smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[N-]C(=S)N(Cc2ccc(F)cc2)C(=O)C1=CNc1cccc(C(F)(F)F)c1	ZINC000013511886	558535624	/nfs/dbraw/zinc/53/56/24/558535624.db2.gz	VKBZZMLZXPNZHY-OQLLNIDSSA-N	-1	1	423.391	3.584	50	10		HHCAMM
Cc1ccccc1N1C(=O)C(=Cc2ccc(O[C@H](C)C(=O)[O-])cc2)C(=O)NC1=S	ZINC000016362872	558788082	/nfs/dbraw/zinc/78/80/82/558788082.db2.gz	FRQCAOQWRLVDTN-YYTPVVGHSA-N	-1	1	410.451	3.519	50	10		HHCAMM
Cc1[n-]n(-c2cccc(Cl)c2)c(=O)c1C=Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000095471471	568626588	/nfs/dbraw/zinc/62/65/88/568626588.db2.gz	TUAZILMVTKLMEA-ZHZULCJRSA-N	-1	1	424.888	3.531	50	10		HHCAMM
CC(C)C[C@@H]1CC(=O)Oc2cc(=O)c3c([O-])c(O)c(-c4ccc(O)c(O)c4)oc-3c21	ZINC000217653028	568903378	/nfs/dbraw/zinc/90/33/78/568903378.db2.gz	PPBDTMYBEGSWSJ-LLVKDONJSA-N	-1	1	412.394	3.721	50	10	biogenic	HHCAMM
COc1ccc(C=CC=C2C(=O)NC(=S)N(c3ccc(C(=O)[O-])cc3)C2=O)cc1	ZINC000009944292	536596436	/nfs/dbraw/zinc/59/64/36/536596436.db2.gz	HGGGCQJRGWXNOI-FKJKDRHESA-N	-1	1	408.435	3.621	50	10		HHCAMM
CN1C(=O)/C(=C/c2ccc(OCc3ccc4ccccc4c3)cc2)C(=O)[N-]C1=S	ZINC000005879172	557678801	/nfs/dbraw/zinc/67/88/01/557678801.db2.gz	VCKOEYXFULCWCC-DEDYPNTBSA-N	-1	1	402.475	3.675	50	10		HHCAMM
Cc1cc(/C=C2\C(=O)[N-]C(=S)NC2=O)c(C)n1-c1ccc(Br)cc1	ZINC000008743124	557804196	/nfs/dbraw/zinc/80/41/96/557804196.db2.gz	GNVZSEFBOCCFRW-UHFFFAOYSA-N	-1	1	404.289	3.611	50	10		HHCAMM
Cc1cc(/C=C2/C(=O)[N-]C(=S)NC2=O)c(C)n1-c1ccc(Br)cc1	ZINC000008743124	557804198	/nfs/dbraw/zinc/80/41/98/557804198.db2.gz	GNVZSEFBOCCFRW-UHFFFAOYSA-N	-1	1	404.289	3.611	50	10		HHCAMM
Cc1cc(C=C2C(=O)[N-]C(=S)NC2=O)c(C)n1-c1ccc(Br)cc1	ZINC000008743124	557804200	/nfs/dbraw/zinc/80/42/00/557804200.db2.gz	GNVZSEFBOCCFRW-UHFFFAOYSA-N	-1	1	404.289	3.611	50	10		HHCAMM
CCn1c(-c2ccc3c(c2)OCCO3)cnc1SCC(=O)c1ccc([O-])cc1O	ZINC000058378084	558923025	/nfs/dbraw/zinc/92/30/25/558923025.db2.gz	PVJRKJHQCDWSAE-UHFFFAOYSA-N	-1	1	412.467	3.727	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C\c1cc(Cl)ccc1OCc1ccc([N+](=O)[O-])cc1	ZINC000001172519	560727623	/nfs/dbraw/zinc/72/76/23/560727623.db2.gz	LWANHCJEZFRBHD-UHFFFAOYSA-N	-1	1	417.830	3.582	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C/c1cc(Cl)ccc1OCc1ccc([N+](=O)[O-])cc1	ZINC000001172519	560727624	/nfs/dbraw/zinc/72/76/24/560727624.db2.gz	LWANHCJEZFRBHD-UHFFFAOYSA-N	-1	1	417.830	3.582	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)C1=Cc1cc(Cl)ccc1OCc1ccc([N+](=O)[O-])cc1	ZINC000001172519	560727625	/nfs/dbraw/zinc/72/76/25/560727625.db2.gz	LWANHCJEZFRBHD-UHFFFAOYSA-N	-1	1	417.830	3.582	50	10		HHCAMM
CN(C)c1ccc([C@@H]2[C@H]3C(=O)N(c4ccccc4)C([O-])=C3ON2c2ccccc2)cc1	ZINC000101997222	560806931	/nfs/dbraw/zinc/80/69/31/560806931.db2.gz	DGHHDANZEPTKRU-DNVJHFABSA-N	-1	1	413.477	3.804	50	10		HHCAMM
CC(C)C[C@H]1CC(=O)Oc2cc(=O)c3c([O-])c(O)c(-c4ccc(O)c(O)c4)oc-3c21	ZINC000217653121	568903426	/nfs/dbraw/zinc/90/34/26/568903426.db2.gz	PPBDTMYBEGSWSJ-NSHDSACASA-N	-1	1	412.394	3.721	50	10	biogenic	HHCAMM
O=C(COc1ccc(Cl)cc1C=C1SC(=S)[N-]C1=O)Nc1ccc(F)cc1	ZINC000009704984	569039233	/nfs/dbraw/zinc/03/92/33/569039233.db2.gz	ADROACPTVFNJIY-NVNXTCNLSA-N	-1	1	422.890	3.985	50	10		HHCAMM
O=c1cc2nc(-c3ccco3)nc(SCc3cccc(Br)c3)n2[n-]1	ZINC000006915841	569181004	/nfs/dbraw/zinc/18/10/04/569181004.db2.gz	JHQOCSXUDQAFFI-UHFFFAOYSA-N	-1	1	403.261	3.732	50	10		HHCAMM
CN1C(=O)C(=Cc2ccc3c(c2)CCN3Cc2ccccc2Cl)C(=O)[N-]C1=S	ZINC000002383547	569391487	/nfs/dbraw/zinc/39/14/87/569391487.db2.gz	SNDWOCOUFPWKAY-LFIBNONCSA-N	-1	1	411.914	4.000	50	10		HHCAMM
CCOc1cc(C=C2SC(=S)[N-]C2=O)ccc1OC(=O)c1ccccc1F	ZINC000016247243	962989699	/nfs/dbraw/zinc/98/96/99/962989699.db2.gz	YVBIZZWMMPUZBK-YBEGLDIGSA-N	-1	1	403.456	3.932	50	10		HHCAMM
Cc1ccc(OCCOCCOc2ccccc2C=C2SC(=S)[N-]C2=O)cc1	ZINC000002962259	557431613	/nfs/dbraw/zinc/43/16/13/557431613.db2.gz	PZVXYWFFYNEMLN-XMHGGMMESA-N	-1	1	415.536	3.958	50	10		HHCAMM
O=C([O-])c1cccc(-c2ccc(/C=C3/C(=O)NN(c4cccc(Cl)c4)C3=O)o2)c1	ZINC000012428662	558404018	/nfs/dbraw/zinc/40/40/18/558404018.db2.gz	TZBRWOWKBPIABI-BOPFTXTBSA-N	-1	1	408.797	3.760	50	10		HHCAMM
Cc1cc(C)cc(N2C(=O)C(=Cc3ccc(O[C@H](C)C(=O)[O-])cc3)C(=O)NC2=S)c1	ZINC000017194835	558825374	/nfs/dbraw/zinc/82/53/74/558825374.db2.gz	JVWBRFXQMKNNSY-JVVDOCDTSA-N	-1	1	424.478	3.827	50	10		HHCAMM
COC(=O)c1ccc(N=Cc2c(C)[n-]n(-c3ccc(Br)cc3)c2=O)cc1	ZINC000101112965	560786679	/nfs/dbraw/zinc/78/66/79/560786679.db2.gz	JGXMVELAPXVYQB-GZTJUZNOSA-N	-1	1	414.259	3.954	50	10		HHCAMM
CC[C@H](C)N1C(=O)C(=CNCCC(c2ccccc2)c2ccccc2)C(=O)[N-]C1=S	ZINC000005925129	568829827	/nfs/dbraw/zinc/82/98/27/568829827.db2.gz	JVZGDAKJKJVUNM-QFGIDJEJSA-N	-1	1	421.566	3.724	50	10		HHCAMM
Cc1cc(C)cc(N2C(=O)C(=Cc3ccc(O[C@@H](C)C(=O)[O-])cc3)C(=O)NC2=S)c1	ZINC000015821645	569010724	/nfs/dbraw/zinc/01/07/24/569010724.db2.gz	JVWBRFXQMKNNSY-BGARDKSCSA-N	-1	1	424.478	3.827	50	10		HHCAMM
COc1cc(C=C2SC(=S)[N-]C2=O)ccc1OCCOc1ccccc1C	ZINC000004590048	569255530	/nfs/dbraw/zinc/25/55/30/569255530.db2.gz	VVSYWPIMIJDPBY-PDGQHHTCSA-N	-1	1	401.509	3.950	50	10		HHCAMM
O=C([O-])c1cccc(-c2ccc(C=C3C(=O)NC(=S)N(c4ccccc4)C3=O)o2)c1	ZINC000009065529	132335508	/nfs/dbraw/zinc/33/55/08/132335508.db2.gz	UEQNTKJOTWXQRA-ATVHPVEESA-N	-1	1	418.430	3.887	50	10		HHCAMM
COc1ccc(C=C2SC(=S)[N-]C2=O)cc1OCc1ccc([N+](=O)[O-])cc1	ZINC000012371393	568514816	/nfs/dbraw/zinc/51/48/16/568514816.db2.gz	DBLKPPFNVIBTQA-SXGWCWSVSA-N	-1	1	402.453	3.671	50	10		HHCAMM
Cc1[n-]n(-c2ccccc2)c(=O)c1C=C1C(=O)NC(=S)N(c2ccc(C)cc2)C1=O	ZINC000019997361	568586083	/nfs/dbraw/zinc/58/60/83/568586083.db2.gz	WAVCZCZIHBICOQ-ZCWPUFOUSA-N	-1	1	418.478	3.548	50	10		HHCAMM
COc1cccc(OCCOc2ccc(C=C3SC(=S)[N-]C3=O)cc2OC)c1	ZINC000002958408	557431073	/nfs/dbraw/zinc/43/10/73/557431073.db2.gz	IQPCKWNQXISNTF-WOJGMQOQSA-N	-1	1	417.508	3.650	50	10		HHCAMM
CCOC(=O)c1c(C)[nH]nc1N=Nc1c(=O)n(-c2ccccc2)[n-]c1-c1ccccc1	ZINC000008426456	557787916	/nfs/dbraw/zinc/78/79/16/557787916.db2.gz	ZYLRHQICOVSFPF-RVYVDECRSA-N	-1	1	416.441	3.798	50	10		HHCAMM
COc1ccccc1OCCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1OC	ZINC000013942008	558604668	/nfs/dbraw/zinc/60/46/68/558604668.db2.gz	CDEVKUUOSKWPLC-PDGQHHTCSA-N	-1	1	417.508	3.650	50	10		HHCAMM
Cc1[n-]n(-c2ccccc2)c(=O)c1C=Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000100148877	559130666	/nfs/dbraw/zinc/13/06/66/559130666.db2.gz	FWVJRBIFXSXEPX-LTGZKZEYSA-N	-1	1	424.526	3.580	50	10		HHCAMM
COc1ccc(-c2coc3c(C[N@H+]4CCC[C@H](C(=O)[O-])C4)c([O-])cc(C)c3c2=O)cc1	ZINC000094993353	568593908	/nfs/dbraw/zinc/59/39/08/568593908.db2.gz	MSNHTKCSVDVKBB-INIZCTEOSA-N	-1	1	423.465	3.779	50	10		HHCAMM
O=C([N-]N1C(=O)/C(=C/c2ccncc2)SC1=S)c1ccc(Cl)cc1Cl	ZINC000008821941	571121623	/nfs/dbraw/zinc/12/16/23/571121623.db2.gz	XEIDDWLGGPZNDG-QPEQYQDCSA-N	-1	1	410.307	3.935	50	10		HHCAMM
Cc1ccc(S(=O)(=O)Nc2cc(Sc3nc[nH]n3)c([O-])c3ccccc23)cc1	ZINC000002685344	557740085	/nfs/dbraw/zinc/74/00/85/557740085.db2.gz	FXLOIHKNBSACNL-UHFFFAOYSA-N	-1	1	412.496	3.924	50	10		HHCAMM
CC[C@@H](C)c1ccc(OCCOc2ccc(C=C3C(=O)[N-]C(=S)NC3=O)cc2)cc1	ZINC000002948376	557773889	/nfs/dbraw/zinc/77/38/89/557773889.db2.gz	ODQNXRHZLNPQLE-OAHLLOKOSA-N	-1	1	424.522	3.572	50	10		HHCAMM
CN1C(=O)/C(=C/c2ccccc2OCc2ccc(Cl)c(Cl)c2)C(=O)[N-]C1=S	ZINC000009311646	557836452	/nfs/dbraw/zinc/83/64/52/557836452.db2.gz	ATMMOYBEGBOOHR-UKTHLTGXSA-N	-1	1	421.305	3.829	50	10		HHCAMM
Cc1ccccc1N1C(=O)C(=Cc2ccc(O[C@@H](C)C(=O)[O-])cc2)C(=O)NC1=S	ZINC000016362874	558788161	/nfs/dbraw/zinc/78/81/61/558788161.db2.gz	FRQCAOQWRLVDTN-RERGGYADSA-N	-1	1	410.451	3.519	50	10		HHCAMM
CCOc1cc(C=C2SC(=S)[N-]C2=O)ccc1OC(=O)c1ccc(F)cc1	ZINC000001030858	568764304	/nfs/dbraw/zinc/76/43/04/568764304.db2.gz	ZMFLFEWSTKDMLT-MHWRWJLKSA-N	-1	1	403.456	3.932	50	10		HHCAMM
CC(C)CCn1c(=O)c2sccc2nc1SCC(=O)c1ccc([O-])c(O)c1	ZINC000002925096	568817151	/nfs/dbraw/zinc/81/71/51/568817151.db2.gz	BBDODUJGRQYCNH-UHFFFAOYSA-N	-1	1	404.513	3.890	50	10		HHCAMM
CC(C)n1[nH]c(=O)c2c1nc1c3ccc(O)c(O)c3oc1c2-c1ccc(C(=O)[O-])cc1	ZINC000085877184	569009717	/nfs/dbraw/zinc/00/97/17/569009717.db2.gz	JKEVJYDGGRJPMO-UHFFFAOYSA-N	-1	1	419.393	3.981	50	10	biogenic	HHCAMM
O=C1Nc2ccc(S(=O)(=O)[N-]c3ccc(O)c(C(F)(F)F)c3)c3cccc1c23	ZINC000079075848	569427018	/nfs/dbraw/zinc/42/70/18/569427018.db2.gz	NGLLPLAXOQBEMP-UHFFFAOYSA-N	-1	1	408.357	3.931	50	10		HHCAMM
O=C([O-])c1ccc(-c2ccc(/C=C3/C(=O)NN(c4cccc(Cl)c4)C3=O)o2)cc1	ZINC000008872515	571130517	/nfs/dbraw/zinc/13/05/17/571130517.db2.gz	QOWLZLZIAIZDDP-BOPFTXTBSA-N	-1	1	408.797	3.760	50	10		HHCAMM
CCOc1ccc(-n2c(C)cc(/C=C3/C(=O)[N-]N(c4ccccc4)C3=O)c2C)cc1	ZINC000004749127	559047255	/nfs/dbraw/zinc/04/72/55/559047255.db2.gz	USVYQDFFOGJTFD-JCMHNJIXSA-N	-1	1	401.466	3.954	50	10		HHCAMM
Cc1[n-]n(-c2ccc(C)cc2)c(=O)c1C=C1C(=O)NC(=S)N(c2ccccc2)C1=O	ZINC000096569895	568761134	/nfs/dbraw/zinc/76/11/34/568761134.db2.gz	BWJPOOFMWGBFCA-LDADJPATSA-N	-1	1	418.478	3.866	50	10		HHCAMM
CCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1OC(=O)c1ccc(F)cc1	ZINC000003108341	568855931	/nfs/dbraw/zinc/85/59/31/568855931.db2.gz	IIVXGSPMFHRAIN-MHWRWJLKSA-N	-1	1	403.456	3.932	50	10		HHCAMM
O=C([O-])c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(Cc4ccco4)C3=O)o2)cc1	ZINC000013689237	558571618	/nfs/dbraw/zinc/57/16/18/558571618.db2.gz	ZKFQMGOPDBURNC-YBEGLDIGSA-N	-1	1	406.350	3.740	50	10		HHCAMM
CC[C@@H](C)N1C(=O)C(=CNCCC(c2ccccc2)c2ccccc2)C(=O)[N-]C1=S	ZINC000005925076	568829876	/nfs/dbraw/zinc/82/98/76/568829876.db2.gz	JVZGDAKJKJVUNM-GFXBCDTMSA-N	-1	1	421.566	3.724	50	10		HHCAMM
Cc1ccc(OCCOCCOc2ccc(C=C3SC(=S)[N-]C3=O)cc2)cc1	ZINC000006213433	569033220	/nfs/dbraw/zinc/03/32/20/569033220.db2.gz	PGPZPHUMYQJTEC-XMHGGMMESA-N	-1	1	415.536	3.958	50	10		HHCAMM
O=C1[N-]C(=S)S/C1=C\c1cc([N+](=O)[O-])ccc1OCCCOc1ccccc1	ZINC000002856669	569224471	/nfs/dbraw/zinc/22/44/71/569224471.db2.gz	MFCRXJWCQCEKLH-ATVHPVEESA-N	-1	1	416.480	3.932	50	10		HHCAMM
CCN1C(=O)C(=Cc2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)C(=O)[N-]C1=S	ZINC000009012605	571210888	/nfs/dbraw/zinc/21/08/88/571210888.db2.gz	DJPAWGWQVLRQBD-MHWRWJLKSA-N	-1	1	412.471	3.798	50	10		HHCAMM
Cc1occc1C(=O)[N-]N1C(=O)/C(=C/c2ccc3c(c2)CCCN3C)SC1=S	ZINC000013730086	558586082	/nfs/dbraw/zinc/58/60/82/558586082.db2.gz	ZRCDVMAHXGHFSE-BOPFTXTBSA-N	-1	1	413.524	3.517	50	10		HHCAMM
CCCC12CN3CC(CCC)(CN(C1)C3c1cc(Br)ccc1[O-])C2=O	ZINC000019323914	558867530	/nfs/dbraw/zinc/86/75/30/558867530.db2.gz	IJVXOPNJINBKST-UHFFFAOYSA-N	-1	1	407.352	3.940	50	10	biogenic	HHCAMM
CCc1ccc(N2NC(=O)/C(=C/c3ccc(-c4cccc(C(=O)[O-])c4)o3)C2=O)cc1	ZINC000004656192	558870197	/nfs/dbraw/zinc/87/01/97/558870197.db2.gz	PNAYHTGDQDTYEQ-UYRXBGFRSA-N	-1	1	402.406	3.669	50	10		HHCAMM
COc1cc(C)ccc1OCCOc1cccc(C=C2SC(=S)[N-]C2=O)c1	ZINC000004679699	558890896	/nfs/dbraw/zinc/89/08/96/558890896.db2.gz	WUYUQJBEVYFTFW-PDGQHHTCSA-N	-1	1	401.509	3.950	50	10		HHCAMM
Cc1cccc(N2C(=O)C(=Cc3ccc(O[C@H](C)C(=O)[O-])cc3)C(=O)NC2=S)c1C	ZINC000015799826	560856190	/nfs/dbraw/zinc/85/61/90/560856190.db2.gz	MKXLYMDRPPNJHT-SWEABUAFSA-N	-1	1	424.478	3.827	50	10		HHCAMM
O=c1cc(CSc2ncnc3c2cnn3-c2ccccc2)c2cc(O)c([O-])cc2o1	ZINC000009981860	571293523	/nfs/dbraw/zinc/29/35/23/571293523.db2.gz	ZFPTYUUCFACWHU-UHFFFAOYSA-N	-1	1	418.434	3.625	50	10		HHCAMM
Cc1cc(C(=O)[O-])ccc1-c1ccc(/C=C2\C(=O)NC(=O)N(C3CCCCC3)C2=O)o1	ZINC000012868210	558482026	/nfs/dbraw/zinc/48/20/26/558482026.db2.gz	HYSUWEHSSGNRER-LDADJPATSA-N	-1	1	422.437	3.748	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C/c1ccc(OCc2ccc([N+](=O)[O-])cc2)c(Cl)c1	ZINC000001172252	560727595	/nfs/dbraw/zinc/72/75/95/560727595.db2.gz	QFBBWXYETGBISH-UHFFFAOYSA-N	-1	1	417.830	3.582	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C\c1ccc(OCc2ccc([N+](=O)[O-])cc2)c(Cl)c1	ZINC000001172252	560727597	/nfs/dbraw/zinc/72/75/97/560727597.db2.gz	QFBBWXYETGBISH-UHFFFAOYSA-N	-1	1	417.830	3.582	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)C1=Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(Cl)c1	ZINC000001172252	560727598	/nfs/dbraw/zinc/72/75/98/560727598.db2.gz	QFBBWXYETGBISH-UHFFFAOYSA-N	-1	1	417.830	3.582	50	10		HHCAMM
CC[C@H](C)N1C(=O)C(=CNCCC(c2ccccc2)c2ccccc2)C(=O)[N-]C1=S	ZINC000101087536	560775518	/nfs/dbraw/zinc/77/55/18/560775518.db2.gz	JVZGDAKJKJVUNM-TYYMKKSVSA-N	-1	1	421.566	3.724	50	10		HHCAMM
CNc1ccc([N-]S(=O)(=O)c2ccc(C)cc2)c2c1C(=O)c1ccccc1C2=O	ZINC000003991732	568931450	/nfs/dbraw/zinc/93/14/50/568931450.db2.gz	XGCBDYIDWHSDMP-UHFFFAOYSA-N	-1	1	406.463	3.613	50	10		HHCAMM
CCCCN1C(=O)C(=CNc2cc(C(F)(F)F)ccc2Cl)C(=O)[N-]C1=S	ZINC000009350954	571250626	/nfs/dbraw/zinc/25/06/26/571250626.db2.gz	HSIIMXPMHUCWKN-CSKARUKUSA-N	-1	1	405.829	3.698	50	10		HHCAMM
Cc1ccccc1N1C(=O)/C(=C/c2cc(Cl)cc(Cl)c2[O-])C(=O)NC1=S	ZINC000001023569	132235109	/nfs/dbraw/zinc/23/51/09/132235109.db2.gz	KZHAZHRMBIZBFE-KPKJPENVSA-N	-1	1	407.278	3.839	50	10		HHCAMM
Cc1cc(C=C2C(=O)[N-]C(=S)N(C)C2=O)c(C)n1-c1ccc(Cl)c(Cl)c1	ZINC000004711834	557585717	/nfs/dbraw/zinc/58/57/17/557585717.db2.gz	BBWYIXYSWMZWEL-QPEQYQDCSA-N	-1	1	408.310	3.657	50	10		HHCAMM
Cc1ccc([C@@H]2CC(=O)Oc3cc(=O)c4c([O-])cc(-c5ccc(O)c(O)c5)oc-4c32)o1	ZINC000096114144	568693640	/nfs/dbraw/zinc/69/36/40/568693640.db2.gz	XSTKBIUPMZNKJC-LBPRGKRZSA-N	-1	1	420.373	3.919	50	10	biogenic	HHCAMM
CC(C)c1ccc(NC(=O)CSc2nc(-c3ccco3)nc3cc(=O)[n-]n32)cc1	ZINC000021537473	568712766	/nfs/dbraw/zinc/71/27/66/568712766.db2.gz	XVELKLJIDSOOJU-UHFFFAOYSA-N	-1	1	409.471	3.532	50	10		HHCAMM
O=C1c2ccccc2N[C@@H](c2cccc(Br)c2[O-])N1C[C@@H]1CCCO1	ZINC000054681729	569371978	/nfs/dbraw/zinc/37/19/78/569371978.db2.gz	XAZFSJNVTDYTDT-KPZWWZAWSA-N	-1	1	403.276	3.900	50	10		HHCAMM
Cc1cccc(OCCOCCOc2ccccc2C=C2SC(=S)[N-]C2=O)c1	ZINC000002962743	557431631	/nfs/dbraw/zinc/43/16/31/557431631.db2.gz	WUXNQIUOGSAYOR-XMHGGMMESA-N	-1	1	415.536	3.958	50	10		HHCAMM
Cc1ccc([C@H]2CC(=O)Oc3cc(=O)c4c([O-])cc(-c5ccc(O)c(O)c5)oc-4c32)o1	ZINC000096114145	568693627	/nfs/dbraw/zinc/69/36/27/568693627.db2.gz	XSTKBIUPMZNKJC-GFCCVEGCSA-N	-1	1	420.373	3.919	50	10	biogenic	HHCAMM
O=C1c2ccccc2N[C@@H](c2cccc(Br)c2[O-])N1C[C@H]1CCCO1	ZINC000054681736	569293814	/nfs/dbraw/zinc/29/38/14/569293814.db2.gz	XAZFSJNVTDYTDT-KZULUSFZSA-N	-1	1	403.276	3.900	50	10		HHCAMM
Cc1cc(C=C2C(=O)[N-]C(=S)N(Cc3ccco3)C2=O)c(C)n1-c1ccc(C)cc1	ZINC000016265831	962996577	/nfs/dbraw/zinc/99/65/77/962996577.db2.gz	QBXWHJCZXSBFMI-NDENLUEZSA-N	-1	1	419.506	3.822	50	10		HHCAMM
CCN1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(Cl)c(C(=O)[O-])c3)c2C)C1=O	ZINC000020030463	558324048	/nfs/dbraw/zinc/32/40/48/558324048.db2.gz	GYZPXNKNXOQLQK-OVCLIPMQSA-N	-1	1	415.833	3.768	50	10		HHCAMM
COc1cc([N+](=O)[O-])cc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)c1[O-]	ZINC000023281011	558778434	/nfs/dbraw/zinc/77/84/34/558778434.db2.gz	DPAGIUNCYBAJHE-UHFFFAOYSA-N	-1	1	411.380	3.650	50	10		HHCAMM
Cc1cc(C)cc(N2C(=O)C(=Cc3ccc(O[C@@H](C)C(=O)[O-])cc3)C(=O)NC2=S)c1	ZINC000017194837	558825401	/nfs/dbraw/zinc/82/54/01/558825401.db2.gz	JVWBRFXQMKNNSY-DZBQEORWSA-N	-1	1	424.478	3.827	50	10		HHCAMM
O=C1[N-]C(=S)S/C1=C/c1cccc(OCCOCCOc2ccccc2)c1	ZINC000006241369	569034610	/nfs/dbraw/zinc/03/46/10/569034610.db2.gz	RDSGZCQTMOWCAO-NBVRZTHBSA-N	-1	1	401.509	3.650	50	10		HHCAMM
O=C(c1ccco1)c1coc2ccc([O-])c(CN3CCN(Cc4cccnc4)CC3)c12	ZINC000253409949	569051395	/nfs/dbraw/zinc/05/13/95/569051395.db2.gz	MQWRKIPTKFNJPO-UHFFFAOYSA-N	-1	1	417.465	3.675	50	10		HHCAMM
O=C(Cn1cc(C=C2SC(=S)[N-]C2=O)c2ccccc21)NCc1cccs1	ZINC000016265137	558781958	/nfs/dbraw/zinc/78/19/58/558781958.db2.gz	UQECUDSTAAMENK-PXNMLYILSA-N	-1	1	413.549	3.508	50	10		HHCAMM
O=C([O-])c1ccc(-c2ccc(/C=C3/C(=O)NN(c4ccccc4)C3=O)o2)cc1Cl	ZINC000017293509	558826532	/nfs/dbraw/zinc/82/65/32/558826532.db2.gz	RQALKWNGORHDSZ-WJDWOHSUSA-N	-1	1	408.797	3.760	50	10		HHCAMM
CSc1nnc(-c2ccccc2NC=C2C(C)=NN(c3ccccc3)C2=O)c(=O)[n-]1	ZINC000100381453	559134641	/nfs/dbraw/zinc/13/46/41/559134641.db2.gz	FUVDYDMPTGXVTL-FOWTUZBSSA-N	-1	1	418.482	3.685	50	10		HHCAMM
CSc1nnc(-c2ccccc2N=Cc2c(C)[nH]n(-c3ccccc3)c2=O)c(=O)[n-]1	ZINC000100381453	559134643	/nfs/dbraw/zinc/13/46/43/559134643.db2.gz	FUVDYDMPTGXVTL-FOWTUZBSSA-N	-1	1	418.482	3.685	50	10		HHCAMM
O=C1C[C@@H](c2ccncc2)c2c(c(O)c(=O)c3c([O-])cc(-c4ccccc4)oc2-3)O1	ZINC000096114170	568694017	/nfs/dbraw/zinc/69/40/17/568694017.db2.gz	MJTFGJNFTZONSL-AWEZNQCLSA-N	-1	1	401.374	3.707	50	10	biogenic	HHCAMM
Cc1cc(Cl)ccc1OCCSc1nc(-c2ccco2)nc2cc(=O)[n-]n21	ZINC000015732584	568982806	/nfs/dbraw/zinc/98/28/06/568982806.db2.gz	IRZNOQNAQISKSK-UHFFFAOYSA-N	-1	1	402.863	3.811	50	10		HHCAMM
COC(=O)c1ccc(N=Cc2c(C)[n-]n(-c3ccc(Br)cc3)c2=O)cc1	ZINC000005575853	557662803	/nfs/dbraw/zinc/66/28/03/557662803.db2.gz	JGXMVELAPXVYQB-BOPFTXTBSA-N	-1	1	414.259	3.954	50	10		HHCAMM
COc1ccc(OC)c(C(=O)c2c(C)oc3ccc([O-])c(CN4CCOCC4)c32)c1	ZINC000033336027	559063585	/nfs/dbraw/zinc/06/35/85/559063585.db2.gz	SORSMHFXEQEHGF-UHFFFAOYSA-N	-1	1	411.454	3.527	50	10		HHCAMM
Cc1[nH]n(-c2cccc(Cl)c2)c(=O)c1C=Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000101150114	559143622	/nfs/dbraw/zinc/14/36/22/559143622.db2.gz	GECHTFRVUIZVIP-NTEUORMPSA-N	-1	1	400.778	3.665	50	10		HHCAMM
COc1c(Br)cc(Br)cc1C=C1SC(=S)[N-]C1=O	ZINC000001512766	569009377	/nfs/dbraw/zinc/00/93/77/569009377.db2.gz	RIAMROZUXKEIEA-FPYGCLRLSA-N	-1	1	409.124	3.709	50	10		HHCAMM
O=C1C[C@@H](c2ccco2)c2c(cc(=O)c3c([O-])cc(-c4ccc(O)c(O)c4)oc2-3)O1	ZINC000096113815	568693385	/nfs/dbraw/zinc/69/33/85/568693385.db2.gz	XCHKXUQHUJHQBK-NSHDSACASA-N	-1	1	406.346	3.611	50	10	biogenic	HHCAMM
O=C1[N-]C(=S)S/C1=C\c1cc([N+](=O)[O-])ccc1OCCOc1ccccc1	ZINC000004590106	569255551	/nfs/dbraw/zinc/25/55/51/569255551.db2.gz	GICHZRQIKUVWJC-WJDWOHSUSA-N	-1	1	402.453	3.541	50	10		HHCAMM
O=C([O-])c1ccc(-c2ccc(C=C3C(=O)NC(=S)N(c4ccccc4)C3=O)o2)cc1	ZINC000008837358	132333707	/nfs/dbraw/zinc/33/37/07/132333707.db2.gz	KQAPQIJWYLDIHY-ATVHPVEESA-N	-1	1	418.430	3.887	50	10		HHCAMM
O=C1c2ccccc2C(=O)c2c1cccc2S(=O)(=O)[N-]c1ccc(O)c(Cl)c1	ZINC000008765836	557806156	/nfs/dbraw/zinc/80/61/56/557806156.db2.gz	CUAKUDJXBXXHDS-UHFFFAOYSA-N	-1	1	413.838	3.622	50	10		HHCAMM
COc1cccc(OCCOc2ccc(C=C3SC(=S)[N-]C3=O)cc2OC)c1	ZINC000013942641	558605008	/nfs/dbraw/zinc/60/50/08/558605008.db2.gz	IQPCKWNQXISNTF-WQRHYEAKSA-N	-1	1	417.508	3.650	50	10		HHCAMM
COc1ccc(N=Cc2c(=O)n(-c3ccc([N+](=O)[O-])cc3)[n-]c2C(F)(F)F)cc1	ZINC000091270661	559070841	/nfs/dbraw/zinc/07/08/41/559070841.db2.gz	QBALWALXEXFCCR-XNTDXEJSSA-N	-1	1	406.320	3.864	50	10		HHCAMM
Cc1ccc(N2C(=O)CC(N3C(=O)C(=Cc4ccccc4)SC3=S)=C2[O-])cc1	ZINC000100864157	560760914	/nfs/dbraw/zinc/76/09/14/560760914.db2.gz	XGHFXIHGGRNLHX-FDIDWWNZSA-N	-1	1	408.504	3.528	50	10		HHCAMM
CC1=NN(c2ccc(Br)cc2)C(=O)C1=CNc1ccc(C(=O)[O-])cc1	ZINC000101077953	560771238	/nfs/dbraw/zinc/77/12/38/560771238.db2.gz	LHBRTNJTFLVVGA-MHWRWJLKSA-N	-1	1	400.232	3.866	50	10		HHCAMM
Cc1[nH]n(-c2ccc(Br)cc2)c(=O)c1C=Nc1ccc(C(=O)[O-])cc1	ZINC000101077953	560771240	/nfs/dbraw/zinc/77/12/40/560771240.db2.gz	LHBRTNJTFLVVGA-MHWRWJLKSA-N	-1	1	400.232	3.866	50	10		HHCAMM
O=C1C[C@H](c2ccco2)c2c(cc(=O)c3c([O-])cc(-c4ccc(O)c(O)c4)oc2-3)O1	ZINC000096113816	568693365	/nfs/dbraw/zinc/69/33/65/568693365.db2.gz	XCHKXUQHUJHQBK-LLVKDONJSA-N	-1	1	406.346	3.611	50	10	biogenic	HHCAMM
O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)c1cc(Cl)ccc1[O-]	ZINC000071816292	569254514	/nfs/dbraw/zinc/25/45/14/569254514.db2.gz	PSYXGBZHIUJMSD-UHFFFAOYSA-N	-1	1	414.811	3.831	50	10		HHCAMM
O=C([N-]N1C(=O)/C(=C/c2ccccn2)SC1=S)c1ccc(Cl)cc1Cl	ZINC000008766440	571115612	/nfs/dbraw/zinc/11/56/12/571115612.db2.gz	BZDCROWELPOIRR-JYRVWZFOSA-N	-1	1	410.307	3.935	50	10		HHCAMM
Cc1ccc(OCCOCCOc2cccc(C=C3SC(=S)[N-]C3=O)c2)cc1	ZINC000016309030	558784889	/nfs/dbraw/zinc/78/48/89/558784889.db2.gz	SFXBXFURSYMUQM-XMHGGMMESA-N	-1	1	415.536	3.958	50	10		HHCAMM
Cn1cccc1/C=C1\SC(=S)N([N-]C(=O)c2ccc(Cl)cc2Cl)C1=O	ZINC000013769876	558867572	/nfs/dbraw/zinc/86/75/72/558867572.db2.gz	OHOZADWVTFRNDC-JYRVWZFOSA-N	-1	1	412.323	3.878	50	10		HHCAMM
O=C([O-])c1cc(-c2ccc(/C=C3\C(=O)NN(c4ccccc4)C3=O)o2)ccc1Cl	ZINC000004156777	568947183	/nfs/dbraw/zinc/94/71/83/568947183.db2.gz	BWOAQNUVYKZNFJ-LFIBNONCSA-N	-1	1	408.797	3.760	50	10		HHCAMM
O=C([O-])c1ccc(-c2ccc(/C=C3\C(=O)NN(c4ccccc4)C3=O)o2)cc1Cl	ZINC000002071246	569277551	/nfs/dbraw/zinc/27/75/51/569277551.db2.gz	RQALKWNGORHDSZ-LFIBNONCSA-N	-1	1	408.797	3.760	50	10		HHCAMM
O=C1c2ccccc2N[C@H](c2cccc(Br)c2[O-])N1C[C@@H]1CCCO1	ZINC000054681732	569293825	/nfs/dbraw/zinc/29/38/25/569293825.db2.gz	XAZFSJNVTDYTDT-SGTLLEGYSA-N	-1	1	403.276	3.900	50	10		HHCAMM
Cc1ccc(S(=O)(=O)n2cc(C=C3SC(=S)[N-]C3=O)c3ccccc32)cc1	ZINC000012628649	558440843	/nfs/dbraw/zinc/44/08/43/558440843.db2.gz	CNSLKOTZZFTOSZ-YVLHZVERSA-N	-1	1	414.533	3.676	50	10		HHCAMM
O=C1[N-]C(=S)N(C2CCCCC2)C(=O)C1=CNc1ccc(Cc2ccncc2)cc1	ZINC000017207060	560703983	/nfs/dbraw/zinc/70/39/83/560703983.db2.gz	GTFMMRGHNFKZTO-HMMYKYKNSA-N	-1	1	420.538	3.544	50	10		HHCAMM
Cc1[nH]n(-c2ccc(Cl)cc2)c(=O)c1C=Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1[O-]	ZINC000101148299	560788494	/nfs/dbraw/zinc/78/84/94/560788494.db2.gz	LVIYHYKXAMBBIU-MDWZMJQESA-N	-1	1	417.765	3.581	50	10		HHCAMM
COC(=O)Cc1c(C)c2ccc([O-])c(CNc3ccc(OC)c(Cl)c3)c2oc1=O	ZINC000008914281	571150249	/nfs/dbraw/zinc/15/02/49/571150249.db2.gz	ZLMWCKNVOLAZOH-UHFFFAOYSA-N	-1	1	417.845	3.797	50	10		HHCAMM
CC[C@@H](C)N1C(=O)/C(=C/c2c(C)[nH]c3ccc(Br)cc32)C(=O)[N-]C1=S	ZINC000001137812	960459159	/nfs/dbraw/zinc/45/91/59/960459159.db2.gz	KGJHCEFKCNUJON-MBBDXHFBSA-N	-1	1	420.332	3.664	50	10		HHCAMM
COc1cc(/C=C2/C(=O)[N-]C(=S)NC2=O)ccc1OCc1ccc(Cl)cc1	ZINC000002591123	557358994	/nfs/dbraw/zinc/35/89/94/557358994.db2.gz	YGHGGZBJOYSRBB-UHFFFAOYSA-N	-1	1	402.859	3.682	50	10		HHCAMM
COc1cc(/C=C2\C(=O)[N-]C(=S)NC2=O)ccc1OCc1ccc(Cl)cc1	ZINC000002591123	557358997	/nfs/dbraw/zinc/35/89/97/557358997.db2.gz	YGHGGZBJOYSRBB-UHFFFAOYSA-N	-1	1	402.859	3.682	50	10		HHCAMM
COc1cc(C=C2C(=O)[N-]C(=S)NC2=O)ccc1OCc1ccc(Cl)cc1	ZINC000002591123	557358999	/nfs/dbraw/zinc/35/89/99/557358999.db2.gz	YGHGGZBJOYSRBB-UHFFFAOYSA-N	-1	1	402.859	3.682	50	10		HHCAMM
Cc1ccccc1OCCOCCOc1cccc(C=C2SC(=S)[N-]C2=O)c1	ZINC000004670587	558882872	/nfs/dbraw/zinc/88/28/72/558882872.db2.gz	VBPYABQXSGPACE-RGEXLXHISA-N	-1	1	415.536	3.958	50	10		HHCAMM
Cc1ccccc1OCCOc1ccc([N+](=O)[O-])cc1C=C1SC(=S)[N-]C1=O	ZINC000012285433	568458564	/nfs/dbraw/zinc/45/85/64/568458564.db2.gz	ZHTRLZKDICFWFU-GZTJUZNOSA-N	-1	1	416.480	3.850	50	10		HHCAMM
Cc1cccc(N2C(=O)C(=Cc3ccc(O[C@@H](C)C(=O)[O-])cc3)C(=O)NC2=S)c1C	ZINC000013940415	558604202	/nfs/dbraw/zinc/60/42/02/558604202.db2.gz	MKXLYMDRPPNJHT-FMNVXAMXSA-N	-1	1	424.478	3.827	50	10		HHCAMM
Cc1[nH]n(-c2ccccc2)c(=O)c1C=C1C(=O)[N-]C(=O)N(c2ccc(C)c(C)c2)C1=O	ZINC000018271876	558835165	/nfs/dbraw/zinc/83/51/65/558835165.db2.gz	OPGWHUKWAMGKGS-LPGQDOADSA-N	-1	1	416.437	3.692	50	10		HHCAMM
CC[C@@H](C)N1C(=O)C(=CNCCC(c2ccccc2)c2ccccc2)C(=O)[N-]C1=S	ZINC000101087535	560775530	/nfs/dbraw/zinc/77/55/30/560775530.db2.gz	JVZGDAKJKJVUNM-RRMQHPPMSA-N	-1	1	421.566	3.724	50	10		HHCAMM
O=S(=O)(Nc1cc(Sc2nc[nH]n2)c([O-])c2ccccc12)c1ccc(F)cc1	ZINC000000816406	568495440	/nfs/dbraw/zinc/49/54/40/568495440.db2.gz	NIDNCFYOVWQKEO-UHFFFAOYSA-N	-1	1	416.459	3.755	50	10		HHCAMM
O=C1NC(=S)N(c2ccc(F)cc2)C(=O)/C1=C\c1cc(Cl)c([O-])c(Cl)c1	ZINC000013894565	558600135	/nfs/dbraw/zinc/60/01/35/558600135.db2.gz	QVRJNVCMDPWLRR-WZUFQYTHSA-N	-1	1	411.241	3.669	50	10		HHCAMM
Cc1[nH]n(-c2ccc(Cl)cc2)c(=O)c1C=Nc1ccc(C(=O)[O-])cc1[N+](=O)[O-]	ZINC000101148418	560788755	/nfs/dbraw/zinc/78/87/55/560788755.db2.gz	VFNQVAAPUWDJSJ-NTEUORMPSA-N	-1	1	400.778	3.665	50	10		HHCAMM
O=C1C[C@@H](c2cccnc2)c2c(c(O)c(=O)c3c([O-])cc(-c4ccccc4)oc2-3)O1	ZINC000096115527	568695220	/nfs/dbraw/zinc/69/52/20/568695220.db2.gz	RSRRQFZGHNPIHP-AWEZNQCLSA-N	-1	1	401.374	3.707	50	10	biogenic	HHCAMM
CCOC(=O)c1c(C)[nH]nc1N=Nc1c(=O)n(-c2ccccc2)[n-]c1-c1ccccc1	ZINC000252643871	569318919	/nfs/dbraw/zinc/31/89/19/569318919.db2.gz	ZYLRHQICOVSFPF-LJQANCHMSA-N	-1	1	416.441	3.798	50	10		HHCAMM
Cc1[nH]n(-c2ccccc2)c(=O)c1C=C1C(=O)[N-]C(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000004209204	132273127	/nfs/dbraw/zinc/27/31/27/132273127.db2.gz	FTKFJVSVRJFQAR-PCJMVEANSA-N	-1	1	422.828	3.728	50	10		HHCAMM
O=C(CSc1nc2ccccc2[nH]1)NCc1cc(C(=O)c2ccccc2)ccc1[O-]	ZINC000000784138	557079783	/nfs/dbraw/zinc/07/97/83/557079783.db2.gz	QZWDJGFAHTURAN-UHFFFAOYSA-N	-1	1	417.490	3.908	50	10		HHCAMM
O=C1[N-]C(=S)S/C1=C\c1ccccc1Oc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000008456338	557791496	/nfs/dbraw/zinc/79/14/96/557791496.db2.gz	GWVNLRQBKQFJBV-VGOFMYFVSA-N	-1	1	403.397	3.784	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)C1=Cc1cn(Cc2cccc3ccccc32)c2ccccc12	ZINC000005102344	559246592	/nfs/dbraw/zinc/24/65/92/559246592.db2.gz	MBERZHRIIBZACE-UHFFFAOYSA-N	-1	1	411.486	3.757	50	10		HHCAMM
CN(C)c1ccc([C@@H]2[C@@H]3C(=O)N(c4ccccc4)C([O-])=C3ON2c2ccccc2)cc1	ZINC000101997218	560806967	/nfs/dbraw/zinc/80/69/67/560806967.db2.gz	DGHHDANZEPTKRU-YTFSRNRJSA-N	-1	1	413.477	3.804	50	10		HHCAMM
COc1ccc(-c2coc3c(C[N@H+]4CCC[C@@H](C(=O)[O-])C4)c([O-])cc(C)c3c2=O)cc1	ZINC000094993354	568593883	/nfs/dbraw/zinc/59/38/83/568593883.db2.gz	MSNHTKCSVDVKBB-MRXNPFEDSA-N	-1	1	423.465	3.779	50	10		HHCAMM
O=C1C[C@H](c2ccncc2)c2c(c(O)c(=O)c3c([O-])cc(-c4ccccc4)oc2-3)O1	ZINC000096114171	568693854	/nfs/dbraw/zinc/69/38/54/568693854.db2.gz	MJTFGJNFTZONSL-CQSZACIVSA-N	-1	1	401.374	3.707	50	10	biogenic	HHCAMM
COc1ccc(-c2c3c[nH]nc3nc3c4ccc(O)c(O)c4oc32)c(C(=O)[O-])c1OC	ZINC000217928100	568920181	/nfs/dbraw/zinc/92/01/81/568920181.db2.gz	BKAUCMKQCJZYKR-UHFFFAOYSA-N	-1	1	421.365	3.651	50	10	biogenic	HHCAMM
O=C([O-])c1ccccc1-c1ccc(/C=C2/C(=O)NN(c3cccc(Cl)c3)C2=O)o1	ZINC000015821236	569010700	/nfs/dbraw/zinc/01/07/00/569010700.db2.gz	NUWWDGYOAIRITC-BOPFTXTBSA-N	-1	1	408.797	3.760	50	10		HHCAMM
O=C(CSc1nnc(-c2ccccc2)n1Cc1ccco1)c1ccc([O-])c(O)c1	ZINC000001278321	557253194	/nfs/dbraw/zinc/25/31/94/557253194.db2.gz	PKTIONATOPTZAV-UHFFFAOYSA-N	-1	1	407.451	3.973	50	10		HHCAMM
O=C1[N-]C(=O)/C(=C\c2cn(Cc3ccc(Cl)cc3Cl)c3ccccc23)C(=O)N1	ZINC000002900087	557424588	/nfs/dbraw/zinc/42/45/88/557424588.db2.gz	CROCWZZEDGMAJB-UHFFFAOYSA-N	-1	1	414.248	3.746	50	10		HHCAMM
O=C1[N-]C(=O)/C(=C/c2cn(Cc3ccc(Cl)cc3Cl)c3ccccc23)C(=O)N1	ZINC000002900087	557424589	/nfs/dbraw/zinc/42/45/89/557424589.db2.gz	CROCWZZEDGMAJB-UHFFFAOYSA-N	-1	1	414.248	3.746	50	10		HHCAMM
CSc1nnc(-c2ccccc2NC=C2C(C)=NN(c3ccccc3)C2=O)c(=O)[n-]1	ZINC000100381452	559134658	/nfs/dbraw/zinc/13/46/58/559134658.db2.gz	FUVDYDMPTGXVTL-VBKFSLOCSA-N	-1	1	418.482	3.685	50	10		HHCAMM
CSc1nnc(-c2ccccc2N=Cc2c(C)[nH]n(-c3ccccc3)c2=O)c(=O)[n-]1	ZINC000100381452	559134659	/nfs/dbraw/zinc/13/46/59/559134659.db2.gz	FUVDYDMPTGXVTL-VBKFSLOCSA-N	-1	1	418.482	3.685	50	10		HHCAMM
CN1c2ccc(S(=O)(=O)[N-]c3ccc4c(c3)OCO4)cc2C(=C2CCCC2)C1=O	ZINC000045895132	568421352	/nfs/dbraw/zinc/42/13/52/568421352.db2.gz	FEUQRZBWRHQWAO-UHFFFAOYSA-N	-1	1	412.467	3.520	50	10		HHCAMM
O=C1C[C@H](c2cccnc2)c2c(c(O)c(=O)c3c([O-])cc(-c4ccccc4)oc2-3)O1	ZINC000096115528	568695310	/nfs/dbraw/zinc/69/53/10/568695310.db2.gz	RSRRQFZGHNPIHP-CQSZACIVSA-N	-1	1	401.374	3.707	50	10	biogenic	HHCAMM
CCOc1cc(C=C2SC(=S)[N-]C2=O)ccc1OC(=O)c1ccc(F)cc1	ZINC000012411507	558401024	/nfs/dbraw/zinc/40/10/24/558401024.db2.gz	ZMFLFEWSTKDMLT-YBEGLDIGSA-N	-1	1	403.456	3.932	50	10		HHCAMM
Cc1cccc(OCCOCCOc2cccc(C=C3SC(=S)[N-]C3=O)c2)c1	ZINC000013941935	558604652	/nfs/dbraw/zinc/60/46/52/558604652.db2.gz	JMCJGKLISCBWCW-XMHGGMMESA-N	-1	1	415.536	3.958	50	10		HHCAMM
COc1c(Br)cc(C=C2SC(=S)[N-]C2=O)cc1Br	ZINC000015685504	558749054	/nfs/dbraw/zinc/74/90/54/558749054.db2.gz	FGDKWJUUYQTFFJ-YWEYNIOJSA-N	-1	1	409.124	3.709	50	10		HHCAMM
CN(C)c1ccc([C@@H]2[C@H]3C(=O)N(c4ccccc4)C([O-])=C3ON2c2ccccc2)cc1	ZINC000018165335	560780569	/nfs/dbraw/zinc/78/05/69/560780569.db2.gz	DGHHDANZEPTKRU-ZLNRFVROSA-N	-1	1	413.477	3.804	50	10		HHCAMM
CC(=O)n1cc(C=C2C(=O)[N-]C(=S)N(Cc3ccccc3)C2=O)c2ccccc21	ZINC000020075043	568587720	/nfs/dbraw/zinc/58/77/20/568587720.db2.gz	SKHOKLODPPYDDO-WQRHYEAKSA-N	-1	1	403.463	3.969	50	10	biogenic	HHCAMM
COc1ccc(N2CCN(CCCNc3cc(C(=O)[O-])c4ccccc4n3)CC2)cc1	ZINC000021715306	568749412	/nfs/dbraw/zinc/74/94/12/568749412.db2.gz	IGYFYAMGBZLLAM-UHFFFAOYSA-N	-1	1	420.513	3.566	50	10		HHCAMM
Cc1cc(C)cc(N2C(=O)C(=Cc3ccc(O[C@H](C)C(=O)[O-])cc3)C(=O)NC2=S)c1	ZINC000015821640	569010713	/nfs/dbraw/zinc/01/07/13/569010713.db2.gz	JVWBRFXQMKNNSY-XWAFYUISSA-N	-1	1	424.478	3.827	50	10		HHCAMM
COc1c(Br)cc(C=C2SC(=S)[N-]C2=O)cc1Br	ZINC000012417986	558402788	/nfs/dbraw/zinc/40/27/88/558402788.db2.gz	FGDKWJUUYQTFFJ-XBXARRHUSA-N	-1	1	409.124	3.709	50	10		HHCAMM
Cc1ccccc1OCCOCCOc1ccc(C=C2SC(=S)[N-]C2=O)cc1	ZINC000004672506	558884585	/nfs/dbraw/zinc/88/45/85/558884585.db2.gz	LJFFDLVKHZYRAA-RGEXLXHISA-N	-1	1	415.536	3.958	50	10		HHCAMM
Cc1[nH]n(-c2cccc(Cl)c2)c(=O)c1C=Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1[O-]	ZINC000101150135	560787055	/nfs/dbraw/zinc/78/70/55/560787055.db2.gz	HAFNQMAKUFCAFX-MDWZMJQESA-N	-1	1	417.765	3.581	50	10		HHCAMM
Cc1ccc(N2C(=O)CC(N3C(=O)C(=Cc4ccccc4)SC3=S)=C2[O-])cc1	ZINC000001447171	568985554	/nfs/dbraw/zinc/98/55/54/568985554.db2.gz	XGHFXIHGGRNLHX-FEEIMYBTSA-N	-1	1	408.504	3.528	50	10		HHCAMM
COc1cc(C=C2SC(=S)[N-]C2=O)ccc1OCCOc1ccc(C)cc1	ZINC000007078430	569218001	/nfs/dbraw/zinc/21/80/01/569218001.db2.gz	CYRDTIBZKWVSRM-LDADJPATSA-N	-1	1	401.509	3.950	50	10		HHCAMM
O=C(c1ccco1)c1coc2ccc([O-])c(CN3CCN(CC(F)(F)F)CC3)c12	ZINC000252497278	569387701	/nfs/dbraw/zinc/38/77/01/569387701.db2.gz	QCVQAPLOQHDKLS-UHFFFAOYSA-N	-1	1	408.376	3.642	50	10		HHCAMM
Cc1ccc(N2C(=O)CC(N3C(=O)C(=Cc4ccccc4)SC3=S)=C2[O-])cc1	ZINC000021548842	963488737	/nfs/dbraw/zinc/48/87/37/963488737.db2.gz	XGHFXIHGGRNLHX-KTZOAPACSA-N	-1	1	408.504	3.528	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)C1=Cc1cc(Cl)ccc1OCc1cccc2ccccc21	ZINC000002985510	557436596	/nfs/dbraw/zinc/43/65/96/557436596.db2.gz	VPHOUPBJNYKMJE-UHFFFAOYSA-N	-1	1	422.893	3.987	50	10		HHCAMM
O=C([O-])c1ccc(-c2ccc(/C=C3/C(=O)NN(c4ccc(Cl)cc4)C3=O)o2)cc1	ZINC000006221909	558583478	/nfs/dbraw/zinc/58/34/78/558583478.db2.gz	CWGRXFKQAMAUHJ-BOPFTXTBSA-N	-1	1	408.797	3.760	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C\c1cn(CCOc2ccccc2F)c2ccccc12	ZINC000018169547	560780826	/nfs/dbraw/zinc/78/08/26/560780826.db2.gz	JBTMKQFPPGLPON-UHFFFAOYSA-N	-1	1	409.442	3.614	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C/c1cn(CCOc2ccccc2F)c2ccccc12	ZINC000018169547	560780827	/nfs/dbraw/zinc/78/08/27/560780827.db2.gz	JBTMKQFPPGLPON-UHFFFAOYSA-N	-1	1	409.442	3.614	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)C1=Cc1cn(CCOc2ccccc2F)c2ccccc12	ZINC000018169547	560780828	/nfs/dbraw/zinc/78/08/28/560780828.db2.gz	JBTMKQFPPGLPON-UHFFFAOYSA-N	-1	1	409.442	3.614	50	10		HHCAMM
COc1ccc2occ(C(=O)c3coc4ccc([O-])c(CN5CCOCC5)c34)c2c1	ZINC000096593691	568763588	/nfs/dbraw/zinc/76/35/88/568763588.db2.gz	KUHYIBPOSCZBNN-UHFFFAOYSA-N	-1	1	407.422	3.956	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C\c1ccc(-c2cc(Cl)c([N+](=O)[O-])cc2Cl)o1	ZINC000001198003	960460933	/nfs/dbraw/zinc/46/09/33/960460933.db2.gz	JJACNKUPQDIRNF-UHFFFAOYSA-N	-1	1	412.210	3.916	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)/C1=C/c1ccc(-c2cc(Cl)c([N+](=O)[O-])cc2Cl)o1	ZINC000001198003	960460942	/nfs/dbraw/zinc/46/09/42/960460942.db2.gz	JJACNKUPQDIRNF-UHFFFAOYSA-N	-1	1	412.210	3.916	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)C1=Cc1ccc(-c2cc(Cl)c([N+](=O)[O-])cc2Cl)o1	ZINC000001198003	960460958	/nfs/dbraw/zinc/46/09/58/960460958.db2.gz	JJACNKUPQDIRNF-UHFFFAOYSA-N	-1	1	412.210	3.916	50	10		HHCAMM
COc1ccc(N2C(=O)/C(=C\c3cc(Cl)cc(Cl)c3[O-])C(=O)NC2=S)cc1	ZINC000009933371	536658175	/nfs/dbraw/zinc/65/81/75/536658175.db2.gz	QUGPNRJRQMTQLW-QPEQYQDCSA-N	-1	1	423.277	3.539	50	10		HHCAMM
Cc1c2ccc([O-])c(O)c2oc(=O)c1CC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000012895657	558483596	/nfs/dbraw/zinc/48/35/96/558483596.db2.gz	FTHQXXQYJVVVEM-UHFFFAOYSA-N	-1	1	407.466	3.536	50	10	biogenic	HHCAMM
O=C1[N-]C(=O)/C(=C\c2c(OCc3ccccc3Cl)ccc3ccccc32)C(=O)N1	ZINC000001176336	560727556	/nfs/dbraw/zinc/72/75/56/560727556.db2.gz	KNTKDCHNNZXWCF-UHFFFAOYSA-N	-1	1	406.825	3.822	50	10		HHCAMM
O=C1[N-]C(=O)/C(=C/c2c(OCc3ccccc3Cl)ccc3ccccc32)C(=O)N1	ZINC000001176336	560727558	/nfs/dbraw/zinc/72/75/58/560727558.db2.gz	KNTKDCHNNZXWCF-UHFFFAOYSA-N	-1	1	406.825	3.822	50	10		HHCAMM
Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)-c2ccccc2S(=O)(=O)[N-]3)cc1	ZINC000001085832	568768020	/nfs/dbraw/zinc/76/80/20/568768020.db2.gz	KIAIWGCNEMTYEN-UHFFFAOYSA-N	-1	1	400.481	3.577	50	10		HHCAMM
CC[C@@H](C)c1ccccc1OCCOc1ccc(C=C2C(=O)[N-]C(=S)NC2=O)cc1	ZINC000002978210	568832772	/nfs/dbraw/zinc/83/27/72/568832772.db2.gz	CQDCULUTWQUDPL-OAHLLOKOSA-N	-1	1	424.522	3.572	50	10		HHCAMM
CCN1C(=O)/C(=C/c2ccc(OCc3ccccc3Cl)cc2)C(=O)[N-]C1=S	ZINC000009328601	571248382	/nfs/dbraw/zinc/24/83/82/571248382.db2.gz	YIJNLFDOFACERT-LFIBNONCSA-N	-1	1	400.887	3.566	50	10		HHCAMM
CC[C@H](C)N1C(=O)/C(=C/c2c(C)[nH]c3ccc(Br)cc32)C(=O)[N-]C1=S	ZINC000001137814	960458656	/nfs/dbraw/zinc/45/86/56/960458656.db2.gz	KGJHCEFKCNUJON-PFMRQGHBSA-N	-1	1	420.332	3.664	50	10		HHCAMM
Cc1ccc(N2C(=O)/C(=C/c3cc(Cl)cc(Cl)c3[O-])C(=O)NC2=S)cc1	ZINC000002855384	132258513	/nfs/dbraw/zinc/25/85/13/132258513.db2.gz	BMDTYKQYHQPHGA-NTUHNPAUSA-N	-1	1	407.278	3.839	50	10		HHCAMM
CC[C@H](C)c1ccc(OCCOc2ccc(C=C3C(=O)[N-]C(=S)NC3=O)cc2)cc1	ZINC000002948378	557773871	/nfs/dbraw/zinc/77/38/71/557773871.db2.gz	ODQNXRHZLNPQLE-HNNXBMFYSA-N	-1	1	424.522	3.572	50	10		HHCAMM
O=S(=O)(c1cccs1)N1CCN(Cc2cc(Cl)c3ccccc3c2[O-])CC1	ZINC000025665620	558646965	/nfs/dbraw/zinc/64/69/65/558646965.db2.gz	LGBYGHDUFMSLBN-UHFFFAOYSA-N	-1	1	422.959	3.767	50	10		HHCAMM
Cc1ccc(N2NC(=O)/C(=C\c3ccc(-c4cc([N+](=O)[O-])ccc4[O-])o3)C2=O)cc1C	ZINC000033290941	559045601	/nfs/dbraw/zinc/04/56/01/559045601.db2.gz	JKFICPIMSFBOJJ-WOJGMQOQSA-N	-1	1	419.393	3.639	50	10		HHCAMM
Cc1cc(C(=O)Oc2ccc(C=C3SC(=S)[N-]C3=O)cc2)cc([N+](=O)[O-])c1	ZINC000005201148	560537866	/nfs/dbraw/zinc/53/78/66/560537866.db2.gz	PEXDPSAYRKEFES-OVCLIPMQSA-N	-1	1	400.437	3.611	50	10		HHCAMM
CCn1c(=O)c2c(nc1SCC(=O)c1ccc([O-])c(O)c1)sc1c2CCCC1	ZINC000002366572	569282653	/nfs/dbraw/zinc/28/26/53/569282653.db2.gz	ARYVDNDRBGAITD-UHFFFAOYSA-N	-1	1	416.524	3.743	50	10		HHCAMM
O=C([N-]N1C(=O)/C(=C/c2cccnc2)SC1=S)c1ccc(Cl)cc1Cl	ZINC000009477358	571261787	/nfs/dbraw/zinc/26/17/87/571261787.db2.gz	QGMXGSJENGHGCV-MLPAPPSSSA-N	-1	1	410.307	3.935	50	10		HHCAMM
O=C1Nc2ccc(S(=O)(=O)[N-]c3ccc(O)c(Br)c3)c3cccc1c23	ZINC000009404640	961640107	/nfs/dbraw/zinc/64/01/07/961640107.db2.gz	BRURZRRWOVEARE-UHFFFAOYSA-N	-1	1	419.256	3.674	50	10		HHCAMM
O=C([O-])c1cccc(-c2ccc(C=C3C(=O)NC(=O)N(Cc4ccco4)C3=O)o2)c1	ZINC000008742510	557803863	/nfs/dbraw/zinc/80/38/63/557803863.db2.gz	FFZYEWIBCULOPF-YBEGLDIGSA-N	-1	1	406.350	3.740	50	10		HHCAMM
CC[C@H](C)c1ccccc1OCCOc1ccc(C=C2C(=O)[N-]C(=S)NC2=O)cc1	ZINC000002978211	568832720	/nfs/dbraw/zinc/83/27/20/568832720.db2.gz	CQDCULUTWQUDPL-HNNXBMFYSA-N	-1	1	424.522	3.572	50	10		HHCAMM
CC(C)C12CN3CC(C(C)C)(CN(C1)C3c1cc(Br)ccc1[O-])C2=O	ZINC000019320129	569063805	/nfs/dbraw/zinc/06/38/05/569063805.db2.gz	XOAWCMBYCSAJIM-UHFFFAOYSA-N	-1	1	407.352	3.652	50	10	biogenic	HHCAMM
O=C1c2ccccc2N[C@H](c2cccc(Br)c2[O-])N1C[C@H]1CCCO1	ZINC000054681739	569293788	/nfs/dbraw/zinc/29/37/88/569293788.db2.gz	XAZFSJNVTDYTDT-XIKOKIGWSA-N	-1	1	403.276	3.900	50	10		HHCAMM
CCOC(=O)c1c(C)[nH]nc1N=Nc1c(=O)n(-c2ccccc2)[n-]c1-c1ccccc1	ZINC000252643870	569318885	/nfs/dbraw/zinc/31/88/85/569318885.db2.gz	ZYLRHQICOVSFPF-IBGZPJMESA-N	-1	1	416.441	3.798	50	10		HHCAMM
CCOc1ccc2ccccc2c1C=C1C(=O)[N-]C(=S)N(Cc2ccco2)C1=O	ZINC000016265490	962996945	/nfs/dbraw/zinc/99/69/45/962996945.db2.gz	QTTXOJYZIWEGQX-PDGQHHTCSA-N	-1	1	406.463	3.658	50	10		HHCAMM
Cc1[nH]n(-c2ccccc2)c(=O)c1C=C1C(=O)[N-]C(=O)N(c2ccc(C)c(C)c2)C1=O	ZINC000008770099	132333311	/nfs/dbraw/zinc/33/33/11/132333311.db2.gz	OPGWHUKWAMGKGS-IZILLXMLSA-N	-1	1	416.437	3.692	50	10		HHCAMM
COc1ccc(N2C(=O)/C(=C/c3cc(Cl)cc(Cl)c3[O-])C(=O)NC2=S)cc1	ZINC000002873466	536656874	/nfs/dbraw/zinc/65/68/74/536656874.db2.gz	QUGPNRJRQMTQLW-NTUHNPAUSA-N	-1	1	423.277	3.539	50	10		HHCAMM
O=C(CSc1nc(-c2ccccc2)cs1)Nc1cc(=O)n(-c2ccccc2)[n-]1	ZINC000004668952	557579130	/nfs/dbraw/zinc/57/91/30/557579130.db2.gz	AQJPMTQXDVJMLH-UHFFFAOYSA-N	-1	1	408.508	3.769	50	10		HHCAMM
O=[N+]([O-])c1cc(S(=O)(=O)[N-]c2ccc(O)c(Br)c2)ccc1Cl	ZINC000004973908	557619043	/nfs/dbraw/zinc/61/90/43/557619043.db2.gz	KAYRZSCFXGUCBX-UHFFFAOYSA-N	-1	1	407.629	3.517	50	10		HHCAMM
Cc1cc(C=Cc2nc([O-])c([N+](=O)[O-])c(=O)[nH]2)c(C)n1-c1cccc(C(F)(F)F)c1	ZINC000009186336	557825389	/nfs/dbraw/zinc/82/53/89/557825389.db2.gz	UVQMSHDTHQEJNE-VOTSOKGWSA-N	-1	1	420.347	3.980	50	10		HHCAMM
COc1cc(C=C2SC(=S)[N-]C2=O)ccc1OCc1ccc([N+](=O)[O-])cc1	ZINC000012419411	558403019	/nfs/dbraw/zinc/40/30/19/558403019.db2.gz	NGDKPMVSPCODHB-SXGWCWSVSA-N	-1	1	402.453	3.671	50	10		HHCAMM
CN(C)c1ccc([C@@H]2[C@@H]3C(=O)N(c4ccccc4)C([O-])=C3ON2c2ccccc2)cc1	ZINC000100799177	559268328	/nfs/dbraw/zinc/26/83/28/559268328.db2.gz	DGHHDANZEPTKRU-ZRBLBEILSA-N	-1	1	413.477	3.804	50	10		HHCAMM
CCn1c(=O)c2cc3ccccc3cc2nc1SCC(=O)c1ccc([O-])c(O)c1	ZINC000007577860	569268342	/nfs/dbraw/zinc/26/83/42/569268342.db2.gz	VFQMULUNKLCRIL-UHFFFAOYSA-N	-1	1	406.463	3.956	50	10		HHCAMM
Cn1cccc1/C=C1/SC(=S)N([N-]C(=O)c2ccc(Cl)cc2Cl)C1=O	ZINC000002407837	569396372	/nfs/dbraw/zinc/39/63/72/569396372.db2.gz	OHOZADWVTFRNDC-MDWZMJQESA-N	-1	1	412.323	3.878	50	10		HHCAMM
COc1cc(C=C2SC(=S)[N-]C2=O)ccc1OCc1ccccc1[N+](=O)[O-]	ZINC000013549715	558538739	/nfs/dbraw/zinc/53/87/39/558538739.db2.gz	ZUQJLPGNCZGQPD-SXGWCWSVSA-N	-1	1	402.453	3.671	50	10		HHCAMM
COc1ccc(OCCOc2ccc(C=C3SC(=S)[N-]C3=O)cc2OC)cc1	ZINC000015800627	558754277	/nfs/dbraw/zinc/75/42/77/558754277.db2.gz	BSIGWGDBFDLXNN-PDGQHHTCSA-N	-1	1	417.508	3.650	50	10		HHCAMM
Cc1[n-]n(-c2ccc(I)cc2)c(=O)c1C=Nc1ccccc1O	ZINC000015931901	558762818	/nfs/dbraw/zinc/76/28/18/558762818.db2.gz	DDJPKOBYTFHJEA-UVTDQMKNSA-N	-1	1	419.222	3.715	50	10		HHCAMM
COc1ccc(-n2[n-]c(C)c(C(C)=Nc3cc(OC)c(OC)c(OC)c3)c2=O)cc1	ZINC000100423033	559199515	/nfs/dbraw/zinc/19/95/15/559199515.db2.gz	WQHHQVTYVLIXTL-MOSHPQCFSA-N	-1	1	411.458	3.830	50	10		HHCAMM
Cc1ccc(N2NC(=O)/C(=C/c3ccc(-c4cc([N+](=O)[O-])ccc4[O-])o3)C2=O)cc1C	ZINC000036042412	569082524	/nfs/dbraw/zinc/08/25/24/569082524.db2.gz	JKFICPIMSFBOJJ-WQRHYEAKSA-N	-1	1	419.393	3.639	50	10		HHCAMM
O=C([O-])c1cccc(-c2ccc(/C=C3/C(=O)NN(c4ccc(Cl)cc4)C3=O)o2)c1	ZINC000012428660	569382485	/nfs/dbraw/zinc/38/24/85/569382485.db2.gz	OJWXVAZPRPROLV-BOPFTXTBSA-N	-1	1	408.797	3.760	50	10		HHCAMM
Cc1ccc(N2C(=O)CC(N3C(=O)C(=Cc4ccccc4)SC3=S)=C2[O-])cc1	ZINC000005785739	960779614	/nfs/dbraw/zinc/77/96/14/960779614.db2.gz	XGHFXIHGGRNLHX-PCJMVEANSA-N	-1	1	408.504	3.528	50	10		HHCAMM
O=c1cc(CSc2nc(C3CC3)n(-c3ccccc3)n2)c2cc(O)c([O-])cc2o1	ZINC000032945537	527481496	/nfs/dbraw/zinc/48/14/96/527481496.db2.gz	MFEWKRBYFHNCSY-UHFFFAOYSA-N	-1	1	407.451	3.955	50	10		HHCAMM
Cc1ccc(OCCOCCOc2ccccc2C=C2SC(=S)[N-]C2=O)cc1	ZINC000013892852	558599867	/nfs/dbraw/zinc/59/98/67/558599867.db2.gz	PZVXYWFFYNEMLN-RGEXLXHISA-N	-1	1	415.536	3.958	50	10		HHCAMM
Cc1ccc(OCCOCCOc2ccc(C=C3SC(=S)[N-]C3=O)cc2)cc1	ZINC000013942764	558604999	/nfs/dbraw/zinc/60/49/99/558604999.db2.gz	PGPZPHUMYQJTEC-RGEXLXHISA-N	-1	1	415.536	3.958	50	10		HHCAMM
O=C1[N-]C(=S)NC(=O)C1=CNc1nc(-c2ccc(C3CCCCC3)cc2)cs1	ZINC000017156751	558824376	/nfs/dbraw/zinc/82/43/76/558824376.db2.gz	UDSLWYJWAIKRJN-UHFFFAOYSA-N	-1	1	412.540	3.685	50	10		HHCAMM
COc1c(Br)cc(Br)cc1C=C1SC(=S)[N-]C1=O	ZINC000016406719	569041291	/nfs/dbraw/zinc/04/12/91/569041291.db2.gz	RIAMROZUXKEIEA-BAQGIRSFSA-N	-1	1	409.124	3.709	50	10		HHCAMM
O=c1cc2nc(-c3ccco3)nc(SCc3ccc(Br)cc3)n2[n-]1	ZINC000006915837	569180980	/nfs/dbraw/zinc/18/09/80/569180980.db2.gz	FAQWCMDOVXZAKA-UHFFFAOYSA-N	-1	1	403.261	3.732	50	10		HHCAMM
CCOC(=O)c1cnc(NC2=NC(=O)C(=Cc3cccc4ccccc34)S2)[n-]c1=O	ZINC000012860312	571308452	/nfs/dbraw/zinc/30/84/52/571308452.db2.gz	VIWTWMRPDZRBCM-MHWRWJLKSA-N	-1	1	420.450	3.595	50	10		HHCAMM