)ccc1O	ZINC000083327281	570629033	/nfs/dbraw/zinc/62/90/33/570629033.db2.gz	GBKQFELQILHTFL-UKTHLTGXSA-N	-1	0	387.189	3.661	40	10		GHCBRM
COc1cc([N+](=O)[O-])ccc1N=Cc1c(C)[n-]n(-c2cccc(Cl)c2)c1=O	ZINC000013575915	570759665	/nfs/dbraw/zinc/75/96/65/570759665.db2.gz	YIOJYQDWEVBMMC-GDNBJRDFSA-N	-1	0	386.795	3.975	40	10		GHCBRM
Cc1[nH]c2ccccc2c1/C=C1/C(=O)[N-]N(c2ccc(Br)cc2)C1=O	ZINC000006184411	571073564	/nfs/dbraw/zinc/07/35/64/571073564.db2.gz	KJDNEPQOBAMCFT-YBEGLDIGSA-N	-1	0	396.244	3.700	40	10		GHCBRM
Cc1c(Cl)cccc1N1C(=O)[N-]C(=O)C(=Cc2cc(Cl)ccc2O)C1=O	ZINC000408885755	231124935	/nfs/dbraw/zinc/12/49/35/231124935.db2.gz	AFOOBBHOAACCNB-XYOKQWHBSA-N	-1	0	391.210	3.674	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(C(F)(F)F)cc1	ZINC000408902047	231126988	/nfs/dbraw/zinc/12/69/88/231126988.db2.gz	DXHWWRDDKFYTFU-NTEUORMPSA-N	-1	0	378.281	3.511	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(-c2cccc(Cl)c2)o1	ZINC000409393652	231200756	/nfs/dbraw/zinc/20/07/56/231200756.db2.gz	RWBVAERJKAKZRT-LFIBNONCSA-N	-1	0	393.786	3.661	40	10		GHCBRM
Cc1ccc(-n2cccc2/C=C2/C(=O)[N-]C(=O)N(C3CCCCC3)C2=O)cc1	ZINC000015013876	207040299	/nfs/dbraw/zinc/04/02/99/207040299.db2.gz	SXXIWUAIRYIFME-RGEXLXHISA-N	-1	0	377.444	3.580	40	10		GHCBRM
Cc1ccc(-n2cccc2/C=C2\C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)cc1	ZINC000408964871	534239756	/nfs/dbraw/zinc/23/97/56/534239756.db2.gz	SXMUKJFCCYBJNK-CPNJWEJPSA-N	-1	0	389.386	3.591	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(C)c3)C2=O)cc1Cl	ZINC000408786243	528369871	/nfs/dbraw/zinc/36/98/71/528369871.db2.gz	MXDQJDKNHCKFRN-XNTDXEJSSA-N	-1	0	384.819	3.714	40	10		GHCBRM
Cc1ccc2c(c1[N-]S(=O)(=O)c1ccccc1)C(=O)c1ccccc1C2=O	ZINC000003847599	570352012	/nfs/dbraw/zinc/35/20/12/570352012.db2.gz	GQTDYNWMKUROOG-UHFFFAOYSA-N	-1	0	377.421	3.571	40	10		GHCBRM
O=C([O-])c1cccc(-c2ccc(C=C3C(=O)OC4(CCCCC4)OC3=O)o2)c1	ZINC000000857519	570496920	/nfs/dbraw/zinc/49/69/20/570496920.db2.gz	LAUCFHPLHGZNHA-UHFFFAOYSA-N	-1	0	382.368	3.789	40	10		GHCBRM
O=C([O-])CCN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S	ZINC000006210086	570738985	/nfs/dbraw/zinc/73/89/85/570738985.db2.gz	XIWBZYQQPVIQNF-SFQUDFHCSA-N	-1	0	399.493	3.942	40	10		GHCBRM
COC(=O)c1ccc(F)c(S(=O)(=O)[N-]c2nc(-c3ccccc3)cs2)c1	ZINC000063182950	570749934	/nfs/dbraw/zinc/74/99/34/570749934.db2.gz	BKQAQDBJLPNCDR-UHFFFAOYSA-N	-1	0	392.433	3.537	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]N(c3ccccc3)C2=O)c1OC(C)C	ZINC000033696057	856546729	/nfs/dbraw/zinc/54/67/29/856546729.db2.gz	DZKOYKTUOQIMRP-MHWRWJLKSA-N	-1	0	386.835	3.597	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)c(C)n1C(C)(C)C	ZINC000408960529	231136551	/nfs/dbraw/zinc/13/65/51/231136551.db2.gz	GNOJQVKKIWGJEN-GZTJUZNOSA-N	-1	0	383.423	3.665	40	10		GHCBRM
Cc1cc(/C=C2/SC(=O)N(CC(=O)[O-])C2=O)c(C)n1-c1ccc(C)c(C)c1	ZINC000409137651	231170014	/nfs/dbraw/zinc/17/00/14/231170014.db2.gz	XQDWPQNHKGMZIX-RQZCQDPDSA-N	-1	0	384.457	3.832	40	10		GHCBRM
COc1ccc(/C=C/C=C2\C(=O)[N-]C(=S)N(c3ccccc3Cl)C2=O)cc1	ZINC000409244532	231186413	/nfs/dbraw/zinc/18/64/13/231186413.db2.gz	FBWQGFZGDKFSAO-VCXFDYNHSA-N	-1	0	398.871	3.736	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3C)C2=O)cc1C	ZINC000409247358	231187836	/nfs/dbraw/zinc/18/78/36/231187836.db2.gz	NFLYXGXBKSMKOB-GXDHUFHOSA-N	-1	0	384.819	3.632	40	10		GHCBRM
O=C1[N-]C(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(-c2ccccc2Cl)o1	ZINC000002215319	209115146	/nfs/dbraw/zinc/11/51/46/209115146.db2.gz	ZOSROTOQIPMLSC-XNTDXEJSSA-N	-1	0	396.786	3.855	40	10		GHCBRM
Cc1[n-]n(-c2ccc(C)cc2)c(=O)c1C=Nc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1	ZINC000100929745	208383219	/nfs/dbraw/zinc/38/32/19/208383219.db2.gz	VAKGBAJIHLXWCS-GDNBJRDFSA-N	-1	0	381.348	3.530	40	10		GHCBRM
C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3/SC(=S)N(CC(=O)[O-])C3=O)cc21	ZINC000208222165	136202808	/nfs/dbraw/zinc/20/28/08/136202808.db2.gz	RKIQXARDWMMXQH-UXYFDLPDSA-N	-1	0	390.530	3.694	40	10		GHCBRM
COc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(C)cc2C)C1=O	ZINC000408815189	533832608	/nfs/dbraw/zinc/83/26/08/533832608.db2.gz	PQRWAMOOKZMIQA-XNTDXEJSSA-N	-1	0	384.819	3.632	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)c(C)c3)C2=O)c1	ZINC000408873648	533944150	/nfs/dbraw/zinc/94/41/50/533944150.db2.gz	ULCPCFGXOVSOCK-RQZCQDPDSA-N	-1	0	384.819	3.632	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(CC)cc3)C2=O)cc1Cl	ZINC000408787040	528369077	/nfs/dbraw/zinc/36/90/77/528369077.db2.gz	ZZOHDWXJMFXKGP-LFIBNONCSA-N	-1	0	398.846	3.968	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C)cc3C)C2=O)cc1	ZINC000409142004	528369761	/nfs/dbraw/zinc/36/97/61/528369761.db2.gz	KSLIQCYRCUILEK-SFQUDFHCSA-N	-1	0	380.469	3.533	40	10		GHCBRM
CCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(CC)cc2)C1=O	ZINC000408807001	528767945	/nfs/dbraw/zinc/76/79/45/528767945.db2.gz	CLKOPNZLFNOYRC-NBVRZTHBSA-N	-1	0	378.428	3.704	40	10		GHCBRM
CC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2cccc(Br)c2)SC1=S	ZINC000005374211	570435979	/nfs/dbraw/zinc/43/59/79/570435979.db2.gz	KRLJBJDTZMANLB-PAKSIRSJSA-N	-1	0	386.292	3.514	40	10		GHCBRM
CCCCOc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccccc3)C2=O)cc1OC	ZINC000108047825	843351147	/nfs/dbraw/zinc/35/11/47/843351147.db2.gz	TYXGBDPOCBZSQP-LGMDPLHJSA-N	-1	0	394.427	3.541	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1ccccc1	ZINC000408723082	231105363	/nfs/dbraw/zinc/10/53/63/231105363.db2.gz	QFXVKWRPPODTJB-XYOKQWHBSA-N	-1	0	377.252	3.825	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3c(O)ccc4ccccc34)C2=O)cc1C	ZINC000408782393	231114554	/nfs/dbraw/zinc/11/45/54/231114554.db2.gz	HSTSZAXAHVIUSW-XDHOZWIPSA-N	-1	0	386.407	3.829	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(F)c3)C2=O)c2ccccc12	ZINC000408914164	231130042	/nfs/dbraw/zinc/13/00/42/231130042.db2.gz	ODLHFHKFDRUUCZ-WOJGMQOQSA-N	-1	0	390.370	3.654	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=S)N(c3cc(C)ccc3C)C2=O)c1C	ZINC000409242253	231186155	/nfs/dbraw/zinc/18/61/55/231186155.db2.gz	WJDPASIBVYAYHM-GZTJUZNOSA-N	-1	0	381.501	3.573	40	10		GHCBRM
CC[C@@H](C)Oc1ccccc1/C=C1/C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000032193767	207394411	/nfs/dbraw/zinc/39/44/11/207394411.db2.gz	XECZFUXVSQMNCW-QLENYVDCSA-N	-1	0	378.428	3.839	40	10		GHCBRM
C[C@H](N1C(=O)[N-]C(=O)/C(=C\c2cccs2)C1=O)C12CC3CC(CC(C3)C1)C2	ZINC000016576086	221364395	/nfs/dbraw/zinc/36/43/95/221364395.db2.gz	KFXYLMXZWGPGMO-AKNKYRMWSA-N	-1	0	384.501	3.815	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)[N-]C2=S)c1	ZINC000409225809	533670989	/nfs/dbraw/zinc/67/09/89/533670989.db2.gz	LKXVYIWDISENNB-MHWRWJLKSA-N	-1	0	375.453	3.616	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3cccc(C)c3C)C2=O)c1	ZINC000408940241	528730846	/nfs/dbraw/zinc/73/08/46/528730846.db2.gz	UQKCDMKDSRWRHZ-AQTBWJFISA-N	-1	0	378.428	3.759	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3cc(C)ccc3C)C2=O)c1	ZINC000408938657	528731008	/nfs/dbraw/zinc/73/10/08/528731008.db2.gz	QUXNNZXDMKKXTA-AQTBWJFISA-N	-1	0	378.428	3.759	40	10		GHCBRM
O=C([O-])CCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1F)N2	ZINC000217686058	570371482	/nfs/dbraw/zinc/37/14/82/570371482.db2.gz	RLKOYHOLVHMMLV-WIEQDCTASA-N	-1	0	398.409	3.996	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(OCC)cc3)C2=O)c1	ZINC000408933811	570686861	/nfs/dbraw/zinc/68/68/61/570686861.db2.gz	BMERRKNZMIJMMN-RGEXLXHISA-N	-1	0	394.427	3.541	40	10		GHCBRM
COc1ccc(-c2ccc(CCC(=O)[O-])n2CC(=O)Nc2ccccc2)cc1	ZINC000014153053	570877733	/nfs/dbraw/zinc/87/77/33/570877733.db2.gz	LUUQIMJARHCRLQ-UHFFFAOYSA-N	-1	0	378.428	3.820	40	10		GHCBRM
COc1cc(C=C2SC(Nc3ccc(C)cc3)=NC2=O)ccc1OCC(=O)[O-]	ZINC000016915422	570915180	/nfs/dbraw/zinc/91/51/80/570915180.db2.gz	LBQYEJWIMQOGFX-LICLKQGHSA-N	-1	0	398.440	3.549	40	10		GHCBRM
CCOc1cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)ccc1OC(C)(C)C	ZINC000108986057	856556519	/nfs/dbraw/zinc/55/65/19/856556519.db2.gz	IIYYAQXPHIFPJV-LGMDPLHJSA-N	-1	0	380.444	3.724	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2)C(=O)/C1=C\c1cccc(OCc2ccccc2)c1	ZINC000408939354	231134401	/nfs/dbraw/zinc/13/44/01/231134401.db2.gz	RVDDHGJPBXJIEI-QNGOZBTKSA-N	-1	0	398.418	3.932	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccc(Br)c3)C2=O)cc1	ZINC000408983181	529662666	/nfs/dbraw/zinc/66/26/66/529662666.db2.gz	FWZOVLFXYVQKEV-WJDWOHSUSA-N	-1	0	399.244	3.678	40	10		GHCBRM
Cc1cccc(/C=C2\SC(=S)N([C@@H](Cc3ccccc3)C(=O)[O-])C2=O)c1	ZINC000005373477	206608779	/nfs/dbraw/zinc/60/87/79/206608779.db2.gz	HTWWZDSNWWCQHG-BQGMYUGNSA-N	-1	0	383.494	3.892	40	10		GHCBRM
COc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCCC4)o3)C2=O)cc1	ZINC000002237349	136196302	/nfs/dbraw/zinc/19/63/02/136196302.db2.gz	ZMFKZWBIEWWXEB-GHRIWEEISA-N	-1	0	395.415	3.785	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3CC)C2=O)cc1Cl	ZINC000408781153	528369138	/nfs/dbraw/zinc/36/91/38/528369138.db2.gz	AKPUQPUIDKCVBX-RVDMUPIBSA-N	-1	0	398.846	3.968	40	10		GHCBRM
CCOc1ccc(Cl)cc1/C=C1/C(=O)[N-]C(=O)N(c2ccccc2CC)C1=O	ZINC000408874060	528470103	/nfs/dbraw/zinc/47/01/03/528470103.db2.gz	ZAMSDKUICHTRFN-VBKFSLOCSA-N	-1	0	398.846	3.968	40	10		GHCBRM
CC[C@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)cc1	ZINC000408903047	529191712	/nfs/dbraw/zinc/19/17/12/529191712.db2.gz	OJZATTZFXAGKTI-HTMJNSLASA-N	-1	0	382.391	3.669	40	10		GHCBRM
Cc1ccc(C=C2C(=O)[N-]C(=S)N(c3ccccc3F)C2=O)cc1[N+](=O)[O-]	ZINC000059135959	570650753	/nfs/dbraw/zinc/65/07/53/570650753.db2.gz	YBPBWZJICMIBDI-XYOKQWHBSA-N	-1	0	385.376	3.714	40	10		GHCBRM
COc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3cccc(Cl)c3)C2=O)cc1Cl	ZINC000408776074	570682268	/nfs/dbraw/zinc/68/22/68/570682268.db2.gz	TXWJCSPFTRVSKP-QPEQYQDCSA-N	-1	0	391.210	3.668	40	10		GHCBRM
CCc1nnc(S/C(=C\c2ccc(N(CC)CC)cc2OC)C(=O)[O-])o1	ZINC000007342692	856546208	/nfs/dbraw/zinc/54/62/08/856546208.db2.gz	LSIQSVSTUKYPET-GDNBJRDFSA-N	-1	0	377.466	3.705	40	10		GHCBRM
CCc1ccc(NC2=NC(=O)C(=Cc3cc([N+](=O)[O-])cc(OC)c3[O-])S2)cc1	ZINC000208526681	856565252	/nfs/dbraw/zinc/56/52/52/856565252.db2.gz	PKYVKLCGDTUYNR-SXGWCWSVSA-N	-1	0	399.428	3.954	40	10		GHCBRM
Cc1cccc(NC2=NC(=O)C(=Cc3ccc(OCC(=O)[O-])cc3)S2)c1C	ZINC000210411350	856566223	/nfs/dbraw/zinc/56/62/23/856566223.db2.gz	OAHUVAWWVVADSG-YVLHZVERSA-N	-1	0	382.441	3.849	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC(C)C)cc3)C2=O)c1C	ZINC000408812822	231117704	/nfs/dbraw/zinc/11/77/04/231117704.db2.gz	MKONGGHFJGIKTH-LDADJPATSA-N	-1	0	378.428	3.757	40	10		GHCBRM
Cc1cc(C=C2SC(=O)NC2=O)c(C)n1-c1cc(C(=O)[O-])ccc1Cl	ZINC000408818106	231118706	/nfs/dbraw/zinc/11/87/06/231118706.db2.gz	XWRKWUYONKSRKM-AUWJEWJLSA-N	-1	0	376.821	3.770	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OC(C)C)C2=O)c1	ZINC000408899287	231126187	/nfs/dbraw/zinc/12/61/87/231126187.db2.gz	OAANFFFRMHAYEZ-LDADJPATSA-N	-1	0	378.428	3.757	40	10		GHCBRM
CCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cc(Cl)ccc2C)C1=O	ZINC000408804374	231116739	/nfs/dbraw/zinc/11/67/39/231116739.db2.gz	FBWITYAJNPCVDU-XNTDXEJSSA-N	-1	0	384.819	3.714	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccn3-c3cccc(C)c3)C2=O)cc1	ZINC000408962958	231136346	/nfs/dbraw/zinc/13/63/46/231136346.db2.gz	LKTZKMINHXFTIY-XSFVSMFZSA-N	-1	0	385.423	3.761	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3c(O)ccc4ccccc43)C2=O)cc1	ZINC000408880366	529662260	/nfs/dbraw/zinc/66/22/60/529662260.db2.gz	JNUHYISBWGGLGY-CPNJWEJPSA-N	-1	0	386.407	3.774	40	10		GHCBRM
O=C([O-])c1ccc(N2C(=O)/C(=C/c3ccc4nccnc4c3)SC2=S)cc1	ZINC000054361141	209112682	/nfs/dbraw/zinc/11/26/82/209112682.db2.gz	JRIPEOFONMPLHO-YBEGLDIGSA-N	-1	0	393.449	3.734	40	10		GHCBRM
Cn1cc(C=C2SC(Nc3ccccc3C(=O)[O-])=NC2=O)c2ccccc21	ZINC000020226941	207184624	/nfs/dbraw/zinc/18/46/24/207184624.db2.gz	MZWWMCQXGDZJBU-LICLKQGHSA-N	-1	0	377.425	3.959	40	10		GHCBRM
COc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(C)c2C)C1=O	ZINC000408801880	533832236	/nfs/dbraw/zinc/83/22/36/533832236.db2.gz	WIMXXKGMOAHIQJ-XNTDXEJSSA-N	-1	0	384.819	3.632	40	10		GHCBRM
Cc1ccc(Cl)cc1N1C(=O)[N-]C(=O)C(=Cc2ccc3c(c2)C[C@@H](C)O3)C1=O	ZINC000408710845	534146005	/nfs/dbraw/zinc/14/60/05/534146005.db2.gz	PJNCAQODUHJLQF-GFQQVXNGSA-N	-1	0	396.830	3.638	40	10		GHCBRM
CC(C)Oc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(Cl)c2)C1=O	ZINC000408808769	528245348	/nfs/dbraw/zinc/24/53/48/528245348.db2.gz	FYQYNPMPLPDOFF-MHWRWJLKSA-N	-1	0	384.819	3.794	40	10		GHCBRM
CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccccc1C(=O)[O-]	ZINC000408770410	528616145	/nfs/dbraw/zinc/61/61/45/528616145.db2.gz	XECPBASOGWCARC-UYRXBGFRSA-N	-1	0	391.423	3.961	40	10		GHCBRM
CCN1C(=O)/C(=C/c2cc(Cl)c(OCC(=O)[O-])c(Cl)c2)SC1=S	ZINC000409376418	528943288	/nfs/dbraw/zinc/94/32/88/528943288.db2.gz	XYUZEULYGXWKEY-YHYXMXQVSA-N	-1	0	392.285	3.678	40	10		GHCBRM
CN(C1=NC(=O)/C(=C/c2c[nH]c3ccccc23)S1)c1ccccc1C(=O)[O-]	ZINC000005374513	570435953	/nfs/dbraw/zinc/43/59/53/570435953.db2.gz	CWHXZFUIORQRHT-YVLHZVERSA-N	-1	0	377.425	3.973	40	10		GHCBRM
O=C([O-])C[C@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S	ZINC000012032243	570599980	/nfs/dbraw/zinc/59/99/80/570599980.db2.gz	ZXRRAMSVKQBQDA-VGVSSDJJSA-N	-1	0	385.466	3.809	40	10		GHCBRM
Cc1cc(C=C2SC(=S)NC2=O)c(C)n1-c1ccc(C(=O)[O-])c(Cl)c1	ZINC000059247896	570652532	/nfs/dbraw/zinc/65/25/32/570652532.db2.gz	AVAHERCZOVEUHU-MKMNVTDBSA-N	-1	0	392.889	3.935	40	10		GHCBRM
COC(=O)c1ccc(C=C2SC(Nc3cc(C(=O)[O-])ccc3C)=NC2=O)cc1	ZINC000054164370	570676305	/nfs/dbraw/zinc/67/63/05/570676305.db2.gz	FIRPCKHPKTUGOF-SXGWCWSVSA-N	-1	0	396.424	3.562	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c(C)n1C	ZINC000408776189	570682388	/nfs/dbraw/zinc/68/23/88/570682388.db2.gz	NCUSLHRLQHVZSA-NTUHNPAUSA-N	-1	0	392.242	3.615	40	10		GHCBRM
Cc1ccccc1NC1=NC(=O)C(=Cc2ccc(O[C@H](C)C(=O)[O-])cc2)S1	ZINC000210836544	602095660	/nfs/dbraw/zinc/09/56/60/602095660.db2.gz	ZRPGDHPMTJZZDI-GPLLRDDGSA-N	-1	0	382.441	3.929	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cc(C)cc(C)c3)C2=O)o1	ZINC000204986516	856563154	/nfs/dbraw/zinc/56/31/54/856563154.db2.gz	VDPOIZCZOVYIQF-SFQUDFHCSA-N	-1	0	397.500	3.574	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)[N-]C2=S)c1	ZINC000409014345	231147159	/nfs/dbraw/zinc/14/71/59/231147159.db2.gz	OXWYFQCJOHEGDC-XDHOZWIPSA-N	-1	0	394.496	3.922	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1c(Cl)cccc1Cl	ZINC000409203673	231179520	/nfs/dbraw/zinc/17/95/20/231179520.db2.gz	XBNNVWWEXUOAMY-XYOKQWHBSA-N	-1	0	379.174	3.799	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2ccccc2OC(C)C)C1=O	ZINC000408885355	529586410	/nfs/dbraw/zinc/58/64/10/529586410.db2.gz	ZVINOCNHZKWIIH-LGMDPLHJSA-N	-1	0	378.428	3.703	40	10		GHCBRM
COC(=O)Cc1[n-]n(-c2ccccc2)c(=O)c1C(C)=Nc1ccccc1Cl	ZINC000112121457	533322375	/nfs/dbraw/zinc/32/23/75/533322375.db2.gz	XDXQEEGLIKGPAV-UYRXBGFRSA-N	-1	0	383.835	3.992	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)[N-]C(=O)C(=Cc3c(O)ccc4ccccc34)C2=O)c1	ZINC000408882357	533674696	/nfs/dbraw/zinc/67/46/96/533674696.db2.gz	QWKBKLQLYOQAOC-LDADJPATSA-N	-1	0	386.407	3.829	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3cc(C)ccc3C)C2=O)c1	ZINC000408866819	533944233	/nfs/dbraw/zinc/94/42/33/533944233.db2.gz	JFXINJBPCSEOLF-CXUHLZMHSA-N	-1	0	384.819	3.632	40	10		GHCBRM
CC(C)C[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2cn(C)c3ccccc23)SC1=S	ZINC000005371540	570435425	/nfs/dbraw/zinc/43/54/25/570435425.db2.gz	QSOPYXJVMUYCLE-HVVQPJKBSA-N	-1	0	388.514	3.879	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCC4)o3)C2=O)cc1	ZINC000059138532	570650741	/nfs/dbraw/zinc/65/07/41/570650741.db2.gz	QUFWHEUSCFZFAM-GHRIWEEISA-N	-1	0	379.416	3.949	40	10		GHCBRM
COc1ccc(N2C(=O)C(=Cc3cc(C)c(O)c(C)c3)C(=O)[N-]C2=S)cc1	ZINC000038172123	856551762	/nfs/dbraw/zinc/55/17/62/856551762.db2.gz	RGIUHNSUIBCSRE-MHWRWJLKSA-N	-1	0	382.441	3.689	40	10		GHCBRM
O=C([O-])CCOc1ccc(C=C2SC(Nc3ccccc3F)=NC2=O)cc1	ZINC000210418798	856565982	/nfs/dbraw/zinc/56/59/82/856565982.db2.gz	HVIGBFQRXQLPOM-WJDWOHSUSA-N	-1	0	386.404	3.762	40	10		GHCBRM
CC(=O)c1ccc(N2C(=O)C(=Cc3ccc(C(=O)[O-])cc3)SC2=S)cc1	ZINC000035040242	957195135	/nfs/dbraw/zinc/19/51/35/957195135.db2.gz	CIKLHMIZOIIGKK-MHWRWJLKSA-N	-1	0	383.450	3.993	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/C=C/c1ccco1	ZINC000000980463	206338220	/nfs/dbraw/zinc/33/82/20/206338220.db2.gz	XPWBUEHPRHCINX-VFVQNCPYSA-N	-1	0	393.251	3.974	40	10		GHCBRM
Nc1ccc2c(O)c(N=Nc3ccc([N+](=O)[O-])cc3)c(S(=O)(=O)[O-])cc2c1	ZINC000004523147	206526035	/nfs/dbraw/zinc/52/60/35/206526035.db2.gz	PEMFTJYWFHQQFA-VHEBQXMUSA-N	-1	0	388.361	3.698	40	10		GHCBRM
O=C([O-])CCN1C(=O)/C(=C\c2ccccc2OCc2ccccc2)SC1=S	ZINC000005070258	534491641	/nfs/dbraw/zinc/49/16/41/534491641.db2.gz	JEQNWFPZLMSWHW-SFQUDFHCSA-N	-1	0	399.493	3.942	40	10		GHCBRM
CC1=NN(c2cccc(C)c2)C(=O)/C1=C\N=c1[n-]nc(-c2ccccc2)s1	ZINC000408531413	528150499	/nfs/dbraw/zinc/15/04/99/528150499.db2.gz	NXSXVHANZIHHHS-ATVHPVEESA-N	-1	0	375.457	3.654	40	10		GHCBRM
CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccccc1C(=O)[O-]	ZINC000409001256	528617529	/nfs/dbraw/zinc/61/75/29/528617529.db2.gz	OQUFGQRJJHROON-AQTBWJFISA-N	-1	0	377.396	3.652	40	10		GHCBRM
Cc1[n-]n(C(=O)c2ccncc2)c(=O)c1N=Nc1ccc(-c2ccc(N)cc2)cc1	ZINC000104204177	570299081	/nfs/dbraw/zinc/29/90/81/570299081.db2.gz	PVPHEEWBXNVLGB-DDJBQFQUSA-N	-1	0	398.426	3.842	40	10		GHCBRM
CCCOc1ccc(/C=C2/C(=O)[N-]N(c3cccc(Cl)c3)C2=O)cc1OC	ZINC000005469433	570441242	/nfs/dbraw/zinc/44/12/42/570441242.db2.gz	NEIOYSRLFWZHIH-YBEGLDIGSA-N	-1	0	386.835	3.599	40	10		GHCBRM
O=C([O-])c1ccc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1	ZINC000006926209	570498942	/nfs/dbraw/zinc/49/89/42/570498942.db2.gz	ZRTQMAYZOOIYEU-VIZOYTHASA-N	-1	0	385.422	3.519	40	10		GHCBRM
Cc1cc(C=C2SC(=O)NC2=O)c(C)n1-c1ccc(C(=O)[O-])c(Cl)c1	ZINC000059250279	570653056	/nfs/dbraw/zinc/65/30/56/570653056.db2.gz	VUQHZLXUPQXQED-MKMNVTDBSA-N	-1	0	376.821	3.770	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCC4)cc3C)C2=O)cc1	ZINC000408959852	231134602	/nfs/dbraw/zinc/13/46/02/231134602.db2.gz	GXUDIJYQKFULAC-XSFVSMFZSA-N	-1	0	389.455	3.570	40	10		GHCBRM
CCCC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(OC)c(OC)c2)SC1=S	ZINC000005371411	206609195	/nfs/dbraw/zinc/60/91/95/206609195.db2.gz	BZLYZMREXKUJIT-DYTQJMLRSA-N	-1	0	395.502	3.548	40	10		GHCBRM
CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2ccc(F)cc2)C1=O	ZINC000015013133	207040284	/nfs/dbraw/zinc/04/02/84/207040284.db2.gz	SQFQNHXGCQXWSD-LVLBFHFTSA-N	-1	0	398.459	3.834	40	10		GHCBRM
C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3/SC(=S)N(CC(=O)[O-])C3=O)cc21	ZINC000208222119	136202866	/nfs/dbraw/zinc/20/28/66/136202866.db2.gz	RKIQXARDWMMXQH-OXFWXOROSA-N	-1	0	390.530	3.694	40	10		GHCBRM
COc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(C)c(C)c2)C1=O	ZINC000408801601	533832407	/nfs/dbraw/zinc/83/24/07/533832407.db2.gz	WHMOERHZGZTSJV-MHWRWJLKSA-N	-1	0	384.819	3.632	40	10		GHCBRM
Cc1c(C=C2C(=O)[N-]C(=O)N(c3cc(C)cc(C)c3)C2=O)c2ccccc2n1C	ZINC000004498193	570379310	/nfs/dbraw/zinc/37/93/10/570379310.db2.gz	KEYSESGTZPYXQJ-UNOMPAQXSA-N	-1	0	387.439	3.770	40	10		GHCBRM
Cc1cc(C=C2C(=O)[N-]C(=O)N(C3CCCCC3)C2=O)c(C)n1C[C@@H]1CCCO1	ZINC000059109234	570653933	/nfs/dbraw/zinc/65/39/33/570653933.db2.gz	YPYRTFIMKLXAEV-LPGQDOADSA-N	-1	0	399.491	3.919	40	10		GHCBRM
COc1ccc(-n2[n-]c(C)c(C(C)=Nc3cccc(OC)c3OC)c2=O)cc1	ZINC000013532733	570757063	/nfs/dbraw/zinc/75/70/63/570757063.db2.gz	IOAKHOOONZSUSQ-CPNJWEJPSA-N	-1	0	381.432	3.821	40	10		GHCBRM
O=C([O-])COc1ccccc1C=C1SC(Nc2cccc(Cl)c2)=NC1=O	ZINC000016910027	570915128	/nfs/dbraw/zinc/91/51/28/570915128.db2.gz	RNWXJMDOKYORPY-OVCLIPMQSA-N	-1	0	388.832	3.886	40	10		GHCBRM
Cc1cc(C)c(N2C(=O)[N-]C(=O)C(=CNc3cccc(Cl)c3)C2=O)c(C)c1	ZINC000408530475	231051672	/nfs/dbraw/zinc/05/16/72/231051672.db2.gz	IYNUMCLHHUXRIR-MHWRWJLKSA-N	-1	0	383.835	3.844	40	10		GHCBRM
CSCC[C@H](C(=O)[O-])N1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S	ZINC000004619899	209120316	/nfs/dbraw/zinc/12/03/16/209120316.db2.gz	XVJQAAPMSJQAQB-OYGDSYQHSA-N	-1	0	387.935	3.748	40	10		GHCBRM
C[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S	ZINC000001281935	206371627	/nfs/dbraw/zinc/37/16/27/206371627.db2.gz	IGVIBAJPLLIKGO-MFVBVHDHSA-N	-1	0	399.493	3.940	40	10		GHCBRM
CCCC[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(OCC)cc2)SC1=S	ZINC000005372279	206608983	/nfs/dbraw/zinc/60/89/83/206608983.db2.gz	NMCSLMCZSUMVJB-XFNCEPBJSA-N	-1	0	379.503	3.930	40	10		GHCBRM
CC(=O)c1cccc(N2C(=O)C(=Cc3ccc(C(=O)[O-])cc3)SC2=S)c1	ZINC000005371693	206609282	/nfs/dbraw/zinc/60/92/82/206609282.db2.gz	STPKVTDWWSXIOP-SXGWCWSVSA-N	-1	0	383.450	3.993	40	10		GHCBRM
O=C1[N-]C(=O)C(=Cc2c(Cc3ccccc3Cl)ccc3ccccc32)C(=O)N1	ZINC000408885227	534785221	/nfs/dbraw/zinc/78/52/21/534785221.db2.gz	XZERPKRCPIGPNH-UHFFFAOYSA-N	-1	0	390.826	3.833	40	10		GHCBRM
CC1=NN(c2ccc(C)c(Cl)c2)C(=O)C1=CNc1ccc(O)c(C(=O)[O-])c1	ZINC000408531521	528149997	/nfs/dbraw/zinc/14/99/97/528149997.db2.gz	KPZMIPGBCSOWED-DHDCSXOGSA-N	-1	0	385.807	3.771	40	10		GHCBRM
CCOc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(F)c2)C1=O	ZINC000409089433	528471004	/nfs/dbraw/zinc/47/10/04/528471004.db2.gz	NPXBYAAVBQVGGX-OQLLNIDSSA-N	-1	0	388.782	3.544	40	10		GHCBRM
O=C([O-])c1cc(N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)ccc1O	ZINC000005374173	570435976	/nfs/dbraw/zinc/43/59/76/570435976.db2.gz	BUBKQWXTIWZDEK-AUWJEWJLSA-N	-1	0	375.402	3.635	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N([C@H](C(=O)[O-])[C@H](C)CC)C2=O)cc1	ZINC000005373642	570436013	/nfs/dbraw/zinc/43/60/13/570436013.db2.gz	CHJJPBZLESNBNE-YKXPOADNSA-N	-1	0	379.503	3.786	40	10		GHCBRM
CC(C)Oc1ccccc1C=C1C(=O)[N-]C(=O)N(c2ccc3c(c2)OCO3)C1=O	ZINC000059104732	570649809	/nfs/dbraw/zinc/64/98/09/570649809.db2.gz	KOYSUCAYWDDINU-OQLLNIDSSA-N	-1	0	394.383	3.709	40	10		GHCBRM
CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(F)c2)C1=O	ZINC000408913162	529387227	/nfs/dbraw/zinc/38/72/27/529387227.db2.gz	SVOUARLHFGFVKL-VVBXCHJUSA-N	-1	0	382.391	3.669	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc(Cl)c2)C(=O)/C1=C/c1c(O)ccc2ccccc12	ZINC000408883846	231124779	/nfs/dbraw/zinc/12/47/79/231124779.db2.gz	WXUOHIYDXMVUFW-GZTJUZNOSA-N	-1	0	392.798	3.865	40	10		GHCBRM
CCOc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3C)C2=O)c1	ZINC000408873947	528288804	/nfs/dbraw/zinc/28/88/04/528288804.db2.gz	XRHNQJUJOIDNDO-MHWRWJLKSA-N	-1	0	384.819	3.714	40	10		GHCBRM
O=C([O-])C[C@@H](c1ccccc1)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S	ZINC000006061949	570232388	/nfs/dbraw/zinc/23/23/88/570232388.db2.gz	ZBJMXVOFRVUGRG-BMANGOCTSA-N	-1	0	385.466	3.809	40	10		GHCBRM
COC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(C(=O)[O-])cc3)C2=O)cc1	ZINC000004342043	570369821	/nfs/dbraw/zinc/36/98/21/570369821.db2.gz	KBMJIKKXRPGGPQ-GDNBJRDFSA-N	-1	0	399.449	3.577	40	10		GHCBRM
CC(C)Oc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(Cl)cc3)C2=O)cc1	ZINC000013546734	570757496	/nfs/dbraw/zinc/75/74/96/570757496.db2.gz	CYZMJEXONZUVTE-BOPFTXTBSA-N	-1	0	384.819	3.794	40	10		GHCBRM
Cc1ccccc1NC=C1C(=O)[N-]C(=S)N(c2ccc(F)c(Cl)c2)C1=O	ZINC000108032340	843296598	/nfs/dbraw/zinc/29/65/98/843296598.db2.gz	KZXQNIJSQDRMSA-XFXZXTDPSA-N	-1	0	389.839	3.531	40	10		GHCBRM
CCCc1nc(SC(=Cc2ccc(N(CC)CC)cc2O)C(=O)[O-])n[nH]1	ZINC000007342209	856546192	/nfs/dbraw/zinc/54/61/92/856546192.db2.gz	OVWXPWDMJSPFKG-GDNBJRDFSA-N	-1	0	376.482	3.527	40	10		GHCBRM
Cc1ccc(NC2=NC(=O)C(=Cc3ccc(O[C@H](C)C(=O)[O-])cc3)S2)cc1	ZINC000210836625	856566524	/nfs/dbraw/zinc/56/65/24/856566524.db2.gz	UXZMRJURIWHVGJ-GPLLRDDGSA-N	-1	0	382.441	3.929	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc3ccccc32)C(=O)C1=CNc1ccc(F)cc1F	ZINC000408530011	231051362	/nfs/dbraw/zinc/05/13/62/231051362.db2.gz	IJKJMSAWFMKAQT-RVDMUPIBSA-N	-1	0	393.349	3.697	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCCCC4)o3)C2=O)cc1	ZINC000408897397	231125697	/nfs/dbraw/zinc/12/56/97/231125697.db2.gz	JFBIFXNEIXBTKK-NBVRZTHBSA-N	-1	0	393.443	3.635	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=S)N(c3cccc(F)c3)C2=O)c(C)n1C(C)(C)C	ZINC000409021689	231147670	/nfs/dbraw/zinc/14/76/70/231147670.db2.gz	TYNUMPRFXFLSTQ-LICLKQGHSA-N	-1	0	399.491	3.830	40	10		GHCBRM
O=C([O-])CN1C(=O)S/C(=C/c2ccc(N3CCCC3)c3ccccc23)C1=O	ZINC000409128962	231168147	/nfs/dbraw/zinc/16/81/47/231168147.db2.gz	QBVQBXOPDQQMBX-GZTJUZNOSA-N	-1	0	382.441	3.561	40	10		GHCBRM
Cc1cc(/C=C2/SC(=O)N(CC(=O)[O-])C2=O)c(C)n1-c1ccccc1Cl	ZINC000409144781	231171065	/nfs/dbraw/zinc/17/10/65/231171065.db2.gz	GQEAQSYWPBRCDJ-OVCLIPMQSA-N	-1	0	390.848	3.868	40	10		GHCBRM
CCc1ccc(N2C(=O)/C(=C/c3ccc(N(CC)CC)o3)C(=O)[N-]C2=S)cc1	ZINC000408817944	529662124	/nfs/dbraw/zinc/66/21/24/529662124.db2.gz	MMBQNPWQJXDOEP-GHRIWEEISA-N	-1	0	397.500	3.520	40	10		GHCBRM
Cc1ccccc1-n1cccc1C=C1C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000015013784	207039971	/nfs/dbraw/zinc/03/99/71/207039971.db2.gz	KZJKHYIGLVQHDV-JXAWBTAJSA-N	-1	0	385.423	3.761	40	10		GHCBRM
COc1cc(C)c(/C=C2/C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)cc1C(C)C	ZINC000016267879	207074570	/nfs/dbraw/zinc/07/45/70/207074570.db2.gz	TWDGTZQVKSJPAI-WQRHYEAKSA-N	-1	0	396.418	3.933	40	10		GHCBRM
O=C([O-])Cn1cc(/C=C2\SC(=S)N(Cc3ccco3)C2=O)c2ccccc21	ZINC000017081468	207084953	/nfs/dbraw/zinc/08/49/53/207084953.db2.gz	HRZKIESAPFZESH-PXNMLYILSA-N	-1	0	398.465	3.720	40	10		GHCBRM
COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(C(=O)[O-])cc1	ZINC000408795312	533266700	/nfs/dbraw/zinc/26/67/00/533266700.db2.gz	LZLNCTXPUKCRAJ-QIQQCEGHSA-N	-1	0	391.423	3.819	40	10		GHCBRM
Cc1ccc(Cl)cc1N1C(=O)[N-]C(=O)C(=Cc2cc(Cl)ccc2O)C1=O	ZINC000408891045	534146614	/nfs/dbraw/zinc/14/66/14/534146614.db2.gz	KJUHYIGKQLYTIB-NTUHNPAUSA-N	-1	0	391.210	3.674	40	10		GHCBRM
CCCC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2cc(OC)ccc2OC)SC1=S	ZINC000005371393	570435462	/nfs/dbraw/zinc/43/54/62/570435462.db2.gz	QPKBHMSFKKBDLP-NWFCWYBLSA-N	-1	0	395.502	3.548	40	10		GHCBRM
O=C([O-])c1cc(N2C(=O)/C(=C/c3cccc(F)c3)SC2=S)ccc1O	ZINC000005374157	570435981	/nfs/dbraw/zinc/43/59/81/570435981.db2.gz	NUBJGFWGXCOSMQ-AUWJEWJLSA-N	-1	0	375.402	3.635	40	10		GHCBRM
O=C([O-])CCN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S	ZINC000006889856	570498727	/nfs/dbraw/zinc/49/87/27/570498727.db2.gz	XIWBZYQQPVIQNF-ATVHPVEESA-N	-1	0	399.493	3.942	40	10		GHCBRM
Cc1cccc(N2[N-]C(=O)/C(=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)c1	ZINC000006924257	570499108	/nfs/dbraw/zinc/49/91/08/570499108.db2.gz	DYJWJPKSPDBIID-PDGQHHTCSA-N	-1	0	389.367	3.625	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccc(Cl)c3)C2=O)cc1Cl	ZINC000408991265	570690057	/nfs/dbraw/zinc/69/00/57/570690057.db2.gz	ZOVSAQXBXGCVLT-ZSOIEALJSA-N	-1	0	375.211	3.968	40	10		GHCBRM
O=C([O-])COc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1	ZINC000409084572	231157447	/nfs/dbraw/zinc/15/74/47/231157447.db2.gz	WVLQEXGNZGNLMJ-QNGOZBTKSA-N	-1	0	398.418	3.985	40	10		GHCBRM
CCc1ccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)[N-]C2=S)cc1	ZINC000409370308	529662679	/nfs/dbraw/zinc/66/26/79/529662679.db2.gz	ORDCYZVDYCLFKL-QGOAFFKASA-N	-1	0	394.496	3.868	40	10		GHCBRM
COc1ccc(-c2c(C)oc3c(ccc([O-])c3CN3CCCOC3)c2=O)cc1	ZINC000032501396	206303112	/nfs/dbraw/zinc/30/31/12/206303112.db2.gz	BZLCAJZSYBLXHF-UHFFFAOYSA-N	-1	0	381.428	3.662	40	10		GHCBRM
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)[N-]c1ccccc1C(=O)c1ccccc1	ZINC000223652719	208906792	/nfs/dbraw/zinc/90/67/92/208906792.db2.gz	NXXAQWPKHBMKBJ-UHFFFAOYSA-N	-1	0	396.424	3.935	40	10		GHCBRM
COc1cc(/C=C2/SC(=S)N([N-]C(=O)c3cccs3)C2=O)ccc1C	ZINC000409345747	533473574	/nfs/dbraw/zinc/47/35/74/533473574.db2.gz	JMALWMJXRYYHNN-NTEUORMPSA-N	-1	0	390.511	3.611	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cc(C)ccc3C)C2=O)cc1	ZINC000409230282	528369057	/nfs/dbraw/zinc/36/90/57/528369057.db2.gz	BSXARISHGXBRGJ-SFQUDFHCSA-N	-1	0	380.469	3.533	40	10		GHCBRM
CCOc1cccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3C)C2=O)c1	ZINC000408867155	528627732	/nfs/dbraw/zinc/62/77/32/528627732.db2.gz	JCVAXEDEJXEGOY-RVDMUPIBSA-N	-1	0	384.819	3.714	40	10		GHCBRM
CCOc1cccc(N2C(=O)/C(=C/c3ccccc3Cl)C(=O)[N-]C2=S)c1	ZINC000408740244	528660472	/nfs/dbraw/zinc/66/04/72/528660472.db2.gz	JOIDVXXVNJVPRJ-XNTDXEJSSA-N	-1	0	386.860	3.570	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OC(C)C)C2=O)c1C	ZINC000408818458	231118559	/nfs/dbraw/zinc/11/85/59/231118559.db2.gz	YAEXNEJNVQEGQQ-SFQUDFHCSA-N	-1	0	378.428	3.757	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/C=C/c1ccco1	ZINC000409107536	231162947	/nfs/dbraw/zinc/16/29/47/231162947.db2.gz	WRNXYDDWPBLIHB-VFVQNCPYSA-N	-1	0	377.183	3.809	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N(CCCC(=O)[O-])C2=O)cc1OCC	ZINC000016684192	210193000	/nfs/dbraw/zinc/19/30/00/210193000.db2.gz	INXBTRFXNNCXRX-PTNGSMBKSA-N	-1	0	395.502	3.550	40	10		GHCBRM
COc1ccc(C2(Nc3ccc(C(=O)[O-])cc3)C(=O)c3ccccc3C2=O)cc1	ZINC000007500001	212074550	/nfs/dbraw/zinc/07/45/50/212074550.db2.gz	AZPMVFRUTMJRAC-UHFFFAOYSA-N	-1	0	387.391	3.780	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(F)c3)C2=O)cc1Cl	ZINC000408781216	528369820	/nfs/dbraw/zinc/36/98/20/528369820.db2.gz	BBCWSBXUWQUZIW-RIYZIHGNSA-N	-1	0	388.782	3.544	40	10		GHCBRM
CCOc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=S)N(c2ccccc2)C1=O	ZINC000408809807	528471083	/nfs/dbraw/zinc/47/10/83/528471083.db2.gz	JJHBJJWCLOCZDJ-RVDMUPIBSA-N	-1	0	386.860	3.570	40	10		GHCBRM
CC[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2cccc(Br)c2)SC1=S	ZINC000005374206	570435963	/nfs/dbraw/zinc/43/59/63/570435963.db2.gz	KRLJBJDTZMANLB-QBQSQJOESA-N	-1	0	386.292	3.514	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCCC4)cc3)C2=O)c1	ZINC000005897616	570460571	/nfs/dbraw/zinc/46/05/71/570460571.db2.gz	HNGBQGUAICMVRK-HKWRFOASSA-N	-1	0	389.455	3.652	40	10		GHCBRM
O=C([O-])COc1ccccc1/C=C1\SC(=S)N(C2CCCCC2)C1=O	ZINC000033373294	570526354	/nfs/dbraw/zinc/52/63/54/570526354.db2.gz	APOFKFUVKPVNIL-GDNBJRDFSA-N	-1	0	377.487	3.684	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(C)c(C)c3)C2=O)c1	ZINC000408935991	570686696	/nfs/dbraw/zinc/68/66/96/570686696.db2.gz	JKXQWPADNKJLFC-UYRXBGFRSA-N	-1	0	378.428	3.759	40	10		GHCBRM
CSCC[C@@H](C(=O)[O-])N1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S	ZINC000004619895	570992536	/nfs/dbraw/zinc/99/25/36/570992536.db2.gz	XVJQAAPMSJQAQB-SERMCNLOSA-N	-1	0	387.935	3.748	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1cccc(O)c1	ZINC000408722921	231105923	/nfs/dbraw/zinc/10/59/23/231105923.db2.gz	OJVIVNPLIVSYCZ-KPKJPENVSA-N	-1	0	393.251	3.530	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccccc2)C(=O)/C1=C/c1ccc(N2CCCCC2)cc1	ZINC000408959845	231134859	/nfs/dbraw/zinc/13/48/59/231134859.db2.gz	GUSZECLZSKKCBT-XDJHFCHBSA-N	-1	0	391.496	3.508	40	10		GHCBRM
O=C1[N-]C(=O)N(Cc2ccco2)C(=O)/C1=C/c1ccc(Sc2ccccc2)o1	ZINC000002211533	212062973	/nfs/dbraw/zinc/06/29/73/212062973.db2.gz	XZWGZXRTYIBFOH-LFIBNONCSA-N	-1	0	394.408	3.686	40	10		GHCBRM
Cn1c2ccccc2c2ccc(CC(=O)N(CC(=O)[O-])Cc3ccccc3)cc21	ZINC000257272407	212014242	/nfs/dbraw/zinc/01/42/42/212014242.db2.gz	NCHBORRJOIRLKM-UHFFFAOYSA-N	-1	0	386.451	3.987	40	10		GHCBRM
COc1cccc(N=C(C)c2c(C)[n-]n(-c3ccc([N+](=O)[O-])cc3)c2=O)c1OC	ZINC000112124236	533574712	/nfs/dbraw/zinc/57/47/12/533574712.db2.gz	YHZPFPXBUSYZII-PDGQHHTCSA-N	-1	0	396.403	3.721	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)[N-]C(=O)C(=CNc3ccc(F)c(Cl)c3)C2=O)c1	ZINC000408526814	533673481	/nfs/dbraw/zinc/67/34/81/533673481.db2.gz	CLURLMWXJZNWJZ-UKTHLTGXSA-N	-1	0	387.798	3.675	40	10		GHCBRM
CCOc1cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)ccc1O[C@H](C)CC	ZINC000409409942	528194543	/nfs/dbraw/zinc/19/45/43/528194543.db2.gz	XXVNSEJGEAESCC-QLENYVDCSA-N	-1	0	380.444	3.724	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3ccc(C(F)(F)F)cc3)C2=O)c1	ZINC000408901308	231127221	/nfs/dbraw/zinc/12/72/21/231127221.db2.gz	XCTBNVFVTHKHFR-MHWRWJLKSA-N	-1	0	388.345	3.989	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C)c(C)c3)C2=O)c1C	ZINC000409075069	231155262	/nfs/dbraw/zinc/15/52/62/231155262.db2.gz	SXDYGLZWSIYIAV-WOJGMQOQSA-N	-1	0	381.501	3.573	40	10		GHCBRM
Cc1cc(/C=C2/C(=O)[N-]C(=O)N(C3CCCC3)C2=O)c(C)n1-c1ccc(F)cc1	ZINC000409197680	231178201	/nfs/dbraw/zinc/17/82/01/231178201.db2.gz	MCATYTDSIIZFRX-UNOMPAQXSA-N	-1	0	395.434	3.638	40	10		GHCBRM
CCc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(Br)cc3)C2=O)cc1	ZINC000408901799	529584600	/nfs/dbraw/zinc/58/46/00/529584600.db2.gz	CMPHODDCINEIBL-LFIBNONCSA-N	-1	0	399.244	3.678	40	10		GHCBRM
CC[C@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2ccc(F)cc2)C1=O	ZINC000015013135	210143196	/nfs/dbraw/zinc/14/31/96/210143196.db2.gz	SQFQNHXGCQXWSD-VLURKWGBSA-N	-1	0	398.459	3.834	40	10		GHCBRM
CCOc1cccc(/C=C2\C(=O)[N-]C(=O)N(c3cc(Cl)ccc3C)C2=O)c1	ZINC000408876872	528627405	/nfs/dbraw/zinc/62/74/05/528627405.db2.gz	OMZPURSTQDVXGJ-MHWRWJLKSA-N	-1	0	384.819	3.714	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N([C@H](C(=O)[O-])[C@@H](C)CC)C2=O)cc1	ZINC000005373644	570435997	/nfs/dbraw/zinc/43/59/97/570435997.db2.gz	CHJJPBZLESNBNE-DEMBHLBLSA-N	-1	0	379.503	3.786	40	10		GHCBRM
CCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OCC)C2=O)cc1	ZINC000059860360	570659966	/nfs/dbraw/zinc/65/99/66/570659966.db2.gz	RIALJOCLCJPYIR-GHRIWEEISA-N	-1	0	380.400	3.991	40	10		GHCBRM
O=C([O-])COc1ccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1	ZINC000020428804	570946719	/nfs/dbraw/zinc/94/67/19/570946719.db2.gz	RNNDUEBAAWPXSW-OQLLNIDSSA-N	-1	0	388.832	3.886	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3cccc(Br)c3)C2=O)c1	ZINC000408782207	231113972	/nfs/dbraw/zinc/11/39/72/231113972.db2.gz	FYHWYROXCBXECG-MHWRWJLKSA-N	-1	0	399.244	3.732	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3Cl)C2=O)cc1Cl	ZINC000408981877	231141078	/nfs/dbraw/zinc/14/10/78/231141078.db2.gz	COYUZFFIDWIFPE-JYRVWZFOSA-N	-1	0	375.211	3.968	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)[N-]C2=S)c(C)c1	ZINC000409123948	231167003	/nfs/dbraw/zinc/16/70/03/231167003.db2.gz	JHSQCOVWGZEBMU-SFQUDFHCSA-N	-1	0	394.496	3.922	40	10		GHCBRM
Cc1cc(/C=C2/SC(=O)N(CC(=O)[O-])C2=O)c(C)n1-c1ccc(C)cc1C	ZINC000409131000	231169257	/nfs/dbraw/zinc/16/92/57/231169257.db2.gz	JCVFOSVWPVAUPG-RQZCQDPDSA-N	-1	0	384.457	3.832	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)cc2)o1	ZINC000409392975	231200501	/nfs/dbraw/zinc/20/05/01/231200501.db2.gz	OMPITSLTRWBVGU-LFIBNONCSA-N	-1	0	393.786	3.661	40	10		GHCBRM
CCOc1cccc(C=C2C(=O)[N-]C(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)c1	ZINC000016693158	210194523	/nfs/dbraw/zinc/19/45/23/210194523.db2.gz	KQODWKRQEJYFAL-YBEGLDIGSA-N	-1	0	381.344	3.500	40	10		GHCBRM
Cc1ccc(C(=O)[O-])cc1NC1=NC(=O)C(=Cc2ccc([N+](=O)[O-])cc2)S1	ZINC000020265149	210326266	/nfs/dbraw/zinc/32/62/66/210326266.db2.gz	XJBSOKCNTZKSLN-NVNXTCNLSA-N	-1	0	383.385	3.684	40	10		GHCBRM
COc1ccc(C=C2C(=O)[N-]C(=O)N(c3cccc(C)c3C)C2=O)cc1OC	ZINC000059860866	533240067	/nfs/dbraw/zinc/24/00/67/533240067.db2.gz	MKWZXSQSLKQPLY-XNTDXEJSSA-N	-1	0	380.400	3.827	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(C(F)(F)F)cc1	ZINC000001098505	136196139	/nfs/dbraw/zinc/19/61/39/136196139.db2.gz	XSMDNNPUUGUTQS-ZROIWOOFSA-N	-1	0	394.349	3.676	40	10		GHCBRM
CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C\c1ccccc1C(=O)[O-]	ZINC000409046915	528145485	/nfs/dbraw/zinc/14/54/85/528145485.db2.gz	LKLLUCMMSBNNKP-POHAHGRESA-N	-1	0	396.271	3.886	40	10		GHCBRM
CN1C(=O)/C(=C\c2cc(Cc3ccccc3)cc([N+](=O)[O-])c2[O-])SC1=S	ZINC000059417915	570656039	/nfs/dbraw/zinc/65/60/39/570656039.db2.gz	GIEFMFUDJVPDHE-XNTDXEJSSA-N	-1	0	386.454	3.722	40	10		GHCBRM
O=C1/C(=C\c2ccc([O-])c([N+](=O)[O-])c2)SC(=S)N1c1cccc(F)c1	ZINC000059417989	570656379	/nfs/dbraw/zinc/65/63/79/570656379.db2.gz	WJFXRZQOCAFDDF-VGOFMYFVSA-N	-1	0	376.390	3.845	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C)cc3C)C2=O)o1	ZINC000204986714	856561932	/nfs/dbraw/zinc/56/19/32/856561932.db2.gz	JOKLQWMNRYVCJS-FOWTUZBSSA-N	-1	0	397.500	3.574	40	10		GHCBRM
CC[C@@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccncc3)C2=O)cc1Cl	ZINC000409389152	529382763	/nfs/dbraw/zinc/38/27/63/529382763.db2.gz	ANCHMWRKBSNESF-JXCQQFQQSA-N	-1	0	399.834	3.579	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)cc3C)C2=O)cc1Cl	ZINC000408797607	231115612	/nfs/dbraw/zinc/11/56/12/231115612.db2.gz	GTKASBYSHXIUAM-NTEUORMPSA-N	-1	0	384.819	3.632	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2cc(Cl)ccc2OC)C1=O	ZINC000408865967	529586552	/nfs/dbraw/zinc/58/65/52/529586552.db2.gz	FNCPKZTZBBMFHK-PTNGSMBKSA-N	-1	0	384.819	3.577	40	10		GHCBRM
COc1ccc(C=C2C(=O)[N-]C(=S)N(c3ccccc3F)C2=O)cc1OC	ZINC000002263130	136196320	/nfs/dbraw/zinc/19/63/20/136196320.db2.gz	MJTKRVDUVQKIIJ-FMIVXFBMSA-N	-1	0	386.404	3.515	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3Cl)C2=O)c1	ZINC000408868093	533943641	/nfs/dbraw/zinc/94/36/41/533943641.db2.gz	MKFNHEDJOCGQGX-MDWZMJQESA-N	-1	0	391.210	3.668	40	10		GHCBRM
COc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2ccc(C(C)C)cc2)C1=O	ZINC000409238084	533952926	/nfs/dbraw/zinc/95/29/26/533952926.db2.gz	YYYXZTQDJVSBRG-SFQUDFHCSA-N	-1	0	380.469	3.650	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3)C2=O)cc1Cl	ZINC000408804386	528640913	/nfs/dbraw/zinc/64/09/13/528640913.db2.gz	FGWIMZNRYSFRGC-RVDMUPIBSA-N	-1	0	384.819	3.795	40	10		GHCBRM
COc1ccc(CCN2C(=O)/C(=C/c3ccc(C(=O)[O-])cc3)SC2=S)cc1	ZINC000005371682	570435507	/nfs/dbraw/zinc/43/55/07/570435507.db2.gz	HWOXHZJCKBDENM-ATVHPVEESA-N	-1	0	399.493	3.837	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)cc1C(=O)[O-]	ZINC000005374318	570435959	/nfs/dbraw/zinc/43/59/59/570435959.db2.gz	GNVKLEHABQMCOV-APSNUPSMSA-N	-1	0	399.449	3.828	40	10		GHCBRM
CCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(C(C)C)cc3)C2=O)c1O	ZINC000005654409	570450329	/nfs/dbraw/zinc/45/03/29/570450329.db2.gz	BVPMQFWPCPFYBE-ATVHPVEESA-N	-1	0	394.427	3.581	40	10		GHCBRM
O=C([O-])C[C@@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(O)cc2)SC1=S	ZINC000012032241	570599926	/nfs/dbraw/zinc/59/99/26/570599926.db2.gz	ZXRRAMSVKQBQDA-BMANGOCTSA-N	-1	0	385.466	3.809	40	10		GHCBRM
Cc1ccc(C(=O)[O-])cc1NC1=NC(=O)C(=Cc2ccc3c(c2)OCO3)S1	ZINC000054164400	570676278	/nfs/dbraw/zinc/67/62/78/570676278.db2.gz	VVHZQALURHJMQL-APSNUPSMSA-N	-1	0	382.397	3.504	40	10		GHCBRM
CCCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000005713248	842612986	/nfs/dbraw/zinc/61/29/86/842612986.db2.gz	QXTCUBFINFYHFR-NBVRZTHBSA-N	-1	0	378.428	3.840	40	10		GHCBRM
CCCc1nc(SC(=Cc2ccc(N(CC)CC)cc2OC)C(=O)[O-])n[nH]1	ZINC000007342243	856545343	/nfs/dbraw/zinc/54/53/43/856545343.db2.gz	XGWYZQZRUPEDOZ-WJDWOHSUSA-N	-1	0	390.509	3.830	40	10		GHCBRM
Cc1c(Cl)cccc1N1C(=O)[N-]C(=O)C(=Cc2ccc(O)c(Cl)c2)C1=O	ZINC000408897077	231126401	/nfs/dbraw/zinc/12/64/01/231126401.db2.gz	VFKWOCNEFYBVTR-YRNVUSSQSA-N	-1	0	391.210	3.674	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCC4)cc3C)C2=O)c1	ZINC000408959874	231135353	/nfs/dbraw/zinc/13/53/53/231135353.db2.gz	HGQRESJLMBULBX-XSFVSMFZSA-N	-1	0	389.455	3.570	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=S)N(c3cc(C)cc(C)c3)C2=O)c1C	ZINC000409014032	231146434	/nfs/dbraw/zinc/14/64/34/231146434.db2.gz	OOWHOCUCVRQBTK-WOJGMQOQSA-N	-1	0	381.501	3.573	40	10		GHCBRM
Cc1cc(/C=C2/SC(=O)N(CC(=O)[O-])C2=O)c(C)n1-c1cccc(C)c1C	ZINC000409145101	231170810	/nfs/dbraw/zinc/17/08/10/231170810.db2.gz	PYFXRYAMTAGTBI-RQZCQDPDSA-N	-1	0	384.457	3.832	40	10		GHCBRM
CCOc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2ccc(C)cc2C)C1=O	ZINC000409146236	231171123	/nfs/dbraw/zinc/17/11/23/231171123.db2.gz	KFXUNOQOJCGSNO-FOWTUZBSSA-N	-1	0	380.469	3.533	40	10		GHCBRM
COCCN1C(=O)S/C(=C/c2ccc(-c3cc(C(=O)[O-])ccc3C)o2)C1=O	ZINC000409148469	231172356	/nfs/dbraw/zinc/17/23/56/231172356.db2.gz	YXOTZDNCYMQLPK-MHWRWJLKSA-N	-1	0	387.413	3.636	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=S)N(c3cccc(Cl)c3)C2=O)c1C	ZINC000409101697	231160701	/nfs/dbraw/zinc/16/07/01/231160701.db2.gz	QOBCTNAWVFFCFC-CXUHLZMHSA-N	-1	0	387.892	3.610	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C)cc3C)C2=O)c1C	ZINC000409102450	231160765	/nfs/dbraw/zinc/16/07/65/231160765.db2.gz	ZTMDIHKADKSKDS-GZTJUZNOSA-N	-1	0	381.501	3.573	40	10		GHCBRM
O=C([O-])CCCN1C(=O)/C(=C/c2ccccc2Br)SC1=S	ZINC000013547884	210067468	/nfs/dbraw/zinc/06/74/68/210067468.db2.gz	FINNRVWTSJEZMM-FLIBITNWSA-N	-1	0	386.292	3.515	40	10		GHCBRM
COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccccc1C(=O)[O-]	ZINC000408998300	533267781	/nfs/dbraw/zinc/26/77/81/533267781.db2.gz	PVIYNLMZSAKWOL-PDGQHHTCSA-N	-1	0	377.396	3.570	40	10		GHCBRM
O=C([O-])c1ccc(N2C(=O)/C(=C/c3cccc(F)c3)SC2=S)cc1O	ZINC000005374153	570435983	/nfs/dbraw/zinc/43/59/83/570435983.db2.gz	NDXQYYKPTVIBSI-AUWJEWJLSA-N	-1	0	375.402	3.635	40	10		GHCBRM
CC[C@@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cccc(F)c3)C2=O)cc1	ZINC000409022288	529383054	/nfs/dbraw/zinc/38/30/54/529383054.db2.gz	MBDACTLCMVNFDC-VBEHJTROSA-N	-1	0	398.459	3.834	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3cccc(Br)c3)C2=O)c1C	ZINC000408865207	231122705	/nfs/dbraw/zinc/12/27/05/231122705.db2.gz	BWKMERLYTAMYLD-XNTDXEJSSA-N	-1	0	399.244	3.732	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Br)cc3)C2=O)cc1	ZINC000408982647	529662488	/nfs/dbraw/zinc/66/24/88/529662488.db2.gz	DQADAWXKMFAKJP-WJDWOHSUSA-N	-1	0	399.244	3.678	40	10		GHCBRM
COc1cc(C)c(/C=C2\C(=O)[N-]C(=O)N(c3cccc(F)c3)C2=O)cc1C(C)C	ZINC000408913431	533565467	/nfs/dbraw/zinc/56/54/67/533565467.db2.gz	UKRVVYKKMMLGQC-VCHYOVAHSA-N	-1	0	396.418	3.933	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)/C(=C/c3ccccc3OC(C)C)C(=O)[N-]C2=S)c1	ZINC000409235009	533670668	/nfs/dbraw/zinc/67/06/68/533670668.db2.gz	AMNQPOOGPDFPBA-SFQUDFHCSA-N	-1	0	394.496	3.922	40	10		GHCBRM
Cc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cccc(Cl)c3C)C2=O)s1	ZINC000409068787	534247910	/nfs/dbraw/zinc/24/79/10/534247910.db2.gz	VRDZOKPLRCOKLU-XYOKQWHBSA-N	-1	0	376.890	3.850	40	10		GHCBRM
Cc1ccccc1N1C(=O)/C(=C/c2ccccc2OC(C)C)C(=O)[N-]C1=S	ZINC000409235481	534820699	/nfs/dbraw/zinc/82/06/99/534820699.db2.gz	BLJIQUQSMIEHTD-FOWTUZBSSA-N	-1	0	380.469	3.614	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3)C2=O)cc1	ZINC000408802837	528641097	/nfs/dbraw/zinc/64/10/97/528641097.db2.gz	IBOXLJDDLTUSQE-GZTJUZNOSA-N	-1	0	384.819	3.795	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3)C2=O)cc1OCC	ZINC000408816126	528641252	/nfs/dbraw/zinc/64/12/52/528641252.db2.gz	RBMIKPHTBXWCHH-GHRIWEEISA-N	-1	0	394.427	3.541	40	10		GHCBRM
COC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2C(=O)c2ccccc2)c1	ZINC000223794968	570485303	/nfs/dbraw/zinc/48/53/03/570485303.db2.gz	MUMRHRKDGBGTGP-UHFFFAOYSA-N	-1	0	395.436	3.505	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Cl)c(Cl)c3)C2=O)cc1	ZINC000059426718	570657060	/nfs/dbraw/zinc/65/70/60/570657060.db2.gz	VZIFEUKBOLZSGK-MDWZMJQESA-N	-1	0	375.211	3.968	40	10		GHCBRM
CCOc1cc(C=C2SC(Nc3ccccc3C(=O)[O-])=NC2=O)ccc1O	ZINC000020227041	570951716	/nfs/dbraw/zinc/95/17/16/570951716.db2.gz	TYNGCJXASWHBPX-YBEGLDIGSA-N	-1	0	384.413	3.572	40	10		GHCBRM
CCc1nnc(S/C(=C\c2ccc(N(C)C)c(Br)c2)C(=O)[O-])o1	ZINC000213416776	856568468	/nfs/dbraw/zinc/56/84/68/856568468.db2.gz	MNORZWVZZOGFEJ-WQLSENKSSA-N	-1	0	398.282	3.678	40	10		GHCBRM
O=C1[N-]C(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(Cl)cc1Cl	ZINC000408911818	231129246	/nfs/dbraw/zinc/12/92/46/231129246.db2.gz	DNQYQESBQALYCG-AWNIVKPZSA-N	-1	0	379.174	3.799	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(Cc3ccccc3)C2=O)c2ccccc12	ZINC000409149851	231172243	/nfs/dbraw/zinc/17/22/43/231172243.db2.gz	SKYUOTDFZBQKNJ-CPNJWEJPSA-N	-1	0	386.407	3.510	40	10		GHCBRM
CCCC1=NN(c2cccc(C(=O)[O-])c2)C(=O)/C1=C/c1cccc(OC)c1O	ZINC000036617121	210155450	/nfs/dbraw/zinc/15/54/50/210155450.db2.gz	JHJIKOOAGQNAJP-FOWTUZBSSA-N	-1	0	380.400	3.685	40	10		GHCBRM
CC[C@@H](C)c1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N(C)C)cc3)C2=O)cc1	ZINC000002236577	212062723	/nfs/dbraw/zinc/06/27/23/212062723.db2.gz	RVSGHJRMKCMCIP-NPQOUYBPSA-N	-1	0	391.471	3.933	40	10		GHCBRM
COc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2ccccc2Cl)C1=O	ZINC000408801626	533833675	/nfs/dbraw/zinc/83/36/75/533833675.db2.gz	VAFBUBLDPFFYPX-FMIVXFBMSA-N	-1	0	391.210	3.668	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)cc3C)C2=O)c1	ZINC000408868541	533943886	/nfs/dbraw/zinc/94/38/86/533943886.db2.gz	OUZLTGOLYWNUNI-CXUHLZMHSA-N	-1	0	384.819	3.632	40	10		GHCBRM
Cc1[n-]n(C(=O)c2ccncc2)c(=O)c1N=Nc1ccc(-c2ccc(N)cc2)cc1	ZINC000104204179	570299193	/nfs/dbraw/zinc/29/91/93/570299193.db2.gz	PVPHEEWBXNVLGB-QTJUSOIVSA-N	-1	0	398.426	3.842	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N([C@@H](C(=O)[O-])[C@@H](C)CC)C2=O)cc1	ZINC000005373649	570436034	/nfs/dbraw/zinc/43/60/34/570436034.db2.gz	CHJJPBZLESNBNE-WKVAABHYSA-N	-1	0	379.503	3.786	40	10		GHCBRM
Cc1ccc(C(=O)[O-])cc1NC1=NC(=O)C(=Cc2ccc(N(C)C)cc2)S1	ZINC000054164389	570676219	/nfs/dbraw/zinc/67/62/19/570676219.db2.gz	JOQVSGKKJRQJLO-YVLHZVERSA-N	-1	0	381.457	3.842	40	10		GHCBRM
Cc1ccccc1C=C1C(=O)[N-]C(=O)N(c2ccc(Br)c(C)c2)C1=O	ZINC000408758221	570799981	/nfs/dbraw/zinc/79/99/81/570799981.db2.gz	HQOJSDFPKANHHH-XNTDXEJSSA-N	-1	0	399.244	3.732	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1ccccc1Cl	ZINC000408722374	231105754	/nfs/dbraw/zinc/10/57/54/231105754.db2.gz	HUIYIHQBDOAVLB-UKTHLTGXSA-N	-1	0	377.252	3.825	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1	ZINC000408803055	231115713	/nfs/dbraw/zinc/11/57/13/231115713.db2.gz	KTWHRAIIWYKZDT-MDWZMJQESA-N	-1	0	391.210	3.668	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccn3-c3ccc(F)cc3)C2=O)cc1	ZINC000408967392	231137839	/nfs/dbraw/zinc/13/78/39/231137839.db2.gz	VLELUCCGNMSWPY-CPNJWEJPSA-N	-1	0	389.386	3.591	40	10		GHCBRM
Cc1cccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)[N-]C2=S)c1C	ZINC000409148247	231172160	/nfs/dbraw/zinc/17/21/60/231172160.db2.gz	PELSBHBYTMMMTB-GZTJUZNOSA-N	-1	0	389.480	3.626	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C(C)C)cc3)C2=O)c(C)c1	ZINC000409234686	231184855	/nfs/dbraw/zinc/18/48/55/231184855.db2.gz	XEFLXVOVVZXWRP-XDHOZWIPSA-N	-1	0	394.496	3.958	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/c1cccs1	ZINC000409239928	231185078	/nfs/dbraw/zinc/18/50/78/231185078.db2.gz	ONBMCBFKIARFOR-XYOKQWHBSA-N	-1	0	382.388	3.598	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=S)N(c3ccccc3C)C2=O)c(C)n1C(C)(C)C	ZINC000409246594	231187673	/nfs/dbraw/zinc/18/76/73/231187673.db2.gz	JHEGMJSVAXLXJV-SFQUDFHCSA-N	-1	0	395.528	4.000	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N([C@H](CC)C(=O)[O-])C2=O)cc1OCC	ZINC000002700863	209378046	/nfs/dbraw/zinc/37/80/46/209378046.db2.gz	FBRFPKJWIBDEAF-DYTQJMLRSA-N	-1	0	395.502	3.548	40	10		GHCBRM
Cc1oc2c(ccc([O-])c2C[N@@H+]2CCC[C@H]2C(=O)[O-])c(=O)c1-c1ccc(F)cc1	ZINC000004029497	209231423	/nfs/dbraw/zinc/23/14/23/209231423.db2.gz	ZBEYEZOELOMFRG-KRWDZBQOSA-N	-1	0	397.402	3.662	40	10		GHCBRM
CC1=NN(c2ccc(Cl)c(C(=O)[O-])c2)C(=O)/C1=C\c1ccc([N+](=O)[O-])cc1	ZINC000096193253	211317299	/nfs/dbraw/zinc/31/72/99/211317299.db2.gz	MVBVMBNFCKGTDR-ZSOIEALJSA-N	-1	0	385.763	3.753	40	10		GHCBRM
Cc1cccc(/C=C2\SC(=S)N([C@H](Cc3ccccc3)C(=O)[O-])C2=O)c1	ZINC000005373480	570435964	/nfs/dbraw/zinc/43/59/64/570435964.db2.gz	HTWWZDSNWWCQHG-WISAJEAXSA-N	-1	0	383.494	3.892	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(Cl)cc1Cl	ZINC000005715306	570734521	/nfs/dbraw/zinc/73/45/21/570734521.db2.gz	YWQPRGLXVWHPIX-NTUHNPAUSA-N	-1	0	379.174	3.799	40	10		GHCBRM
O=C([O-])COc1cccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)c1	ZINC000016909758	570914963	/nfs/dbraw/zinc/91/49/63/570914963.db2.gz	OTODUKPCURNZIN-OQLLNIDSSA-N	-1	0	388.832	3.886	40	10		GHCBRM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C\c1cccn1-c1cccc(C(F)(F)F)c1	ZINC000108133431	856556013	/nfs/dbraw/zinc/55/60/13/856556013.db2.gz	BFQYDEBUNFYGTK-AQTBWJFISA-N	-1	0	397.356	3.958	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3cccc(C(F)(F)F)c3)C2=O)c1	ZINC000408782881	231114152	/nfs/dbraw/zinc/11/41/52/231114152.db2.gz	KYYYLILWFYSDEF-MHWRWJLKSA-N	-1	0	388.345	3.989	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)C2=O)c1	ZINC000408961875	231136041	/nfs/dbraw/zinc/13/60/41/231136041.db2.gz	PAUJMOWELSVHEC-RIYZIHGNSA-N	-1	0	399.790	3.531	40	10		GHCBRM
COc1ccc(/C=C/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3C)C2=O)cc1	ZINC000409231080	231184529	/nfs/dbraw/zinc/18/45/29/231184529.db2.gz	BFLMVVLAMMBMLQ-XPNFCJTCSA-N	-1	0	396.830	3.880	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C/c1ccsc1	ZINC000409235742	231185197	/nfs/dbraw/zinc/18/51/97/231185197.db2.gz	QDHKSRDRGHTMFP-WUXMJOGZSA-N	-1	0	382.388	3.598	40	10		GHCBRM
CCn1c(C)cc(/C=C2\C(=O)[N-]C(=S)N(c3ccccc3Cl)C2=O)c1C	ZINC000409245362	231186182	/nfs/dbraw/zinc/18/61/82/231186182.db2.gz	ROTCDXZDZAJKOA-GXDHUFHOSA-N	-1	0	387.892	3.610	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC(C)C)cc3)C2=O)cc1	ZINC000408986844	529662702	/nfs/dbraw/zinc/66/27/02/529662702.db2.gz	NKELJJPHROUDSD-UYRXBGFRSA-N	-1	0	378.428	3.703	40	10		GHCBRM
CC[C@@H](C)Oc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3cccnc3)C2=O)cc1Cl	ZINC000015013733	210142885	/nfs/dbraw/zinc/14/28/85/210142885.db2.gz	ATNCNVASFPJZIE-CDCQXCROSA-N	-1	0	399.834	3.579	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OC(C)C)C2=O)c1	ZINC000408817593	533673687	/nfs/dbraw/zinc/67/36/87/533673687.db2.gz	WHRGQLUTAWTEAM-SFQUDFHCSA-N	-1	0	378.428	3.757	40	10		GHCBRM
CCOc1cc(/C=C2\SC(=S)N(CC(=O)[O-])C2=O)ccc1O[C@@H](C)CC	ZINC000409335362	528197933	/nfs/dbraw/zinc/19/79/33/528197933.db2.gz	ZFVIKZDLNXJQRZ-GPILYODUSA-N	-1	0	395.502	3.548	40	10		GHCBRM
CCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000408797782	528767422	/nfs/dbraw/zinc/76/74/22/528767422.db2.gz	GZFZLFLLCSXJRB-FOWTUZBSSA-N	-1	0	384.819	3.795	40	10		GHCBRM
Cc1ccc(S(=O)(=O)[N-]c2ccc(C)c3c2C(=O)c2ccccc2C3=O)cc1	ZINC000003845297	570351569	/nfs/dbraw/zinc/35/15/69/570351569.db2.gz	HZNFZVLMRXZAME-UHFFFAOYSA-N	-1	0	391.448	3.880	40	10		GHCBRM
CCCC[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2cc(OC)ccc2OC)SC1=S	ZINC000005371390	570435465	/nfs/dbraw/zinc/43/54/65/570435465.db2.gz	QPKBHMSFKKBDLP-OJNRTJSBSA-N	-1	0	395.502	3.548	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(Cl)cc3Cl)C2=O)c(C)n1C	ZINC000408777204	570683785	/nfs/dbraw/zinc/68/37/85/570683785.db2.gz	WQTMRNNEHURWMG-NTUHNPAUSA-N	-1	0	392.242	3.615	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OCC(C)C)cc3)C2=O)cc1	ZINC000408784876	231114379	/nfs/dbraw/zinc/11/43/79/231114379.db2.gz	URTPJMATQKVUDJ-XDHOZWIPSA-N	-1	0	378.428	3.696	40	10		GHCBRM
COCCCN1C(=O)S/C(=C\c2ccc(-c3cccc(C(=O)[O-])c3)o2)C1=O	ZINC000409223053	231183520	/nfs/dbraw/zinc/18/35/20/231183520.db2.gz	YQKBVIAFPFGJBS-WJDWOHSUSA-N	-1	0	387.413	3.718	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)C(=O)[N-]C2=S)cc1Cl	ZINC000409242198	231186488	/nfs/dbraw/zinc/18/64/88/231186488.db2.gz	VJWIYOPTRDITRM-YBEGLDIGSA-N	-1	0	399.903	3.546	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=CNc2ccc(C)c(Cl)c2)C1=O	ZINC000408535168	529586739	/nfs/dbraw/zinc/58/67/39/529586739.db2.gz	XVAAGQUWTLURBX-RVDMUPIBSA-N	-1	0	383.835	3.790	40	10		GHCBRM
CCn1cc(/C=C2/C(=O)[N-]C(=S)N(c3cccc(F)c3)C2=O)c2ccccc21	ZINC000013546770	210067031	/nfs/dbraw/zinc/06/70/31/210067031.db2.gz	UGZTYOLWEYGNBE-YVLHZVERSA-N	-1	0	393.443	3.632	40	10		GHCBRM
COc1ccc(/C=C2\SC(=O)N([C@@H](C(=O)[O-])C(C)C)C2=S)cc1OC	ZINC000005171678	209575852	/nfs/dbraw/zinc/57/58/52/209575852.db2.gz	IETKGPSICQYDQT-YLHGKKIISA-N	-1	0	381.475	3.650	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)[N-]C2=S)c1	ZINC000409242175	533672537	/nfs/dbraw/zinc/67/25/37/533672537.db2.gz	NFYCDYOWOPJMAC-LDADJPATSA-N	-1	0	394.496	3.922	40	10		GHCBRM
CC1=NN(c2nnn[n-]2)C(=O)C1=Cc1ccc(-c2cc(Cl)ccc2Cl)o1	ZINC000012412857	570419196	/nfs/dbraw/zinc/41/91/96/570419196.db2.gz	NCMUPEKWOMUHJR-XFFZJAGNSA-N	-1	0	389.202	3.573	40	10		GHCBRM
CCOc1cc(C=C2C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)ccc1OC	ZINC000059135266	570650188	/nfs/dbraw/zinc/65/01/88/570650188.db2.gz	COEFPQQGVAYVPI-XNTDXEJSSA-N	-1	0	384.363	3.740	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc4c(c3)C[C@H](C)O4)C2=O)cc1Cl	ZINC000408710740	231102658	/nfs/dbraw/zinc/10/26/58/231102658.db2.gz	IAEMMOLWTBKECA-RGZVIEDOSA-N	-1	0	396.830	3.638	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3)C2=O)c(C)n1C1CCCC1	ZINC000408779285	231114161	/nfs/dbraw/zinc/11/41/61/231114161.db2.gz	UGPNJDBQUMHQRH-CPNJWEJPSA-N	-1	0	377.444	3.886	40	10		GHCBRM
Cc1cccc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)C(=O)[N-]C2=S)c1C	ZINC000409134749	231169464	/nfs/dbraw/zinc/16/94/64/231169464.db2.gz	TXIVVYDRCKCVPY-LDADJPATSA-N	-1	0	394.496	3.922	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=CNc2cccc3ccccc32)C1=O	ZINC000408534845	529586159	/nfs/dbraw/zinc/58/61/59/529586159.db2.gz	RLYGNOZABFHQEO-NBVRZTHBSA-N	-1	0	385.423	3.981	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2cc(Cl)cc(OC)c2)C1=O	ZINC000408873709	529586443	/nfs/dbraw/zinc/58/64/43/529586443.db2.gz	WKBWAKXGZPRSTP-YBEGLDIGSA-N	-1	0	384.819	3.577	40	10		GHCBRM
CC1=CC(C)(C)N(C)c2ccc(/C=C3/SC(=S)N(CC(=O)[O-])C3=O)cc21	ZINC000208441564	136202720	/nfs/dbraw/zinc/20/27/20/136202720.db2.gz	NZRVVTRDDCTTIP-OVCLIPMQSA-N	-1	0	388.514	3.604	40	10		GHCBRM
Cc1[n-]n(-c2cccc(C)c2)c(=O)c1C=Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000408529842	528150686	/nfs/dbraw/zinc/15/06/86/528150686.db2.gz	ICVQNDNURBWWFI-YVLHZVERSA-N	-1	0	381.348	3.530	40	10		GHCBRM
CCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(C)c(C)c2)C1=O	ZINC000408802080	528767628	/nfs/dbraw/zinc/76/76/28/528767628.db2.gz	CSLNFGSCJAHORB-QGOAFFKASA-N	-1	0	378.428	3.759	40	10		GHCBRM
CCCC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1=S	ZINC000005372165	570435719	/nfs/dbraw/zinc/43/57/19/570435719.db2.gz	CJUNOPFJYVQKME-ADVGAGMGSA-N	-1	0	378.519	3.597	40	10		GHCBRM
O=Cc1ccc(/C=C2\SC(=S)N([C@@H](C(=O)[O-])c3ccccc3)C2=O)cc1	ZINC000005375027	570436322	/nfs/dbraw/zinc/43/63/22/570436322.db2.gz	OASNUWFMEQCZFZ-DDITZMBXSA-N	-1	0	383.450	3.526	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cc(C)cc(C)c3)C2=O)cc1	ZINC000059426655	570656794	/nfs/dbraw/zinc/65/67/94/570656794.db2.gz	XKBAIFWKCYCLHO-XSFVSMFZSA-N	-1	0	391.471	3.816	40	10		GHCBRM
O=C([O-])/C(=C\c1ccc(N2CCOCC2)cc1)Sc1nc2ccccc2o1	ZINC000007365565	856545374	/nfs/dbraw/zinc/54/53/74/856545374.db2.gz	UHMZVBOLMURHOV-QGOAFFKASA-N	-1	0	382.441	3.882	40	10		GHCBRM
Cn1cc(C=C2SC(Nc3ccc(C(=O)[O-])cc3)=NC2=O)c2ccccc21	ZINC000016936531	230897383	/nfs/dbraw/zinc/89/73/83/230897383.db2.gz	VNVXGVRIPIUILP-YVLHZVERSA-N	-1	0	377.425	3.959	40	10		GHCBRM
Cc1cc(C=C2SC(=S)NC2=O)c(C)n1-c1cc(C(=O)[O-])ccc1Cl	ZINC000408996082	231143906	/nfs/dbraw/zinc/14/39/06/231143906.db2.gz	KVYNTKWQWRDVKT-AUWJEWJLSA-N	-1	0	392.889	3.935	40	10		GHCBRM
Cc1cc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C(C)C)cc3)C2=O)c(C)n1C	ZINC000409230152	231184121	/nfs/dbraw/zinc/18/41/21/231184121.db2.gz	BZYGTHMUXNDYBU-WOJGMQOQSA-N	-1	0	381.501	3.597	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccccc2Cl)C(=O)/C1=C/c1ccc(Cl)s1	ZINC000409247005	231187362	/nfs/dbraw/zinc/18/73/62/231187362.db2.gz	FSWYJCLHQCMHTM-VQHVLOKHSA-N	-1	0	383.281	3.886	40	10		GHCBRM
Cc1ccc(-n2cccc2/C=C2/C(=O)[N-]C(=O)N(C3CCCCC3)C2=O)cc1C	ZINC000015013870	210142698	/nfs/dbraw/zinc/14/26/98/210142698.db2.gz	SRDVITAISUKQJD-ZHZULCJRSA-N	-1	0	391.471	3.889	40	10		GHCBRM
CC[C@H](C)c1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N(C)C)cc3)C2=O)cc1	ZINC000002236582	212062416	/nfs/dbraw/zinc/06/24/16/212062416.db2.gz	RVSGHJRMKCMCIP-AUQXIXNCSA-N	-1	0	391.471	3.933	40	10		GHCBRM
CCOc1cc(/C=C2\SC(=S)N(CC(=O)[O-])C2=O)ccc1O[C@H](C)CC	ZINC000409335364	528197321	/nfs/dbraw/zinc/19/73/21/528197321.db2.gz	ZFVIKZDLNXJQRZ-PDICVPPASA-N	-1	0	395.502	3.548	40	10		GHCBRM
Cc1[n-]n(C(=O)c2ccncc2)c(=O)c1N=Nc1ccc(-c2ccc(N)cc2)cc1	ZINC000104204171	570299091	/nfs/dbraw/zinc/29/90/91/570299091.db2.gz	PVPHEEWBXNVLGB-ZELGORGJSA-N	-1	0	398.426	3.842	40	10		GHCBRM
CCCC[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(OC)c(OC)c2)SC1=S	ZINC000005371410	570435353	/nfs/dbraw/zinc/43/53/53/570435353.db2.gz	BZLYZMREXKUJIT-GQVHDAKQSA-N	-1	0	395.502	3.548	40	10		GHCBRM
O=C1[N-]N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cc(Cl)cc(Cl)c1[O-]	ZINC000005569764	570446850	/nfs/dbraw/zinc/44/68/50/570446850.db2.gz	MNKZNRNUAJMKEY-SDQBBNPISA-N	-1	0	383.618	3.814	40	10		GHCBRM
CCc1ccc(N2C(=O)/C(=C\c3cc(C)n(CC)c3C)C(=O)[N-]C2=S)cc1	ZINC000006006686	570463882	/nfs/dbraw/zinc/46/38/82/570463882.db2.gz	LDBOFENLMPMJGP-PDGQHHTCSA-N	-1	0	381.501	3.519	40	10		GHCBRM
CC(C)N1C(=O)[N-]C(=O)/C(=C/c2ccc(-c3cccc(C(F)(F)F)c3)o2)C1=O	ZINC000009323932	570555037	/nfs/dbraw/zinc/55/50/37/570555037.db2.gz	BFFXSYQSXOUFDI-ZROIWOOFSA-N	-1	0	392.333	3.836	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccco1	ZINC000059198512	570651707	/nfs/dbraw/zinc/65/17/07/570651707.db2.gz	OHVDHDZPXDLLCT-XYOKQWHBSA-N	-1	0	377.219	3.714	40	10		GHCBRM
Cc1ccc(N2[N-]C(=O)/C(=C\c3cccc(Br)c3)C2=O)cc1Cl	ZINC000059416947	570655474	/nfs/dbraw/zinc/65/54/74/570655474.db2.gz	QMZUKGXWUBUGHG-RIYZIHGNSA-N	-1	0	391.652	3.872	40	10		GHCBRM
O=C([O-])COc1ccc(C=C2SC(Nc3cccc(Cl)c3)=NC2=O)cc1	ZINC000016906616	570914929	/nfs/dbraw/zinc/91/49/29/570914929.db2.gz	STQXOJKJWZKLTL-OVCLIPMQSA-N	-1	0	388.832	3.886	40	10		GHCBRM
O=C([O-])COc1ccccc1/C=C1\SC(=S)N(c2ccccc2F)C1=O	ZINC000210432337	856566579	/nfs/dbraw/zinc/56/65/79/856566579.db2.gz	OYVNLVJIVZOFMD-DHDCSXOGSA-N	-1	0	389.429	3.695	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2)C(=O)/C1=C/c1ccc(-c2ccc(F)cc2F)o1	ZINC000408601601	231075427	/nfs/dbraw/zinc/07/54/27/231075427.db2.gz	KSDABLNBJFZRGY-LFIBNONCSA-N	-1	0	394.333	3.891	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)[N-]C2=S)c(C)c1	ZINC000408965584	231137534	/nfs/dbraw/zinc/13/75/34/231137534.db2.gz	JAQQVHNTNBNAHP-XYOKQWHBSA-N	-1	0	376.890	3.850	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)[N-]C2=S)c(C)c1	ZINC000409144532	231170879	/nfs/dbraw/zinc/17/08/79/231170879.db2.gz	OHWWERMXLPNWOE-GZTJUZNOSA-N	-1	0	389.480	3.626	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(Cl)cc3)C2=O)cc1	ZINC000016157349	210184308	/nfs/dbraw/zinc/18/43/08/210184308.db2.gz	YRVNGDOPTRPBPN-AQTBWJFISA-N	-1	0	397.862	3.853	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(CC)cc3)C2=O)cc1	ZINC000408817796	528640942	/nfs/dbraw/zinc/64/09/42/528640942.db2.gz	WHJMHHJURSHQFG-XMHGGMMESA-N	-1	0	378.428	3.704	40	10		GHCBRM
CCc1ccc(N2C(=O)C(=Cc3ccc(N(C)C)cc3)C(=O)[N-]C2=S)cc1	ZINC000033850385	856550543	/nfs/dbraw/zinc/55/05/43/856550543.db2.gz	HLGCEEBLEAIKOI-QGOAFFKASA-N	-1	0	379.485	3.987	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cccc(C)c3C)C2=O)o1	ZINC000204986893	856562923	/nfs/dbraw/zinc/56/29/23/856562923.db2.gz	WHBRLHOEMIDRNX-FOWTUZBSSA-N	-1	0	397.500	3.574	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Cl)cc3Cl)C2=O)c1	ZINC000408739559	231109821	/nfs/dbraw/zinc/10/98/21/231109821.db2.gz	CQVBITNCTLYZNP-RIYZIHGNSA-N	-1	0	375.211	3.968	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3Cl)C2=O)cc1Cl	ZINC000408803102	231115367	/nfs/dbraw/zinc/11/53/67/231115367.db2.gz	LGKPUGLVIXCPAR-DHZHZOJOSA-N	-1	0	391.210	3.668	40	10		GHCBRM
CC1=NN(c2ccc(Cl)c(C(=O)[O-])c2)C(=O)/C1=C\c1ccc2c(c1)OCO2	ZINC000013372260	210060980	/nfs/dbraw/zinc/06/09/80/210060980.db2.gz	QWYFDQIZFTZJLM-MLPAPPSSSA-N	-1	0	384.775	3.573	40	10		GHCBRM
CCCC[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(O)c(OCC)c2)SC1=S	ZINC000005372093	209590188	/nfs/dbraw/zinc/59/01/88/209590188.db2.gz	UHXLRUIWMIQOJE-GQVHDAKQSA-N	-1	0	395.502	3.636	40	10		GHCBRM
CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(C(=O)[O-])cc1	ZINC000409041318	528145453	/nfs/dbraw/zinc/14/54/53/528145453.db2.gz	UXOCFYISUKSWAB-UXBLZVDNSA-N	-1	0	396.271	3.886	40	10		GHCBRM
Nc1ccc2c(O)c(N=Nc3ccc([N+](=O)[O-])cc3)c(S(=O)(=O)[O-])cc2c1	ZINC000104366710	570301936	/nfs/dbraw/zinc/30/19/36/570301936.db2.gz	PEMFTJYWFHQQFA-HNENSFHCSA-N	-1	0	388.361	3.698	40	10		GHCBRM
O=C([O-])[C@H](Cc1ccccc1)N1C(=O)/C(=C\c2cccc(F)c2)SC1=S	ZINC000006061375	570465445	/nfs/dbraw/zinc/46/54/45/570465445.db2.gz	YOXUOPFXFNNIAV-KFXIKWRMSA-N	-1	0	387.457	3.723	40	10		GHCBRM
COc1ccc(S(=O)(=O)[N-]c2nc(-c3ccccc3)cs2)cc1OC	ZINC000007052469	570500580	/nfs/dbraw/zinc/50/05/80/570500580.db2.gz	BZVYORMGOFANOB-UHFFFAOYSA-N	-1	0	376.459	3.628	40	10		GHCBRM
Cc1cccc(COc2ccccc2/C=C2\SC(=S)N(CC(=O)[O-])C2=O)c1	ZINC000059272401	570653009	/nfs/dbraw/zinc/65/30/09/570653009.db2.gz	WJGDORGWYGDNEU-YVLHZVERSA-N	-1	0	399.493	3.860	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000059106200	570653417	/nfs/dbraw/zinc/65/34/17/570653417.db2.gz	NJVNFQMURMKVAD-MDWZMJQESA-N	-1	0	389.726	3.894	40	10		GHCBRM
CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2cccc(F)c2)C1=O	ZINC000409017277	529387380	/nfs/dbraw/zinc/38/73/80/529387380.db2.gz	LYGSAJRUTUOFDM-VVBXCHJUSA-N	-1	0	398.459	3.834	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=CNc3ccc(F)c(Cl)c3)C2=O)cc1C	ZINC000408534250	231052626	/nfs/dbraw/zinc/05/26/26/231052626.db2.gz	PYJQNHWALQVNGJ-NTEUORMPSA-N	-1	0	387.798	3.675	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1ccccc1	ZINC000408813896	231117825	/nfs/dbraw/zinc/11/78/25/231117825.db2.gz	YWAUAMIRHQFMJN-HMMYKYKNSA-N	-1	0	398.418	3.932	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl	ZINC000408919191	231131473	/nfs/dbraw/zinc/13/14/73/231131473.db2.gz	UPGOOSNCBIBTGP-QPEQYQDCSA-N	-1	0	395.242	3.964	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccccc2Cl)C(=O)/C1=C/c1ccc(O)c(Cl)c1	ZINC000409242132	231186254	/nfs/dbraw/zinc/18/62/54/231186254.db2.gz	MNDZGSGWCCDBSL-JXMROGBWSA-N	-1	0	393.251	3.530	40	10		GHCBRM
CCc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2ccc(OC(C)C)cc2)C1=O	ZINC000408874616	529586453	/nfs/dbraw/zinc/58/64/53/529586453.db2.gz	CODVRRVYIRCPOV-AQTBWJFISA-N	-1	0	378.428	3.703	40	10		GHCBRM
COc1cccc(/C=C2\C(=O)N(c3ccc(C(=O)[O-])cc3)N=C2C(F)(F)F)c1	ZINC000005880418	209620262	/nfs/dbraw/zinc/62/02/62/209620262.db2.gz	JMUDYJWYOKGUFO-GDNBJRDFSA-N	-1	0	390.317	3.742	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(C)c3C)C2=O)c1	ZINC000408878716	533944377	/nfs/dbraw/zinc/94/43/77/533944377.db2.gz	AMPDHUQYSURLQO-CXUHLZMHSA-N	-1	0	384.819	3.632	40	10		GHCBRM
Cc1ccc(Cl)cc1N1C(=O)[N-]C(=O)C(=Cc2cccc(Cl)c2)C1=O	ZINC000408867282	534145792	/nfs/dbraw/zinc/14/57/92/534145792.db2.gz	KHDCDKJFIOQYBW-RIYZIHGNSA-N	-1	0	375.211	3.968	40	10		GHCBRM
O=C([N-]N1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S)c1ccccc1F	ZINC000005552691	570445772	/nfs/dbraw/zinc/44/57/72/570445772.db2.gz	ZDBCJIXIPLTRGU-SXGWCWSVSA-N	-1	0	397.456	3.853	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC(C)C)cc3)C2=O)cc1C	ZINC000005753695	570455342	/nfs/dbraw/zinc/45/53/42/570455342.db2.gz	WXTSXPDFHLAVFY-XDHOZWIPSA-N	-1	0	378.428	3.757	40	10		GHCBRM
O=C([O-])COc1ccccc1C=C1SC(Nc2ccc(Cl)cc2)=NC1=O	ZINC000108267648	856555747	/nfs/dbraw/zinc/55/57/47/856555747.db2.gz	CEKGKGGKKVFPLV-DHDCSXOGSA-N	-1	0	388.832	3.886	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccccc1Cl	ZINC000408723657	231106043	/nfs/dbraw/zinc/10/60/43/231106043.db2.gz	ZBTRKAGTCOVSNB-MDWZMJQESA-N	-1	0	377.252	3.825	40	10		GHCBRM
CCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(Cl)c2C)C1=O	ZINC000408809874	231117359	/nfs/dbraw/zinc/11/73/59/231117359.db2.gz	SKTDVRVAECDEAV-SDNWHVSQSA-N	-1	0	384.819	3.714	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)c2ccccc12	ZINC000408842686	231120580	/nfs/dbraw/zinc/12/05/80/231120580.db2.gz	BXOXPCGHYXGUMS-LDADJPATSA-N	-1	0	390.370	3.654	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1c(F)cccc1Cl	ZINC000408787858	231114676	/nfs/dbraw/zinc/11/46/76/231114676.db2.gz	AIGWVLYBCGJFBT-XYOKQWHBSA-N	-1	0	379.174	3.799	40	10		GHCBRM
COC(=O)c1ccc(N=C(C)c2c(C)[n-]n(-c3ccc(OC)cc3)c2=O)cc1	ZINC000012651840	221217046	/nfs/dbraw/zinc/21/70/46/221217046.db2.gz	CQBBINNXBUWCBQ-CPNJWEJPSA-N	-1	0	379.416	3.590	40	10		GHCBRM
CCOc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)c1	ZINC000408876945	528288672	/nfs/dbraw/zinc/28/86/72/528288672.db2.gz	RXDZPRRLPJRDJV-LICLKQGHSA-N	-1	0	384.819	3.714	40	10		GHCBRM
COc1cc(C=C2C(=O)[N-]C(=O)NC2=O)ccc1OCc1c(C)cc(C)cc1C	ZINC000059305951	858284039	/nfs/dbraw/zinc/28/40/39/858284039.db2.gz	UMODXUILVRYJJQ-UHFFFAOYSA-N	-1	0	394.427	3.789	40	10		GHCBRM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccccc2C(=O)c2ccccc2)c1	ZINC000196028230	909006094	/nfs/dbraw/zinc/00/60/94/909006094.db2.gz	UWSBAGSVUGOFOQ-UHFFFAOYSA-N	-1	0	397.452	3.736	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc4c(c3)C[C@@H](C)O4)C2=O)cc1Cl	ZINC000408710739	231102640	/nfs/dbraw/zinc/10/26/40/231102640.db2.gz	IAEMMOLWTBKECA-GFQQVXNGSA-N	-1	0	396.830	3.638	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(OCc3ccccc3)cc2)C(=O)/C1=C/c1ccco1	ZINC000409211874	231181572	/nfs/dbraw/zinc/18/15/72/231181572.db2.gz	OLFQFWMNIYBSPU-CPNJWEJPSA-N	-1	0	388.379	3.525	40	10		GHCBRM
O=Cc1ccc(/C=C2\SC(=S)N([C@H](C(=O)[O-])c3ccccc3)C2=O)cc1	ZINC000005375026	220863121	/nfs/dbraw/zinc/86/31/21/220863121.db2.gz	OASNUWFMEQCZFZ-IZNAZMGOSA-N	-1	0	383.450	3.526	40	10		GHCBRM
COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccc(C(=O)[O-])cc1	ZINC000409024271	533266461	/nfs/dbraw/zinc/26/64/61/533266461.db2.gz	PAPSYUYQTYWKGY-UNOMPAQXSA-N	-1	0	391.423	3.879	40	10		GHCBRM
COc1cc(OC)c(C=C2C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)c(OC)c1	ZINC000001192754	136196209	/nfs/dbraw/zinc/19/62/09/136196209.db2.gz	HZMLTXQOYUIQMT-LFIBNONCSA-N	-1	0	396.399	3.528	40	10		GHCBRM
Cc1ccc(CN2C(=O)/C(=C/c3ccccc3OCC(=O)[O-])SC2=S)cc1	ZINC000409055519	533909438	/nfs/dbraw/zinc/90/94/38/533909438.db2.gz	ZCEVPGAAKWAAGG-YVLHZVERSA-N	-1	0	399.493	3.860	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(OCC)cc3)C2=O)cc1	ZINC000408814618	528640868	/nfs/dbraw/zinc/64/08/68/528640868.db2.gz	ZLWNOBLDIGLBAX-XMHGGMMESA-N	-1	0	394.427	3.541	40	10		GHCBRM
CCOc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1	ZINC000408990755	570689752	/nfs/dbraw/zinc/68/97/52/570689752.db2.gz	YLQKPAKVOZJJIU-YBEGLDIGSA-N	-1	0	384.819	3.714	40	10		GHCBRM
CCOC(=O)c1c(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])sc2c1CC[C@@H](C)C2	ZINC000004662490	570988902	/nfs/dbraw/zinc/98/89/02/570988902.db2.gz	KNTLMNCJNFJXAY-AGIUHOORSA-N	-1	0	393.505	3.879	40	10		GHCBRM
O=C1[N-]N(c2ccc(Br)cc2)C(=O)/C1=C\c1c(F)cccc1Cl	ZINC000003038710	862132497	/nfs/dbraw/zinc/13/24/97/862132497.db2.gz	MRXBCWUWZORWDQ-WQLSENKSSA-N	-1	0	395.615	3.703	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1cccc(O)c1	ZINC000408851273	231121402	/nfs/dbraw/zinc/12/14/02/231121402.db2.gz	XCQTXMIQBDFIDU-DHZHZOJOSA-N	-1	0	393.251	3.530	40	10		GHCBRM
Cc1cc(C=C2SC(=S)NC2=O)c(C)n1-c1ccc(Cl)c(C(=O)[O-])c1	ZINC000408999017	231144643	/nfs/dbraw/zinc/14/46/43/231144643.db2.gz	RDMZVXWCBZFDAT-NSIKDUERSA-N	-1	0	392.889	3.935	40	10		GHCBRM
Cc1ccccc1-n1cccc1/C=C1/C(=O)[N-]C(=O)N(C2CCCCC2)C1=O	ZINC000015013880	221326455	/nfs/dbraw/zinc/32/64/55/221326455.db2.gz	ZQDGMUDZLHLWTN-JXAWBTAJSA-N	-1	0	377.444	3.580	40	10		GHCBRM
COc1cccc(C=C2C(=O)[N-]C(=S)N(c3ccc(C)cc3)C2=O)c1OC	ZINC000001197601	136196129	/nfs/dbraw/zinc/19/61/29/136196129.db2.gz	FJNUNQIPYBJWDD-RVDMUPIBSA-N	-1	0	382.441	3.684	40	10		GHCBRM
CCCC1=NN(c2ccc(C(=O)[O-])cc2)C(=O)/C1=C/c1cccc(OC)c1O	ZINC000036617190	528065001	/nfs/dbraw/zinc/06/50/01/528065001.db2.gz	DVVJMJVYPODEEZ-FOWTUZBSSA-N	-1	0	380.400	3.685	40	10		GHCBRM
CCOc1cc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3)C2=O)ccc1OC(C)C	ZINC000408817919	528195866	/nfs/dbraw/zinc/19/58/66/528195866.db2.gz	WPBHFHIASBDSFJ-SFQUDFHCSA-N	-1	0	394.427	3.539	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(Cl)cc3)C2=O)c1	ZINC000408941441	528731370	/nfs/dbraw/zinc/73/13/70/528731370.db2.gz	WOXINMONFFTKJO-ATVHPVEESA-N	-1	0	384.819	3.795	40	10		GHCBRM
COc1ccc(N2C(=O)C(=Cc3ccc(N4CCCC4)o3)C(=O)[N-]C2=S)cc1	ZINC000059138538	570650691	/nfs/dbraw/zinc/65/06/91/570650691.db2.gz	QLFYIKHQFOGGEE-FOWTUZBSSA-N	-1	0	397.456	3.560	40	10		GHCBRM
COc1ccc(C=C2SC(Nc3cc(C(=O)[O-])ccc3C)=NC2=O)c(OC)c1	ZINC000054164266	570676026	/nfs/dbraw/zinc/67/60/26/570676026.db2.gz	ROZYRRARLJDOPT-MFOYZWKCSA-N	-1	0	398.440	3.793	40	10		GHCBRM
CCCCc1ccc(-n2c(C)cc(/C=C3/C(=O)[N-]C(=O)N(C)C3=O)c2C)cc1	ZINC000408991414	570690123	/nfs/dbraw/zinc/69/01/23/570690123.db2.gz	NYJCJTUHVWLJSB-UYRXBGFRSA-N	-1	0	379.460	3.528	40	10		GHCBRM
Cc1cc(/C=C2/NC(=O)[N-]C2=O)c(C)n1-c1ccc(OCc2ccccc2)cc1	ZINC000409053422	570696621	/nfs/dbraw/zinc/69/66/21/570696621.db2.gz	CLVCPIWIEXSCDL-FYJGNVAPSA-N	-1	0	387.439	3.853	40	10		GHCBRM
Cn1cc(C=C2SC(Nc3cccc(C(=O)[O-])c3)=NC2=O)c2ccccc21	ZINC000016936384	570914938	/nfs/dbraw/zinc/91/49/38/570914938.db2.gz	CBRSIQLEHANWCQ-YVLHZVERSA-N	-1	0	377.425	3.959	40	10		GHCBRM
O=C([O-])c1ccccc1/C=C1/SC(=S)N(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000113830666	231022915	/nfs/dbraw/zinc/02/29/15/231022915.db2.gz	VAWGYIYMSFBMKM-NTEUORMPSA-N	-1	0	386.410	3.699	40	10		GHCBRM
Cc1cc(C)c(N2C(=O)[N-]C(=O)C(=CNc3ccc(C)c(C)c3)C2=O)c(C)c1	ZINC000408535903	231053829	/nfs/dbraw/zinc/05/38/29/231053829.db2.gz	UNURBJHNMXDIKX-WOJGMQOQSA-N	-1	0	377.444	3.808	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccn3-c3ccccc3F)C2=O)cc1	ZINC000408963768	231136952	/nfs/dbraw/zinc/13/69/52/231136952.db2.gz	PDNXKLDTKVPSNB-GHRIWEEISA-N	-1	0	389.386	3.591	40	10		GHCBRM
COc1cccc(/C=C2\SC(=S)N([C@H](C(=O)[O-])c3ccccc3)C2=O)c1	ZINC000012032584	221145179	/nfs/dbraw/zinc/14/51/79/221145179.db2.gz	YBJFBVHJAYUQFB-QZFKAFNDSA-N	-1	0	385.466	3.722	40	10		GHCBRM
CCN(CC)c1ccc(C=C2C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)c(O)c1	ZINC000001306513	136196412	/nfs/dbraw/zinc/19/64/12/136196412.db2.gz	AEPIAYPXCREJCK-GZTJUZNOSA-N	-1	0	397.406	3.884	40	10		GHCBRM
CC(C)c1ccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)C(=O)[N-]C2=S)cc1	ZINC000409246536	528108531	/nfs/dbraw/zinc/10/85/31/528108531.db2.gz	CNAFXOJMKJYBLQ-UYRXBGFRSA-N	-1	0	393.512	3.707	40	10		GHCBRM
CC(C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3)C2=O)cc1	ZINC000408812256	528131296	/nfs/dbraw/zinc/13/12/96/528131296.db2.gz	SABXHKPJFWGTPB-LICLKQGHSA-N	-1	0	384.819	3.794	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C)cc3)C2=O)cc1	ZINC000408741088	528293039	/nfs/dbraw/zinc/29/30/39/528293039.db2.gz	KCHVISPKCFIOIM-XMHGGMMESA-N	-1	0	393.512	3.673	40	10		GHCBRM
CCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cc(C)ccc2C)C1=O	ZINC000408806467	528767715	/nfs/dbraw/zinc/76/77/15/528767715.db2.gz	DZDOQTRQYLCYSC-GHRIWEEISA-N	-1	0	378.428	3.759	40	10		GHCBRM
CCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccccc2Cl)C1=O	ZINC000408807500	528768161	/nfs/dbraw/zinc/76/81/61/528768161.db2.gz	DARZJFKNTYYCCM-WYMLVPIESA-N	-1	0	384.819	3.795	40	10		GHCBRM
CC[C@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2cccc(F)c2)C1=O	ZINC000409017274	529197322	/nfs/dbraw/zinc/19/73/22/529197322.db2.gz	LYGSAJRUTUOFDM-HNEYUBDGSA-N	-1	0	398.459	3.834	40	10		GHCBRM
Cc1[n-]n(C(=O)c2ccncc2)c(=O)c1N=Nc1ccc(-c2ccc(N)cc2)cc1	ZINC000104204174	570299128	/nfs/dbraw/zinc/29/91/28/570299128.db2.gz	PVPHEEWBXNVLGB-RMBMZXQHSA-N	-1	0	398.426	3.842	40	10		GHCBRM
Cc1ccccc1/C=C1\SC(=S)N([C@H](Cc2ccccc2)C(=O)[O-])C1=O	ZINC000005373430	570435966	/nfs/dbraw/zinc/43/59/66/570435966.db2.gz	IPFTYYJDJFWZSW-WISAJEAXSA-N	-1	0	383.494	3.892	40	10		GHCBRM
CC[C@H]1CCc2c(sc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)[O-])c2C(=O)OC)C1	ZINC000005476953	570441274	/nfs/dbraw/zinc/44/12/74/570441274.db2.gz	RSSRWUKYZJVTQJ-XQQFMLRXSA-N	-1	0	393.505	3.879	40	10		GHCBRM
COc1cc(C=C2SC(Nc3ccc(C)cc3)=NC2=O)ccc1OCC(=O)[O-]	ZINC000210455294	856566212	/nfs/dbraw/zinc/56/62/12/856566212.db2.gz	LBQYEJWIMQOGFX-YVLHZVERSA-N	-1	0	398.440	3.549	40	10		GHCBRM
Cc1cc(/C=C2/SC(=O)N(CC(=O)[O-])C2=O)c(C)n1-c1cc(C)cc(C)c1	ZINC000409134134	231169008	/nfs/dbraw/zinc/16/90/08/231169008.db2.gz	MWFZKJHZEDWADI-RQZCQDPDSA-N	-1	0	384.457	3.832	40	10		GHCBRM
CCOc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2cc(C)ccc2C)C1=O	ZINC000409238476	231185103	/nfs/dbraw/zinc/18/51/03/231185103.db2.gz	DNASDQCZXJLJSG-FOWTUZBSSA-N	-1	0	380.469	3.533	40	10		GHCBRM
O=C([O-])CN1C(=O)/C(=C\c2ccc(Sc3ccccc3)o2)SC1=S	ZINC000409330658	231190978	/nfs/dbraw/zinc/19/09/78/231190978.db2.gz	LPIZEDDYBMEMFB-XYOKQWHBSA-N	-1	0	377.468	3.717	40	10		GHCBRM
COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccccc1C(=O)[O-]	ZINC000409071711	533268820	/nfs/dbraw/zinc/26/88/20/533268820.db2.gz	PFHSFXYZJIFXJL-PTNGSMBKSA-N	-1	0	397.814	3.915	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=CNc3ccc(Cl)cc3Cl)C2=O)c1	ZINC000100925625	136189382	/nfs/dbraw/zinc/18/93/82/136189382.db2.gz	RRYMXVDNEVNWPH-LCYFTJDESA-N	-1	0	390.226	3.881	40	10		GHCBRM
CCCCOc1ccccc1/C=C1\SC(=S)N(CCCC(=O)[O-])C1=O	ZINC000026510012	221642655	/nfs/dbraw/zinc/64/26/55/221642655.db2.gz	GWSPVTRDTHMIBV-QINSGFPZSA-N	-1	0	379.503	3.932	40	10		GHCBRM
O=C([O-])COc1ccccc1/C=C1\SC(=S)N(Cc2ccccc2)C1=O	ZINC000034112361	221798854	/nfs/dbraw/zinc/79/88/54/221798854.db2.gz	FITRSAHBWUEVJS-YBEGLDIGSA-N	-1	0	385.466	3.551	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3cc(C)cc(C)c3)C2=O)cc1	ZINC000408985837	528641285	/nfs/dbraw/zinc/64/12/85/528641285.db2.gz	BEKXORBVRZNLJP-CPNJWEJPSA-N	-1	0	394.496	3.924	40	10		GHCBRM
CCCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OCC)cc3)C2=O)cc1	ZINC000408896664	528696806	/nfs/dbraw/zinc/69/68/06/528696806.db2.gz	HARCQXSCPHXKSN-RGEXLXHISA-N	-1	0	394.427	3.541	40	10		GHCBRM
COc1ccc(N2C(=O)/C(=C\c3cc(C)n(C(C)C)c3C)C(=O)[N-]C2=S)cc1	ZINC000001160757	570251726	/nfs/dbraw/zinc/25/17/26/570251726.db2.gz	IHBNIZRKHNMYKG-WQRHYEAKSA-N	-1	0	397.500	3.526	40	10		GHCBRM
COc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)c2ccccc2)cc1F	ZINC000223655601	570477073	/nfs/dbraw/zinc/47/70/73/570477073.db2.gz	LVNVCGPYIVJXHH-UHFFFAOYSA-N	-1	0	385.416	3.866	40	10		GHCBRM
COc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1C	ZINC000408990341	570689787	/nfs/dbraw/zinc/68/97/87/570689787.db2.gz	XBIUBSJVLREGLY-DHDCSXOGSA-N	-1	0	384.819	3.632	40	10		GHCBRM
CCOc1ccc(-n2c(C)cc(C=C3C(=O)[N-]C(=O)N(CC)C3=O)c2C)cc1	ZINC000005947711	570736629	/nfs/dbraw/zinc/73/66/29/570736629.db2.gz	HOJRRUYLPQQGCK-LDADJPATSA-N	-1	0	381.432	3.815	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3ccccc3OCC(=O)[O-])SC2=S)cc1	ZINC000210431932	856566101	/nfs/dbraw/zinc/56/61/01/856566101.db2.gz	DISHKCSSWOMNGD-YBEGLDIGSA-N	-1	0	385.466	3.864	40	10		GHCBRM
Cc1cc(C)c(N2C(=O)[N-]C(=O)C(=CNc3ccccc3Cl)C2=O)c(C)c1	ZINC000408532929	231052868	/nfs/dbraw/zinc/05/28/68/231052868.db2.gz	NCGJSPJKLWLBIX-GXDHUFHOSA-N	-1	0	383.835	3.844	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(F)cc1	ZINC000408859548	231122784	/nfs/dbraw/zinc/12/27/84/231122784.db2.gz	XYGZIKYZVVJSPX-DHZHZOJOSA-N	-1	0	395.242	3.964	40	10		GHCBRM
COc1ccc(/C=C/C=C2\C(=O)[N-]C(=O)N(c3ccc(Cl)cc3)C2=O)cc1	ZINC000408961488	231136243	/nfs/dbraw/zinc/13/62/43/231136243.db2.gz	MPPGASYRLHNXPU-GFJWLWTISA-N	-1	0	382.803	3.571	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(Cl)s1	ZINC000408967140	231138550	/nfs/dbraw/zinc/13/85/50/231138550.db2.gz	QATMUFNVKQJIPK-YRNVUSSQSA-N	-1	0	383.281	3.886	40	10		GHCBRM
Cc1cccc(N2C(=O)/C(=C/c3c[nH]c4ccccc34)C(=O)[N-]C2=S)c1C	ZINC000409137097	231170125	/nfs/dbraw/zinc/17/01/25/231170125.db2.gz	TXPOTBMIWUWJCA-MHWRWJLKSA-N	-1	0	375.453	3.616	40	10		GHCBRM
O=C([O-])COc1cccc(/C=C2/C(=O)N(c3ccccc3)N=C2c2ccccc2)c1	ZINC000409081018	231156323	/nfs/dbraw/zinc/15/63/23/231156323.db2.gz	OYLXYVHRSLCQOO-RCCKNPSSSA-N	-1	0	398.418	3.985	40	10		GHCBRM
CCc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CC(=O)[O-])C3=O)c2C)cc1	ZINC000409129492	529579588	/nfs/dbraw/zinc/57/95/88/529579588.db2.gz	JZDKWTJCXCMXJG-LICLKQGHSA-N	-1	0	384.457	3.777	40	10		GHCBRM
O=C([O-])C[C@H](c1ccccc1)N1C(=O)/C(=C\c2cccc(O)c2)SC1=S	ZINC000006061830	220917300	/nfs/dbraw/zinc/91/73/00/220917300.db2.gz	ZBJMXVOFRVUGRG-VGVSSDJJSA-N	-1	0	385.466	3.809	40	10		GHCBRM
COc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(C)c1	ZINC000408988824	533240137	/nfs/dbraw/zinc/24/01/37/533240137.db2.gz	RRNBEMHVSFPNAD-SXGWCWSVSA-N	-1	0	384.819	3.632	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cn(C)c4ccccc34)C2=O)cc1Cl	ZINC000005797506	136196819	/nfs/dbraw/zinc/19/68/19/136196819.db2.gz	VOMXDUKVZLWMPV-SXGWCWSVSA-N	-1	0	393.830	3.807	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC(C)C)cc3)C2=O)c1	ZINC000408819172	533673765	/nfs/dbraw/zinc/67/37/65/533673765.db2.gz	YJZFCKHVQLKJQG-LDADJPATSA-N	-1	0	378.428	3.757	40	10		GHCBRM
O=C([O-])c1ccc(N2C(=O)/C(=C/c3cnc4ccccc4n3)SC2=S)cc1	ZINC000054361183	222013179	/nfs/dbraw/zinc/01/31/79/222013179.db2.gz	ASFIZTONCTXEEV-SXGWCWSVSA-N	-1	0	393.449	3.734	40	10		GHCBRM
CCOc1c(Cl)cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)cc1Cl	ZINC000409400082	528167684	/nfs/dbraw/zinc/16/76/84/528167684.db2.gz	OOQCHKNRLHSPQK-JYRVWZFOSA-N	-1	0	377.227	3.854	40	10		GHCBRM
CC(C)Oc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccccc2Cl)C1=O	ZINC000408801749	528244722	/nfs/dbraw/zinc/24/47/22/528244722.db2.gz	BKBLCOONAZNUOC-SDNWHVSQSA-N	-1	0	384.819	3.794	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=S)N(c3ccccc3)C2=O)cc1Cl	ZINC000408769102	528369534	/nfs/dbraw/zinc/36/95/34/528369534.db2.gz	NWSZCFZMYFRCQO-GXDHUFHOSA-N	-1	0	386.860	3.570	40	10		GHCBRM
CCCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OCC)C2=O)cc1	ZINC000408900791	528696014	/nfs/dbraw/zinc/69/60/14/528696014.db2.gz	VBQXNRGLQCFVTH-JXAWBTAJSA-N	-1	0	394.427	3.541	40	10		GHCBRM
COC(=O)c1ccc(/C=C2\SC(=S)N(c3cccc(C(=O)[O-])c3)C2=O)cc1	ZINC000004342044	570369664	/nfs/dbraw/zinc/36/96/64/570369664.db2.gz	YYJPISKOPJUFCR-DHDCSXOGSA-N	-1	0	399.449	3.577	40	10		GHCBRM
Cc1ccc(Sc2ccc(C=C3C(=O)[N-]C(=O)NC3=O)cc2[N+](=O)[O-])cc1	ZINC000006814854	570494977	/nfs/dbraw/zinc/49/49/77/570494977.db2.gz	VSUMFUYHPWHLMK-UHFFFAOYSA-N	-1	0	383.385	3.644	40	10		GHCBRM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc(Cl)cc1C(=O)c1ccccc1	ZINC000224370205	570510957	/nfs/dbraw/zinc/51/09/57/570510957.db2.gz	XFDRWQAMEPMTSD-UHFFFAOYSA-N	-1	0	390.848	3.977	40	10		GHCBRM
Cc1nn(C)c(C)c1N=Cc1c(C)[n-]n(-c2ccc(Br)cc2)c1=O	ZINC000408756127	570545423	/nfs/dbraw/zinc/54/54/23/570545423.db2.gz	HRULRIJRLNHNLZ-OQLLNIDSSA-N	-1	0	388.269	3.518	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3cccc(Cl)c3)C2=O)c1	ZINC000408936510	570687477	/nfs/dbraw/zinc/68/74/77/570687477.db2.gz	KRBRSOCGYXVQLK-BOPFTXTBSA-N	-1	0	384.819	3.795	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccccc1F	ZINC000408854685	231121480	/nfs/dbraw/zinc/12/14/80/231121480.db2.gz	BHTJSWFFEGQFNR-CSKARUKUSA-N	-1	0	395.242	3.964	40	10		GHCBRM
Cn1cc(/C=C2/SC(=S)N([N-]C(=O)c3cccs3)C2=O)c2ccccc21	ZINC000409347332	231194117	/nfs/dbraw/zinc/19/41/17/231194117.db2.gz	PQCVGOGIHWPKTA-OQLLNIDSSA-N	-1	0	399.522	3.786	40	10		GHCBRM
Cc1cccc(N2C(=O)/C(=C\c3ccc(Cl)s3)C(=O)[N-]C2=S)c1C	ZINC000009263200	221076105	/nfs/dbraw/zinc/07/61/05/221076105.db2.gz	IHDNUVGKYNQOPB-WQLSENKSSA-N	-1	0	376.890	3.850	40	10		GHCBRM
COc1c(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3ccccc3)C2=O)cc1Cl	ZINC000409043912	533422423	/nfs/dbraw/zinc/42/24/23/533422423.db2.gz	ABCINPWMDPJPNQ-KPKJPENVSA-N	-1	0	391.210	3.668	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=CC=Cc3ccccc3[N+](=O)[O-])C2=O)cc1	ZINC000001192716	136196157	/nfs/dbraw/zinc/19/61/57/136196157.db2.gz	DUKFVQOOMKTADZ-ANSBUGDOSA-N	-1	0	377.356	3.966	40	10		GHCBRM
O=C([O-])c1cccc(N2C(=O)/C(=C/c3ccc4nccnc4c3)SC2=S)c1	ZINC000054361140	222014087	/nfs/dbraw/zinc/01/40/87/222014087.db2.gz	MIWPTZOROZRDJT-SXGWCWSVSA-N	-1	0	393.449	3.734	40	10		GHCBRM
Cc1ccc(Cl)cc1N1C(=O)[N-]C(=O)C(=Cc2ccc3c(c2)C[C@H](C)O3)C1=O	ZINC000408710846	534146562	/nfs/dbraw/zinc/14/65/62/534146562.db2.gz	PJNCAQODUHJLQF-RGZVIEDOSA-N	-1	0	396.830	3.638	40	10		GHCBRM
CC1(C)Cc2cc(/C=C3\C(=O)[N-]C(=O)N(c4cccc(Cl)c4)C3=O)ccc2O1	ZINC000408710865	527771214	/nfs/dbraw/zinc/77/12/14/527771214.db2.gz	QTURPIYPGMZFKG-CXUHLZMHSA-N	-1	0	396.830	3.720	40	10		GHCBRM
CCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3C)C2=O)cc1	ZINC000408796041	528369399	/nfs/dbraw/zinc/36/93/99/528369399.db2.gz	CTYZNXBRFZNBBT-RVDMUPIBSA-N	-1	0	384.819	3.714	40	10		GHCBRM
CC(C)Cn1cc(/C=C2/C(=O)[N-]C(=O)N(C3CCCC3)C2=O)c2ccccc21	ZINC000409204053	528698451	/nfs/dbraw/zinc/69/84/51/528698451.db2.gz	CEVAONHVBIILIT-WQRHYEAKSA-N	-1	0	379.460	3.702	40	10		GHCBRM
CC[C@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)cc1	ZINC000408897442	529191839	/nfs/dbraw/zinc/19/18/39/529191839.db2.gz	JHEUIINQPJRVIH-SJPXOZHESA-N	-1	0	378.428	3.839	40	10		GHCBRM
CCOc1cc(C=C2C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)ccc1OC	ZINC000001200331	535658173	/nfs/dbraw/zinc/65/81/73/535658173.db2.gz	WTIRMSSTAUJXBI-LFIBNONCSA-N	-1	0	380.400	3.909	40	10		GHCBRM
O=C1[N-]N(c2ccccc2)C(=O)/C1=C\c1ccccc1OCc1cccc(F)c1	ZINC000035225058	570418415	/nfs/dbraw/zinc/41/84/15/570418415.db2.gz	QFZPCQKBZDRAEG-ZHZULCJRSA-N	-1	0	388.398	3.866	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2)C(=O)C1=Cc1ccc(O)c(Br)c1	ZINC000027904382	570444814	/nfs/dbraw/zinc/44/48/14/570444814.db2.gz	IUOZDNVNFMBUQU-WQLSENKSSA-N	-1	0	387.189	3.661	40	10		GHCBRM
O=C([O-])CCN1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S	ZINC000009188433	570551260	/nfs/dbraw/zinc/55/12/60/570551260.db2.gz	JEQNWFPZLMSWHW-ATVHPVEESA-N	-1	0	399.493	3.942	40	10		GHCBRM
COc1ccc(C=C2C(=O)[N-]C(=O)N(c3cc(C)cc(C)c3)C2=O)cc1[N+](=O)[O-]	ZINC000016269115	570920091	/nfs/dbraw/zinc/92/00/91/570920091.db2.gz	DNQVMWGTQJDOAU-DHDCSXOGSA-N	-1	0	395.371	3.727	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OCC(C)C)cc3)C2=O)cc1	ZINC000408981310	529662510	/nfs/dbraw/zinc/66/25/10/529662510.db2.gz	APNOOLJFGIARHW-MOSHPQCFSA-N	-1	0	392.455	3.950	40	10		GHCBRM
COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccccc1C(=O)[O-]	ZINC000409071104	533265775	/nfs/dbraw/zinc/26/57/75/533265775.db2.gz	ONCOISGYZKUFBT-RGEXLXHISA-N	-1	0	395.455	3.948	40	10		GHCBRM
O=C([O-])c1cccc(N2C(=O)/C(=C/c3cnc4ccccc4n3)SC2=S)c1	ZINC000054361182	222014412	/nfs/dbraw/zinc/01/44/12/222014412.db2.gz	SXQXLLCDVMUPMB-SXGWCWSVSA-N	-1	0	393.449	3.734	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=S)N(c3ccc(C)c(C)c3)C2=O)o1	ZINC000408811215	528293502	/nfs/dbraw/zinc/29/35/02/528293502.db2.gz	KVIKZQQDOXOJJW-SFQUDFHCSA-N	-1	0	397.500	3.574	40	10		GHCBRM
CCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(C)c2C)C1=O	ZINC000408809162	528767955	/nfs/dbraw/zinc/76/79/55/528767955.db2.gz	KLKLPXSDYYVQJG-GHRIWEEISA-N	-1	0	378.428	3.759	40	10		GHCBRM
CCOC(=O)c1c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)[O-])sc2c1CC[C@@H](C)C2	ZINC000005020623	570424244	/nfs/dbraw/zinc/42/42/44/570424244.db2.gz	UFWMPQNXIXEGJU-FRRDWIJNSA-N	-1	0	391.489	3.655	40	10		GHCBRM
Cc1ccc(C(=O)[O-])cc1N1C(=O)/C(=C/c2nc3ccccc3[nH]2)SC1=S	ZINC000005235968	570432098	/nfs/dbraw/zinc/43/20/98/570432098.db2.gz	FICGVQVINDYENS-DHDCSXOGSA-N	-1	0	395.465	3.975	40	10		GHCBRM
O=C([O-])c1cc(N2C(=O)/C(=C/c3ccccc3F)SC2=S)ccc1O	ZINC000005374140	570435974	/nfs/dbraw/zinc/43/59/74/570435974.db2.gz	IITGTYKZOBZCNA-AUWJEWJLSA-N	-1	0	375.402	3.635	40	10		GHCBRM
Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C(=O)[N-]N(c3ccccc3)C2=O)o1	ZINC000027831247	570444162	/nfs/dbraw/zinc/44/41/62/570444162.db2.gz	RCEHNRFSZCAYTL-LDADJPATSA-N	-1	0	389.367	3.625	40	10		GHCBRM
CCOc1cccc(N2C(=O)[N-]C(=O)C(=Cc3cc(C)c(O)c(C)c3)C2=O)c1	ZINC000038172793	856551497	/nfs/dbraw/zinc/55/14/97/856551497.db2.gz	XAAIWKSAJAWJFY-LICLKQGHSA-N	-1	0	380.400	3.914	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2Cl)C(=O)/C1=C/c1c(O)ccc2ccccc12	ZINC000408898094	231125860	/nfs/dbraw/zinc/12/58/60/231125860.db2.gz	ULTRKDNWCJAZTL-RVDMUPIBSA-N	-1	0	392.798	3.865	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)[N-]C2=S)c1	ZINC000408968453	231137896	/nfs/dbraw/zinc/13/78/96/231137896.db2.gz	YYESHVIZQQONEW-MDWZMJQESA-N	-1	0	376.890	3.850	40	10		GHCBRM
CCOc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2cc(C)cc(C)c2)C1=O	ZINC000408988705	231143133	/nfs/dbraw/zinc/14/31/33/231143133.db2.gz	IXPKYPAEFFFORP-SFQUDFHCSA-N	-1	0	380.469	3.533	40	10		GHCBRM
CCOc1ccccc1N1C(=O)[N-]C(=O)C(=Cc2ccccc2OC(C)C)C1=O	ZINC000409230512	231184783	/nfs/dbraw/zinc/18/47/83/231184783.db2.gz	DZLQVDZYVQSKMN-DTQAZKPQSA-N	-1	0	394.427	3.539	40	10		GHCBRM
CCc1ccccc1-n1c(C)cc(/C=C2\SC(=O)N(CC(=O)[O-])C2=O)c1C	ZINC000408966403	529559120	/nfs/dbraw/zinc/55/91/20/529559120.db2.gz	LKPCRJFZJFBNJV-YVLHZVERSA-N	-1	0	384.457	3.777	40	10		GHCBRM
Cc1ccc(C(=O)[O-])cc1NC1=NC(=O)C(=Cc2nc3ccccc3n2C)S1	ZINC000020227150	221478967	/nfs/dbraw/zinc/47/89/67/221478967.db2.gz	JLBKVRNOYDROQC-MHWRWJLKSA-N	-1	0	392.440	3.662	40	10		GHCBRM
COc1cc(Cl)cc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3)C2=O)c1	ZINC000408867045	533945342	/nfs/dbraw/zinc/94/53/42/533945342.db2.gz	JAIQXDAPFGJOFI-VIZOYTHASA-N	-1	0	391.210	3.668	40	10		GHCBRM
Cc1ccc(-n2cccc2/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)cc1	ZINC000408966582	534239719	/nfs/dbraw/zinc/23/97/19/534239719.db2.gz	PHEKLGCVGSWPJI-XSFVSMFZSA-N	-1	0	385.423	3.761	40	10		GHCBRM
CCOc1cc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)ccc1O[C@@H](C)CC	ZINC000409409940	528194373	/nfs/dbraw/zinc/19/43/73/528194373.db2.gz	XXVNSEJGEAESCC-LUJRCDHRSA-N	-1	0	380.444	3.724	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cc(C)ccc3C)C2=O)cc1	ZINC000408805582	528640820	/nfs/dbraw/zinc/64/08/20/528640820.db2.gz	GZEDRPDTKJYXOQ-QGOAFFKASA-N	-1	0	378.428	3.759	40	10		GHCBRM
O=C([O-])CCCCCN1C(=O)/C(=C\c2cc(Cl)ccc2O)SC1=S	ZINC000002798633	570989389	/nfs/dbraw/zinc/98/93/89/570989389.db2.gz	OVTJEZNVVSKFIN-UKTHLTGXSA-N	-1	0	385.894	3.892	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3cccn3-c3ccccc3)C(=O)[N-]C2=S)cc1	ZINC000408856475	231122850	/nfs/dbraw/zinc/12/28/50/231122850.db2.gz	KBHSAPFCLIFSMG-XMHGGMMESA-N	-1	0	387.464	3.617	40	10		GHCBRM
Cc1c(Cl)cccc1N1C(=O)[N-]C(=O)C(=Cc2cccc(Cl)c2)C1=O	ZINC000408868809	231123322	/nfs/dbraw/zinc/12/33/22/231123322.db2.gz	OXYDKBNMOOSFQK-UKTHLTGXSA-N	-1	0	375.211	3.968	40	10		GHCBRM
Cc1cc(C)cc(Cc2ccc3ccccc3c2C=C2C(=O)[N-]C(=O)NC2=O)c1	ZINC000408867521	231124074	/nfs/dbraw/zinc/12/40/74/231124074.db2.gz	LJDNEIDQKQADDC-UHFFFAOYSA-N	-1	0	384.435	3.797	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCC4)cc3)C2=O)cc1	ZINC000408961333	529662172	/nfs/dbraw/zinc/66/21/72/529662172.db2.gz	RQLRYPXUXIYHNP-HMMYKYKNSA-N	-1	0	389.455	3.516	40	10		GHCBRM
CCc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3Br)C2=O)cc1	ZINC000408984214	529662620	/nfs/dbraw/zinc/66/26/20/529662620.db2.gz	IGNBMVKWHADSLS-PTNGSMBKSA-N	-1	0	399.244	3.678	40	10		GHCBRM
COc1cccc(/C=C2\SC(=S)N([C@@H](C(=O)[O-])c3ccccc3)C2=O)c1	ZINC000012032583	221144777	/nfs/dbraw/zinc/14/47/77/221144777.db2.gz	YBJFBVHJAYUQFB-UVQBRAAOSA-N	-1	0	385.466	3.722	40	10		GHCBRM
Cc1ccc(C)c(N2C(=O)[N-]C(=O)C(=Cc3cccc(Br)c3)C2=O)c1	ZINC000408869846	533674910	/nfs/dbraw/zinc/67/49/10/533674910.db2.gz	UILXIJOMXOXEKO-XNTDXEJSSA-N	-1	0	399.244	3.732	40	10		GHCBRM
Cc1[n-]n(-c2ccccc2)c(=O)c1C=C1SC(=S)N(c2ccccc2)C1=O	ZINC000408902121	528151948	/nfs/dbraw/zinc/15/19/48/528151948.db2.gz	KJPBVTLVGOGHIJ-WLSWZUKCSA-N	-1	0	393.493	3.974	40	10		GHCBRM
COc1cccc(/C=C2\SC(=S)N(c3ccc(C(=O)[O-])c(O)c3)C2=O)c1	ZINC000005373615	570435957	/nfs/dbraw/zinc/43/59/57/570435957.db2.gz	LEQWKCQVZKOQHG-NVNXTCNLSA-N	-1	0	387.438	3.505	40	10		GHCBRM
CC[C@@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)cc3)C2=O)cc1	ZINC000408897439	529383003	/nfs/dbraw/zinc/38/30/03/529383003.db2.gz	JHEUIINQPJRVIH-DQPIFXJKSA-N	-1	0	378.428	3.839	40	10		GHCBRM
Cc1ccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)[N-]C2=S)cc1C	ZINC000408818636	231118528	/nfs/dbraw/zinc/11/85/28/231118528.db2.gz	PWCBKQMHULLFDJ-WOJGMQOQSA-N	-1	0	389.480	3.626	40	10		GHCBRM
Cc1c(C=C2C(=O)[N-]C(=O)N(c3cccc(C)c3C)C2=O)c2ccccc2n1C	ZINC000408850317	231122009	/nfs/dbraw/zinc/12/20/09/231122009.db2.gz	LFBKWFLJMODNTA-PDGQHHTCSA-N	-1	0	387.439	3.770	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Cl)c([N+](=O)[O-])c3)C2=O)cc1C	ZINC000408859127	231122970	/nfs/dbraw/zinc/12/29/70/231122970.db2.gz	SYRMYCHKIJVION-RIYZIHGNSA-N	-1	0	399.790	3.531	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(-c2ccccc2)o1	ZINC000409013451	231147107	/nfs/dbraw/zinc/14/71/07/231147107.db2.gz	ABYBJIPEUNOXGI-SFQUDFHCSA-N	-1	0	392.411	3.917	40	10		GHCBRM
COc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(Cl)c3C)C2=O)c(C)c1	ZINC000409242158	231186580	/nfs/dbraw/zinc/18/65/80/231186580.db2.gz	NBJBMLGZMSBBFZ-XNTDXEJSSA-N	-1	0	384.819	3.632	40	10		GHCBRM
COc1ccc(CCN2C(=O)/C(=C\c3ccc(C(=O)[O-])cc3)SC2=S)cc1	ZINC000035040227	221810842	/nfs/dbraw/zinc/81/08/42/221810842.db2.gz	HWOXHZJCKBDENM-SFQUDFHCSA-N	-1	0	399.493	3.837	40	10		GHCBRM
CCOc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(CC)cc2)C1=O	ZINC000408803414	528471295	/nfs/dbraw/zinc/47/12/95/528471295.db2.gz	OPTFJBYDGIPOTB-SFQUDFHCSA-N	-1	0	398.846	3.968	40	10		GHCBRM
CCCC[C@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(OC)cc2OC)SC1=S	ZINC000005371365	570435496	/nfs/dbraw/zinc/43/54/96/570435496.db2.gz	XTWYRRIJMBWDTD-MLJKTZRHSA-N	-1	0	395.502	3.548	40	10		GHCBRM
CCCC[C@@H](C(=O)[O-])N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1=S	ZINC000005372163	570435624	/nfs/dbraw/zinc/43/56/24/570435624.db2.gz	CJUNOPFJYVQKME-XFNCEPBJSA-N	-1	0	378.519	3.597	40	10		GHCBRM
CC[C@H]1CCc2c(sc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)[O-])c2C(=O)OC)C1	ZINC000005476954	570441226	/nfs/dbraw/zinc/44/12/26/570441226.db2.gz	RSSRWUKYZJVTQJ-AVGNSLFASA-N	-1	0	393.505	3.879	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Cl)cc3)C2=O)cc1Cl	ZINC000408990249	570689732	/nfs/dbraw/zinc/68/97/32/570689732.db2.gz	WMCUYJPEUUIYMB-ZSOIEALJSA-N	-1	0	375.211	3.968	40	10		GHCBRM
COc1ccc(-n2[n-]c(C)c(C=Nc3c(C)cc(C)cc3[N+](=O)[O-])c2=O)cc1	ZINC000016267612	570920160	/nfs/dbraw/zinc/92/01/60/570920160.db2.gz	MUWFNNTUCWYOIQ-BOPFTXTBSA-N	-1	0	380.404	3.939	40	10		GHCBRM
Cc1ccc(C(=O)Oc2ccccc2/C=C2\C(=O)[N-]N(c3ccccc3)C2=O)cc1	ZINC000033584803	856547468	/nfs/dbraw/zinc/54/74/68/856547468.db2.gz	YWEUGVBINFXIPG-HMMYKYKNSA-N	-1	0	398.418	3.676	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(F)cc2)C(=O)/C1=C\c1cccc(C(F)(F)F)c1	ZINC000111504728	231021382	/nfs/dbraw/zinc/02/13/82/231021382.db2.gz	GGVNRDUEOMWHSO-ZROIWOOFSA-N	-1	0	394.349	3.676	40	10		GHCBRM
Cc1cc(C)c(N2C(=O)[N-]C(=O)C(=CNc3cccc(C)c3C)C2=O)c(C)c1	ZINC000408535650	231054395	/nfs/dbraw/zinc/05/43/95/231054395.db2.gz	UCUCXQCYXOGPQL-GZTJUZNOSA-N	-1	0	377.444	3.808	40	10		GHCBRM
Cc1cccc(N2C(=O)[N-]C(=O)C(=Cc3c(O)ccc4ccccc34)C2=O)c1C	ZINC000408891322	231124630	/nfs/dbraw/zinc/12/46/30/231124630.db2.gz	OOGASIFRCSEHRN-LDADJPATSA-N	-1	0	386.407	3.829	40	10		GHCBRM
O=C1/C(=C\c2cc([N+](=O)[O-])ccc2[O-])C(C(F)(F)F)=NN1c1ccccc1	ZINC000408973771	231138747	/nfs/dbraw/zinc/13/87/47/231138747.db2.gz	UYMXFTMUQGRYOU-LCYFTJDESA-N	-1	0	377.278	3.649	40	10		GHCBRM
COc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3cc(C)cc(C)c3)C2=O)cc1Cl	ZINC000408780883	533240740	/nfs/dbraw/zinc/24/07/40/533240740.db2.gz	MQBBEPXBUVSRBY-DHDCSXOGSA-N	-1	0	384.819	3.632	40	10		GHCBRM
CCOc1cc(Cl)cc(/C=C2/C(=O)[N-]C(=O)N(c3ccccc3CC)C2=O)c1	ZINC000408874334	528288637	/nfs/dbraw/zinc/28/86/37/528288637.db2.gz	AFGBOYVMVTWFTA-BOPFTXTBSA-N	-1	0	398.846	3.968	40	10		GHCBRM
CCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OC(C)C)C2=O)cc1	ZINC000408804276	528482453	/nfs/dbraw/zinc/48/24/53/528482453.db2.gz	WYJKGWVOXWDELK-QGOAFFKASA-N	-1	0	394.427	3.539	40	10		GHCBRM
CCCOc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccccc3CC)C2=O)cc1	ZINC000408875878	528640607	/nfs/dbraw/zinc/64/06/07/528640607.db2.gz	LWYVPCNJDYAXNU-JXAWBTAJSA-N	-1	0	378.428	3.704	40	10		GHCBRM
CC[C@H](C)Oc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3cccc(F)c3)C2=O)cc1	ZINC000408914541	529191857	/nfs/dbraw/zinc/19/18/57/529191857.db2.gz	YJQGZSJTJVWHIR-FHXOWUIVSA-N	-1	0	382.391	3.669	40	10		GHCBRM
CCN1C(=O)[N-]C(=O)/C(=C\c2ccc(-c3cc(Cl)ccc3Cl)o2)C1=O	ZINC000059109622	570653856	/nfs/dbraw/zinc/65/38/56/570653856.db2.gz	WHEKMJGDNNEFHA-XYOKQWHBSA-N	-1	0	379.199	3.735	40	10		GHCBRM
Cc1c(/C=C2/C(=O)[N-]C(=S)N(c3ccccc3C)C2=O)c2ccccc2n1C	ZINC000059302813	570655106	/nfs/dbraw/zinc/65/51/06/570655106.db2.gz	IZHQFCZOESDDER-ATVHPVEESA-N	-1	0	389.480	3.626	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(Br)cc3)C2=O)cc1C	ZINC000059336681	570655204	/nfs/dbraw/zinc/65/52/04/570655204.db2.gz	FXVLSMVSJLSPNX-MHWRWJLKSA-N	-1	0	399.244	3.732	40	10		GHCBRM
CCc1ccc(NC2=NC(=O)C(=Cc3ccccc3OCC(=O)[O-])S2)cc1	ZINC000005794726	570735929	/nfs/dbraw/zinc/73/59/29/570735929.db2.gz	AXUGHYBTRLROBW-BOPFTXTBSA-N	-1	0	382.441	3.795	40	10		GHCBRM
O=C1[N-]C(=S)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(C(F)(F)F)cc1	ZINC000001098504	570987410	/nfs/dbraw/zinc/98/74/10/570987410.db2.gz	XSMDNNPUUGUTQS-NTEUORMPSA-N	-1	0	394.349	3.676	40	10		GHCBRM
N#Cc1ccccc1COc1cccc(/C=C2/C(=O)[N-]N(c3ccccc3)C2=O)c1	ZINC000035132712	856551734	/nfs/dbraw/zinc/55/17/34/856551734.db2.gz	AVTZMGTVEBMOOS-HMAPJEAMSA-N	-1	0	395.418	3.599	40	10		GHCBRM
Cc1ccc(NC2=NC(=O)C(=Cc3ccc(O[C@@H](C)C(=O)[O-])cc3)S2)cc1	ZINC000210836591	856566137	/nfs/dbraw/zinc/56/61/37/856566137.db2.gz	UXZMRJURIWHVGJ-MFVBVHDHSA-N	-1	0	382.441	3.929	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(N4CCCCC4)cc3)C2=O)cc1	ZINC000408901768	231127710	/nfs/dbraw/zinc/12/77/10/231127710.db2.gz	ZVRIZPDJEILYLE-HMMYKYKNSA-N	-1	0	389.455	3.652	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(C)c([N+](=O)[O-])c3)C2=O)cc1Cl	ZINC000408987986	231142016	/nfs/dbraw/zinc/14/20/16/231142016.db2.gz	QAWAHJDCQMPKKH-AUWJEWJLSA-N	-1	0	399.790	3.531	40	10		GHCBRM
CCOc1ccccc1/C=C1\C(=O)[N-]C(=S)N(c2cccc(C)c2C)C1=O	ZINC000409124322	231167114	/nfs/dbraw/zinc/16/71/14/231167114.db2.gz	BAEAZGJSVLYXDC-FOWTUZBSSA-N	-1	0	380.469	3.533	40	10		GHCBRM
Cc1c(Cl)cccc1N1C(=O)/C(=C\c2ccc(N(C)C)cc2)C(=O)[N-]C1=S	ZINC000409108220	231162870	/nfs/dbraw/zinc/16/28/70/231162870.db2.gz	SJXNMDAZKMPFOS-PTNGSMBKSA-N	-1	0	399.903	3.546	40	10		GHCBRM
O=C([N-]N1C(=O)/C(=C\c2ccc(Cl)cc2)SC1=S)c1cccs1	ZINC000409342473	231192808	/nfs/dbraw/zinc/19/28/08/231192808.db2.gz	FFNLLGJUZUGESO-XYOKQWHBSA-N	-1	0	380.903	3.948	40	10		GHCBRM
O=C1[N-]N(c2ccc(F)c(Cl)c2)C(=O)/C1=C\c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000005749356	220896838	/nfs/dbraw/zinc/89/68/38/220896838.db2.gz	HYQUAGYUSRYQBT-YHYXMXQVSA-N	-1	0	396.161	3.502	40	10		GHCBRM
C[C@@H](N1C(=O)[N-]C(=O)/C(=C\c2cccs2)C1=O)C12CC3CC(CC(C3)C1)C2	ZINC000016576084	221364476	/nfs/dbraw/zinc/36/44/76/221364476.db2.gz	KFXYLMXZWGPGMO-OMJVHFJTSA-N	-1	0	384.501	3.815	40	10		GHCBRM
Cc1[n-]n(-c2ccccc2)c(=O)c1C=C1SC(=S)N(c2ccccc2)C1=O	ZINC000408902120	528151257	/nfs/dbraw/zinc/15/12/57/528151257.db2.gz	KJPBVTLVGOGHIJ-QRYYFKOISA-N	-1	0	393.493	3.974	40	10		GHCBRM
CCOc1ccc2ccccc2c1/C=C1/C(=O)[N-]C(=O)N(C2CCCC2)C1=O	ZINC000409196517	528624880	/nfs/dbraw/zinc/62/48/80/528624880.db2.gz	ONPFPWFOFALAGZ-AQTBWJFISA-N	-1	0	378.428	3.643	40	10		GHCBRM
CCCCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(OC)cc3)C2=O)cc1	ZINC000408899726	528677695	/nfs/dbraw/zinc/67/76/95/528677695.db2.gz	QBOLGYZGLCBXGP-RGEXLXHISA-N	-1	0	394.427	3.541	40	10		GHCBRM
CCCOc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(Cl)c2)C1=O	ZINC000408807775	528767204	/nfs/dbraw/zinc/76/72/04/528767204.db2.gz	OREOSHRTINICOS-LFIBNONCSA-N	-1	0	384.819	3.795	40	10		GHCBRM
O=C([O-])COc1ccc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)cc1	ZINC000001157970	570250490	/nfs/dbraw/zinc/25/04/90/570250490.db2.gz	FIXLWAQZIGIRGY-YBEGLDIGSA-N	-1	0	385.466	3.551	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N([C@@H](CC)C(=O)[O-])C2=O)cc1OCC	ZINC000002700861	570295746	/nfs/dbraw/zinc/29/57/46/570295746.db2.gz	FBRFPKJWIBDEAF-GQVHDAKQSA-N	-1	0	395.502	3.548	40	10		GHCBRM
COc1ccc(-c2csc([N-]S(=O)(=O)c3ccc(C)cc3)n2)cc1N	ZINC000217686506	570320273	/nfs/dbraw/zinc/32/02/73/570320273.db2.gz	IBXYLRDKFZTNBO-UHFFFAOYSA-N	-1	0	375.475	3.510	40	10		GHCBRM
COc1ccc2ccccc2c1/C=C1\C(=O)[N-]N(c2ccc(Cl)cc2)C1=O	ZINC000000859648	570497936	/nfs/dbraw/zinc/49/79/36/570497936.db2.gz	PYNCSKTWUGLVCT-LDADJPATSA-N	-1	0	378.815	3.963	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)/C1=C\c1cccc(C(F)(F)F)c1	ZINC000005756902	570995576	/nfs/dbraw/zinc/99/55/76/570995576.db2.gz	KCYKPBLCCQAUDI-ZROIWOOFSA-N	-1	0	378.281	3.511	40	10		GHCBRM
O=C([N-]N1C(=O)/C(=C\c2cccc(Cl)c2)SC1=S)c1cccs1	ZINC000409329406	231191113	/nfs/dbraw/zinc/19/11/13/231191113.db2.gz	FKDGGOXCWQJFQC-XYOKQWHBSA-N	-1	0	380.903	3.948	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccccc2Cl)C(=O)C1=CNc1ccc(Cl)cc1	ZINC000100401391	136196053	/nfs/dbraw/zinc/19/60/53/136196053.db2.gz	LRKLZUNILLTGKW-FMIVXFBMSA-N	-1	0	376.199	3.572	40	10		GHCBRM
CCOc1ccc2ccccc2c1/C=C1/C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000408741225	528624232	/nfs/dbraw/zinc/62/42/32/528624232.db2.gz	ONDMEIZRBLYHFG-RGEXLXHISA-N	-1	0	386.407	3.905	40	10		GHCBRM
CCOc1cccc(N2C(=O)/C(=C/c3ccc(Cl)s3)C(=O)[N-]C2=S)c1	ZINC000408966645	528659603	/nfs/dbraw/zinc/65/96/03/528659603.db2.gz	NGVQKSQOBIZZHQ-UKTHLTGXSA-N	-1	0	392.889	3.632	40	10		GHCBRM
CCCCOc1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccccc3OC)C2=O)cc1	ZINC000408899349	528677794	/nfs/dbraw/zinc/67/77/94/528677794.db2.gz	OPOIKSVKNVOYHY-JXAWBTAJSA-N	-1	0	394.427	3.541	40	10		GHCBRM
CC(C)C[C@H](C(=O)[O-])N1C(=O)/C(=C/c2cn(C)c3ccccc23)SC1=S	ZINC000005371541	570435491	/nfs/dbraw/zinc/43/54/91/570435491.db2.gz	QSOPYXJVMUYCLE-AVIKPIRVSA-N	-1	0	388.514	3.879	40	10		GHCBRM
CCN(CC)c1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)c(C)c3)C2=O)cc1	ZINC000408772880	570682322	/nfs/dbraw/zinc/68/23/22/570682322.db2.gz	IRYZAASMXRJDRQ-XSFVSMFZSA-N	-1	0	391.471	3.816	40	10		GHCBRM
O=C([O-])CN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S	ZINC000001238457	570987516	/nfs/dbraw/zinc/98/75/16/570987516.db2.gz	KDHQPBOMSXIRRL-YBEGLDIGSA-N	-1	0	385.466	3.551	40	10		GHCBRM
CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)[N-]C(=O)N(c2ccc(F)cc2)C1=O	ZINC000408903653	529387051	/nfs/dbraw/zinc/38/70/51/529387051.db2.gz	VKWHDNCWBDJNAF-LVLBFHFTSA-N	-1	0	382.391	3.669	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cc([N+](=O)[O-])ccc3Cl)C2=O)cc1C	ZINC000408851520	231121972	/nfs/dbraw/zinc/12/19/72/231121972.db2.gz	CJEBWPUJNCWHQV-OQLLNIDSSA-N	-1	0	399.790	3.531	40	10		GHCBRM
O=C1[N-]C(=S)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1cccc(F)c1	ZINC000408856228	231122993	/nfs/dbraw/zinc/12/29/93/231122993.db2.gz	JOMLCSIWBKGVKQ-DHZHZOJOSA-N	-1	0	395.242	3.964	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3c(O)ccc4ccccc34)C2=O)c(C)c1	ZINC000408897142	231125895	/nfs/dbraw/zinc/12/58/95/231125895.db2.gz	WCMMAFLJHHSESS-LDADJPATSA-N	-1	0	386.407	3.829	40	10		GHCBRM
Cc1cc(C)cc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)C(=O)[N-]C2=S)c1	ZINC000408812965	231117089	/nfs/dbraw/zinc/11/70/89/231117089.db2.gz	CFPLUUWSFGNMOF-WOJGMQOQSA-N	-1	0	389.480	3.626	40	10		GHCBRM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cccn3-c3ccccc3C)C2=O)cc1	ZINC000408966094	231137527	/nfs/dbraw/zinc/13/75/27/231137527.db2.gz	MUFNQWXZOYDKMC-XMHGGMMESA-N	-1	0	385.423	3.761	40	10		GHCBRM
CC1=NN(c2ccc(C(=O)[O-])cc2)C(=O)/C1=C/c1ccc(N2CCCC2)cc1	ZINC000100469106	212116319	/nfs/dbraw/zinc/11/63/19/212116319.db2.gz	JREMZRTXUOLJDI-XSFVSMFZSA-N	-1	0	375.428	3.791	40	10		GHCBRM
COc1ccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(C)c(C)c3)C2=O)cc1Cl	ZINC000408781565	533240479	/nfs/dbraw/zinc/24/04/79/533240479.db2.gz	BUWKBHWAXGEPKC-DHDCSXOGSA-N	-1	0	384.819	3.632	40	10		GHCBRM
COc1ccc(-n2[n-]c(C)c(C(C)=Nc3cc(OC)ccc3OC)c2=O)cc1	ZINC000112121154	534021496	/nfs/dbraw/zinc/02/14/96/534021496.db2.gz	YFTQSEDFPVAFFG-MOSHPQCFSA-N	-1	0	381.432	3.821	40	10		GHCBRM
CCOc1cc(C)c(/C=C2\C(=O)[N-]C(=O)N(c3ccncc3)C2=O)cc1C(C)C	ZINC000409391498	528239853	/nfs/dbraw/zinc/23/98/53/528239853.db2.gz	IHTGSEFKQJOXDT-LDADJPATSA-N	-1	0	393.443	3.579	40	10		GHCBRM
CCOc1cc(Cl)cc(/C=C2/C(=O)[N-]C(=O)N(c3ccccc3F)C2=O)c1	ZINC000408872103	528288610	/nfs/dbraw/zinc/28/86/10/528288610.db2.gz	KLAYXGRANMGQHR-ZROIWOOFSA-N	-1	0	388.782	3.544	40	10		GHCBRM
O=C([O-])[C@H](Cc1ccccc1)N1C(=O)/C(=C/c2ccccc2F)SC1=S	ZINC000005374129	570435990	/nfs/dbraw/zinc/43/59/90/570435990.db2.gz	SYUMGYJBXUIHIZ-CNYBTUBUSA-N	-1	0	387.457	3.723	40	10		GHCBRM
CCOc1ccc(-c2ccc(C=C3SC(=S)NC3=O)o2)cc1[N+](=O)[O-]	ZINC000005713803	570452648	/nfs/dbraw/zinc/45/26/48/570452648.db2.gz	ASZKTBAXZSWZLT-RIYZIHGNSA-N	-1	0	376.415	3.742	40	10		GHCBRM
CC[C@H](C)Oc1ccccc1/C=C1/C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000032193770	570509994	/nfs/dbraw/zinc/50/99/94/570509994.db2.gz	XECZFUXVSQMNCW-LUJRCDHRSA-N	-1	0	378.428	3.839	40	10		GHCBRM
CCCCN1C(=O)/C(=C\c2cc(OCC)c([O-])c([N+](=O)[O-])c2)SC1=S	ZINC000036617151	570892896	/nfs/dbraw/zinc/89/28/96/570892896.db2.gz	LCIKLDLSWGKZGG-UKTHLTGXSA-N	-1	0	382.463	3.700	40	10		GHCBRM
COCCN1C(=O)S/C(=C/c2ccc(-c3cccc(C(=O)[O-])c3C)o2)C1=O	ZINC000409146426	231170802	/nfs/dbraw/zinc/17/08/02/231170802.db2.gz	UAXKZNSMNKZNNV-MHWRWJLKSA-N	-1	0	387.413	3.636	40	10		GHCBRM
COc1cc(N2N=C(C)C(=CNc3cccc(C(=O)[O-])c3)C2=O)ccc1Cl	ZINC000408537144	532961198	/nfs/dbraw/zinc/96/11/98/532961198.db2.gz	ZIDJKCZIERBPNW-GDNBJRDFSA-N	-1	0	385.807	3.765	40	10		GHCBRM
CCOc1ccc(/C=C2\SC(=S)N(CCCCCC(=O)[O-])C2=O)cc1	ZINC000012504545	221200496	/nfs/dbraw/zinc/20/04/96/221200496.db2.gz	QBMFDYUYKLOXHK-QINSGFPZSA-N	-1	0	379.503	3.932	40	10		GHCBRM
COc1ccc(Cl)cc1/C=C1\C(=O)[N-]C(=O)N(c2cccc(Cl)c2)C1=O	ZINC000408802874	533833334	/nfs/dbraw/zinc/83/33/34/533833334.db2.gz	IPPCBDRMKIURRW-RIYZIHGNSA-N	-1	0	391.210	3.668	40	10		GHCBRM
CCCCCCOc1c(Cl)cc(C=C2C(=O)[N-]C(=O)NC2=O)cc1Cl	ZINC000408538402	528147294	/nfs/dbraw/zinc/14/72/94/528147294.db2.gz	MHIMFDWLYNKODT-UHFFFAOYSA-N	-1	0	385.247	3.702	40	10		GHCBRM
CCCOc1ccc(/C=C2\C(=O)[N-]C(=O)N(c3ccc(C)cc3C)C2=O)cc1	ZINC000408803558	528640784	/nfs/dbraw/zinc/64/07/84/528640784.db2.gz	QLNDQZVDHHASFX-QGOAFFKASA-N	-1	0	378.428	3.759	40	10		GHCBRM
CCOc1cc(C=C2SC(Nc3cc(C(=O)[O-])ccc3C)=NC2=O)ccc1O	ZINC000020227043	570249106	/nfs/dbraw/zinc/24/91/06/570249106.db2.gz	WXEIMIYTWMKYBV-MFOYZWKCSA-N	-1	0	398.440	3.880	40	10		GHCBRM
CCC1=NN2C(=NC(=O)/C(=C/c3ccc(-c4ccc(C(=O)[O-])cc4)o3)C2=N)S1	ZINC000005857341	570459093	/nfs/dbraw/zinc/45/90/93/570459093.db2.gz	MTHVSMCZGXHTMW-ILUQACKLSA-N	-1	0	394.412	3.674	40	10		GHCBRM
CCCOc1ccc(C=C2C(=O)[N-]C(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000032101755	570508497	/nfs/dbraw/zinc/50/84/97/570508497.db2.gz	FVPDMQKBGSCKEU-ATVHPVEESA-N	-1	0	395.371	3.890	40	10		GHCBRM
COc1ccc(NS(=O)(=O)c2ccc(-n3c(C)ccc3C)cc2)c(OC)c1	ZINC000058850508	570648208	/nfs/dbraw/zinc/64/82/08/570648208.db2.gz	DQQDQGVSYABVFP-UHFFFAOYSA-N	-1	0	386.473	3.912	40	10		GHCBRM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000059135083	570650219	/nfs/dbraw/zinc/65/02/19/570650219.db2.gz	RGFZYUOCBPMZHX-KPKJPENVSA-N	-1	0	389.726	3.894	40	10		GHCBRM
CCCOc1cccc(/C=C2/C(=O)[N-]C(=O)N(c3ccc(CC)cc3)C2=O)c1	ZINC000408933525	570686806	/nfs/dbraw/zinc/68/68/06/570686806.db2.gz	ANDICYGAKIMJQQ-RGEXLXHISA-N	-1	0	378.428	3.704	40	10		GHCBRM