smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)Nc3cccc4[nH]ccc43)[C@H]21	ZINC000217619796	569880632	/nfs/dbraw/zinc/88/06/32/569880632.db2.gz	QUKNZOXUJCSDNZ-VWLOTQADSA-N	0	0	482.496	3.939	50	70	biogenic	JHIARN
CC(C)[C@H](NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O)c1nc2ccccc2n1C(C)C	ZINC000217677534	569880962	/nfs/dbraw/zinc/88/09/62/569880962.db2.gz	MBYSLJMFXQYDKZ-OFNKIYASSA-N	0	0	461.566	3.961	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)NCc3cccn3C(C)C)[C@H]21	ZINC000217679780	569880979	/nfs/dbraw/zinc/88/09/79/569880979.db2.gz	DZYRNGXTJRCBQT-VWLOTQADSA-N	0	0	488.544	3.517	50	70	biogenic	JHIARN
COc1ccc(CNC(=O)CCCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1OC	ZINC000218034799	569882532	/nfs/dbraw/zinc/88/25/32/569882532.db2.gz	MLCDRMJVNKFVCA-AREMUKBSSA-N	0	0	485.540	3.915	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)N3CCc4ccccc4C3)[C@@H]21	ZINC000217648682	569880839	/nfs/dbraw/zinc/88/08/39/569880839.db2.gz	MTQILWPSVRQRNF-HHHXNRCGSA-N	0	0	497.551	3.794	50	70	biogenic	JHIARN
COc1ccc(CNC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1OC	ZINC000217763880	569881473	/nfs/dbraw/zinc/88/14/73/569881473.db2.gz	YPUGRGTVMSZSRF-RUZDIDTESA-N	0	0	471.513	3.525	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)NCc3ccccc3)[C@@H]21	ZINC000217894655	569882080	/nfs/dbraw/zinc/88/20/80/569882080.db2.gz	LAOIKBWOTVWZDK-RUZDIDTESA-N	0	0	471.513	3.525	50	70	biogenic	JHIARN
COc1ccc(CNC(=O)CCCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1OC	ZINC000218034895	569882525	/nfs/dbraw/zinc/88/25/25/569882525.db2.gz	MLCDRMJVNKFVCA-SANMLTNESA-N	0	0	485.540	3.915	50	70	biogenic	JHIARN
Cc1cccc2cc([C@H]3CC(=O)Oc4cc(C)n(CCc5ccc(O)cc5)c(=O)c43)c(=O)[nH]c12	ZINC000218097095	569882756	/nfs/dbraw/zinc/88/27/56/569882756.db2.gz	NUFROAGFGNJQBZ-HXUWFJFHSA-N	0	0	456.498	3.696	50	70	biogenic	JHIARN
COc1cc(OC)c([C@H]2CC(=O)Oc3cc(C)n(CCc4ccc(O)cc4)c(=O)c32)cc1OC	ZINC000218123260	569882894	/nfs/dbraw/zinc/88/28/94/569882894.db2.gz	NPJORFRYYQYCTN-LJQANCHMSA-N	0	0	465.502	3.572	50	70	biogenic	JHIARN
COc1ccc(CCNC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1OC	ZINC000217598003	569880394	/nfs/dbraw/zinc/88/03/94/569880394.db2.gz	XHOALKXRTACBDM-SANMLTNESA-N	0	0	485.540	3.568	50	70	biogenic	JHIARN
COCc1cc(=O)c(O)c([C@H](CC(=O)N2CCc3c([nH]c4ccccc43)C2)c2ccc(C)o2)o1	ZINC000217604745	569880521	/nfs/dbraw/zinc/88/05/21/569880521.db2.gz	MEKTUGRWIVFWIV-LJQANCHMSA-N	0	0	462.502	3.981	50	70	biogenic	JHIARN
O=C(CCCCCN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@@H]21)NCC1CCOCC1	ZINC000217700696	569881068	/nfs/dbraw/zinc/88/10/68/569881068.db2.gz	QULHNGUBUFBUDR-RUZDIDTESA-N	0	0	461.562	3.905	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)Nc3ccc(F)c(F)c3F)[C@H]21	ZINC000217721199	569881173	/nfs/dbraw/zinc/88/11/73/569881173.db2.gz	JBPDOGBIAIQHJL-QHCPKHFHSA-N	0	0	497.429	3.875	50	70	biogenic	JHIARN
COCc1cc(=O)c(O)c([C@@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2ccc(O)cc2)o1	ZINC000217880488	569881978	/nfs/dbraw/zinc/88/19/78/569881978.db2.gz	PRUITEWAVTXRKV-NRFANRHFSA-N	0	0	474.513	3.786	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1cc(OC)c(OC)c(OC)c1)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217922712	569882097	/nfs/dbraw/zinc/88/20/97/569882097.db2.gz	WRAMPEAXAKITAZ-HXUWFJFHSA-N	0	0	497.544	3.531	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCc3ccco3)[C@H]21	ZINC000217965589	569882247	/nfs/dbraw/zinc/88/22/47/569882247.db2.gz	UGBZKYGNCGRSMN-DEOSSOPVSA-N	0	0	475.501	3.508	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)Nc1ccc(NC(=O)C2CCC2)c(OC)c1	ZINC000218480033	569883402	/nfs/dbraw/zinc/88/34/02/569883402.db2.gz	CPRISXPYWFODDZ-SFHVURJKSA-N	0	0	454.479	3.691	50	70		JHIARN
CC(=O)Nc1ccc(NC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1	ZINC000217863697	569881920	/nfs/dbraw/zinc/88/19/20/569881920.db2.gz	PKWJPLXYFWZJMD-XMMPIXPASA-N	0	0	454.486	3.789	50	70	biogenic	JHIARN
COC(=O)[C@H](Cc1ccccc1)NC(=O)CC/C(C)=C/Cc1c(OC)c2c(c(C)c1OC)COC2=O	ZINC000217724553	569881252	/nfs/dbraw/zinc/88/12/52/569881252.db2.gz	ROXXVBDOTANZJA-BVZCLVNKSA-N	0	0	495.572	3.852	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCCc3ccco3)[C@@H]21	ZINC000217790222	569881553	/nfs/dbraw/zinc/88/15/53/569881553.db2.gz	VVPOHBQKUHZXQI-RUZDIDTESA-N	0	0	489.528	3.551	50	70	biogenic	JHIARN
COc1ccccc1N1CCN(C(=O)CN2c3cccnc3Sc3ccccc3C2=O)CC1	ZINC000218381219	569883267	/nfs/dbraw/zinc/88/32/67/569883267.db2.gz	HZAKUKUWBMNPBJ-UHFFFAOYSA-N	0	0	460.559	3.550	50	70		JHIARN
CSCC[C@H](NC(=O)c1c(C)cc(C)n(C[C@@H]2CCCO2)c1=O)c1nc2ccccc2[nH]1	ZINC000218466332	569883366	/nfs/dbraw/zinc/88/33/66/569883366.db2.gz	STXJRDLZRUAPEX-PXNSSMCTSA-N	0	0	454.596	3.745	50	70		JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCCCC(=O)NC(C)C)[C@@H]21	ZINC000217593226	569880444	/nfs/dbraw/zinc/88/04/44/569880444.db2.gz	ASKBLOSMVNQOPY-XMMPIXPASA-N	0	0	465.550	3.904	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3nc(C)cs3)[C@H]21	ZINC000217625928	569880650	/nfs/dbraw/zinc/88/06/50/569880650.db2.gz	RHVIVHLYCFZIOQ-NRFANRHFSA-N	0	0	478.530	3.612	50	70	biogenic	JHIARN
Cc1cc(=O)c(O)c([C@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2ccc3c(c2)OCO3)o1	ZINC000217647705	569880797	/nfs/dbraw/zinc/88/07/97/569880797.db2.gz	ICFLWOXDKKQFKL-LJQANCHMSA-N	0	0	472.497	3.971	50	70	biogenic	JHIARN
COc1ccc(CCNC(=O)CCCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1	ZINC000217686226	569881037	/nfs/dbraw/zinc/88/10/37/569881037.db2.gz	SMMOSMJUODVBKL-SANMLTNESA-N	0	0	469.541	3.949	50	70	biogenic	JHIARN
O=C1Nc2c(cccc2C(F)(F)F)[C@@]12[C@H]1C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1[C@@H]1CCCN12	ZINC000217728415	569881242	/nfs/dbraw/zinc/88/12/42/569881242.db2.gz	JACTYZJSKFLAHC-QNFHRHJVSA-N	0	0	475.854	3.790	50	70		JHIARN
COc1ccc([C@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2oc(C)cc(=O)c2O)cc1O	ZINC000217748262	569881469	/nfs/dbraw/zinc/88/14/69/569881469.db2.gz	QFGSIXIIHZXFJB-IBGZPJMESA-N	0	0	474.513	3.956	50	70	biogenic	JHIARN
COc1cc([C@@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2oc(C)cc(=O)c2O)ccc1O	ZINC000217785983	569881519	/nfs/dbraw/zinc/88/15/19/569881519.db2.gz	BWGTWGIWNBYCPK-LJQANCHMSA-N	0	0	474.513	3.956	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)Nc3cccnc3)[C@H]21	ZINC000217800671	569881619	/nfs/dbraw/zinc/88/16/19/569881619.db2.gz	NMMMOJQJIOZXEP-DEOSSOPVSA-N	0	0	472.501	3.633	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCc3ccccc3)[C@H]21	ZINC000218013681	569882417	/nfs/dbraw/zinc/88/24/17/569882417.db2.gz	SWIXDKLLWPZVKC-SANMLTNESA-N	0	0	485.540	3.915	50	70	biogenic	JHIARN
CC(C)[C@H](NC(=O)COc1cc(O)c2c(c1)OC(C)(C)CC2=O)c1nc2ccccc2n1C	ZINC000218092943	569882757	/nfs/dbraw/zinc/88/27/57/569882757.db2.gz	OGAIJTGPCNZVFK-QHCPKHFHSA-N	0	0	451.523	3.915	50	70	biogenic	JHIARN
COc1cc(OC)c([C@@H]2CC(=O)Oc3cc(C)n(CCc4ccc(O)cc4)c(=O)c32)cc1OC	ZINC000218123179	569882881	/nfs/dbraw/zinc/88/28/81/569882881.db2.gz	NPJORFRYYQYCTN-IBGZPJMESA-N	0	0	465.502	3.572	50	70	biogenic	JHIARN
COc1ccc(CCNC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1OC	ZINC000217597924	569880392	/nfs/dbraw/zinc/88/03/92/569880392.db2.gz	XHOALKXRTACBDM-AREMUKBSSA-N	0	0	485.540	3.568	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1c(=O)[nH][nH]c1Cc1ccc2c(c1)CCC(C)(C)O2)c1cc(OC)c(O)c(OC)c1	ZINC000217831626	569881762	/nfs/dbraw/zinc/88/17/62/569881762.db2.gz	DHHASSSNGXCXEC-SFHVURJKSA-N	0	0	496.560	3.815	50	70	biogenic	JHIARN
Cc1ccc2occ([C@H]3CC(=O)Oc4cc(C)n(CCc5ccc(O)cc5)c(=O)c43)c(=O)c2c1	ZINC000217998265	569882383	/nfs/dbraw/zinc/88/23/83/569882383.db2.gz	XAOJZFMPJODACE-LJQANCHMSA-N	0	0	457.482	3.961	50	70	biogenic	JHIARN
COc1ccc([C@@H]2CC(=O)Oc3cc(C)n(CCc4ccc(O)cc4)c(=O)c32)c(OC)c1OC	ZINC000218001090	569882384	/nfs/dbraw/zinc/88/23/84/569882384.db2.gz	HDTJAUZMUYCGQD-IBGZPJMESA-N	0	0	465.502	3.572	50	70	biogenic	JHIARN
CC(C)C[C@H](NC(=O)c1cc(Br)ccc1-n1cnnn1)c1nc2ccccc2[nH]1	ZINC000218602638	569883467	/nfs/dbraw/zinc/88/34/67/569883467.db2.gz	KZNYZUKROYQYBJ-KRWDZBQOSA-N	0	0	454.332	3.818	50	70		JHIARN
Cc1cc(=O)c(O)c([C@@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2ccc3c(c2)OCO3)o1	ZINC000217647785	569880818	/nfs/dbraw/zinc/88/08/18/569880818.db2.gz	ICFLWOXDKKQFKL-IBGZPJMESA-N	0	0	472.497	3.971	50	70	biogenic	JHIARN
COc1ccc(CCNC(=O)CCCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1	ZINC000217686138	569881018	/nfs/dbraw/zinc/88/10/18/569881018.db2.gz	SMMOSMJUODVBKL-AREMUKBSSA-N	0	0	469.541	3.949	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)Nc3ccc(F)c(F)c3F)[C@@H]21	ZINC000217721281	569881154	/nfs/dbraw/zinc/88/11/54/569881154.db2.gz	JBPDOGBIAIQHJL-HSZRJFAPSA-N	0	0	497.429	3.875	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)Nc3nccs3)[C@@H]21	ZINC000217749931	569881444	/nfs/dbraw/zinc/88/14/44/569881444.db2.gz	AQDJHBGFGVQOIU-OAQYLSRUSA-N	0	0	478.530	3.694	50	70	biogenic	JHIARN
COc1ccc(CCNC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1	ZINC000217898130	569882047	/nfs/dbraw/zinc/88/20/47/569882047.db2.gz	CYNWANRRBGMMBQ-VWLOTQADSA-N	0	0	455.514	3.559	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1coc2ccccc2c1=O)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000218120077	569882842	/nfs/dbraw/zinc/88/28/42/569882842.db2.gz	VRIGIVZGOYOSAA-FQEVSTJZSA-N	0	0	475.497	3.612	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)Nc1cccc(C(=O)Nc2nccs2)c1	ZINC000218277628	569883189	/nfs/dbraw/zinc/88/31/89/569883189.db2.gz	TVPBMCSLIVPSBG-INIZCTEOSA-N	0	0	453.476	3.653	50	70		JHIARN
Cc1cccc2cc([C@@H]3CC(=O)Oc4cc(C)n(CCc5ccc(O)cc5)c(=O)c43)c(=O)[nH]c12	ZINC000218097022	569882716	/nfs/dbraw/zinc/88/27/16/569882716.db2.gz	NUFROAGFGNJQBZ-FQEVSTJZSA-N	0	0	456.498	3.696	50	70	biogenic	JHIARN
CSCC[C@H](NC(=O)CCCCCn1nnc2ccccc2c1=O)c1nc2ccccc2n1C	ZINC000218273898	569883119	/nfs/dbraw/zinc/88/31/19/569883119.db2.gz	XOSSNTAALQKETL-NRFANRHFSA-N	0	0	478.622	3.849	50	70		JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)Nc3ccccn3)[C@@H]21	ZINC000217755578	569881401	/nfs/dbraw/zinc/88/14/01/569881401.db2.gz	BGBZMJBVWWOPIN-XMMPIXPASA-N	0	0	472.501	3.633	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1ccc(OC)c(OC)c1)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217803853	569881736	/nfs/dbraw/zinc/88/17/36/569881736.db2.gz	KSEHIAQMJGPHIY-FQEVSTJZSA-N	0	0	467.518	3.523	50	70	biogenic	JHIARN
COCc1cc(=O)c(O)c([C@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2ccc(O)cc2)o1	ZINC000217880417	569882023	/nfs/dbraw/zinc/88/20/23/569882023.db2.gz	PRUITEWAVTXRKV-OAQYLSRUSA-N	0	0	474.513	3.786	50	70	biogenic	JHIARN
CSCC[C@H](NC(=O)COc1ccc2c(C)cc(=O)oc2c1)c1nc2ccccc2n1C	ZINC000217906411	569882054	/nfs/dbraw/zinc/88/20/54/569882054.db2.gz	IGRUJBLMOORAIT-IBGZPJMESA-N	0	0	451.548	3.978	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)Nc1ccc(NC(=O)C2CCC2)c(OC)c1	ZINC000218480103	569883412	/nfs/dbraw/zinc/88/34/12/569883412.db2.gz	CPRISXPYWFODDZ-GOSISDBHSA-N	0	0	454.479	3.691	50	70		JHIARN
COC(=O)C[C@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[nH][nH]c1=O)c1cc2c(c(OC)c1)OCO2	ZINC000217653434	569880901	/nfs/dbraw/zinc/88/09/01/569880901.db2.gz	WSDVFLQAOJDJSU-SFHVURJKSA-N	0	0	494.544	3.830	50	70	biogenic	JHIARN
COc1cc([C@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2oc(C)cc(=O)c2O)ccc1O	ZINC000217785912	569881502	/nfs/dbraw/zinc/88/15/02/569881502.db2.gz	BWGTWGIWNBYCPK-IBGZPJMESA-N	0	0	474.513	3.956	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)Nc1cccc(C(=O)Nc2nccs2)c1	ZINC000218277547	569883222	/nfs/dbraw/zinc/88/32/22/569883222.db2.gz	TVPBMCSLIVPSBG-MRXNPFEDSA-N	0	0	453.476	3.653	50	70		JHIARN
COC(=O)[C@H](CC(C)C)NC(=O)CC/C(C)=C/Cc1c(OC)c2c(c(C)c1OC)COC2=O	ZINC000217625444	569880678	/nfs/dbraw/zinc/88/06/78/569880678.db2.gz	WRIAWOBSNUUJRD-UCSSQIFYSA-N	0	0	461.555	3.656	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)N3CCc4ccccc4C3)[C@H]21	ZINC000217648605	569880784	/nfs/dbraw/zinc/88/07/84/569880784.db2.gz	MTQILWPSVRQRNF-MHZLTWQESA-N	0	0	497.551	3.794	50	70	biogenic	JHIARN
COCc1cc(=O)c(O)c([C@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2cccc(O)c2)o1	ZINC000217713768	569881123	/nfs/dbraw/zinc/88/11/23/569881123.db2.gz	VUJSVDOHSBUOIT-OAQYLSRUSA-N	0	0	474.513	3.786	50	70	biogenic	JHIARN
O=C1Nc2c(cccc2C(F)(F)F)[C@]12[C@H]1C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]1[C@@H]1CCCN12	ZINC000217728497	569881282	/nfs/dbraw/zinc/88/12/82/569881282.db2.gz	JACTYZJSKFLAHC-FSBGXSNOSA-N	0	0	475.854	3.790	50	70		JHIARN
COc1ccc(CNC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1OC	ZINC000217763964	569881432	/nfs/dbraw/zinc/88/14/32/569881432.db2.gz	YPUGRGTVMSZSRF-VWLOTQADSA-N	0	0	471.513	3.525	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)NC3CCCCCC3)[C@@H]21	ZINC000217699274	569881022	/nfs/dbraw/zinc/88/10/22/569881022.db2.gz	PIGROARWBXEHSF-XMMPIXPASA-N	0	0	463.534	3.658	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1cc2c(c(Cl)c1)OCO2)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217816943	569881721	/nfs/dbraw/zinc/88/17/21/569881721.db2.gz	QAJNAIVDPRXECH-GOSISDBHSA-N	0	0	485.920	3.888	50	70	biogenic	JHIARN
COc1ccc(N2C[C@@H](C(=O)N[C@@H](CC(C)C)c3nc4ccccc4[nH]3)CC2=O)c(OC)c1	ZINC000218206303	569883003	/nfs/dbraw/zinc/88/30/03/569883003.db2.gz	JDIVDSOHAUKHFL-JXFKEZNVSA-N	0	0	450.539	3.837	50	70		JHIARN
CC(C)C[C@H](NC(=O)c1cc(Br)ccc1-n1cnnn1)c1nc2ccccc2n1C	ZINC000218387419	569883375	/nfs/dbraw/zinc/88/33/75/569883375.db2.gz	QPSSQCOMACHBQK-KRWDZBQOSA-N	0	0	468.359	3.829	50	70		JHIARN
COc1cc(NC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc(OC)c1OC	ZINC000217642226	569880790	/nfs/dbraw/zinc/88/07/90/569880790.db2.gz	OPLUAAMDJXKLEW-RUZDIDTESA-N	0	0	487.512	3.856	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)Nc3ccc4cc[nH]c4c3)[C@H]21	ZINC000217811335	569881723	/nfs/dbraw/zinc/88/17/23/569881723.db2.gz	KPUDHZIBRALYDA-VWLOTQADSA-N	0	0	482.496	3.939	50	70	biogenic	JHIARN
COc1c2c(c(C)c(OC)c1C/C=C(\C)CCC(=O)NCc1c(C)nn(C)c1C)COC2=O	ZINC000217660600	569880917	/nfs/dbraw/zinc/88/09/17/569880917.db2.gz	OSUGAQBOMRLXCT-RIYZIHGNSA-N	0	0	455.555	3.618	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3cccc(O)c3)[C@@H]21	ZINC000217729558	569881286	/nfs/dbraw/zinc/88/12/86/569881286.db2.gz	GOGQIYHASZQRAC-XMMPIXPASA-N	0	0	473.485	3.553	50	70	biogenic	JHIARN
O=C(CCCN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@H]21)NCc1ccc2c(c1)OCO2	ZINC000217865305	569881921	/nfs/dbraw/zinc/88/19/21/569881921.db2.gz	RGQVDQKSOHGSCE-VWLOTQADSA-N	0	0	469.497	3.627	50	70	biogenic	JHIARN
O=C(CN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@H]21)Nc1ccc2c(c1)OCCCO2	ZINC000217862814	569881923	/nfs/dbraw/zinc/88/19/23/569881923.db2.gz	DYOYLNBCYGCEJA-DEOSSOPVSA-N	0	0	455.470	3.601	50	70	biogenic	JHIARN
O=C(CN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@H]21)NCCn1ccc2ccccc21	ZINC000217937115	569882188	/nfs/dbraw/zinc/88/21/88/569882188.db2.gz	PUSKIOGKDFXLOB-VWLOTQADSA-N	0	0	450.498	3.573	50	70	biogenic	JHIARN
COc1ccc(N2C[C@H](C(=O)N[C@@H](CC(C)C)c3nc4ccccc4[nH]3)CC2=O)c(OC)c1	ZINC000218206216	569882984	/nfs/dbraw/zinc/88/29/84/569882984.db2.gz	JDIVDSOHAUKHFL-UZLBHIALSA-N	0	0	450.539	3.837	50	70		JHIARN
COC(=O)C[C@@H](c1cc(F)c(F)c(F)c1)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000218453681	569883374	/nfs/dbraw/zinc/88/33/74/569883374.db2.gz	JVOHFEGMEIYEGH-KRWDZBQOSA-N	0	0	461.436	3.923	50	70		JHIARN
COC(=O)c1ccc(NC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1	ZINC000217696566	569881028	/nfs/dbraw/zinc/88/10/28/569881028.db2.gz	FHRXAOLHHLTACC-QHCPKHFHSA-N	0	0	455.470	3.617	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1ccc(OC)c(OC)c1)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217803788	569881666	/nfs/dbraw/zinc/88/16/66/569881666.db2.gz	KSEHIAQMJGPHIY-HXUWFJFHSA-N	0	0	467.518	3.523	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)NCCc3ccccc3)[C@H]21	ZINC000217935062	569882195	/nfs/dbraw/zinc/88/21/95/569882195.db2.gz	XDYUFFUJNSAXOX-SANMLTNESA-N	0	0	485.540	3.568	50	70	biogenic	JHIARN
Cc1nc2cc(NC(=O)C[C@@H]3NC(=O)c4ccccc4NC3=O)ccc2n1CCc1ccccc1	ZINC000218027460	569882462	/nfs/dbraw/zinc/88/24/62/569882462.db2.gz	QIFYDSCLMUTDTC-QHCPKHFHSA-N	0	0	467.529	3.667	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3cccc(O)c3)[C@H]21	ZINC000217729479	569881208	/nfs/dbraw/zinc/88/12/08/569881208.db2.gz	GOGQIYHASZQRAC-DEOSSOPVSA-N	0	0	473.485	3.553	50	70	biogenic	JHIARN
Cc1cc2c(c(=O)n1CCc1ccc(O)cc1)[C@@H](c1cc3cccc4c3n(c1=O)CCC4)CC(=O)O2	ZINC000218075987	569882664	/nfs/dbraw/zinc/88/26/64/569882664.db2.gz	PAOOEOOOGHJIPU-JOCHJYFZSA-N	0	0	482.536	3.807	50	70	biogenic	JHIARN
Cc1ccc2[nH]c(=O)c([C@H]3CC(=O)Oc4cc(C)n(CCc5ccc(O)cc5)c(=O)c43)cc2c1	ZINC000218087071	569882748	/nfs/dbraw/zinc/88/27/48/569882748.db2.gz	PJIHUGRQTPNTBI-HXUWFJFHSA-N	0	0	456.498	3.696	50	70	biogenic	JHIARN
COc1ccc(N2C(=O)N[C@@H](CC(=O)NCCC(c3ccccc3)c3ccccc3)C2=O)cc1	ZINC000218444674	569883364	/nfs/dbraw/zinc/88/33/64/569883364.db2.gz	NTGBXEMJTHANOJ-DEOSSOPVSA-N	0	0	457.530	3.849	50	70		JHIARN
COc1c(C)c2c(c(O)c1C/C=C(\C)CCC(=O)N1CCN(c3ccccc3)CC1)C(=O)OC2	ZINC000217785609	569881550	/nfs/dbraw/zinc/88/15/50/569881550.db2.gz	LYYYWADLIZTFMB-GIJQJNRQSA-N	0	0	464.562	3.997	50	70	biogenic	JHIARN
COCc1cc(=O)c(O)c([C@@H](CC(=O)N2CCc3c([nH]c4ccccc43)C2)c2ccc(C)o2)o1	ZINC000217604827	569880481	/nfs/dbraw/zinc/88/04/81/569880481.db2.gz	MEKTUGRWIVFWIV-IBGZPJMESA-N	0	0	462.502	3.981	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[nH][nH]c1=O)c1cc2ccccc2[nH]c1=O	ZINC000217856762	569881897	/nfs/dbraw/zinc/88/18/97/569881897.db2.gz	NBKWJLHZENGXDA-IBGZPJMESA-N	0	0	487.556	3.934	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)Nc1cccc(-c2nnc(-c3cccnc3)[nH]2)c1	ZINC000218122984	569882836	/nfs/dbraw/zinc/88/28/36/569882836.db2.gz	MQOJFLZANWYOCH-LJQANCHMSA-N	0	0	471.473	3.791	50	70		JHIARN
COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)Nc1cccc(-c2nc(-c3ccccn3)n[nH]2)c1	ZINC000218356743	569883263	/nfs/dbraw/zinc/88/32/63/569883263.db2.gz	OXRGYEVBKCXDPJ-LJQANCHMSA-N	0	0	471.473	3.791	50	70		JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCCCC(=O)NC(C)C)[C@H]21	ZINC000217593154	569880436	/nfs/dbraw/zinc/88/04/36/569880436.db2.gz	ASKBLOSMVNQOPY-DEOSSOPVSA-N	0	0	465.550	3.904	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3ccc4[nH]cnc4c3)[C@@H]21	ZINC000217717767	569881140	/nfs/dbraw/zinc/88/11/40/569881140.db2.gz	RMXVQIMTBZHREQ-RUZDIDTESA-N	0	0	497.511	3.724	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3ccc(O)cc3)[C@@H]21	ZINC000217809752	569881689	/nfs/dbraw/zinc/88/16/89/569881689.db2.gz	FZPMYVCLJUYLBR-XMMPIXPASA-N	0	0	473.485	3.553	50	70	biogenic	JHIARN
COc1ccc(CCNC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1	ZINC000217898044	569882091	/nfs/dbraw/zinc/88/20/91/569882091.db2.gz	CYNWANRRBGMMBQ-RUZDIDTESA-N	0	0	455.514	3.559	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[nH][nH]c1=O)c1ccc2c(c1)OCO2	ZINC000217860726	569881929	/nfs/dbraw/zinc/88/19/29/569881929.db2.gz	AGUSGTUWHSBTPE-GOSISDBHSA-N	0	0	464.518	3.821	50	70	biogenic	JHIARN
O=C(CN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@@H]21)Nc1ccc2c(c1)OCCCO2	ZINC000217862743	569881943	/nfs/dbraw/zinc/88/19/43/569881943.db2.gz	DYOYLNBCYGCEJA-XMMPIXPASA-N	0	0	455.470	3.601	50	70	biogenic	JHIARN
COc1cc([C@H]2CC(=O)Oc3cc(C)n(CCc4ccc(O)cc4)c(=O)c32)cc(OC)c1OC	ZINC000217978625	569882297	/nfs/dbraw/zinc/88/22/97/569882297.db2.gz	QMOAFPSEYIZPGR-LJQANCHMSA-N	0	0	465.502	3.572	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1cc2c(cc1O)OCO2)c1cc2cc(C)cc(C)c2nc1N1CCOCC1	ZINC000218139513	569882960	/nfs/dbraw/zinc/88/29/60/569882960.db2.gz	HSXNGFHAUDCIQB-GOSISDBHSA-N	0	0	464.518	3.818	50	70		JHIARN
COc1cc(NC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc(OC)c1OC	ZINC000217642311	569880774	/nfs/dbraw/zinc/88/07/74/569880774.db2.gz	OPLUAAMDJXKLEW-VWLOTQADSA-N	0	0	487.512	3.856	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3ccc(O)cc3)[C@H]21	ZINC000217809676	569881657	/nfs/dbraw/zinc/88/16/57/569881657.db2.gz	FZPMYVCLJUYLBR-DEOSSOPVSA-N	0	0	473.485	3.553	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)NCCc3ccccc3)[C@@H]21	ZINC000217935141	569882226	/nfs/dbraw/zinc/88/22/26/569882226.db2.gz	XDYUFFUJNSAXOX-AREMUKBSSA-N	0	0	485.540	3.568	50	70	biogenic	JHIARN
COc1ccc([C@H]2CC(=O)Oc3cc(C)n(CCc4ccc(O)cc4)c(=O)c32)c(OC)c1OC	ZINC000218001176	569882408	/nfs/dbraw/zinc/88/24/08/569882408.db2.gz	HDTJAUZMUYCGQD-LJQANCHMSA-N	0	0	465.502	3.572	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1coc2ccccc2c1=O)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000218119977	569882777	/nfs/dbraw/zinc/88/27/77/569882777.db2.gz	VRIGIVZGOYOSAA-HXUWFJFHSA-N	0	0	475.497	3.612	50	70	biogenic	JHIARN
CN(C(=O)COc1ccc2occ(-c3ccc(Br)s3)c2c1)[C@H]1CCS(=O)(=O)C1	ZINC000218299444	569883220	/nfs/dbraw/zinc/88/32/20/569883220.db2.gz	LELLOKLQURLQLG-LBPRGKRZSA-N	0	0	484.393	3.948	50	70		JHIARN
O=C(CC[C@@H]1NC(=O)c2ccccc2NC1=O)NCCc1nc(-c2ccc(Cl)cc2)cs1	ZINC000217685289	569881081	/nfs/dbraw/zinc/88/10/81/569881081.db2.gz	FFUGQQKACINYGS-SFHVURJKSA-N	0	0	468.966	3.653	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCCc3ccco3)[C@H]21	ZINC000217790147	569881570	/nfs/dbraw/zinc/88/15/70/569881570.db2.gz	VVPOHBQKUHZXQI-VWLOTQADSA-N	0	0	489.528	3.551	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)Nc3cccnc3)[C@@H]21	ZINC000217800746	569881588	/nfs/dbraw/zinc/88/15/88/569881588.db2.gz	NMMMOJQJIOZXEP-XMMPIXPASA-N	0	0	472.501	3.633	50	70	biogenic	JHIARN
COCCCNC(=O)CCCCCN1C(=O)c2ccccc2N2C(=O)c3c(ccc(OC)c3OC)[C@H]21	ZINC000217787325	569881638	/nfs/dbraw/zinc/88/16/38/569881638.db2.gz	SVEIKLYGHYWVGE-VWLOTQADSA-N	0	0	495.576	3.532	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1cc2c(c(Cl)c1)OCO2)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217817014	569881734	/nfs/dbraw/zinc/88/17/34/569881734.db2.gz	QAJNAIVDPRXECH-SFHVURJKSA-N	0	0	485.920	3.888	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1c(=O)[nH][nH]c1Cc1ccc2c(c1)CCC(C)(C)O2)c1cc(OC)c(O)c(OC)c1	ZINC000217831548	569881764	/nfs/dbraw/zinc/88/17/64/569881764.db2.gz	DHHASSSNGXCXEC-GOSISDBHSA-N	0	0	496.560	3.815	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[nH][nH]c1=O)c1ccc2c(c1)OCO2	ZINC000217860793	569881910	/nfs/dbraw/zinc/88/19/10/569881910.db2.gz	AGUSGTUWHSBTPE-SFHVURJKSA-N	0	0	464.518	3.821	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCCC(C)C)[C@H]21	ZINC000217857910	569881917	/nfs/dbraw/zinc/88/19/17/569881917.db2.gz	RBMOLXMOKRPNRX-DEOSSOPVSA-N	0	0	465.550	3.761	50	70	biogenic	JHIARN
O=C(CCCN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@@H]21)NCc1ccc2c(c1)OCO2	ZINC000217865237	569881925	/nfs/dbraw/zinc/88/19/25/569881925.db2.gz	RGQVDQKSOHGSCE-RUZDIDTESA-N	0	0	469.497	3.627	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[nH][nH]c1=O)c1cc2ccccc2[nH]c1=O	ZINC000217856835	569881941	/nfs/dbraw/zinc/88/19/41/569881941.db2.gz	NBKWJLHZENGXDA-LJQANCHMSA-N	0	0	487.556	3.934	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1cc(OC)c(OC)cc1OC)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217888256	569881988	/nfs/dbraw/zinc/88/19/88/569881988.db2.gz	NIPPYCZTUHBUFK-FQEVSTJZSA-N	0	0	497.544	3.531	50	70	biogenic	JHIARN
Cc1cc2c(c(=O)n1CCc1ccc(O)cc1)[C@H](c1cc3cccc4c3n(c1=O)CCC4)CC(=O)O2	ZINC000218075901	569882617	/nfs/dbraw/zinc/88/26/17/569882617.db2.gz	PAOOEOOOGHJIPU-QFIPXVFZSA-N	0	0	482.536	3.807	50	70	biogenic	JHIARN
COc1ccc(N2C[C@@H](C(=O)N[C@@H](CC(C)C)c3nc4ccccc4n3C)CC2=O)c(OC)c1	ZINC000218280614	569883238	/nfs/dbraw/zinc/88/32/38/569883238.db2.gz	BKJCVPUPNNKXFD-PXNSSMCTSA-N	0	0	464.566	3.847	50	70		JHIARN
CSCC[C@H](NC(=O)c1c(C)cc(C)n(C[C@H]2CCCO2)c1=O)c1nc2ccccc2[nH]1	ZINC000218466402	569883368	/nfs/dbraw/zinc/88/33/68/569883368.db2.gz	STXJRDLZRUAPEX-XLIONFOSSA-N	0	0	454.596	3.745	50	70		JHIARN
CC(C)[C@H](NC(=O)CC[C@@H]1NC(=O)c2ccccc2NC1=O)c1nc2ccccc2n1C(C)C	ZINC000217677444	569880960	/nfs/dbraw/zinc/88/09/60/569880960.db2.gz	MBYSLJMFXQYDKZ-REWPJTCUSA-N	0	0	461.566	3.961	50	70	biogenic	JHIARN
COC(=O)c1ccc(NC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1	ZINC000217696478	569881016	/nfs/dbraw/zinc/88/10/16/569881016.db2.gz	FHRXAOLHHLTACC-HSZRJFAPSA-N	0	0	455.470	3.617	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)NC3CCCCCC3)[C@H]21	ZINC000217699193	569881060	/nfs/dbraw/zinc/88/10/60/569881060.db2.gz	PIGROARWBXEHSF-DEOSSOPVSA-N	0	0	463.534	3.658	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3ccc4[nH]cnc4c3)[C@H]21	ZINC000217717677	569881149	/nfs/dbraw/zinc/88/11/49/569881149.db2.gz	RMXVQIMTBZHREQ-VWLOTQADSA-N	0	0	497.511	3.724	50	70	biogenic	JHIARN
COc1ccc2cc(NC(=O)CN3C(=O)c4ccccc4N4C(=O)c5ccccc5[C@@H]43)cnc2c1	ZINC000217713251	569881151	/nfs/dbraw/zinc/88/11/51/569881151.db2.gz	UYWZRMVWZXPPSL-RUZDIDTESA-N	0	0	464.481	3.997	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)Nc3ccc4cc[nH]c4c3)[C@@H]21	ZINC000217811421	569881732	/nfs/dbraw/zinc/88/17/32/569881732.db2.gz	KPUDHZIBRALYDA-RUZDIDTESA-N	0	0	482.496	3.939	50	70	biogenic	JHIARN
COc1cc([C@@H]2CC(=O)Oc3cc(C)n(CCc4ccc(O)cc4)c(=O)c32)cc(OC)c1OC	ZINC000217978548	569882267	/nfs/dbraw/zinc/88/22/67/569882267.db2.gz	QMOAFPSEYIZPGR-IBGZPJMESA-N	0	0	465.502	3.572	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)Nc1cccc(-c2nc(-c3ccccn3)n[nH]2)c1	ZINC000218356807	569883304	/nfs/dbraw/zinc/88/33/04/569883304.db2.gz	OXRGYEVBKCXDPJ-IBGZPJMESA-N	0	0	471.473	3.791	50	70		JHIARN
COCc1cc(=O)c(O)c([C@@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2cccc(O)c2)o1	ZINC000217713853	569881186	/nfs/dbraw/zinc/88/11/86/569881186.db2.gz	VUJSVDOHSBUOIT-NRFANRHFSA-N	0	0	474.513	3.786	50	70	biogenic	JHIARN
COc1ccc([C@@H](CC(=O)N2CCc3c4ccccc4[nH]c3C2)c2oc(C)cc(=O)c2O)cc1O	ZINC000217748352	569881479	/nfs/dbraw/zinc/88/14/79/569881479.db2.gz	QFGSIXIIHZXFJB-LJQANCHMSA-N	0	0	474.513	3.956	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1ccc(OC)c(OC)c1OC)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217793978	569881646	/nfs/dbraw/zinc/88/16/46/569881646.db2.gz	JURGCQRZTRVGFQ-FQEVSTJZSA-N	0	0	497.544	3.531	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1ccc(OC)cc1OC)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217823210	569881759	/nfs/dbraw/zinc/88/17/59/569881759.db2.gz	RYNNZZKNMIXLEN-NRFANRHFSA-N	0	0	467.518	3.523	50	70	biogenic	JHIARN
CC(=O)Nc1ccc(NC(=O)CCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1	ZINC000217863794	569881949	/nfs/dbraw/zinc/88/19/49/569881949.db2.gz	PKWJPLXYFWZJMD-DEOSSOPVSA-N	0	0	454.486	3.789	50	70	biogenic	JHIARN
COc1ccc(CNC(=O)CCCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)cc1	ZINC000217825076	569881746	/nfs/dbraw/zinc/88/17/46/569881746.db2.gz	GBSVBQMMLYBQIO-RUZDIDTESA-N	0	0	455.514	3.907	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)NCc3ccccc3)[C@H]21	ZINC000217894584	569882068	/nfs/dbraw/zinc/88/20/68/569882068.db2.gz	LAOIKBWOTVWZDK-VWLOTQADSA-N	0	0	471.513	3.525	50	70	biogenic	JHIARN
Cc1ccc2occ([C@@H]3CC(=O)Oc4cc(C)n(CCc5ccc(O)cc5)c(=O)c43)c(=O)c2c1	ZINC000217998189	569882330	/nfs/dbraw/zinc/88/23/30/569882330.db2.gz	XAOJZFMPJODACE-IBGZPJMESA-N	0	0	457.482	3.961	50	70	biogenic	JHIARN
Cc1ccc2[nH]c(=O)c([C@@H]3CC(=O)Oc4cc(C)n(CCc5ccc(O)cc5)c(=O)c43)cc2c1	ZINC000218086983	569882721	/nfs/dbraw/zinc/88/27/21/569882721.db2.gz	PJIHUGRQTPNTBI-FQEVSTJZSA-N	0	0	456.498	3.696	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1cc2c(cc1O)OCO2)c1cc2cc(C)cc(C)c2nc1N1CCOCC1	ZINC000218139433	569882850	/nfs/dbraw/zinc/88/28/50/569882850.db2.gz	HSXNGFHAUDCIQB-SFHVURJKSA-N	0	0	464.518	3.818	50	70		JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)Nc3ccccn3)[C@H]21	ZINC000217755493	569881433	/nfs/dbraw/zinc/88/14/33/569881433.db2.gz	BGBZMJBVWWOPIN-DEOSSOPVSA-N	0	0	472.501	3.633	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1ccc(OC)c(OC)c1OC)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217793903	569881620	/nfs/dbraw/zinc/88/16/20/569881620.db2.gz	JURGCQRZTRVGFQ-HXUWFJFHSA-N	0	0	497.544	3.531	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1cc(OC)c(OC)c(OC)c1)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217922783	569882152	/nfs/dbraw/zinc/88/21/52/569882152.db2.gz	WRAMPEAXAKITAZ-FQEVSTJZSA-N	0	0	497.544	3.531	50	70	biogenic	JHIARN
COc1ccc([C@H]2CC(=O)Oc3ccc4c(c32)OC2(CCCCC2)CC4=O)cc1OCC(N)=O	ZINC000218092824	569882723	/nfs/dbraw/zinc/88/27/23/569882723.db2.gz	QEKMWXQMCDBGKP-QGZVFWFLSA-N	0	0	465.502	3.668	50	70	biogenic	JHIARN
COc1ccc([C@@H]2CC(=O)Oc3ccc4c(c32)OC2(CCCCC2)CC4=O)cc1OCC(N)=O	ZINC000218092742	569882765	/nfs/dbraw/zinc/88/27/65/569882765.db2.gz	QEKMWXQMCDBGKP-KRWDZBQOSA-N	0	0	465.502	3.668	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)NCc3cccn3C(C)C)[C@@H]21	ZINC000217679869	569880978	/nfs/dbraw/zinc/88/09/78/569880978.db2.gz	DZYRNGXTJRCBQT-RUZDIDTESA-N	0	0	488.544	3.517	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1ccc(OC)cc1OC)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217823124	569881751	/nfs/dbraw/zinc/88/17/51/569881751.db2.gz	RYNNZZKNMIXLEN-OAQYLSRUSA-N	0	0	467.518	3.523	50	70	biogenic	JHIARN
COC(=O)C[C@H](c1cc(OC)c(OC)cc1OC)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000217888179	569881989	/nfs/dbraw/zinc/88/19/89/569881989.db2.gz	NIPPYCZTUHBUFK-HXUWFJFHSA-N	0	0	497.544	3.531	50	70	biogenic	JHIARN
COc1ccc(N2C[C@H](C(=O)N[C@@H](CC(C)C)c3nc4ccccc4n3C)CC2=O)c(OC)c1	ZINC000218280578	569883217	/nfs/dbraw/zinc/88/32/17/569883217.db2.gz	BKJCVPUPNNKXFD-XLIONFOSSA-N	0	0	464.566	3.847	50	70		JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CC(=O)Nc3cccc4[nH]ccc43)[C@@H]21	ZINC000217619872	569880628	/nfs/dbraw/zinc/88/06/28/569880628.db2.gz	QUKNZOXUJCSDNZ-RUZDIDTESA-N	0	0	482.496	3.939	50	70	biogenic	JHIARN
O=C(CN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@@H]21)NCCn1ccc2ccccc21	ZINC000217937031	569882201	/nfs/dbraw/zinc/88/22/01/569882201.db2.gz	PUSKIOGKDFXLOB-RUZDIDTESA-N	0	0	450.498	3.573	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)Nc1cccc(-c2nnc(-c3cccnc3)[nH]2)c1	ZINC000218123067	569882784	/nfs/dbraw/zinc/88/27/84/569882784.db2.gz	MQOJFLZANWYOCH-IBGZPJMESA-N	0	0	471.473	3.791	50	70		JHIARN
COC(=O)C[C@H](c1cc(F)c(F)c(F)c1)c1c(O)cc(C)n(CCc2ccc(O)cc2)c1=O	ZINC000218453590	569883330	/nfs/dbraw/zinc/88/33/30/569883330.db2.gz	JVOHFEGMEIYEGH-QGZVFWFLSA-N	0	0	461.436	3.923	50	70		JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCC(=O)Nc3nc(C)cs3)[C@@H]21	ZINC000217626025	569880644	/nfs/dbraw/zinc/88/06/44/569880644.db2.gz	RHVIVHLYCFZIOQ-OAQYLSRUSA-N	0	0	478.530	3.612	50	70	biogenic	JHIARN
COC(=O)C[C@@H](c1c(Cc2ccc3c(c2)CCC(C)(C)O3)[nH][nH]c1=O)c1cc2c(c(OC)c1)OCO2	ZINC000217653356	569880875	/nfs/dbraw/zinc/88/08/75/569880875.db2.gz	WSDVFLQAOJDJSU-GOSISDBHSA-N	0	0	494.544	3.830	50	70	biogenic	JHIARN
COc1ccc2c(ccn2CCNC(=O)CN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)c1	ZINC000217724441	569881155	/nfs/dbraw/zinc/88/11/55/569881155.db2.gz	OWNONXFAMXKTOE-SANMLTNESA-N	0	0	480.524	3.581	50	70	biogenic	JHIARN
COc1ccc2c(ccn2CCNC(=O)CN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@@H]32)c1	ZINC000217724358	569881162	/nfs/dbraw/zinc/88/11/62/569881162.db2.gz	OWNONXFAMXKTOE-AREMUKBSSA-N	0	0	480.524	3.581	50	70	biogenic	JHIARN
COc1ccc2cc(NC(=O)CN3C(=O)c4ccccc4N4C(=O)c5ccccc5[C@H]43)cnc2c1	ZINC000217713338	569881188	/nfs/dbraw/zinc/88/11/88/569881188.db2.gz	UYWZRMVWZXPPSL-VWLOTQADSA-N	0	0	464.481	3.997	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)Nc3nccs3)[C@H]21	ZINC000217749836	569881470	/nfs/dbraw/zinc/88/14/70/569881470.db2.gz	AQDJHBGFGVQOIU-NRFANRHFSA-N	0	0	478.530	3.694	50	70	biogenic	JHIARN
COCCCNC(=O)CCCCCN1C(=O)c2ccccc2N2C(=O)c3c(ccc(OC)c3OC)[C@@H]21	ZINC000217787239	569881568	/nfs/dbraw/zinc/88/15/68/569881568.db2.gz	SVEIKLYGHYWVGE-RUZDIDTESA-N	0	0	495.576	3.532	50	70	biogenic	JHIARN
COc1ccc(CNC(=O)CCCN2C(=O)c3ccccc3N3C(=O)c4ccccc4[C@H]32)cc1	ZINC000217825172	569881748	/nfs/dbraw/zinc/88/17/48/569881748.db2.gz	GBSVBQMMLYBQIO-VWLOTQADSA-N	0	0	455.514	3.907	50	70	biogenic	JHIARN
Cc1nn(Cc2ccccc2Cl)c(C)c1NC(=O)CC[C@@H]1NC(=O)c2ccccc2NC1=O	ZINC000217847655	569881813	/nfs/dbraw/zinc/88/18/13/569881813.db2.gz	NBPKJRAKIYTKST-FQEVSTJZSA-N	0	0	465.941	3.671	50	70	biogenic	JHIARN
CN(C(=O)COc1ccc2occ(-c3ccc(Br)s3)c2c1)[C@@H]1CCS(=O)(=O)C1	ZINC000218299387	569883195	/nfs/dbraw/zinc/88/31/95/569883195.db2.gz	LELLOKLQURLQLG-GFCCVEGCSA-N	0	0	484.393	3.948	50	70		JHIARN
COc1ccc2cnn(CC(=O)N[C@H](c3nc4ccccc4n3C(C)C)C(C)C)c(=O)c2c1OC	ZINC000218345122	569883303	/nfs/dbraw/zinc/88/33/03/569883303.db2.gz	IXAAOXQWGOUVBQ-QHCPKHFHSA-N	0	0	477.565	3.858	50	70		JHIARN
O=C(CCCCCN1C(=O)c2ccccc2N2C(=O)c3ccccc3[C@H]21)NCC1CCOCC1	ZINC000217700790	569881075	/nfs/dbraw/zinc/88/10/75/569881075.db2.gz	QULHNGUBUFBUDR-VWLOTQADSA-N	0	0	461.562	3.905	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCCC(C)C)[C@@H]21	ZINC000217858012	569881906	/nfs/dbraw/zinc/88/19/06/569881906.db2.gz	RBMOLXMOKRPNRX-XMMPIXPASA-N	0	0	465.550	3.761	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCc3ccco3)[C@@H]21	ZINC000217965677	569882295	/nfs/dbraw/zinc/88/22/95/569882295.db2.gz	UGBZKYGNCGRSMN-XMMPIXPASA-N	0	0	475.501	3.508	50	70	biogenic	JHIARN
COc1ccc2c(c1OC)C(=O)N1c3ccccc3C(=O)N(CCCC(=O)NCc3ccccc3)[C@@H]21	ZINC000218013767	569882465	/nfs/dbraw/zinc/88/24/65/569882465.db2.gz	SWIXDKLLWPZVKC-AREMUKBSSA-N	0	0	485.540	3.915	50	70	biogenic	JHIARN