smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cc1nn(C)c2c1[C@H](NC1CCN(c3ccc4c(c3)CCC4)CC1)CCC2	1857678071	RPXHOECQIPERRF-OAQYLSRUSA-N	364.537	3.853	10	50	FHCA	
COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C\c1ccccc1F	5791451	RLEZPILTSOFWRB-BOPFTXTBSA-N	367.376	3.712	10	50	FHCA	
O=C1Nc2ccc(S(=O)(=O)Nc3ccc(O)c(Cl)c3)c3cccc1c23	1212938	FQWAQUPLBBOCSP-UHFFFAOYSA-N	374.805	3.565	10	50	FHCA	
O=C(O)c1ccccc1/C=C1\SC(=S)N(c2ccccc2F)C1=O	16192779	TZGZNMXZQZTQMQ-ZROIWOOFSA-N	359.403	3.930	10	50	FHCA	
Cc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)o1	1125155	BSBKIOAZWIKCOO-JXMROGBWSA-N	365.172	3.561	10	50	FHCA	
Cc1ccc(-n2c(C)cc(/C=C3\C(=N)N4N=CSC4=NC3=O)c2C)cc1	3858825	ZXROCDUUCSOZSJ-WNMDJLCMSA-N	363.446	3.652	10	50	FHCA	
Cc1ccc(/C=C2/C(=N)N3N=C(c4ccc(C)cc4)SC3=NC2=O)cc1	15837425	NOUDFEPTYOOOGS-XGMUFTHNSA-N	360.442	3.971	10	50	FHCA	
O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1	14011142	XDITWUFHWLJCQZ-WQLSENKSSA-N	361.184	3.660	10	50	FHCA	
COc1ccc2c(c1)C1=NN(C(C)=O)[C@H](c3ccc(N(C)C)cc3)[C@@H]1CC2	4030188	DSMFEJUJISYLBI-DENIHFKCSA-N	363.461	3.631	10	50	FHCA	
O=C(O)CCN1C(=O)/C(=C\c2cccc(Cl)c2Cl)SC1=S	1133370	DNUZUNZFMUTTFG-RMKNXTFCSA-N	362.259	3.669	10	50	FHCA	
c1ccc(-c2nnc3n2CCN(Cc2ccc(N4CCCC4)cc2)CC3)cc1	11880472	VGMFTRYYFYHOJS-UHFFFAOYSA-N	373.504	3.604	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1cccs1	1104164	PBSNHJKBAUTXDS-WJDWOHSUSA-N	355.415	3.634	10	50	FHCA	
COCCNc1cc(Br)c2noc3c2c1C(=O)c1ccccc1-3	4770066	QDTRULWIASKHEU-UHFFFAOYSA-N	373.206	3.860	10	50	FHCA	
C[C@@H]1CN(c2ccc(CNc3cc(N)ccc3[N+](=O)[O-])cc2F)C[C@@H](C)O1	170616252	NTFCFQWOXVKXOW-CHWSQXEVSA-N	374.416	3.542	10	50	FHCA	
O=C(O)c1cc(N(Cc2ccccc2O)Cc2ccccc2O)ccc1O	2504634	RTYOLBQXFXYMKY-UHFFFAOYSA-N	365.385	3.708	10	50	FHCA	biogenic,in-vitro
COc1ccc(N/C=C2\C(=O)N(c3ccc(C)cc3)N=C2C)c([N+](=O)[O-])c1	100500198	PIOPIUIMOOTKAU-WJDWOHSUSA-N	366.377	3.630	10	50	FHCA	
Cc1cc(C(=O)N2CCCC2(C)C)c(C)n1-c1ccc2c(c1)OCCO2	1875254443	WMEFMYMOWIBDLS-UHFFFAOYSA-N	354.450	3.880	10	50	FHCA	
CCCC1=NN(c2ccc(F)cc2)C(=O)/C1=C/NC[C@H](O)c1ccccc1	100111180	BRYOBWUWNPFOLE-ZPBCLNFZSA-N	367.424	3.536	10	50	FHCA	
Cc1ccc(C)c(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1	72119385	XPUGWAGXQDFHNL-GOSISDBHSA-N	352.478	3.560	10	50	FHCA	
CCN1C(=O)/C(=C/C=C2N(CC)c3ccccc3N2CC)SC1=S	208261337	XFMSGIQFOAMETH-PTNGSMBKSA-N	359.520	3.958	10	50	FHCA	
O=C1Nc2ccc(F)cc2/C1=C1/SC(=S)N(c2ccccc2)C1=O	4949412	XLDOQDRKALFBGC-YPKPFQOOSA-N	356.403	3.554	10	50	FHCA	
CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NCc1ccco1	100095454	BQFAFWIRFVURPB-WJDWOHSUSA-N	352.419	3.676	10	50	FHCA	
CC(C)Cn1cncc1CNC1CCN(c2ccc3c(c2)CCC3)CC1	821502102	IRQAGIITRXMPMI-UHFFFAOYSA-N	352.526	3.786	10	50	FHCA	
CC(C)[C@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2Cl)SC1=S	3892509	KGXHVHSLPHBMDE-SEVUFMINSA-N	355.868	3.650	10	50	FHCA	
O=C1NN(c2ccc(F)cc2)C(=O)/C1=C\c1cccc(Cl)c1Cl	1125754	SBYAQPSZKISCEV-WQLSENKSSA-N	351.164	3.594	10	50	FHCA	
COc1ccc([C@H]2CC(c3cc(Cl)ccc3O)=NN2C(C)=O)cc1OC	1121537	CBYBEJXTZIFQBY-MRXNPFEDSA-N	374.824	3.760	10	50	FHCA	
Cc1cc(O)c(Br)c(C)c1NS(=O)(=O)c1ccccc1	947549	LMTUFROAXRRQHR-UHFFFAOYSA-N	356.241	3.572	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccccc1O	1157345	QUUHPQBPBNLPLQ-KAMYIIQDSA-N	369.804	3.923	10	50	FHCA	
CC(C)[C@H]1CN(Cc2ccccc2O)CCC(=O)N1Cc1ccc(F)cc1	71745889	KFHMOTJEVPMSGJ-HXUWFJFHSA-N	370.468	3.790	10	50	FHCA	
COc1ccc(-c2c3cn[nH]c3nc3c2oc2c(O)c(O)ccc23)cc1O	217825719	OLXHHBMFBAJJLZ-UHFFFAOYSA-N	363.329	3.650	10	50	FHCA	biogenic
CCN(CC)c1ccc(/C=C2\NC(=S)N(c3ccccc3)C2=O)cc1	2758595	JXTAAZXKXZZPFT-JXAWBTAJSA-N	351.475	3.795	10	50	FHCA	
CSc1cnc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nc1	225817888	SHQOBYCZNDCHQV-STQMWFEESA-N	362.474	3.563	10	50	FHCA	
O=C1NN(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1ccc(F)cc1	16116170	VZNJIISALRNSAE-RZNTYIFUSA-N	351.164	3.594	10	50	FHCA	
O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1Cc1ccc2c(c1)OCO2	15015223	FDWWQMWCERPDGF-PXNMLYILSA-N	373.430	3.956	10	50	FHCA	
COc1ccc(C2=C/C(=C/c3cccc(OC)c3OC)C(=O)O2)c(OC)c1	843828	YXINWDKBGYGATQ-UVTDQMKNSA-N	368.385	3.702	10	50	FHCA	
COc1ccc([C@@H](NC(C)=O)c2c(O)ccc3ccccc23)cc1OC	1197080	IIDLZHSTJAXEIU-OAQYLSRUSA-N	351.402	3.788	10	50	FHCA	
COc1ccccc1[C@H](NC(C)=O)c1cc(Cl)c2cccnc2c1O	869258	VBZSJOLGJVSKSW-KRWDZBQOSA-N	356.809	3.828	10	50	FHCA	
COc1ccc(OC)c(C2=C/C(=C/c3ccc([N+](=O)[O-])cc3)C(=O)O2)c1	2918928	ZRWJGRWYVBLMHF-LCYFTJDESA-N	353.330	3.593	10	50	FHCA	
COc1cc(/C=C2\SC(=S)N(Nc3ccccc3)C2=O)ccc1O	13471822	FDFHGZDQTBXWIJ-GDNBJRDFSA-N	358.444	3.629	10	50	FHCA	
COc1ccc(C2=NN(C(=O)C(F)(F)F)[C@H](c3cccs3)C2)c(O)c1	253433460	XHTXKCTXBKTAFY-LBPRGKRZSA-N	370.352	3.702	10	50	FHCA	
O=C(O)c1ccccc1/C=C1\SC(=S)N(Nc2ccccc2)C1=O	2981254	KBKIMUVVVVJMHM-UVTDQMKNSA-N	356.428	3.613	10	50	FHCA	
CCCC[C@H]1C[C@H]1C(=O)Oc1cccc2c1C(=O)c1c(O)cccc1C2=O	5003821	ZYBYCZKZDFBDHL-SWLSCSKDSA-N	364.397	3.899	10	50	FHCA	
O=S(=O)(Cc1ccccc1Cl)NCc1ccc(N2CCCC2)cc1	13668500	HBELCUBGWUTUCN-UHFFFAOYSA-N	364.898	3.560	10	50	FHCA	
O=C1/C(=C/c2ccc([N+](=O)[O-])o2)SC(=S)N1c1ccc(F)cc1	1159599	NHOPOHRDIPSCKV-XFFZJAGNSA-N	350.352	3.733	10	50	FHCA	
CN(C)c1ccc(CNc2ccc(I)cc2)cc1	640390	DSQSKOIJGIMWLU-UHFFFAOYSA-N	352.219	3.969	10	50	FHCA	
Cc1ccccc1NC(=O)c1ccc2c(c1N)C(=O)c1ccccc1C2=O	3878835	BDWCHHIAVKCAEQ-UHFFFAOYSA-N	356.381	3.605	10	50	FHCA	
O=C1c2ccccc2C(=O)C1(Nc1ccccc1)c1ccc([N+](=O)[O-])cc1	3039434	DZASDXOJQKFKGH-UHFFFAOYSA-N	358.353	3.981	10	50	FHCA	
CCOc1ccc(/C=C2/C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)cc1	16156571	FHPDNRZXNNIJIH-LDADJPATSA-N	350.374	3.590	10	50	FHCA	
COc1cccc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)c1O	13602654	YTTIGKPEDXEMRN-ZSOIEALJSA-N	361.419	3.946	10	50	FHCA	
CSc1cnc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nc1	225817853	SHQOBYCZNDCHQV-CHWSQXEVSA-N	362.474	3.563	10	50	FHCA	
COc1ccc(CN2CCC(CO)(CCCc3ccccc3)CC2)c(O)c1	11935006	KORYKXOEDOMMJP-UHFFFAOYSA-N	369.505	3.998	10	50	FHCA	
CCCC(=O)N[C@@H](c1cccc([N+](=O)[O-])c1)c1ccc2cccnc2c1O	3894216	SWDCNWUXTXPNMJ-SFHVURJKSA-N	365.389	3.854	10	50	FHCA	
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C	2325809594	MPWHPNILXORUPV-GOSISDBHSA-N	369.465	3.509	10	50	FHCA	
Cc1ccccc1C(=O)NN1C(=O)/C(=C\c2ccccc2F)SC1=S	5030143	NPHDUNCHICJMQP-XNTDXEJSSA-N	372.446	3.680	10	50	FHCA	
O=C(Nc1c(Cl)ccc2nonc12)c1cc([N+](=O)[O-])ccc1Cl	170617630	HQTBTONSEBFMHR-UHFFFAOYSA-N	353.121	3.690	10	50	FHCA	
COc1cc(/C=C2\SC(c3ccc(C)cc3)=NC2=O)cc(OC)c1O	826808	GOXBBIMCZQLBKU-YBEGLDIGSA-N	355.415	3.779	10	50	FHCA	
O=C(O)[C@H](c1cc(-c2ccccc2)ccc1O)N1Cc2ccccc2C1=O	2356134281	HQRJUZSCOAKIKB-FQEVSTJZSA-N	359.381	3.841	10	50	FHCA	
COc1ccccc1N1C(=N)S/C(=C/c2ccc(N(C)C)cc2)C1=O	5657748	PHODNEQLGQTFOL-NETLLJLASA-N	353.447	3.817	10	50	FHCA	
O=C1N=C(O)/C(=C\c2ccc(-c3ccc(Cl)c(Cl)c3)o2)C(=O)N1	2981573	DGCSWTQMHJGREL-UHFFFAOYSA-N	351.145	3.843	10	50	FHCA	
CSc1cnc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nc1	225817868	SHQOBYCZNDCHQV-BETUJISGSA-N	362.474	3.563	10	50	FHCA	
Cc1cc(/C=c2/sc3nc4ccccc4n3c2=O)c(C)n1-c1ccccc1	9311439	SJMYMKPBODEZSH-DEDYPNTBSA-N	371.465	3.864	10	50	FHCA	in-vitro
O=C(O)c1ccc(N2N=C(C(F)(F)F)/C(=C/c3cccs3)C2=O)cc1	2996280	BKJZTAWQONHJFX-WQLSENKSSA-N	366.320	3.795	10	50	FHCA	
O=C(O)CCc1ccc(-c2cccs2)n1CC(=O)Nc1ccccc1	4516924	PDSVVZAXOVQTKH-UHFFFAOYSA-N	354.431	3.873	10	50	FHCA	
Cc1ccc(N2NC(=O)/C(=C/c3ccc(Br)cc3)C2=O)cc1C	4460734	RDQUBXHMJSELBM-YBEGLDIGSA-N	371.234	3.527	10	50	FHCA	
CCCOc1ccc(/C=C2\SC(=S)N(C[C@@H]3CCCO3)C2=O)cc1	13124920	DWIQZTRUJJLTIY-CNYBTUBUSA-N	363.504	3.856	10	50	FHCA	
COc1ccc(C(=O)[C@H]2CCCN(Cc3ccccc3O)C2)cc1OC	12588138	RQLIVOAMFDOWGQ-KRWDZBQOSA-N	355.434	3.504	10	50	FHCA	
CSc1nnc2c(n1)O[C@@H](c1ccc(N(C)C)cc1)Nc1ccccc1-2	822514	OQLFJXHUVQHPBU-KRWDZBQOSA-N	365.462	3.830	10	50	FHCA	
Cc1nn(C)c2c1[C@@H](NC(=O)c1c(C)c3cccc(C)c3n1C)CCC2	1857670507	RHDQWZYKYHHJGQ-INIZCTEOSA-N	350.466	3.644	10	50	FHCA	
Cc1cc(C(=O)N2CCC(c3nccn3C)CC2)c(C)n1-c1ccccc1	91950554	SMCRCBYUHNYVPG-UHFFFAOYSA-N	362.477	3.847	10	50	FHCA	
CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/c1cc2ccccc2[nH]c1=O	100651218	CZHBJCHJVLZJHW-LICLKQGHSA-N	363.804	3.988	10	50	FHCA	
CCOc1ccc(-n2c(C)cc(/C=C3/SC(=S)NC3=O)c2C)cc1	1158805	OMFVTXRDIKXPIB-MHWRWJLKSA-N	358.488	3.982	10	50	FHCA	
CC(C)OC(=O)CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S	1180084	RKTOFQKCYZVOLC-ZLRVCTSNSA-N	361.488	3.786	10	50	FHCA	
CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1cccc([N+](=O)[O-])c1	100148694	KBCGMYNLVDKYHT-WQRHYEAKSA-N	350.378	3.930	10	50	FHCA	
O=C1/C(=C\c2ccccc2)SC(=S)N1C(=O)c1cccc([N+](=O)[O-])c1	408822872	ZRFXUHKMHFRJPW-NTEUORMPSA-N	370.411	3.636	10	50	FHCA	
O=C1CC[C@@H]2CN(Cc3ccccc3O)CC[C@@H]2N1Cc1ccc(F)cc1	15005073	ZGHTWHHVPPWJMK-XLIONFOSSA-N	368.452	3.544	10	50	FHCA	
CSc1nnc2c(n1)O[C@H](c1ccc(N(C)C)cc1)Nc1ccccc1-2	822515	OQLFJXHUVQHPBU-QGZVFWFLSA-N	365.462	3.830	10	50	FHCA	
O=c1oc(-c2ccc(C(F)(F)F)cc2)nn1Cc1cc(Cl)ccc1O	1489679	QKOWACXSXTXRKA-UHFFFAOYSA-N	370.714	3.929	10	50	FHCA	in-vitro
CCN1C(=O)/C(=C\c2ccc(-c3cccc(C(=O)O)c3)o2)SC1=S	5017504	ISAWMFUNLFSUSB-NTEUORMPSA-N	359.428	3.866	10	50	FHCA	
Cc1cc(C(=O)N[C@@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1cccc(F)c1	1875354347	FGWKVFLVYXIGOP-DOTOQJQBSA-N	372.440	3.997	10	50	FHCA	
c1ccc(-n2cncn2)c(CNC2CCN(c3ccc4c(c3)CCC4)CC2)c1	1506431490	MJIWFLOTVTWGMF-UHFFFAOYSA-N	373.504	3.515	10	50	FHCA	
CC(=O)N1N=C(c2ccc(O)cc2)C[C@@H]1c1ccc(Br)cc1	1200970	IAHDJIUAJOHPGF-QGZVFWFLSA-N	359.223	3.852	10	50	FHCA	
CCCCc1nc(CN2CC3(C2)CN(c2ccc(OC)cc2)C3)c(Cl)[nH]1	2100483747	LLLBCHRMGXRTRA-UHFFFAOYSA-N	374.916	3.737	10	50	FHCA	
O=C(O)[C@@H](c1ccccc1)N1C(=O)/C(=C/c2ccc(F)cc2)SC1=S	966723	VOSYPXSHMLLTKA-BAAYTWLHSA-N	373.430	3.853	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\c3ccc(OC)c(O)c3)SC2=S)cc1	5052069	MJWYTOCVVHIXAN-MHWRWJLKSA-N	373.455	3.815	10	50	FHCA	
CN(C)c1ccc(NC(=O)C(C)(C)C)c(Cc2nnc(C(F)(F)F)o2)c1	205367174	ZLBGMKAAMMWOGR-UHFFFAOYSA-N	370.375	3.730	10	50	FHCA	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccccc1C(F)(F)F)C(=O)C2=O	2172634	QEGGLVTYRCAVMP-SJORKVTESA-N	353.340	3.608	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3ccc(C(C)(C)C)cc3)CC2)cc1	1143993	MFCLTVZDMMUTID-UHFFFAOYSA-N	352.478	3.955	10	50	FHCA	
Cc1ccc(N2C(=O)/C(=C3/C(=O)N(C)c4ccccc43)SC2=S)cc1	1227103	ZHEXDNAZZUINOG-NXVVXOECSA-N	366.467	3.747	10	50	FHCA	
COc1ccc(N2CCN(Cc3cc(Br)cs3)CC2)cc1	55543005	VAAMZLSOYNMZAI-UHFFFAOYSA-N	367.312	3.841	10	50	FHCA	
CN1CCN(c2ccc(CNC(=O)c3ccc(C(C)(C)C)cc3)cc2)CC1	65365591	SMPNWQMYVQNODR-UHFFFAOYSA-N	365.521	3.666	10	50	FHCA	
Cc1ccc(/C=C2\C(=O)NN(c3ccc(Cl)c(Cl)c3)C2=O)s1	1209736	GESVGTIZNIGVOH-YRNVUSSQSA-N	353.230	3.825	10	50	FHCA	
COc1ccc(-n2c(C)cc(/C=C3/SC(=S)N(C)C3=O)c2C)cc1	1151034	FJROVLKCKKKBIH-MHWRWJLKSA-N	358.488	3.934	10	50	FHCA	aggregator
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1c(Cl)cccc1Cl)C(=O)C2=O	2106585	ZRJBLBWFXJEPTI-SJORKVTESA-N	354.233	3.896	10	50	FHCA	
N=C1/C(=C/c2c[nH]c3ccccc23)C(=O)N=C2SC(c3ccccc3)=NN12	6672137	YDFNNWVLIBSUEU-SRRKIXIOSA-N	371.425	3.835	10	50	FHCA	
CSC[C@@](C)(O)CNCc1ccc(N(C)Cc2cccs2)cc1	823921476	GSSYGKSOZODNDT-SFHVURJKSA-N	350.553	3.588	10	50	FHCA	
O=C(O)c1ccc2c(c1)C(=O)N(c1ccc(OCc3ccccc3)cc1)C2=O	1233021	NIEPFFACVBWEKA-UHFFFAOYSA-N	373.364	3.764	10	50	FHCA	
Cc1cc(C(=O)N2CCC[C@@H](c3nccn3C)C2)c(C)n1-c1ccccc1	95516605	IKBIFKPEFWWHGM-GOSISDBHSA-N	362.477	3.847	10	50	FHCA	
CCCCCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(N(C)C)cc1	4309842	BUNGEUJFFQPYHS-GOSISDBHSA-N	359.470	3.504	10	50	FHCA	
Oc1ccc(CCNCCCCCCNCCc2ccccc2)cc1O	3798745	RYBJORHCUPVNMB-UHFFFAOYSA-N	356.510	3.623	10	50	FHCA	world
COc1cc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)ccc1OC(C)=O	4738975	RVIHQWKCUKLNNR-LICLKQGHSA-N	350.370	3.910	10	50	FHCA	
C[C@@H](N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccccc1O	783520795	ZPNSCVQVTCNMCQ-OCCSQVGLSA-N	364.367	3.867	10	50	FHCA	
Cc1cc(C(=O)N[C@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1ccccc1F	1875354826	QBGYFGSAVDPJLY-CVEARBPZSA-N	372.440	3.997	10	50	FHCA	
CCCOc1ccc(/C=C2\SC(=S)N(C[C@H]3CCCO3)C2=O)cc1	13124921	DWIQZTRUJJLTIY-DFSFMLJYSA-N	363.504	3.856	10	50	FHCA	
O=C(NCc1ccc(F)cc1)c1nc(-c2ccc(-n3cccc3)cc2)no1	4707461	GYTGTQVZQJKVNE-UHFFFAOYSA-N	362.364	3.596	10	50	FHCA	
Cc1cc(C(=O)N2CCC[C@H](Cn3ccnc3)C2)c(C)n1-c1ccccc1	95372611	OIXUSUOKFCXPQA-LJQANCHMSA-N	362.477	3.843	10	50	FHCA	
COc1ccc2nc(/N=N/c3ccc(N(CCO)CCO)cc3)sc2c1	5319490	SJZTZHPYEJPQME-QZQOTICOSA-N	372.450	3.511	10	50	FHCA	
COc1ccccc1CC(=O)c1ccc(O)c(CN2CCCCC2)c1O	23135309	NFYMPILOJNGGQF-UHFFFAOYSA-N	355.434	3.518	10	50	FHCA	biogenic
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@H](O)C[C@H]1C1CCCCC1	1875263352	SCECZGCEBDZPAZ-RTWAWAEBSA-N	371.525	3.512	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/Nc1ccc(Cl)c(C(=O)O)c1	100148720	AHVYYNOBXFUYOX-XNTDXEJSSA-N	355.781	3.757	10	50	FHCA	
Cc1ccc(CS(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1	10113264	BNUXQUNVLBCOSB-UHFFFAOYSA-N	358.507	3.605	10	50	FHCA	
CC(=O)C[C@H](c1ccccc1)C1(Br)C(=O)c2ccccc2C1=O	22781526	ZIPQVCOBTBIFIP-MRXNPFEDSA-N	371.230	3.962	10	50	FHCA	
CCN(Cc1ccccc1)c1ccc(CNC[C@]2(O)CCSC2)cc1	236966136	KKCJMVTZYJRTSR-OAQYLSRUSA-N	356.535	3.671	10	50	FHCA	
O=C1c2ccc3[nH]c(-c4ccc([N+](=O)[O-])cc4)nc3c2C(=O)[C@H]2C=CC=C[C@H]12	219034773	FUWHSUBEUWFXTG-KBPBESRZSA-N	371.352	3.876	10	50	FHCA	
COc1ccc(O)c(CN2CCC[C@H](C(=O)c3cc(F)ccc3F)C2)c1	12058059	ACNSACAFQDCKCJ-ZDUSSCGKSA-N	361.388	3.774	10	50	FHCA	
CCN(CC)c1ccc([C@@H]2[C@H]3CCCC[C@]3(O)CCN2C(=O)OC)cc1	5979324	BAPXFDGYOLEISY-SBHAEUEKSA-N	360.498	3.967	10	50	FHCA	biogenic
CSc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1	1184179	WSPDGHJKBIBSNB-GZTJUZNOSA-N	366.442	3.692	10	50	FHCA	
CCOCCCN1C(=O)/C(=C/C2=Cc3ccccc3OC2)SC1=S	6354806	YEHLEYIHNRRUJP-WJDWOHSUSA-N	361.488	3.633	10	50	FHCA	
COc1ccc2c(c1)c(=O)oc1cc(OCc3ccc(C(=O)O)o3)ccc12	5543668	DKZHFDVDZFOJDF-UHFFFAOYSA-N	366.325	3.825	10	50	FHCA	
C[C@H](Cc1ccc(N)cc1)C(=O)OCc1cc(Cl)cc2c1OCOC2	225604739	GZECJPQLTZASGS-GFCCVEGCSA-N	361.825	3.711	10	50	FHCA	
O=C(NCc1ccc(N2CCOCC2)cc1)C1(c2ccccc2)CCCC1	71384579	GOWLCUBZJCXJFI-UHFFFAOYSA-N	364.489	3.651	10	50	FHCA	
CCOc1ccccc1N1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1	4980637	GOOLXMPLDKAKES-BQYQJAHWSA-N	365.521	3.987	10	50	FHCA	
O=C(NC1=NN(c2ccc(Oc3ccccc3)cc2)C(=O)C1)c1ccccc1	2565273	FGCDQBHDUJXTRT-UHFFFAOYSA-N	371.396	3.959	10	50	FHCA	
Cc1c(C(=O)N2CC[C@@H](Oc3ccccc3)C2)n(C)c2ccc(F)cc12	426677757	AXJXZZXGJCLNRQ-QGZVFWFLSA-N	352.409	3.919	10	50	FHCA	
COc1ccccc1Cc1nc(Cc2ccc(N)cc2)n(C(C)(C)C)n1	824821899	VBCKMXFXGYTKLH-UHFFFAOYSA-N	350.466	3.806	10	50	FHCA	
CCO[C@@H](CC)C(O)(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1	1670346	RMNLSRHTDYZQMF-NRFANRHFSA-N	356.510	3.870	10	50	FHCA	
O=C1c2ccccc2C(=O)c2[nH]c(-c3c(F)c(F)c(F)c(F)c3F)nc21	2907165	VEDVYFSKPKXOQU-UHFFFAOYSA-N	364.229	3.548	10	50	FHCA	
O=C(NC1CCCCCC1)c1nc(-c2ccc(-n3cccc3)cc2)no1	4623117	DHQSZJNRTAYPBA-UHFFFAOYSA-N	350.422	3.980	10	50	FHCA	
CC1=C(C(=O)OC2CCC(C)CC2)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1	1226005	HYXYXSQAUIJADG-GFEPPQMASA-N	371.481	3.502	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C/c3c(C)[nH]c4ccccc34)NC2=S)cc1	2898820	CHYXPZHUQMOSLO-WQRHYEAKSA-N	363.442	3.747	10	50	FHCA	
CCCCCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(N(C)C)cc1	4309843	BUNGEUJFFQPYHS-SFHVURJKSA-N	359.470	3.504	10	50	FHCA	
COc1ccc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(OC)c1OC	1176136	LYBSDCOAOUFANU-FOWTUZBSSA-N	352.390	3.519	10	50	FHCA	
Cc1cccc(OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)c1	5093014	FFZVVOQIOUVAFU-UHFFFAOYSA-N	371.392	3.788	10	50	FHCA	
CN(C)Cc1c(O)ccc(C(=O)COc2ccc(Cl)cc2Cl)c1O	19912014	CLUIFQQTUDYEIT-UHFFFAOYSA-N	370.232	3.728	10	50	FHCA	
O=C1OC(c2ccc(Cl)cc2)=C/C1=C/c1cc2c(cc1[N+](=O)[O-])OCO2	2878717	NVNRNSLUEPKMQB-XGICHPGQSA-N	371.732	3.958	10	50	FHCA	
CCN(CC)c1ccc(/C=C2\SC(N3C[C@H](C)O[C@@H](C)C3)=NC2=O)cc1	3902553	XEDNFPHGUHMWTG-YDAJUHKJSA-N	373.522	3.612	10	50	FHCA	
O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1c1ccc(F)cc1	5753243	CPWDTLQPFVCQPM-OVCLIPMQSA-N	359.403	3.960	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/Nc1ccc([N+](=O)[O-])cc1Cl	100497380	NUYHHACOEDHVQE-GXDHUFHOSA-N	356.769	3.967	10	50	FHCA	
COC(=O)c1ccccc1-c1ccc(/C=C2/SC(=S)N(C)C2=O)o1	5112123	XXKYUSQTXNUDBF-NTEUORMPSA-N	359.428	3.564	10	50	FHCA	
Cc1cc(/C=C2\SC(=O)N(C)C2=O)c(C)n1-c1cccc([N+](=O)[O-])c1	13546631	HPCNLWCJHMOLNU-NVNXTCNLSA-N	357.391	3.668	10	50	FHCA	
Cc1cc(C)c2nc(NC3=N[C@@H](c4ccccc4)CC(=O)N3)nc(C)c2c1	887796	WJVKPOOHLWHFBA-QGZVFWFLSA-N	359.433	3.584	10	50	FHCA	
O=C(O)CCc1ccc(-c2ccc(F)cc2)n1-c1ccc(C(=O)O)cc1	4151200	BZNFNTHXWWSLHN-UHFFFAOYSA-N	353.349	3.999	10	50	FHCA	
Cc1nn(-c2ccc(S(=O)(=O)O)cc2)c(O)c1/N=N\c1ccccc1	100134138	XYRJCVNSUGQSQU-ZCXUNETKSA-N	358.379	3.548	10	50	FHCA	in-vitro
CC(=O)[C@@H](N=Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1	256169220	KBNQUAQMTGZQGJ-OAHLLOKOSA-N	360.757	3.928	10	50	FHCA	
Oc1ccc(-c2ccc3c(c2)OCO3)cc1CNCC1(O)CCCCC1	12279415	ZNIZEQRLSOPGOE-UHFFFAOYSA-N	355.434	3.573	10	50	FHCA	
CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1cccc(O)c1	13616131	YTWJTCLKXJYWLG-UYRXBGFRSA-N	363.413	3.968	10	50	FHCA	
COc1cccc([C@H](C)N[C@H](c2ccccc2F)c2nccn2C)c1O	846137223	CIDPIMANHVWWER-SCLBCKFNSA-N	355.413	3.714	10	50	FHCA	
COc1ccc([C@@H](NC(=O)C(C)C)c2ccc3cccnc3c2O)cc1	37867416	RVEFWDFDCPPOIN-GOSISDBHSA-N	350.418	3.811	10	50	FHCA	biogenic
CCC[C@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2Cl)SC1=S	1191193	OEJAGYZCNREKQG-HQQGHWSLSA-N	355.868	3.795	10	50	FHCA	
CCN(CCO)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	254841066	JJZVLVUELJRGGM-UHFFFAOYSA-N	359.342	3.737	10	50	FHCA	
CCCCCN1C(=O)/C(=C2/C(=O)N(CC)c3ccccc32)SC1=S	2672924	PWQRCEYVUUPJKU-PFONDFGASA-N	360.504	3.815	10	50	FHCA	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(O)c2ccccc12	4884946	CGOPCLIYQIJYNK-UHFFFAOYSA-N	358.375	3.563	10	50	FHCA	
CCOc1ccc(N/C=C2/Sc3sc(C(C)=O)c(C)[n+]3C2=O)cc1	6844950	UEIXGUAYUAPVTR-UHFFFAOYSA-O	361.468	3.645	10	50	FHCA	
Cc1ccc(/C=C2\SC(=S)N(CCC(=O)NC3CCCC3)C2=O)cc1	13799925	NQEAKCGNWMPIRK-VBKFSLOCSA-N	374.531	3.645	10	50	FHCA	
Cc1ccc(N2NC(=O)/C(=C/c3c[nH]c4ccccc34)C2=O)cc1Cl	19419169	DLTIOKVVGIKBEJ-NVNXTCNLSA-N	351.793	3.591	10	50	FHCA	
COc1cc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)ccc1O	1233139	IDMDIGOMBOGNAB-MHWRWJLKSA-N	357.456	3.802	10	50	FHCA	
O=C(O)[C@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(F)cc2)SC1=S	6112162	VOSYPXSHMLLTKA-IPJDOKCGSA-N	373.430	3.853	10	50	FHCA	
Cc1ccc(S(=O)(=O)Nc2c(C)cc(O)c(Br)c2C)cc1	1513702	TWCRTZWJCWHHLC-UHFFFAOYSA-N	370.268	3.881	10	50	FHCA	
COc1cc2c(cc1OC)[C@H](c1cc(Cl)cc(Cl)c1O)NCC2	22204758	LKKRQAIVTCEJMN-MRXNPFEDSA-N	354.233	3.951	10	50	FHCA	
Cc1cc(C(=O)N[C@@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1ccccc1	1875338907	PXRVWFWIHDUNEO-DLBZAZTESA-N	354.450	3.857	10	50	FHCA	
CSc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1	1214499	GVCWAYQJPHSFPA-GZTJUZNOSA-N	366.442	3.692	10	50	FHCA	
Nc1ncnc(Nc2ccc(Cl)cc2C(=O)c2ccccc2)c1[N+](=O)[O-]	4059588	LVYOHGORPJWIMQ-UHFFFAOYSA-N	369.768	3.595	10	50	FHCA	
CC(=O)N[C@@H](c1ccc(N(C)C)cc1)c1cc(Cl)c2cccnc2c1O	869254	RWZYBQBQFVZGAD-SFHVURJKSA-N	369.852	3.885	10	50	FHCA	
COc1ccccc1/C=C1\SC(=S)N(CCCCCC(=O)O)C1=O	12504559	BFXVGOWNUZLOQR-KAMYIIQDSA-N	365.476	3.541	10	50	FHCA	
Cc1cc(C)c(CN2CCN(Cc3c(C)cc(C)cc3O)CC2)c(O)c1	19639079	VVGRLCZTIXVWSF-UHFFFAOYSA-N	354.494	3.649	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)SC2=S)cc1	4477987	JMXLIACXRVAMGP-CXUHLZMHSA-N	371.439	3.830	10	50	FHCA	
CN(C)[C@@H](CNC1CCN(c2ccc3c(c2)CCC3)CC1)c1ccco1	1506403410	RCKRCYYLVOBOSC-NRFANRHFSA-N	353.510	3.630	10	50	FHCA	
O=C(O)c1cccc(N2C(=O)/C(=C\c3ccccc3F)SC2=S)c1	967152	GWFWZCMKFUNLOB-NTEUORMPSA-N	359.403	3.930	10	50	FHCA	
COc1ccc(S(=O)(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1	1200061	VOACMIPOWXSUKS-UHFFFAOYSA-N	364.423	3.759	10	50	FHCA	
CCn1cc([C@H]2OCCC[C@@H]2NCc2ccc(N3CCCCC3)cc2)cn1	328646977	SZMNPRZLNBQWCB-FCHUYYIVSA-N	368.525	3.903	10	50	FHCA	
O=C1NC(=O)N(CCC2=CCCCC2)C(=O)/C1=C\Nc1cccc(Cl)c1	2892792	RKEBXMZJVRZVJX-VBKFSLOCSA-N	373.840	3.605	10	50	FHCA	
Cc1ccc(OCCOc2ccc(/C=C3/SC(=S)NC3=O)cc2)cc1	3002864	WFQPFFJITLTBHJ-SFQUDFHCSA-N	371.483	3.942	10	50	FHCA	
COc1ccc(C2=C/C(=C/c3ccccc3[N+](=O)[O-])C(=O)O2)c(OC)c1	4351879	VVKJQUQADPGXLG-LCYFTJDESA-N	353.330	3.593	10	50	FHCA	
O=C([C@@H]1Nc2ccccc2[C@@H]2C=CC[C@@H]12)N1CCc2[nH]nc(C3CCC3)c2C1	23337266	GBFJMYKVPPZMJP-LBUQITIBSA-N	374.488	3.716	10	50	FHCA	
CN(C)c1ccc(-c2nc(-c3cn([C@H]4CC[C@@H](N)CC4)nn3)cs2)cc1	1875281411	YFHUVJGCIDIRGM-FZNQNYSPSA-N	368.510	3.577	10	50	FHCA	
O=C1c2c(ccc3[nH]c(-c4ccc([N+](=O)[O-])cc4)nc23)C(=O)[C@@H]2C=CC=C[C@H]12	219034910	FUWHSUBEUWFXTG-KGLIPLIRSA-N	371.352	3.876	10	50	FHCA	
O=C1Nc2ccccc2/C1=C1/SC(=S)N(c2ccccc2F)C1=O	1476434	AKKHPLNUFIWAHQ-YPKPFQOOSA-N	356.403	3.554	10	50	FHCA	
COc1ccc(C2=C/C(=C/c3cccc([N+](=O)[O-])c3)C(=O)O2)c(OC)c1	2919077	HNAOTHPDOSTATM-JYRVWZFOSA-N	353.330	3.593	10	50	FHCA	
Oc1ccc(Br)cc1CN1CCC(N2CCCCC2)CC1	4745793	OEHIVNCXYPJGEI-UHFFFAOYSA-N	353.304	3.605	10	50	FHCA	
COc1ccc(N2CCN(Cc3cccc(Br)c3)CC2)cc1	55542990	DPRZMRPZXOEJEE-UHFFFAOYSA-N	361.283	3.780	10	50	FHCA	
CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1cc([N+](=O)[O-])ccc1O	19732264	LUZUCJIZDRQNQT-YBEGLDIGSA-N	366.377	3.636	10	50	FHCA	
COCCCN1C(=O)/C(=C/C2=Cc3ccccc3O[C@@H]2C)SC1=S	1818600	DMYLSUFHRMMFLE-COOUDCDJSA-N	361.488	3.632	10	50	FHCA	
COc1ccc(C2=C/C(=C/c3ccc(C)c([N+](=O)[O-])c3)C(=O)O2)c(OC)c1	1197402	DPLZMQQJJRIMLI-ZSOIEALJSA-N	367.357	3.902	10	50	FHCA	
Oc1ccccc1CN1CCN(Cc2ccccc2O)C1c1ccco1	19320984	SNOKCLWIPAYOOM-UHFFFAOYSA-N	350.418	3.707	10	50	FHCA	
Cc1cccc(N2C(=O)/C(=C/c3cc(C)n(C)c3C)C(O)=NC2=S)c1	8738566	PWKHLUGNOGCSFX-MHWRWJLKSA-N	353.447	3.622	10	50	FHCA	
CN1C(=O)/C(=C/c2cc(Cl)cc(Br)c2O)SC1=S	1204813	LWIMCHAMXAGRRN-BAQGIRSFSA-N	364.673	3.639	10	50	FHCA	
COc1ccc(N2CCN(c3ccc(-c4ccc(F)cc4)nn3)CC2)cc1	20735632	VBRJCTVBELHFEK-UHFFFAOYSA-N	364.424	3.618	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\c3ccc(C(=O)O)cc3)SC2=S)cc1	4950043	KPOFUOVEENBTTQ-XNTDXEJSSA-N	371.439	3.799	10	50	FHCA	
Cc1cccc(OCCOc2cccc(/C=C3\SC(=S)NC3=O)c2)c1	13942523	BQUDXGJMHGBKEK-ATVHPVEESA-N	371.483	3.942	10	50	FHCA	
O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)SC(=S)N1Cc1ccccc1	15009735	WAXFSZOLSONKKH-XNTDXEJSSA-N	356.428	3.996	10	50	FHCA	
O=C1/C(=C\c2c[nH]c3ccccc23)C(O)=NC(=S)N1c1ccc(F)cc1	1296447	CFAFLTPUPWSUOH-DHDCSXOGSA-N	365.389	3.979	10	50	FHCA	
COCCCN1C(=O)/C(=C/c2cccc(Br)c2)SC1=S	2372284	KQKXGVHTGNPODL-XFXZXTDPSA-N	372.309	3.687	10	50	FHCA	
COc1cccc(C(=O)[C@H]2CCCN(Cc3ccc(OC)cc3O)C2)c1	12595042	REKMWRWPKPTDFJ-KRWDZBQOSA-N	355.434	3.504	10	50	FHCA	
Cc1cc(O)cc(C)c1NS(=O)(=O)c1ccc(Br)cc1	951365	NTKFDEAIKJRFRK-UHFFFAOYSA-N	356.241	3.572	10	50	FHCA	
O=C(NN1C(=O)/C(=C/c2ccccc2)SC1=S)c1ccccc1Cl	1227963	WTFITOCUXDTJGD-UVTDQMKNSA-N	374.874	3.886	10	50	FHCA	
CC[C@H]1COCCN1C(=O)c1ccc(-n2c(C)cc(C(C)=O)c2C)cc1	77539126	SDYNVYQICZFKPF-SFHVURJKSA-N	354.450	3.548	10	50	FHCA	
CC1=C(C(=O)OCC2CCCCC2)[C@H](c2ccc(N(C)C)cc2)NC(=O)N1	801127	ALXAIEQBXPEBJL-IBGZPJMESA-N	371.481	3.504	10	50	FHCA	
Cc1cc(C)cc(-n2c(C)cc(/C=C3/C(=O)N(C)C(=O)N=C3O)c2C)c1	1177559	UEIQGLGPUCOYPS-LICLKQGHSA-N	351.406	3.643	10	50	FHCA	
CCOC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\Nc1ccc(O)cc1	100249955	MZFUWNXWIDAUBX-WJDWOHSUSA-N	357.797	3.738	10	50	FHCA	
CCCC(=O)N[C@H](c1cccc([N+](=O)[O-])c1)c1ccc2cccnc2c1O	3894217	SWDCNWUXTXPNMJ-GOSISDBHSA-N	365.389	3.854	10	50	FHCA	
O=C(CCC1CCN(Cc2cc(Cl)ccc2O)CC1)N1CCCC1	12303629	ZUXNOELDSJQFNS-UHFFFAOYSA-N	350.890	3.660	10	50	FHCA	
CC(C)(C)c1ccc(C(=O)NCc2ccc(N3CCOCC3)cc2)cc1	12381681	MEBXQDBBVNUETG-UHFFFAOYSA-N	352.478	3.751	10	50	FHCA	
COc1ccc(N2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)cc1	55543897	LXKOXXIBJSOXCZ-UHFFFAOYSA-N	361.829	3.579	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(O)c(Br)c1	100147858	KCFYAJPHEPFFGY-NTEUORMPSA-N	357.207	3.961	10	50	FHCA	
CCOc1cc(/C=C2\SC(=S)N(CC)C2=O)ccc1OC(F)F	7717792	IUWHVLWWPCFIOU-WQLSENKSSA-N	359.419	3.908	10	50	FHCA	
O=C(O)CC[C@H](NC(=O)Nc1ccc(/N=N/c2ccccc2)cc1)C(=O)O	71767394	FLCMIASZWXROHD-SKAIHHOBSA-N	370.365	3.542	10	50	FHCA	
CCOC(=O)[C@@H](C)Oc1ccc2c(oc(=O)c3cc(OC)ccc32)c1C	1183698	FXDVPUIGILNDBQ-GFCCVEGCSA-N	356.374	3.594	10	50	FHCA	
CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/N[C@H](C)c1ccccc1	100095295	PSQAVLOPIGPCQA-RNEAKCBISA-N	350.378	3.552	10	50	FHCA	
O=C1NC(=S)S/C1=C\c1ccc(OC(=O)c2ccccc2F)cc1	16247554	YDIFHRMEFMAFRO-ZROIWOOFSA-N	359.403	3.534	10	50	FHCA	
Cc1cc(-n2c(C)cc(/C=C3\NC(O)=NC3=O)c2C)ccc1Br	13801486	KNICWBHNWTXPJL-NVNXTCNLSA-N	374.238	3.550	10	50	FHCA	
O=C1/C(=C/c2ccc(O)cc2)SC(=S)N1c1ccc([N+](=O)[O-])cc1	5018604	ZXXUMJIVLIVTMZ-ZROIWOOFSA-N	358.400	3.706	10	50	FHCA	
CCCCN1C(=O)/C(=C2\SC(=S)N(CCC)C2=O)c2ccccc21	13800028	PLMOLZOJWQAFCG-PFONDFGASA-N	360.504	3.815	10	50	FHCA	
CCOc1cccc(CN2CCC[C@@H](C(=O)c3ccccc3OC)C2)c1O	11932982	OPOKDGFSSQDKQH-MRXNPFEDSA-N	369.461	3.894	10	50	FHCA	
CC1=C(C(=O)OCC2CCCCC2)[C@@H](c2ccc(N(C)C)cc2)NC(=O)N1	801126	ALXAIEQBXPEBJL-LJQANCHMSA-N	371.481	3.504	10	50	FHCA	
O=C(O)CCCCCN1C(=O)/C(=C\c2ccc(F)cc2)SC1=S	1811418	CSIAIHVXCOTWLB-JLHYYAGUSA-N	353.440	3.672	10	50	FHCA	
O=C(O)c1ccc(N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)cc1	966740	SBAWETQNNLKNNE-ZROIWOOFSA-N	359.403	3.930	10	50	FHCA	
Cc1ccccc1C1=NN2C(=N)/C(=C/c3cccs3)C(=O)N=C2S1	1179298	MUXVPUZFXQUGAW-KXXGJRMMSA-N	352.444	3.724	10	50	FHCA	
CN(C)c1ccc(/C=C2/C(=O)N(c3cccc(Cl)c3)C(=O)N=C2O)cc1	1184860	VFWMMOLGXBLXRD-MHWRWJLKSA-N	369.808	3.913	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3csc(C(C)C)n3)[C@H](C)C2)cc1	72406830	YPTNWTVZXNOIGR-CQSZACIVSA-N	359.495	3.626	10	50	FHCA	
O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1c1cccc(Cl)c1	170613732	WOWIADPXPCEOLF-UHFFFAOYSA-N	351.189	3.668	10	50	FHCA	
CN1C(=O)/C(=C2\SC(=S)N(c3ccccc3F)C2=O)c2ccccc21	1247664	XIQQKQPWEXUBGA-PFONDFGASA-N	370.430	3.578	10	50	FHCA	
O=C1/C(=C/c2cccc([N+](=O)[O-])c2O)SC(=S)N1Cc1ccccc1	16479722	ZTWBCEZQPRYIGY-ZROIWOOFSA-N	372.427	3.702	10	50	FHCA	in-vivo
COc1cccc(CN(C)[C@@H]2CCCN(CCc3ccccc3)C2)c1O	20235228	UOJKRLWTUCTFBX-HXUWFJFHSA-N	354.494	3.540	10	50	FHCA	
CN(C)c1ccc(/C=C2\C(=O)N(c3ccccc3F)C(=S)N=C2O)cc1	15769828	MTZOXFWDKHNLEB-KAMYIIQDSA-N	369.421	3.563	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3ccn(C(C)(C)C)c3)CC2(C)C)cc1	95361669	FZNHGBNZUSEGKV-UHFFFAOYSA-N	369.509	3.993	10	50	FHCA	
C[C@H]1CN(Cc2c(O)ccc3c(-c4ccccc4)cc(=O)oc23)C[C@H](C)O1	19790394	WFVKUPXLIMZXQM-GJZGRUSLSA-N	365.429	3.775	10	50	FHCA	
CN(Cc1nnc(-c2ccccc2)o1)Cc1cc(-c2ncccn2)ccc1O	11973204	BHZWPRSCSZEZGO-UHFFFAOYSA-N	373.416	3.531	10	50	FHCA	
O=C(O)CCN1C(=O)/C(=C\c2ccc(Cl)c(Cl)c2)SC1=S	2672543	ZUPWWCFFFPOUJN-UXBLZVDNSA-N	362.259	3.669	10	50	FHCA	
COc1cc2c(cc1OC)[C@@H](c1cc(Cl)cc(Cl)c1O)NCC2	22204761	LKKRQAIVTCEJMN-INIZCTEOSA-N	354.233	3.951	10	50	FHCA	
COc1ccc(N2CCN(Cc3ccc(Br)s3)CC2)cc1	55543001	XBEACWWLXMPPKV-UHFFFAOYSA-N	367.312	3.841	10	50	FHCA	
Oc1nc2ccc(CNC3CCN(c4ccc5c(c4)CCC5)CC3)cc2[nH]1	952972035	RTOQILOHUATNPR-UHFFFAOYSA-N	362.477	3.516	10	50	FHCA	
COc1cc(-c2c3cn[nH]c3nc3c2oc2c(O)c(O)ccc23)ccc1O	217842735	RHPKVKRGCRQQNN-UHFFFAOYSA-N	363.329	3.650	10	50	FHCA	biogenic
COc1cccc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)c1O	1159380	ANTBYKLGYCDDEG-ZROIWOOFSA-N	361.419	3.946	10	50	FHCA	
CCOc1ccccc1N1C(=O)N=C(O)/C(=C/C=C/c2ccco2)C1=O	8738571	KRZIFWYMAKKJLC-UHFVGQSGSA-N	352.346	3.741	10	50	FHCA	
Cc1cc(C)c(N2C(=O)NC(=O)/C(=C/C=C/c3ccccc3)C2=O)c(C)c1	16310868	CNTDDKNSNXJBKN-YJMOAXFXSA-N	360.413	3.834	10	50	FHCA	
Cc1oc(-c2cccs2)nc1COC(=O)CCOc1ccc(N)cc1	241371421	MNMHGAUQRZFLQZ-UHFFFAOYSA-N	358.419	3.806	10	50	FHCA	
CCCCN1C(=O)/C(=C\c2ccc(OC)c(OC)c2OC)SC1=S	4793802	HVNYOSWBGSIHPX-JLHYYAGUSA-N	367.492	3.714	10	50	FHCA	
CC(=O)C[C@@H](c1ccccc1)C1(Br)C(=O)c2ccccc2C1=O	22781520	ZIPQVCOBTBIFIP-INIZCTEOSA-N	371.230	3.962	10	50	FHCA	
CCCCOc1cc([N+](=O)[O-])c(OCCCC)cc1N1CCOCC1	4255243	MKVBADWWJFSRRK-UHFFFAOYSA-N	352.431	3.789	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3cccc4cnccc34)[C@H](C)C2)cc1	72432434	QNAVKHVATXLBLC-MRXNPFEDSA-N	361.445	3.594	10	50	FHCA	
COc1ccc(OC)c(C2=C/C(=C/c3cc([N+](=O)[O-])ccc3C)C(=O)O2)c1	1160733	WEKSGBUGGWUZQH-ZSOIEALJSA-N	367.357	3.902	10	50	FHCA	
Cc1ccccc1OCCOc1ccc(/C=C2\SC(=S)NC2=O)cc1	13897842	BVIQYPWIVIDHJT-ATVHPVEESA-N	371.483	3.942	10	50	FHCA	
CCN(CCO)c1ccc(/N=N\c2sc3cc(OC)ccc3[n+]2C)cc1	16678683	ZZJJYUNNNYLVAR-UHFFFAOYSA-N	371.486	3.968	10	50	FHCA	in-vitro
Cc1[nH]c2ccccc2c1/C=C/c1nc2ccccc2c(=O)n1CCCO	4063656	HBDSNIOZAKSKBK-VAWYXSNFSA-N	359.429	3.739	10	50	FHCA	biogenic
COc1ccc(O)c(CN[C@@H](C)c2cnn(-c3cccc(F)c3)c2C)c1	12373214	JUGLVCNPMOBOIT-ZDUSSCGKSA-N	355.413	3.885	10	50	FHCA	
CCCC[C@H]1C[C@@H]1C(=O)Oc1cccc2c1C(=O)c1c(O)cccc1C2=O	5003819	ZYBYCZKZDFBDHL-WFASDCNBSA-N	364.397	3.899	10	50	FHCA	
Oc1ccc(CCNC(=S)Nc2ccc(Cl)cc2Cl)cc1O	1058950	HLEHHTNDXCWHCU-UHFFFAOYSA-N	357.262	3.934	10	50	FHCA	
COc1ccc(C(=O)[C@@H]2CCCN(Cc3ccccc3O)C2)cc1OC	12588132	RQLIVOAMFDOWGQ-QGZVFWFLSA-N	355.434	3.504	10	50	FHCA	
O=C1/C(=C/C2=Cc3ccccc3OC2)SC(=S)N1Cc1ccco1	2533396	ZZEUABJVJLPCDX-SXGWCWSVSA-N	355.440	4.000	10	50	FHCA	
COc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccccc2)C1=O	22107374	XHUVKOUPVZLAKR-QGOAFFKASA-N	372.380	3.515	10	50	FHCA	
CCc1cccc(C)c1-n1c(C)cc(/C=C2/C(=O)NC(=S)N=C2O)c1C	8997666	ORQCKUGAWDZSNE-UHFFFAOYSA-N	367.474	3.720	10	50	FHCA	
COc1cccc(/C=C2/SC(=S)N(CCCCCC(=O)O)C2=O)c1	1916881	HYLQGWNFXDFPBC-SDNWHVSQSA-N	365.476	3.541	10	50	FHCA	
O=C(O)c1ccccc1/C=C1/SC(=S)N(c2ccc(F)cc2)C1=O	1236524	BNQMMOVZPNXQMA-NTEUORMPSA-N	359.403	3.930	10	50	FHCA	
COc1cccc(N2C(=O)/C(=C/c3ccc(O)c(OC)c3)SC2=S)c1	978019	AYBCVXLJMZDBDX-SXGWCWSVSA-N	373.455	3.815	10	50	FHCA	
CCCOc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2O)cc1OC	4854705	ZQGJPTAMOXUTJZ-VBKFSLOCSA-N	352.390	3.786	10	50	FHCA	
Fc1c(F)c(N2CCCCCC2)c(F)c(F)c1/C=C/CN1CCOCC1	20406418	HLCWDSCDVKKBSJ-AATRIKPKSA-N	372.406	3.969	10	50	FHCA	
Cn1cc(C(=O)N2C[C@@H](C(C)(C)C)c3ccccc32)c([C@H]2CCCNC2)n1	333320981	UMONSPUSPUDGIM-MAUKXSAKSA-N	366.509	3.677	10	50	FHCA	
CN1CC[C@@H](CNCc2ccc(N3CCCCC3)cc2)[C@@H]1c1cccnc1	328642423	RALOGLXJQIXRFI-GMAHTHKFSA-N	364.537	3.855	10	50	FHCA	
COC(=O)C1=C(C)N(Cc2ccco2)C(=O)/C1=C\c1ccc(Cl)cc1	1074385	ALNIUWXIRCFCCD-YBEGLDIGSA-N	357.793	3.806	10	50	FHCA	
CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C\NCc1ccc(Cl)cc1	13756953	YKDCVCIZDSKXJV-BOPFTXTBSA-N	370.796	3.644	10	50	FHCA	
Cc1cccnc1NCCNC1CCN(c2ccc3c(c2)CCC3)CC1	1506396467	SRWJDLVSIMURBA-UHFFFAOYSA-N	350.510	3.549	10	50	FHCA	
Oc1ccc(Br)cc1CN1CCC(N2CCCCCC2)CC1	1167848	VCWPPAHWZDBLEQ-UHFFFAOYSA-N	367.331	3.995	10	50	FHCA	
O=C(c1ccc(-c2ccc(C3=S=CC=C3)s2)cc1)N1CCC[C@H](O)C1	426429030	PUNYXHQBMUDWPP-INIZCTEOSA-N	369.511	3.638	10	50	FHCA	
Cc1cc(C(=O)N[C@@H]2CCOC3(CCOCC3)C2)c(C)n1-c1ccccc1	77357141	SXMAIISKXLRLLY-GOSISDBHSA-N	368.477	3.552	10	50	FHCA	
O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C/c2ccccc2)SC1=S	966970	VGIFXQDHKSESDU-JORMNFRLSA-N	369.467	3.584	10	50	FHCA	
CSc1ccccc1N1C(=O)[C@@H]2C[C@H]1CN2Cc1cc(Cl)ccc1O	11977038	SBYGZUSBYYIQEF-HOCLYGCPSA-N	374.893	3.757	10	50	FHCA	
COc1ccc(C(=O)[C@@H]2CCCN(Cc3ccccc3O)C2)c(OC)c1	12701250	OOTDKQQRWIQFBH-MRXNPFEDSA-N	355.434	3.504	10	50	FHCA	
COc1ccc2c(c1)CCC1=C2NC(=S)N[C@H]1c1ccc(N(C)C)cc1	13545904	NOYBEYGHQKYHRT-IBGZPJMESA-N	365.502	3.638	10	50	FHCA	
Cc1n[nH]c(C)c1CCCNC1CCN(c2ccc3c(c2)CCC3)CC1	1506406081	MJZWEMDKLJDSMZ-UHFFFAOYSA-N	352.526	3.706	10	50	FHCA	
O=C(O)c1ccccc1/C=C1\SC(=S)N(Cc2ccccc2)C1=O	2124220	CRHQFJBLIPEBLK-GDNBJRDFSA-N	355.440	3.786	10	50	FHCA	
CO[C@@H]1C[C@@H](c2ncc[nH]2)N(Cc2ccc(N3CCCCC3)c(C)c2)C1	818311098	JGVIKJXJPRIPHK-QUCCMNQESA-N	354.498	3.670	10	50	FHCA	
COc1ccccc1N1C(=O)/C(=C/c2ccc3c(c2)OCO3)SC1=S	1104348	DVXGVMBVIREASH-SXGWCWSVSA-N	371.439	3.830	10	50	FHCA	
CCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S	2507235	NWQSFOUKECDTIE-IAOKNECISA-N	360.460	3.622	10	50	FHCA	biogenic
COc1ccc(N2CCN(C(=O)c3cc(F)c(F)cc3Cl)CC2)cc1	6967646	HUTHRFDNBHQZMA-UHFFFAOYSA-N	366.795	3.589	10	50	FHCA	
CC(C)(C)c1cccc(CN2CCc3[nH]cnc3[C@H]2c2ccncc2)c1O	67756957	ILEKBWNEGKTEAS-HXUWFJFHSA-N	362.477	3.956	10	50	FHCA	
O=C1/C(=C/c2cccc([N+](=O)[O-])c2)SC(=S)N1Cc1ccccc1	1225524	WNSLRPUSKLVHRV-GDNBJRDFSA-N	356.428	3.996	10	50	FHCA	
CCc1nc2cc(CNC(=O)c3ccc(C)c(O)c3O)ccc2n1C1CC1	802188094	XFKJHDQGCDCDMH-UHFFFAOYSA-N	365.433	3.583	10	50	FHCA	
Cc1noc(C)c1[C@@H]1CCCN1C1CCN(c2ccc3c(c2)OCO3)CC1	65498554	DOGHWHKTGIJSKV-SFHVURJKSA-N	369.465	3.826	10	50	FHCA	
Cc1cc(/C=C2/C(=O)N(c3ccc(Cl)cc3)C(=S)N=C2O)c(C)n1C	1181816	NUAKOVUZHMBGQW-OQLLNIDSSA-N	373.865	3.967	10	50	FHCA	
COc1ccc(Cl)cc1/C=C1\C(=O)N(c2cccc(C(=O)O)c2)N=C1C	4853186	BKTLVJWAZRMPEC-YBEGLDIGSA-N	370.792	3.853	10	50	FHCA	
Oc1ccc(-c2ccccn2)cc1CN1CCN(c2ccccc2F)CC1	299765769	CVZSUJDIVHAHIN-UHFFFAOYSA-N	363.436	3.916	10	50	FHCA	
Cc1ccccc1N1C(=O)N=C(O)/C(=C\c2cnn(-c3ccccc3)c2)C1=O	1183428	UISFLEPIOGYTGN-GZTJUZNOSA-N	372.384	3.687	10	50	FHCA	
CC(=O)c1ccc(/N=N/C(C(N)=O)=C2\NC(C)(C)Cc3ccccc32)cc1	103812051	ZXSRRUROLCGTBS-WKZWHVCQSA-N	362.433	3.751	10	50	FHCA	in-vitro
CCc1ccc(N2N=C(C)/C(=C\c3cc(OC)c(O)c(OC)c3)C2=O)cc1	5046832	YDODPUFODOGVSB-LICLKQGHSA-N	366.417	3.778	10	50	FHCA	
CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)/C1=C/N[C@@H](C)c1ccccc1	100095299	PSQAVLOPIGPCQA-HTMJNSLASA-N	350.378	3.552	10	50	FHCA	
COCCn1c(C)cc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)c1C	13124821	YYYOVLVFXFDHMA-LICLKQGHSA-N	373.840	3.502	10	50	FHCA	
Cc1cc(C)c(O)c(CN2CCC[C@@H](C(=O)c3ccc4c(c3)OCO4)C2)c1	71748928	ZCYHDTPEDVMDDX-QGZVFWFLSA-N	367.445	3.833	10	50	FHCA	
COc1ccc(N2CCN([C@H]3CCCN(CCC=C(C)C)C3)CC2)cc1	72151677	YPOPDSHBZXRDAF-NRFANRHFSA-N	357.542	3.638	10	50	FHCA	
C[C@@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(F)cc3)cc2)C1	71376298	HMXNFMXIMFRJRO-OAHLLOKOSA-N	362.470	3.541	10	50	FHCA	
COc1ccccc1/C=C1\SC(=S)N(c2cccc(C(=O)O)c2)C1=O	13058473	GKWRCQCNWLPEJX-GDNBJRDFSA-N	371.439	3.799	10	50	FHCA	
c1ccc(-c2cnc(SCc3nncs3)n2C[C@@H]2CCCO2)cc1	916534774	XUUWINUNXIAAFV-AWEZNQCLSA-N	358.492	3.873	10	50	FHCA	
O=C(C1CCC1)N1CCN(c2ccc(OCc3ccccc3)cc2)CC1	2789380	ZXXHFDRZZYUZMJ-UHFFFAOYSA-N	350.462	3.714	10	50	FHCA	
CC(C)=CCc1cc(-c2coc3cc(O)cc(O)c3c2=O)cc(O)c1O	14762993	JOQWUUJQWPZLAT-UHFFFAOYSA-N	354.358	3.791	10	50	FHCA	biogenic,in-vitro
O=C(NCc1ccccc1Cl)C1CCN(Cc2ccccc2O)CC1	6322911	IVQOJYDAWNDICE-UHFFFAOYSA-N	358.869	3.574	10	50	FHCA	
CCC(=O)N[C@H](c1cccs1)c1cc([N+](=O)[O-])c2cccnc2c1O	4844910	DEXNORPUTBBNSC-HNNXBMFYSA-N	357.391	3.526	10	50	FHCA	
C[C@H]1C(O)[C@H](C)[C@H](c2ccc(N(C)C)cc2)N[C@H]1c1ccc(N(C)C)cc1	248063662	QTSVDXZTCFEZTA-AHWCRGGASA-N	367.537	3.837	10	50	FHCA	
CC(=O)N(/C=C1\SC(=S)N(c2ccccc2)C1=O)c1ccccc1	1036938	OKRZQEGMFHNZLW-VBKFSLOCSA-N	354.456	3.946	10	50	FHCA	
CCC(=O)N[C@@H](c1ccc(C)cc1)c1cc([N+](=O)[O-])c2cccnc2c1O	4684865	SOOZZAWHFOKELH-SFHVURJKSA-N	365.389	3.773	10	50	FHCA	
O=C(O)c1ccc(/C=C2\SC(=S)N(CCc3ccccc3)C2=O)cc1	210398927	STKNQJMZZNBXDJ-VBKFSLOCSA-N	369.467	3.829	10	50	FHCA	
O=S(=O)(Nc1ccc(O)c2ccccc12)c1cccc2cccnc12	1120410	VOLVNBIKBMKQKR-UHFFFAOYSA-N	350.399	3.894	10	50	FHCA	
CCc1cccc2c(C3=CCN(c4cn[nH]c(=O)c4Cl)CC3)c[nH]c12	170624616	OWVPLHGJBFOYDJ-UHFFFAOYSA-N	354.841	3.761	10	50	FHCA	
CCCC[C@@H]1C[C@H]1C(=O)Oc1cccc2c1C(=O)c1c(O)cccc1C2=O	5003820	ZYBYCZKZDFBDHL-IUODEOHRSA-N	364.397	3.899	10	50	FHCA	
Cc1cc(CN(C)Cc2cc(-c3ccc4c(c3)OCO4)ccc2O)on1	19720690	JJOUQTZWHCUOCW-UHFFFAOYSA-N	352.390	3.716	10	50	FHCA	
CC[C@@H]1CCc2c(sc(NC(=O)CCC(=O)O)c2C(=O)OC(C)C)C1	5953976	AOYPCACRACGRSF-LLVKDONJSA-N	367.467	3.632	10	50	FHCA	
O=C(CC1(c2ccccc2)C(=O)c2ccccc2C1=O)NC1CCCCC1	3082264	HSCODGJSFKXBFW-UHFFFAOYSA-N	361.441	3.843	10	50	FHCA	
Cc1cc(/C=C2/C(=O)N(c3cccc(Cl)c3)C(=S)N=C2O)c(C)n1C	13801304	QJQQMTPOYIGMLI-OVCLIPMQSA-N	373.865	3.967	10	50	FHCA	
Oc1ccc2c(oc3c(-c4ccc5c(c4)OCO5)c4cn[nH]c4nc32)c1O	217833065	WWZOYJJBFODWIY-UHFFFAOYSA-N	361.313	3.664	10	50	FHCA	biogenic
C[C@@H](N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccccc1O	783520797	ZPNSCVQVTCNMCQ-TZMCWYRMSA-N	364.367	3.867	10	50	FHCA	
Cc1cccc(N2C(=O)/C(=C3/C(=O)Nc4ccccc43)SC2=S)c1	1068600	LIRAWCJKTMXXDY-PFONDFGASA-N	352.440	3.723	10	50	FHCA	
O=C1c2ccccc2C(=O)c2c1ccc1c(=O)n(-c3ccc(Cl)cc3)[nH]c21	4309881	SRNXZDOELWBLAV-UHFFFAOYSA-N	374.783	3.748	10	50	FHCA	
Cc1cc(/C=C2/C(=O)N(Cc3ccccc3)C(=O)N=C2O)c(C)n1C1CC1	1100028	NTEWMWDVWNCUSL-WOJGMQOQSA-N	363.417	3.942	10	50	FHCA	
COc1cc(/C=C2/C(=O)N(c3ccc(C)c(C)c3)N=C2C)cc(OC)c1O	4839131	LYOZYOJJBSZAJY-RQZCQDPDSA-N	366.417	3.832	10	50	FHCA	
COc1ccc(O)c(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)c1	16215202	HIPITHDKRGMZOH-YBEGLDIGSA-N	357.456	3.802	10	50	FHCA	
CCCCOC(=O)CCN1C(=O)/C(=C\c2cccs2)SC1=S	4746267	JCRYMNGIIYYMPS-ZRDIBKRKSA-N	355.506	3.683	10	50	FHCA	
CCN(Cc1ccccc1)c1ccc(CNC[C@@]2(O)CCSC2)cc1	236965896	KKCJMVTZYJRTSR-NRFANRHFSA-N	356.535	3.671	10	50	FHCA	
Cc1c(CCNC(=O)N(C)[C@@H](C)c2ccon2)c2cccc3c2n1CCC3	426443405	PNSLLYWEGVJCAC-HNNXBMFYSA-N	366.465	3.829	10	50	FHCA	
O=C(CCc1ccc2c(c1)OCO2)NCc1ccc(N2CCCCC2)cc1	72119414	BQQSYIQLFQJXCU-UHFFFAOYSA-N	366.461	3.655	10	50	FHCA	
O=S(=O)(O)c1cccc(N/N=N/c2ccc(Br)cc2)c1	4996363	DSPGYPPAGHWCCL-UHFFFAOYSA-N	356.201	3.807	10	50	FHCA	
COc1ccc(N2CCN(Cc3ccnc(C(C)C)n3)CC2(C)C)cc1	72128353	VDXCXNFKNNXZGY-UHFFFAOYSA-N	354.498	3.709	10	50	FHCA	
O=C1N=C(O)/C(=C\c2cnn(-c3ccccc3)c2)C(=O)N1C1CCCCC1	1183559	LITJEKQVPLQDSP-GZTJUZNOSA-N	364.405	3.507	10	50	FHCA	
C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@H]1CCNC[C@H]1F	888101874	QDDVXMAOISBHSF-YVWKXTFCSA-N	370.468	3.820	10	50	FHCA	
CC[C@]1(O)CCC[C@H]2CN(C3CCN(c4ccc(OC)cc4)CC3)C[C@H]21	2356167549	RVUCHGQLMDYCPJ-WTOYTKOKSA-N	358.526	3.537	10	50	FHCA	
O=C(O)CCc1ccc(-c2ccc(F)cc2)n1-c1cccc(C(=O)O)c1	4151210	HMOJSEUGGXLZBR-UHFFFAOYSA-N	353.349	3.999	10	50	FHCA	
COc1ccc(C2=C/C(=C/c3ccc(OC)c(OC)c3)C(=O)O2)c(OC)c1	1197282	KPMNTTTZEIOJMJ-ZROIWOOFSA-N	368.385	3.702	10	50	FHCA	
CCCC[C@@H]1C[C@@H]1C(=O)Oc1cccc2c1C(=O)c1c(O)cccc1C2=O	5003818	ZYBYCZKZDFBDHL-DOMZBBRYSA-N	364.397	3.899	10	50	FHCA	
CCOc1ccc(N2C(=O)/C(=C/c3ccc(O)c(O)c3)SC2=S)cc1	1211301	QPXJCAXCYQQAQR-YBEGLDIGSA-N	373.455	3.902	10	50	FHCA	
COCCN1C(=O)/C(=C/c2cc(Cl)cc(Cl)c2O)SC1=S	2980447	HLECFVZZKMSWCR-YHYXMXQVSA-N	364.275	3.547	10	50	FHCA	
Cc1ccc(C2(O)CCN(Cc3cc(Cl)cc(Cl)c3O)CC2)nc1	67774825	QLBQQHHHLCIZRL-UHFFFAOYSA-N	367.276	3.886	10	50	FHCA	
O=C1OC(c2ccc(Br)cc2)=C/C1=C/c1ccc([N+](=O)[O-])o1	5944723	YZCCUHCSZYANIO-YFHOEESVSA-N	362.135	3.932	10	50	FHCA	
COc1ccccc1[C@H](NC(=O)C(C)C)c1ccc2cccnc2c1O	855783	LKTAHGUJCBIECB-IBGZPJMESA-N	350.418	3.811	10	50	FHCA	
COc1ccc(/C=C2\SC(=S)N(Cc3cccnc3)C2=O)cc1C	13518985	MRRDKSDLJAJQKT-SXGWCWSVSA-N	356.472	3.800	10	50	FHCA	
Cc1nccn1[C@H](C)CC(=O)NCCc1c(C)n2c3c(cccc13)CCC2	670466611	WHCNIBNNDFZWAX-OAHLLOKOSA-N	364.493	3.711	10	50	FHCA	
CCN(CC)c1ccc(/C=C2\SC(=S)N(CCCOC)C2=O)cc1	13370589	PFNGRLSXKCKCSD-SSZFMOIBSA-N	364.536	3.771	10	50	FHCA	
COc1ccccc1[C@@H]1CC(c2ccccc2O)=NN1C(=O)c1ccco1	170620250	OKNDJBIUURKKIZ-KRWDZBQOSA-N	362.385	3.985	10	50	FHCA	
Cc1ccc(/C=C2/C(=O)NC(=S)N(c3ccc(Cl)cc3)C2=O)s1	711654	BMYMVIVQKFBRAQ-JYRVWZFOSA-N	362.863	3.541	10	50	FHCA	
O=C(O)[C@H](Cc1ccccc1)N1C(=O)/C(=C\c2ccccc2)SC1=S	6133305	VGIFXQDHKSESDU-DLEKYWELSA-N	369.467	3.584	10	50	FHCA	
O=C(c1ccco1)N1CCN(c2ccc(OCc3ccccc3)cc2)CC1	2783158	SBELZSUJGGYNQH-UHFFFAOYSA-N	362.429	3.821	10	50	FHCA	
C[C@H]1[C@@H](c2ccc(N(C)C)cc2)N[C@@H](c2ccc(N(C)C)cc2)[C@@H](C)[C@@H]1O	248063669	QTSVDXZTCFEZTA-WLPKDZNLSA-N	367.537	3.837	10	50	FHCA	
CCC[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2Cl)SC1=S	1191190	OEJAGYZCNREKQG-LCFDYFRESA-N	355.868	3.795	10	50	FHCA	
COc1ccc(N2C(=O)NC(=O)/C(=C\c3cccc4ccccc34)C2=O)cc1	1192493	BGLRTVISRBTCOA-CPNJWEJPSA-N	372.380	3.515	10	50	FHCA	
O=C(O)[C@@H](c1ccccc1)N1C(=O)/C(=C\c2ccc(F)cc2)SC1=S	6112204	VOSYPXSHMLLTKA-YVGNARHYSA-N	373.430	3.853	10	50	FHCA	
CC(=O)N[C@@H](/C=C/c1ccccc1)c1cc([N+](=O)[O-])c2cccnc2c1O	2470682	XZEYWCXRLQDHJG-FVNWOWOISA-N	363.373	3.739	10	50	FHCA	
[N-]=[N+]=NCC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O	71788201	CLEZARXVEABQBI-KRWDZBQOSA-N	366.377	3.679	10	50	FHCA	in-vitro
COc1ccc(N2C(=O)N=C(O)/C(=C\c3cccn3C(C)(C)C)C2=O)cc1	1273970	PJCSZUJFNZDQMR-FOWTUZBSSA-N	367.405	3.758	10	50	FHCA	
NC(=O)[C@H]1CCCN(CCC=C2c3ccccc3CCc3ccccc32)C1	196922999	BNJRGBGMOJJNOQ-FQEVSTJZSA-N	360.501	3.804	10	50	FHCA	
CCc1ccc(S(=O)(=O)Nc2ccc(O)c(Br)c2)cc1	781563	LEAVLYYITJLYDI-UHFFFAOYSA-N	356.241	3.518	10	50	FHCA	
CCN(CC)c1ccc(/C=C2\SC(N3C[C@@H](C)O[C@H](C)C3)=NC2=O)cc1	1185394	XEDNFPHGUHMWTG-QIWHAVBOSA-N	373.522	3.612	10	50	FHCA	
CCOc1cccc(/C=C2\SC(=S)N(Cc3cccnc3)C2=O)c1O	13941850	OBKGILJKPSYQIH-DHDCSXOGSA-N	372.471	3.587	10	50	FHCA	
CC(C)c1ccc(/C=C2\C(=O)NC(=S)N(c3ccccc3)C2=O)cc1	2854840	VALKNQOOMCLCIP-SFQUDFHCSA-N	350.443	3.641	10	50	FHCA	
Cc1cc(C(=O)N[C@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1cccc(F)c1	1875354350	FGWKVFLVYXIGOP-WBVHZDCISA-N	372.440	3.997	10	50	FHCA	
Cc1c(C(=O)O)cccc1-n1c(C)cc(/C=C2/SC(=S)NC2=O)c1C	1176349	LXPWERSRILJZBC-OVCLIPMQSA-N	372.471	3.590	10	50	FHCA	
CCSc1nnc2c(n1)O[C@H](c1ccc(O)c(O)c1)Nc1ccccc1-2	845748	KCTGAGJZSNWGFC-MRXNPFEDSA-N	368.418	3.565	10	50	FHCA	
CCCOc1ccccc1/C=C1\SC(=S)N(C[C@@H]2CCCO2)C1=O	16713507	GWLSTIJXZHBIKK-HNDQUVLASA-N	363.504	3.856	10	50	FHCA	
O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)SC(=S)N1Cc1ccccc1	1225532	WAXFSZOLSONKKH-GDNBJRDFSA-N	356.428	3.996	10	50	FHCA	
Cc1c(NS(=O)(=O)c2ccccc2)cc(Br)c(O)c1C	947556	OEBXGIWQVPVBJE-UHFFFAOYSA-N	356.241	3.572	10	50	FHCA	
Cc1nccn1[C@@H](C)CC(=O)NCCc1c(C)n2c3c(cccc13)CCC2	670466610	WHCNIBNNDFZWAX-HNNXBMFYSA-N	364.493	3.711	10	50	FHCA	
COc1ccc(N2CCOCC2)c(NC(=O)c2ccc(C)c(Cl)c2)c1	7496946	WCIKBOKDVWYUCL-UHFFFAOYSA-N	360.841	3.746	10	50	FHCA	
O=C1c2ccc3[nH]c(-c4ccc([N+](=O)[O-])cc4)nc3c2C(=O)[C@@H]2C=CC=C[C@@H]12	219034832	FUWHSUBEUWFXTG-ZIAGYGMSSA-N	371.352	3.876	10	50	FHCA	
COCCCn1c(CCC(=O)O)ccc1-c1ccc(Br)cc1	3017295	XCSUUELFTWRUIK-UHFFFAOYSA-N	366.255	3.971	10	50	FHCA	
COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccccc1F	1162865	DLNXDOYBTRQBIW-JXAWBTAJSA-N	365.404	3.741	10	50	FHCA	
Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(C(N)=O)cc2F)cc1	225437785	YYSWIJYCTNRGDC-UHFFFAOYSA-N	351.381	3.584	10	50	FHCA	
CCN(CC)c1ccc([C@@H]2[C@@H]3CCCC[C@]3(O)CCN2C(=O)OC)cc1	5979322	BAPXFDGYOLEISY-ZVDOUQERSA-N	360.498	3.967	10	50	FHCA	biogenic
CCCCOc1ccccc1/C=C1\SC(=S)N(CCOC)C1=O	16713502	CBPFIDRBYUUCLA-QINSGFPZSA-N	351.493	3.713	10	50	FHCA	
COc1ccc2c(c1)c(=O)oc1cc(OCC(=O)OC(C)(C)C)ccc12	1183909	FBZSNMQFZGLDFR-UHFFFAOYSA-N	356.374	3.675	10	50	FHCA	
O=C(O)CCCN1C(=O)/C(=C/c2c(F)cccc2Cl)SC1=S	2224429	DVBNDYCWYQBTRZ-XFFZJAGNSA-N	359.831	3.545	10	50	FHCA	
CC1CCN(c2ccc([C@H](C)NS(=O)(=O)c3ccccc3)cc2)CC1	71376153	HNJXLSIGNRVPCN-KRWDZBQOSA-N	358.507	3.962	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3cc(Cl)cc(Cl)c3)CC2)cc1	6967643	VMJJMTZXESCEPG-UHFFFAOYSA-N	365.260	3.964	10	50	FHCA	
CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccc(N2CCCCC2)cc1	275530718	LXIFOCXDKOIXEH-PMACEKPBSA-N	354.498	3.513	10	50	FHCA	
Cc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccccc3C)C2=O)cc1	1210434	XPPJJWXMSYVVIU-LFIBNONCSA-N	368.483	3.850	10	50	FHCA	
CC(C)c1ccc(N2C(=O)NC(=O)/C(=C/c3c[nH]c4ccccc34)C2=O)cc1	19789015	AZZUJQSTGONDDG-WQRHYEAKSA-N	373.412	3.958	10	50	FHCA	
COc1ccc(N2CCN(C(=O)CCSc3ccc(C)cc3)CC2)cc1	2843185	SJOJCHHHEAHRIE-UHFFFAOYSA-N	370.518	3.835	10	50	FHCA	
CCC(=S)/C=C1\Sc2ccc(C)cc2N1CCCS(=O)(=O)O	2026216	JUGWSQUFWGNGRS-GDNBJRDFSA-N	357.522	3.806	10	50	FHCA	
O=C(NN1C(=O)/C(=C/c2ccccc2)SC1=S)c1cccc(Cl)c1	1227947	YPPIVZJTIZMZHL-ZROIWOOFSA-N	374.874	3.886	10	50	FHCA	
Cc1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1ccccc1	1875338909	PXRVWFWIHDUNEO-IRXDYDNUSA-N	354.450	3.857	10	50	FHCA	
O=C(O)c1cccc(N2C(=O)/C(=C/c3ccc(F)cc3)SC2=S)c1	966733	KZPMAUJRJISOLI-ZSOIEALJSA-N	359.403	3.930	10	50	FHCA	
O=C(Cc1ccccc1)N[C@@H](c1ccco1)c1ccc2cccnc2c1O	3894221	HNPYDBOZQIKEOR-OAQYLSRUSA-N	358.397	3.982	10	50	FHCA	
CC(=O)N[C@H](c1ccc(N(C)C)cc1)c1cc(Cl)c2cccnc2c1O	869255	RWZYBQBQFVZGAD-GOSISDBHSA-N	369.852	3.885	10	50	FHCA	
CCOC(=O)c1cccc(N2C(=O)/C(=C\c3ccncc3)SC2=S)c1	4461497	SBDXFLYUQCCKSI-XNTDXEJSSA-N	370.455	3.664	10	50	FHCA	
CCN(CC)c1ccc(CN2CCN(c3ccccc3OC)CC2)c(O)c1	23281632	WDSJXDFSLNYSMI-UHFFFAOYSA-N	369.509	3.569	10	50	FHCA	
CCOc1ccc(/C=C2\C(=O)N(Cc3ccco3)C(C)=C2C(=O)OC)cc1	4122359	HFCYWLBMIZSTSA-PDGQHHTCSA-N	367.401	3.551	10	50	FHCA	
CC1=NN(c2nc3ccccc3[nH]2)C(=O)/C1=C/Nc1ccc(Cl)cc1	100182501	VSADGXGFTCNING-GXDHUFHOSA-N	351.797	3.935	10	50	FHCA	
CN(C)c1ccc(CNn2cnnc2SCc2ccccc2F)cc1	623765	QHWNOEVVYXROHF-UHFFFAOYSA-N	357.458	3.519	10	50	FHCA	
CCOC(=O)CC1(Cc2ccc(CC)cc2)C(=O)c2ccccc2C1=O	1229792	RHEMVDMUCHXDHX-UHFFFAOYSA-N	350.414	3.810	10	50	FHCA	
Oc1ccc(-c2cccnc2)cc1CN1CCC(N2CCCCC2)CC1	11881873	RFGSOTWHEAUTRE-UHFFFAOYSA-N	351.494	3.905	10	50	FHCA	
Cc1ccc(C)c(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)c1	71385452	DAHJXBAVLOBHFU-UHFFFAOYSA-N	358.507	3.772	10	50	FHCA	
c1ccc([C@@H]2CCCN2C2CCN(c3ccc4c(c3)OCO4)CC2)nc1	65493673	CBAPKOVKHXASAE-IBGZPJMESA-N	351.450	3.616	10	50	FHCA	
CCOC(=O)c1c(C)n(-c2ccccc2)c2ccc(O)c(CN(C)C)c12	1227931	FHUAHZXWMLDGLP-UHFFFAOYSA-N	352.434	3.883	10	50	FHCA	
Cc1ccccc1C1=NN2C(=N)/C(=C/c3ccc(F)cc3)C(=O)N=C2S1	1179349	PWKVXCITTRQEGG-ACXWOISZSA-N	364.405	3.802	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3csc4c3CCCC4)CC2)cc1	2769046	HQEFPDNDRDYCCC-UHFFFAOYSA-N	356.491	3.598	10	50	FHCA	
CN(Cc1ccccc1O)CC1CCN(CCc2ccccc2F)CC1	12717104	BLRKDCMVLJJHSM-UHFFFAOYSA-N	356.485	3.918	10	50	FHCA	
Cc1cc(-c2ccc(C=C3C(=O)OC(C)(C)OC3=O)o2)c([N+](=O)[O-])cc1C	1113123	FJMCAWJUNSQTRG-UHFFFAOYSA-N	371.345	3.691	10	50	FHCA	
CO[C@H]1c2cc(C(C)C)c(O)c(O)c2[C@@]23CCCC(C)(C)[C@@H]2[C@@H]1OC3=O	31155321	XNPVHIQPSAZTLC-NYUBLWNDSA-N	360.450	3.912	10	50	FHCA	biogenic,in-vitro
Cc1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1ccccc1F	1875354827	QBGYFGSAVDPJLY-HOTGVXAUSA-N	372.440	3.997	10	50	FHCA	
CCCOc1ccc(/C=C2/SC(N3C[C@H](C)O[C@@H](C)C3)=NC2=O)cc1	4756084	WIELMNLZIIKRIM-JUACWREWSA-N	360.479	3.555	10	50	FHCA	
Cc1ccc(N2CCN(Cc3cc(-c4cnccn4)ccc3O)CC2)c(C)c1	64058558	IXMRAIWPYVMMFV-UHFFFAOYSA-N	374.488	3.788	10	50	FHCA	
COc1ccc(/C=C2\SC(=S)N(Cc3cccnc3)C2=O)c(OC)c1	13943918	YBMDPIIOWATKGO-PXNMLYILSA-N	372.471	3.500	10	50	FHCA	
CCCCOC(=O)/C(=C\c1ccc(N(C)C)cc1)NC(=O)c1ccccc1	4974147	JMFQOXXUWMFLBP-CAPFRKAQSA-N	366.461	3.867	10	50	FHCA	
O=C1N=C(Nc2cccc(C(=O)O)c2)S/C1=C/c1c[nH]c2ccccc12	109778798	KGKAPVKWSWQHEH-CXUHLZMHSA-N	363.398	3.949	10	50	FHCA	
COc1ccc(O)c([C@@H](C)NCc2cc(OC)c(OC)cc2SC)c1	328595058	JQDQIAQDMARZLC-GFCCVEGCSA-N	363.479	3.991	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/Nc1cc(Br)ccc1O	100148661	LABASLVTFTWKGL-GXDHUFHOSA-N	372.222	3.873	10	50	FHCA	
Cc1cccc(OCCOc2ccc(/C=C3\SC(=S)NC3=O)cc2)c1	16182904	OKCDPABLZUGZLX-ATVHPVEESA-N	371.483	3.942	10	50	FHCA	
O=C1NN(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(-c2ccccc2F)o1	1185917	IMKIKVZZZQJSPH-WJDWOHSUSA-N	366.323	3.686	10	50	FHCA	
Cc1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1cccc(F)c1	1875354349	FGWKVFLVYXIGOP-RDJZCZTQSA-N	372.440	3.997	10	50	FHCA	
O=C1Nc2ccc(F)cc2/C1=C1/SC(=S)N(C2CCCCC2)C1=O	1141658	JLYQTHAVGLFAIP-YPKPFQOOSA-N	362.451	3.682	10	50	FHCA	
COc1ccc([C@H](NC(C)=O)c2cc(Cl)c3cccnc3c2O)cc1	869260	MTDGALZWYHDFPI-KRWDZBQOSA-N	356.809	3.828	10	50	FHCA	
Cc1nc(C)c(CC(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)s1	215920342	FWVTZNKMCHRKCC-CQSZACIVSA-N	357.523	3.855	10	50	FHCA	
Cc1cc(/C=C2\C(=O)NC(=S)N=C2O)c(C)n1-c1ccc(Cl)cc1	8744486	GCWZGVGNKBPAGY-UHFFFAOYSA-N	359.838	3.502	10	50	FHCA	
CN1C(=O)/C(=C/c2cccc(OC(=O)c3cccs3)c2)SC1=S	1117762	IYEVAMSJAYLFMZ-LCYFTJDESA-N	361.469	3.798	10	50	FHCA	
CCCCCCN1C(=O)/C(=C2/C(=O)N(C)c3ccccc32)SC1=S	2672922	QJRGEILUFFPQEO-PFONDFGASA-N	360.504	3.815	10	50	FHCA	
COc1ccc2c(c1)CC[C@H]1C2=NN(C(C)=O)[C@H]1c1ccc(N(C)C)cc1	1189456	ABCOZFPPGDRJAT-UNMCSNQZSA-N	363.461	3.631	10	50	FHCA	
Cc1oc(C(=O)O)cc1COc1ccc2c3c(c(=O)oc2c1)CCCC3	4028291	MYLCYXOJPQFBAU-UHFFFAOYSA-N	354.358	3.850	10	50	FHCA	biogenic
COC(=O)Oc1ccc(/C=C2/C(=O)N(c3ccccc3)N=C2C)cc1OC	5101751	AZJBVHXJHUWYNQ-LFIBNONCSA-N	366.373	3.647	10	50	FHCA	
COc1cccc(CN2CCC[C@@H](N(C)CCc3ccccc3)C2)c1O	19774551	NNJIUQHNVBUKHY-HXUWFJFHSA-N	354.494	3.540	10	50	FHCA	
CCOC(=O)c1cccc(-n2c(C)cc(/C=C3/SC(=O)NC3=O)c2C)c1	1178022	UUBRCQNMEFPASH-MHWRWJLKSA-N	370.430	3.595	10	50	FHCA	
O=C1/C(=C/c2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1C1CCCCC1	15011626	CTISAVXPYXTUAJ-ZROIWOOFSA-N	364.448	3.834	10	50	FHCA	
O=C(O)C1=NN(c2ccccc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl	23114640	QJBXEOJTMYCTTF-JYRVWZFOSA-N	361.184	3.864	10	50	FHCA	
COc1ccc(N2CCN(C/C=C/c3ccc(N(C)C)cc3)CC2)cc1	3682101	JDRVEWZOFXHYTA-SNAWJCMRSA-N	351.494	3.597	10	50	FHCA	
CCCCOC(=O)CCN1C(=O)/C(=C/c2ccc(C)cc2)SC1=S	2299714	KJDWOYQHDABNGD-QINSGFPZSA-N	363.504	3.930	10	50	FHCA	
COc1ccc2c(c1)C1=NN(C(C)=O)[C@@H](c3ccc(N(C)C)cc3)[C@@H]1CC2	4030189	DSMFEJUJISYLBI-KNQAVFIVSA-N	363.461	3.631	10	50	FHCA	
CCCCC1(C)OC(=O)C(=Cc2ccc(Br)cc2)C(=O)O1	2971884	UDTIXVLHBQOTIS-UHFFFAOYSA-N	353.212	3.839	10	50	FHCA	
COc1ccc(OC)c(C2=C/C(=C/c3cccc(OC)c3OC)C(=O)O2)c1	1197346	ARVRUWULCIOLHD-UVTDQMKNSA-N	368.385	3.702	10	50	FHCA	
O=c1c2ccccc2nc(/C=C/c2ccc(O)c(O)c2)n1-c1ccccc1	4163189	PHPLMVDSUMFPES-ACCUITESSA-N	356.381	3.967	10	50	FHCA	
C[C@H]1CN(Cc2c(O)ccc3c(=O)c(-c4ccccc4)coc23)C[C@H](C)O1	19497514	CGKRXLVATORLPE-GJZGRUSLSA-N	365.429	3.775	10	50	FHCA	biogenic
Cc1cccc(NC(=O)CN2C(=O)/C(=C\c3ccccc3)SC2=S)c1	4990585	NCHYVFIKSJOIRR-LFIBNONCSA-N	368.483	3.835	10	50	FHCA	
O[C@]1(C(F)(F)F)CC(c2ccccc2)=NN1C(=S)c1ccccc1	711922	RIANETHNVIQQBE-INIZCTEOSA-N	350.365	3.723	10	50	FHCA	
COC(=O)c1cccc(-n2c(C)cc(/C=C3\SC(=O)NC3=O)c2C)c1C	13785460	VUXBARPGJVPWRH-SXGWCWSVSA-N	370.430	3.513	10	50	FHCA	
CCOc1cccc(CN2CCN(C/C=C/c3ccccc3)CC2)c1O	19633844	RMMNQDGKPCVEPF-JXMROGBWSA-N	352.478	3.622	10	50	FHCA	
Cc1ccc2c(c1)/C(=C1/SC(=S)N(Cc3ccccc3)C1=O)C(=O)N2	13778114	RXRWOEBPNNQYPA-NXVVXOECSA-N	366.467	3.719	10	50	FHCA	
COc1ccc(OC)c(/C=C2/C=C(c3ccc(OC)cc3OC)OC2=O)c1	843823	WFFLUCJHWOFJSQ-ZROIWOOFSA-N	368.385	3.702	10	50	FHCA	
Cc1cc(C(=O)N[C@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1ccc(F)cc1	1875354400	GKHACDOBGVSMCU-WBVHZDCISA-N	372.440	3.997	10	50	FHCA	
COc1cccc([C@@H](C)N[C@H](c2ccccc2F)c2nccn2C)c1O	846137222	CIDPIMANHVWWER-FZKQIMNGSA-N	355.413	3.714	10	50	FHCA	
Cc1cccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])s3)C(O)=NC2=S)c1	9044338	YAAUTAXFJOGMSQ-XYOKQWHBSA-N	373.415	3.636	10	50	FHCA	
O=C(O)c1ccc(N2N=C(c3ccccc3)/C(=C/c3ccco3)C2=O)cc1	4952185	DPRAAWJDYOMXPN-AQTBWJFISA-N	358.353	3.812	10	50	FHCA	
CC(=O)NC1=NC(=O)/C(=C/c2cccc(OCc3ccc(F)cc3)c2)S1	1137664	SXJWSZYQUKCWPS-YVLHZVERSA-N	370.405	3.511	10	50	FHCA	
CC1CCN(c2ccc([C@@H](C)NS(=O)(=O)c3ccccc3)cc2)CC1	71376151	HNJXLSIGNRVPCN-QGZVFWFLSA-N	358.507	3.962	10	50	FHCA	
Cc1cc(O)c(C(C)C)cc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	4754775	FMEIYCYGXCSLGE-UHFFFAOYSA-N	350.396	3.533	10	50	FHCA	
CN(C(=O)C(F)(F)F)c1c(Cl)ccc2c1C(=O)c1ccccc1C2=O	4833261	NYXPSOMBEYNGHZ-UHFFFAOYSA-N	367.710	3.641	10	50	FHCA	
O=C(CCc1cccc2ccccc12)NCc1ccc(N2CCOCC2)cc1	67338885	JQJISVNYYDGRJB-UHFFFAOYSA-N	374.484	3.925	10	50	FHCA	
CC(=O)N(/C=C1/SC(=S)N(Cc2ccccc2)C1=O)c1ccccc1	19800256	QWEVJIQQVMALHL-GHRIWEEISA-N	368.483	3.941	10	50	FHCA	
CCN(CC)c1ccc(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1	2883623	ZYJWQWWBUCSFJA-AQTBWJFISA-N	365.389	3.786	10	50	FHCA	
COc1ccc(N2CCN(CC(=O)Nc3ccc(C(C)C)cc3)CC2)cc1	55069955	QSHPFMOFDYGZEZ-UHFFFAOYSA-N	367.493	3.579	10	50	FHCA	
O=C1c2ccccc2C(=O)C1C(c1ccco1)C1C(=O)c2ccccc2C1=O	104804006	TWNCYIGLQLDHPB-UHFFFAOYSA-N	370.360	3.754	10	50	FHCA	
COc1ccc(N2CCCC2)c(NC(=O)COc2ccccc2Cl)c1	4998666	VVHQMLWERNTLCL-UHFFFAOYSA-N	360.841	3.966	10	50	FHCA	
COC(=O)c1ccc(/C=C2\SC(=S)N(c3cccc(O)c3)C2=O)cc1	12562220	AIPICNRFSJRQSY-DHDCSXOGSA-N	371.439	3.585	10	50	FHCA	
COc1ccc2c(c1)sc(/N=N/N=c1\sc3ccccc3n1C)[n+]2C	4773287	IKSWKHGMVNDLSF-UHFFFAOYSA-N	370.483	3.887	10	50	FHCA	
CCCn1cc(C(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)c(C)n1	215448331	ZTDMNNNKRBEXBD-INIZCTEOSA-N	354.498	3.768	10	50	FHCA	
CCOc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)ccc1OC(C)=O	15658958	PRIQTDUJJVETOS-PDGQHHTCSA-N	364.401	3.817	10	50	FHCA	
C[C@@H](Cc1ccccn1)NC1CCN(c2ccc(OC(F)F)cc2)CC1	924904248	ABXDFMDHOXGZJM-HNNXBMFYSA-N	361.436	3.873	10	50	FHCA	
Cc1ccccc1C(=O)NN1C(=O)/C(=C\c2cccs2)SC1=S	4860296	OYHJCPUHVPPBMB-UKTHLTGXSA-N	360.485	3.603	10	50	FHCA	
Cc1ccc2[nH]c(=O)c(/C=C3\SC(=S)N(C4CCCC4)C3=O)cc2c1	20137849	YCZQWJGOFXRIPN-YBEGLDIGSA-N	370.499	3.980	10	50	FHCA	
O=C(NCCO)c1ccc2nc3c4ccccc4c4ccccc4c3nc2c1	4473366	HVCSGBYFFNWNNR-UHFFFAOYSA-N	367.408	3.812	10	50	FHCA	
COc1ccccc1[C@H]1CC(c2ccccc2O)=NN1C(=O)c1ccco1	170620251	OKNDJBIUURKKIZ-QGZVFWFLSA-N	362.385	3.985	10	50	FHCA	
Cc1ccc(-n2c(C)cc(/C=C3\SC(=O)NC3=O)c2C)cc1[N+](=O)[O-]	13785583	GPSRHKHRIATSMW-CHHVJCJISA-N	357.391	3.635	10	50	FHCA	
Cc1ccc(OCCOc2ccccc2/C=C2/SC(=S)NC2=O)cc1	3002780	TVYYYDMRRUIOID-SFQUDFHCSA-N	371.483	3.942	10	50	FHCA	
CCOc1ccc(CNC[C@@H]2CCCN3CCCC[C@H]23)cc1CN(C)C	952963358	JYAGDHVPBOHQDB-PZJWPPBQSA-N	359.558	3.501	10	50	FHCA	
COC(=O)c1ccc(/C=C2\SC(Nc3ccccc3C)=NC2=O)cc1	2954550	KAHNLHOKYNEKTG-WJDWOHSUSA-N	352.415	3.864	10	50	FHCA	
COc1cccc(-n2c(C)cc(C(=O)O[C@H](C)c3nc(C)no3)c2C)c1	170602197	KLIFCSNBIILQEA-CYBMUJFWSA-N	355.394	3.712	10	50	FHCA	
Cc1ccc(C2=NN3C(=N)/C(=C/c4cccs4)C(=O)N=C3S2)cc1	3858700	XLZUSPJYGMXFPI-KXXGJRMMSA-N	352.444	3.724	10	50	FHCA	
CCN(CC)c1ccc(N=Nc2cc(S(=O)(=O)O)ccc2O)c(O)c1	254513481	DSZXUTUBVLAYLI-UHFFFAOYSA-N	365.411	3.606	10	50	FHCA	
CCc1cc2c(-c3ccccc3)cc(=O)oc2cc1O[C@H](C)C(=O)OC	5554502	ZSLVWWHUXPQLCE-CYBMUJFWSA-N	352.386	3.963	10	50	FHCA	
Oc1ccc(Br)cc1CN1CCN(C2CCCCCC2)CC1	20435677	PNXZGUZVBFSZKM-UHFFFAOYSA-N	367.331	3.995	10	50	FHCA	
Cc1nn(C)c2c1[C@H](NC(=O)c1c(C)c3cccc(C)c3n1C)CCC2	1857670508	RHDQWZYKYHHJGQ-MRXNPFEDSA-N	350.466	3.644	10	50	FHCA	
Cc1ccc2oc(C(=O)NCc3ccc(N4CCOCC4)cc3)c(C)c2c1	15065473	IPKMGEAPWRPEGO-UHFFFAOYSA-N	364.445	3.816	10	50	FHCA	
Cc1ccc(N2CCN(C3=NC(=O)/C(=C\c4cccs4)S3)CC2)cc1	4600295	ADOYTKQHYUAREE-GHRIWEEISA-N	369.515	3.849	10	50	FHCA	
CCC(=O)N[C@H](c1ccc(OC)c(OC)c1)c1ccc2cccnc2c1O	1197088	QNPSQPFPEUYCEM-LJQANCHMSA-N	366.417	3.573	10	50	FHCA	biogenic
CCCCC(=O)N[C@@H](c1ccco1)c1cc([N+](=O)[O-])c2cccnc2c1O	2470727	WOPMNHIPUZXLPC-QGZVFWFLSA-N	369.377	3.837	10	50	FHCA	
O=C1N=C(N2CCCCCC2)S/C1=C1\C(=O)Nc2ccc(Cl)cc21	2850698	VUULXGBNBOQRLI-YPKPFQOOSA-N	361.854	3.509	10	50	FHCA	
COc1ccc2c(c1)C1=NN(C(C)=O)[C@H](c3ccc(N(C)C)cc3)[C@H]1CC2	984342	DSMFEJUJISYLBI-SIKLNZKXSA-N	363.461	3.631	10	50	FHCA	
Cc1ccc(-c2nc3sccn3c2C=C2C(=O)OC(C)(C)OC2=O)cc1	4003172	RHHWCYPZPOYZKN-UHFFFAOYSA-N	368.414	3.591	10	50	FHCA	
COc1cccc(N2C(=O)/C(=C/c3ccc(C(=O)O)cc3)SC2=S)c1	978012	LVZPRINBVQKZKA-DHDCSXOGSA-N	371.439	3.799	10	50	FHCA	
Cc1cc(/N=N/c2ccc(S(=O)(=O)NC3CCCC3)cc2)c(N)cc1O	1772572780	IRKMSULWLDLTIK-QZQOTICOSA-N	374.466	3.919	10	50	FHCA	
CCN1C(=O)/C(=C\c2cccc(OC(=O)c3ccco3)c2)SC1=S	4478019	IQYQWCKXYHPKRE-GXDHUFHOSA-N	359.428	3.720	10	50	FHCA	
O=C1NC(=O)N(Cc2ccc(F)cc2)C(=O)/C1=C\c1cccc2ccccc12	2996634	FQMDECHUGXFJEX-UNOMPAQXSA-N	374.371	3.641	10	50	FHCA	
O=C1c2ccc(Br)cc2C(=O)c2ccc(Br)cc21	16697729	JUFYHUWBLXKCJM-UHFFFAOYSA-N	366.008	3.987	10	50	FHCA	in-vitro
Cc1cc(C=O)c(C)n1-c1ccc(N2CCOCC2)c(Br)c1	666801	YDKZDGLEEFVWBS-UHFFFAOYSA-N	363.255	3.506	10	50	FHCA	
CSc1nnc(CNC(=O)c2cc(C)n(-c3ccccc3C)c2C)s1	225484198	FTPFXMVVJUXCSS-UHFFFAOYSA-N	372.519	3.906	10	50	FHCA	
COC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(O)cc3)C2=O)cc1	16677525	RZOKEIYUCWRZRA-GDNBJRDFSA-N	371.439	3.585	10	50	FHCA	
O=C1/C(=C/c2ccc([N+](=O)[O-])o2)SC(=S)N1c1ccccc1F	1159217	WKRDXRKTLNKEDB-XFFZJAGNSA-N	350.352	3.733	10	50	FHCA	
COc1ccc(/C=C2\C(=O)N(c3ccc(Cl)c(C(=O)O)c3)N=C2C)cc1	4524180	MJRJPJADHWIEBX-DHDCSXOGSA-N	370.792	3.853	10	50	FHCA	
Cc1ccc(S(=O)(=O)Nc2ccc(O)c3ccccc23)cc1[N+](=O)[O-]	4884949	QNCWCZOZZJDSSO-UHFFFAOYSA-N	358.375	3.563	10	50	FHCA	
Oc1c(F)cccc1CN1CCC(n2cc(-c3ccsc3)nn2)CC1	20209830	SCKIAEQBOVCNQQ-UHFFFAOYSA-N	358.442	3.688	10	50	FHCA	
COc1ccc2c(c1)C1=C(CC2)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1	3644362	DWYYGQXBLIOSOM-LJQANCHMSA-N	365.502	3.638	10	50	FHCA	
Cc1ccc(N2NC(=O)/C(=C/C=C/c3ccccc3Cl)C2=O)cc1C	23634307	LMVJXZPSAZVVRT-IURGNXBSSA-N	352.821	3.974	10	50	FHCA	
Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccccc3Cl)C2=O)cc1C	1180276	JYROGZXVFQGFQL-XNTDXEJSSA-N	354.793	3.623	10	50	FHCA	
CC(=O)N[C@H](/C=C/c1ccccc1)c1cc([N+](=O)[O-])c2cccnc2c1O	12379470	XZEYWCXRLQDHJG-OAGJVSPASA-N	363.373	3.739	10	50	FHCA	
CC(=C\c1cc(Br)ccc1O)/C=C1/SC(=S)N(C)C1=O	4918128	VPMRXTATLAISFG-TUXZCDOTSA-N	370.293	3.932	10	50	FHCA	
COc1ccccc1N1CCN(C/C=C/c2ccc(N(C)C)cc2)CC1	4980774	DQDXJAXRPBFAKS-VOTSOKGWSA-N	351.494	3.597	10	50	FHCA	
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H](O)C[C@H]1C1CCCCC1	1875263353	SCECZGCEBDZPAZ-SFTDATJTSA-N	371.525	3.512	10	50	FHCA	
CCN(CC)Cc1cc(CCNC(=O)c2ccc(Cl)cc2)ccc1O	4350551	KYKCJPKYNHVTLQ-UHFFFAOYSA-N	360.885	3.860	10	50	FHCA	
Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)cc1	71376502	WWVLTHSBIGOJFW-KRWDZBQOSA-N	358.507	3.710	10	50	FHCA	
COC[C@@H](c1ccccn1)N(C)C1CCN(c2ccc3c(c2)CCC3)CC1	952862972	TWHDIIGJNWTOKG-QHCPKHFHSA-N	365.521	3.859	10	50	FHCA	
Cc1ccc(/C=C2\SC(=S)N(Cc3ccc4c(c3)OCO4)C2=O)o1	1159384	NGBNICPSGFREJX-CHHVJCJISA-N	359.428	3.718	10	50	FHCA	
Oc1ccccc1CN1CCC(n2cc(-c3ccc(F)cc3)nn2)CC1	23379695	AGVVWHTVGCKZCS-UHFFFAOYSA-N	352.413	3.627	10	50	FHCA	
Cc1c(CCNC(=O)N(C)[C@H](C)c2ccon2)c2cccc3c2n1CCC3	426443406	PNSLLYWEGVJCAC-OAHLLOKOSA-N	366.465	3.829	10	50	FHCA	
Cc1cc(C(=O)N[C@@H](C)c2n[nH]c(C(C)C)n2)c(C)n1-c1ccccc1F	2325711299	NNQXFKRXWRKHSL-ZDUSSCGKSA-N	369.444	3.966	10	50	FHCA	
Cc1cc(C(=O)N(C)Cc2nncn2C(C)C)c(C)n1-c1ccccc1	95383063	CHXLXXCSLRQDMP-UHFFFAOYSA-N	351.454	3.539	10	50	FHCA	
O=C1CCC[C@H]1c1cc(NS(=O)(=O)c2ccc(Cl)cc2)ccc1O	5048431	XYELBVKFSZKFGH-AWEZNQCLSA-N	365.838	3.683	10	50	FHCA	
COc1cc(/C=C2\SC(=S)N(CCc3ccccc3)C2=O)ccc1O	13370586	YYYKIHLFWDLBMD-ATVHPVEESA-N	371.483	3.845	10	50	FHCA	
Cn1cc(C(=O)N2C[C@H](C(C)(C)C)c3ccccc32)c([C@@H]2CCCNC2)n1	333320982	UMONSPUSPUDGIM-QAPCUYQASA-N	366.509	3.677	10	50	FHCA	
CCn1cc(/C=C2\SC(=S)N(CCc3ccccc3)C2=O)c(C)n1	20606676	WBOGIGQQNVUMCR-WJDWOHSUSA-N	357.504	3.655	10	50	FHCA	
CC(/C=C1\SC(=S)N([C@H](C(=O)O)C(C)C)C1=O)=C\c1ccccc1	1209544	WZSFHXDLBDYXPF-WAGUNMSTSA-N	361.488	3.943	10	50	FHCA	
Cc1ccc(/C=C2\SC(=S)N(CC(=O)NC3CCCCC3)C2=O)cc1	15799515	CYPUSXNSVPTQQI-WJDWOHSUSA-N	374.531	3.645	10	50	FHCA	
COc1ccc(N2CCC(N3CC(Oc4ccc(C)cc4)C3)CC2)cc1	1506415946	BTSJXXYSVXUVOF-UHFFFAOYSA-N	352.478	3.736	10	50	FHCA	
CC(C)N1C(=O)S/C(=C/c2ccc(N(C)C)c(Br)c2)C1=O	4688163	RKEGKFMBFIDJPX-MDWZMJQESA-N	369.284	3.960	10	50	FHCA	
CCN1C(=O)/C(=C\c2ccc(-c3ccccc3C(=O)OC)o2)SC1=S	4812575	LJEVJNWYVBQCTI-XNTDXEJSSA-N	373.455	3.954	10	50	FHCA	
CCCOc1ccccc1/C=C1\SC(=S)N(C[C@H]2CCCO2)C1=O	16713509	GWLSTIJXZHBIKK-VQCBNXJZSA-N	363.504	3.856	10	50	FHCA	
CCO/C(C)=C1\C(=O)N(c2nc3ccccc3s2)N=C1C(F)(F)F	849847	XTWRJKHORVDTJN-FLIBITNWSA-N	355.341	3.872	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccccc1F	2826597	CEDDCHFZCOGGOK-WJDWOHSUSA-N	355.340	3.842	10	50	FHCA	
CC1=C(C(=O)OC2CCC(C)CC2)[C@H](c2ccc(N(C)C)cc2)NC(=O)N1	1226004	HYXYXSQAUIJADG-JVMACKPJSA-N	371.481	3.502	10	50	FHCA	
N=C1/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)C(=O)N=C2SC=NN12	4916950	NZSHZHFNWKEURX-NFFPZGGSSA-N	356.794	3.849	10	50	FHCA	
Cc1cc(C)c(O)c(CN2CCC[C@H](C(=O)c3ccc4c(c3)OCO4)C2)c1	71748927	ZCYHDTPEDVMDDX-KRWDZBQOSA-N	367.445	3.833	10	50	FHCA	
COc1ccc(N2CCN(C(=S)Nc3ccc(C)cc3C)CC2)cc1	13544360	FEWXQJKOCHDEHC-UHFFFAOYSA-N	355.507	3.831	10	50	FHCA	
Cc1ccc(CN2C(=O)/C(=C3/C(=O)Nc4ccccc43)SC2=S)cc1	1165145	ZNJTYAGJGYWBNE-NXVVXOECSA-N	366.467	3.719	10	50	FHCA	
CN(C)c1ccc(/C=C2\SC(=S)N(c3ccc(O)cc3)C2=O)cc1	12524354	DBROGSOZCBHQTN-WJDWOHSUSA-N	356.472	3.864	10	50	FHCA	
Cc1ccc(N2C(=O)/C(=C/C=C/c3ccco3)C(=O)NC2=S)cc1Cl	686739	AYNCXNUUERDREH-FMDPHQNASA-N	372.833	3.629	10	50	FHCA	
Nc1ccc(N2CCN(C(=O)c3ccccc3-c3ccccc3)CC2)cc1	12376983	VLLUZZCGCKTPOQ-UHFFFAOYSA-N	357.457	3.898	10	50	FHCA	
COc1cccc(CN2CCC[C@H](N(C)CCc3ccccc3)C2)c1O	19774553	NNJIUQHNVBUKHY-FQEVSTJZSA-N	354.494	3.540	10	50	FHCA	
COC(=O)c1ccc(N/C=C2\C(=O)N(c3ccc(C)cc3C)N=C2C)cc1	5578408	LMFVMOPMEOESHK-PDGQHHTCSA-N	363.417	3.809	10	50	FHCA	
O=C(NCc1ccccc1O)Nc1ccc(OCCN2CCCCC2)cc1	768996010	MBZKZQRSYNFIBJ-UHFFFAOYSA-N	369.465	3.579	10	50	FHCA	
COc1ccccc1/C=C1\C(=O)N(c2ccccc2C)C(=S)N=C1O	22780867	OWIWJTSPXXNYRN-KAMYIIQDSA-N	352.415	3.675	10	50	FHCA	
CCCOc1ccc(/C=C2/SC(N3C[C@@H](C)O[C@H](C)C3)=NC2=O)cc1	4756083	WIELMNLZIIKRIM-DPOBWDHUSA-N	360.479	3.555	10	50	FHCA	
COc1ccc(N2CCOCC2)c(NC(=O)c2ccc(C)cc2Cl)c1	16577922	WQLIDELDBIQOGP-UHFFFAOYSA-N	360.841	3.746	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3cc(C)nc4ccccc34)CC2)cc1	2628510	GIFSZZKNVVUCPY-UHFFFAOYSA-N	361.445	3.514	10	50	FHCA	
COc1ccc2c(c1)C1=C(CC2)[C@H](c2ccc(N(C)C)cc2)NC(=S)N1	3644360	DWYYGQXBLIOSOM-IBGZPJMESA-N	365.502	3.638	10	50	FHCA	
CCC1=NN2C(=N)/C(=C\c3ccc(N(CC)CC)cc3)C(=O)N=C2S1	15799213	AEDHCOSLUVLKKV-BTTQMQCWSA-N	355.467	3.562	10	50	FHCA	
COc1ccc(C2=NN(C(=O)C(F)(F)F)[C@@H](c3cccs3)C2)c(O)c1	253433459	XHTXKCTXBKTAFY-GFCCVEGCSA-N	370.352	3.702	10	50	FHCA	
COc1cc(CCNCc2ccccc2O)c(OC)cc1Br	299817292	RSUNJYKZRKIBNB-UHFFFAOYSA-N	366.255	3.504	10	50	FHCA	in-vitro
CCOC(=O)CCCN1C(=O)S/C(=C/c2ccc(OC)cc2)C1=S	5010049	IFFBODLVFNZRKH-SDNWHVSQSA-N	365.476	3.876	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3O)SC2=S)cc1	4477976	KJPMXJIBKWOPMB-XNTDXEJSSA-N	373.455	3.815	10	50	FHCA	
COc1ccc2c(c1)CC[C@H]1C2=NN(C(C)=O)[C@@H]1c1ccc(N(C)C)cc1	1189576	ABCOZFPPGDRJAT-RBBKRZOGSA-N	363.461	3.631	10	50	FHCA	
Cc1cccc(N2C(=O)/C(=C/c3cc(C)n(C)c3C)C(O)=NC2=S)c1C	8769944	GPEHVQMXTUXNGC-MHWRWJLKSA-N	367.474	3.930	10	50	FHCA	
CCN1C(=O)/C(=C/c2cc(C)n(-c3cccc(C)c3C)c2C)NC1=S	980396	OBVYUMYMADWQMC-BOPFTXTBSA-N	353.491	3.788	10	50	FHCA	
CC(C)c1ccc(N2C(=O)NC(=O)/C(=C/C=C/c3ccco3)C2=O)cc1	12382977	CJOKZQXLSSIEPY-CZMAMTTRSA-N	350.374	3.626	10	50	FHCA	
Cc1cc(/C=C2\SC(=S)NC2=O)c(C)n1-c1ccc(N(C)C)cc1	15218822	ISCHQYHWLATBOZ-YBEGLDIGSA-N	357.504	3.649	10	50	FHCA	
COc1cccc([C@H]2CC(c3ccccc3O)=NN2C(=O)c2ccco2)c1	225518187	NHVJPBGJWKJRII-GOSISDBHSA-N	362.385	3.985	10	50	FHCA	
CCOc1ccc(/C=C2/SC(N3CCC(C)CC3)=NC2=O)cc1OC	4694795	LGUAYZMHZMNGFT-SFQUDFHCSA-N	360.479	3.796	10	50	FHCA	
Cc1ccc(/C=C2/SC(=S)N(CCC(=O)N3CCCCC3)C2=O)cc1	1304761	ODBJDVXVRKXMKR-DTQAZKPQSA-N	374.531	3.599	10	50	FHCA	
Cc1ccc(OCC(=O)Nc2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1	5092501	RGQZPGVLHPRELP-UHFFFAOYSA-N	371.392	3.788	10	50	FHCA	
COc1cc(OC)c(C=C2C(=O)N(c3ccccc3)N=C2C)c(OC)c1	2040779935	HVZITFWFDAJLKD-UHFFFAOYSA-N	352.390	3.519	10	50	FHCA	
CCn1cc(/C=C/c2nc3ccccc3c(=O)n2CCCO)c2ccccc21	4536185	POIJRGCZCPWFSU-OUKQBFOZSA-N	373.456	3.924	10	50	FHCA	
COc1cc(OC)c(OC)cc1/C=C1\C(=O)N(c2ccccc2)N=C1C	13765081	KLKLRVHECUFKIT-YBEGLDIGSA-N	352.390	3.519	10	50	FHCA	
COc1cccc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)c1O	16228125	ZUAQHEXCWGLCJW-GDNBJRDFSA-N	357.456	3.802	10	50	FHCA	
Cc1ccc(N2C(=O)NC(=O)/C(=C/c3cccc(C(F)(F)F)c3)C2=O)cc1	4471555	OWXZFQPZSLKYRO-GDNBJRDFSA-N	374.318	3.680	10	50	FHCA	
Cc1ccsc1/C=C1/SC(=S)N(CCCCCC(=O)O)C1=O	4839414	MNQNFEJMDZGICU-FMIVXFBMSA-N	355.506	3.903	10	50	FHCA	
COc1ccc(N2CCC(NCCN3CCCc4ccccc43)CC2)cc1	765416032	ICFQRFGBRISQEJ-UHFFFAOYSA-N	365.521	3.706	10	50	FHCA	
C[C@H](N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccccc1O	783520794	ZPNSCVQVTCNMCQ-JSGCOSHPSA-N	364.367	3.867	10	50	FHCA	
c1cncc(-c2cc(CNC3CCN(c4ccc5c(c4)CCC5)CC3)on2)c1	1506421743	LIVVBBRMFMQYPB-UHFFFAOYSA-N	374.488	3.984	10	50	FHCA	
COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc4ccccc34)C2=O)cc1	1233252	UTDZFRTUOYOBCE-QGOAFFKASA-N	372.380	3.515	10	50	FHCA	
S=C(c1ccc(-c2ccc(Br)cc2)o1)N1CCOCC1	1005520	KNKOSBLAZUXOAT-UHFFFAOYSA-N	352.253	3.717	10	50	FHCA	
COc1ccc(N2CCN(C(=O)COc3ccc(C(C)C)cc3)CC2)cc1	1110186	YZSRUQDUNSPSQF-UHFFFAOYSA-N	368.477	3.546	10	50	FHCA	
CN(C)Cc1c(O)ccc2cc(-c3nc4ccccc4s3)c(=O)oc12	870800	PLLCAMNQDAHMSF-UHFFFAOYSA-N	352.415	3.837	10	50	FHCA	biogenic
O=C1/C(=C\c2cccc([N+](=O)[O-])c2O)SC(=S)N1c1ccccc1	13476997	YIDLGHGPBRDDHS-UKTHLTGXSA-N	358.400	3.706	10	50	FHCA	
O=C(NN1C(=O)/C(=C\c2ccccc2Cl)SC1=S)c1ccccc1	15008486	FZQIGIGFUWSCQK-GXDHUFHOSA-N	374.874	3.886	10	50	FHCA	
CCCCC1=NN2C(=N)/C(=C/c3ccc(N(C)C)cc3)C(=O)N=C2S1	4706983	NIHFJBZXTPELOP-OVZHKCSHSA-N	355.467	3.562	10	50	FHCA	
CN1C(=O)/C(=C/c2ccc(OC(=O)c3ccc(F)cc3)cc2)SC1=S	1205337	VIFXLUQQIIHHCF-GDNBJRDFSA-N	373.430	3.876	10	50	FHCA	
Cc1cc(C(=O)N[C@H](C)c2n[nH]c(C(C)C)n2)c(C)n1-c1ccccc1F	2325711298	NNQXFKRXWRKHSL-CYBMUJFWSA-N	369.444	3.966	10	50	FHCA	
Cc1cccc(-c2nc(CC(=O)NCCc3ccc(N)cc3)cs2)c1	170676940	XBCFMXPNYONBJJ-UHFFFAOYSA-N	351.475	3.602	10	50	FHCA	
COc1cccc([C@@H]2CC(c3ccccc3O)=NN2C(=O)c2ccco2)c1	225518156	NHVJPBGJWKJRII-SFHVURJKSA-N	362.385	3.985	10	50	FHCA	
CCCC1=NN(c2ccc(F)cc2)C(=O)/C1=C/NC[C@@H](O)c1ccccc1	100111182	BRYOBWUWNPFOLE-ITICKHJUSA-N	367.424	3.536	10	50	FHCA	
CCOc1cccc(CN2CCC[C@H](C(=O)c3ccccc3OC)C2)c1O	11932983	OPOKDGFSSQDKQH-INIZCTEOSA-N	369.461	3.894	10	50	FHCA	
COc1ccc(/C=C2/SC(=S)N(Cc3ccco3)C2=O)c(OC)c1	15856931	YNMMYMFENMXUBK-OVCLIPMQSA-N	361.444	3.698	10	50	FHCA	
Cc1oc2ccc(O)c(CN3CCOCC3)c2c1C(=O)Nc1ccccc1	19793998	YMIRMNQHCUULSM-UHFFFAOYSA-N	366.417	3.531	10	50	FHCA	
O=C(Nc1ccc2c(c1)C(=O)c1ccccc1C2=O)c1cccc([N+](=O)[O-])c1	4984377	VNMSCCACVADDMZ-UHFFFAOYSA-N	372.336	3.623	10	50	FHCA	
N=C1/C(=C/c2ccc(Cl)cc2)C(=O)N=C2SC(C(F)(F)F)=NN12	4701603	QSUMBKURHBLGQR-PVKCIBLZSA-N	358.732	3.521	10	50	FHCA	
CCCOc1ccc(/C=C2/SC(N3C[C@H](C)O[C@H](C)C3)=NC2=O)cc1	17993615	WIELMNLZIIKRIM-ZJLQCSDHSA-N	360.479	3.555	10	50	FHCA	
C[C@H]1[C@H](c2ccc(N(C)C)cc2)N[C@@H](c2ccc(N(C)C)cc2)[C@@H](C)[C@@H]1O	248063665	QTSVDXZTCFEZTA-AOSFDVDRSA-N	367.537	3.837	10	50	FHCA	
CCN1C(=O)/C(=C\c2ccc(N(C)C)c(Br)c2)SC1=S	4498381	KKJYHOFSDJMWCU-XYOKQWHBSA-N	371.325	3.736	10	50	FHCA	
CCCc1cc2c(-c3ccccc3)cc(=O)oc2cc1OCC(=O)OC	639094	CZPMIYGBOGXFKX-UHFFFAOYSA-N	352.386	3.964	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\c3cc(OC)ccc3O)SC2=S)cc1	4714576	QXRNGDDQWMQXDM-MHWRWJLKSA-N	373.455	3.815	10	50	FHCA	
Cc1noc(/C=C/c2ccc(N(C)C)c(Br)c2)c1[N+](=O)[O-]	4821133	TYMWUJHTGXEBJN-FNORWQNLSA-N	352.188	3.890	10	50	FHCA	
Oc1ccc(Br)cc1CN1CCN(c2ccc(F)cc2)CC1	55292184	WLKSSXNNYOOPSY-UHFFFAOYSA-N	365.246	3.616	10	50	FHCA	
COC(=O)c1ccc(-c2ccc(/C=C3/SC(=S)N(C)C3=O)o2)cc1	13810477	XCEIUAXIBVPARP-NTEUORMPSA-N	359.428	3.564	10	50	FHCA	
COc1ccc(OC)c(-c2ccc(O)c(CN3CCCC[C@H]3CCO)c2)c1	20536915	XXWIMXOQONAEKV-SFHVURJKSA-N	371.477	3.813	10	50	FHCA	
CO[C@@H]1C[C@H](c2ncc[nH]2)N(Cc2ccc(N3CCCCC3)c(C)c2)C1	888079189	JGVIKJXJPRIPHK-UYAOXDASSA-N	354.498	3.670	10	50	FHCA	
O=C1N=C(Nc2cccnc2)S/C1=C\c1ccc(Br)cc1	8766082	SQBMQPYRMPYTPX-JYRVWZFOSA-N	360.236	3.927	10	50	FHCA	
C[C@H](N=[N+]=[N-])[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O	108644331	LLJMYBCJYQGZOS-APPDUMDISA-N	366.377	3.677	10	50	FHCA	
Cc1cc(C(=O)N2CCC[C@H](c3nccn3C)C2)c(C)n1-c1ccccc1	95516604	IKBIFKPEFWWHGM-SFHVURJKSA-N	362.477	3.847	10	50	FHCA	
CC1=NN(c2ccc(Cl)c(C(=O)O)c2)C(=O)/C1=C\c1ccccc1O	19119315	PQMJSXYZUGGGHT-JYRVWZFOSA-N	356.765	3.550	10	50	FHCA	
CCOc1ccc(CNC2(CN3CCCCC3)CCCCC2)cc1CO	952980539	XHFOXDYIFPGULR-UHFFFAOYSA-N	360.542	3.856	10	50	FHCA	
CN(c1ccccc1)c1ccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)cc1	5611326	BDVNENHVHWVPHW-LTGZKZEYSA-N	369.424	3.916	10	50	FHCA	
O=C1c2ccccc2C(=O)C1(Nc1cccc([N+](=O)[O-])c1)c1ccccc1	763019	FDUDNHSCQUJTDA-UHFFFAOYSA-N	358.353	3.981	10	50	FHCA	
COc1cccc(/C=C2/C=C(c3ccc(C)cc3)OC2=O)c1OC(C)=O	13389575	WLJHBWOMJJSLAZ-BOPFTXTBSA-N	350.370	3.910	10	50	FHCA	
CCN(CC)c1ccc(/C=C2\SC(N3C[C@H](C)O[C@H](C)C3)=NC2=O)cc1	3902551	XEDNFPHGUHMWTG-QPWAZXNSSA-N	373.522	3.612	10	50	FHCA	
O=C(c1ccc(-c2ccc(C3=S=CC=C3)s2)cc1)N1CCC[C@@H](O)C1	426429035	PUNYXHQBMUDWPP-MRXNPFEDSA-N	369.511	3.638	10	50	FHCA	
COc1ccc(OC)c(C2=C/C(=C/c3cccc([N+](=O)[O-])c3)C(=O)O2)c1	1198558	VWGOXDZDRZSLIL-JYRVWZFOSA-N	353.330	3.593	10	50	FHCA	
CCC(=S)/C=C1\Sc2ccc(OC)cc2N1CCCS(=O)(=O)O	2913687	XCCQFFXWHDHDCN-GDNBJRDFSA-N	373.521	3.507	10	50	FHCA	
COc1ccc(CCN(C)C/C=C/c2ccc(N(C)C)cc2)cc1OC	5393671	OORZVMRCXPCFJG-VOTSOKGWSA-N	354.494	3.958	10	50	FHCA	
Cc1cc(C(=O)CSc2nnc(N)s2)c(C)n1-c1ccc(F)cc1	3509854	SFLYICFLPIQDKK-UHFFFAOYSA-N	362.455	3.642	10	50	FHCA	
COC(=O)Cn1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c2ccccc21	4819527	KFPHQKVUYVRJIJ-XDHOZWIPSA-N	373.412	3.620	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccccc1O	759596	NLTRFXCAHFANTR-WJDWOHSUSA-N	369.804	3.923	10	50	FHCA	
CCCCN1C(=O)/C(=C/c2cn(CC)c3ccccc23)C(O)=NC1=S	2403963	VCRBUSXULANOBA-RVDMUPIBSA-N	355.463	3.928	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OC2CSC2)cc1	100148234	XHIBANMELFRYLZ-YBFXNURJSA-N	350.443	3.987	10	50	FHCA	
COC(=O)c1sc2nc(-c3ccncc3)cc(C(F)(F)F)c2c1N	804081	VJKLXICZOFLFQX-UHFFFAOYSA-N	353.325	3.746	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\c3cccc(C(=O)O)c3)SC2=S)cc1	4819375	DIRCMDLFIBRCCB-XNTDXEJSSA-N	371.439	3.799	10	50	FHCA	
O=C1c2ccc3[nH]c(-c4ccc([N+](=O)[O-])cc4)nc3c2C(=O)[C@@H]2C=CC=C[C@H]12	219034697	FUWHSUBEUWFXTG-UONOGXRCSA-N	371.352	3.876	10	50	FHCA	
CC(=O)NC1=NC(=O)/C(=C/c2ccccc2OCc2cccc(F)c2)S1	1137141	TTWJUASOWFXVNN-YVLHZVERSA-N	370.405	3.511	10	50	FHCA	
CN(C)[C@H](CNC1CCN(c2ccc3c(c2)CCC3)CC1)c1ccco1	1506403413	RCKRCYYLVOBOSC-OAQYLSRUSA-N	353.510	3.630	10	50	FHCA	
CCN1C(=O)/C(=C\C=C\C=C\N(C(C)=O)c2ccccc2)SC1=S	4579129	WZXXRBKHXLWUCL-XYNPZBRDSA-N	358.488	3.874	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C\c1c(C)nn(-c2ccccc2)c1O	766492	PHCPNSHHXUOXSD-UYRXBGFRSA-N	358.401	3.692	10	50	FHCA	
CSc1ccc(/C=C2/SC(N3CCCC[C@@H]3CCO)=NC2=O)cc1	6928746	NIYYTBAGZGYGKP-RGHBXIHOSA-N	362.520	3.616	10	50	FHCA	
O=C1N=C(O)/C(=C\c2cnc(-c3ccccc3)nc2)C(=O)N1c1ccccc1	1408019	IIWRYHHCNJCQBG-GZTJUZNOSA-N	370.368	3.650	10	50	FHCA	
COc1ccc(C2=C/C(=C/c3ccc([N+](=O)[O-])cc3)C(=O)O2)c(OC)c1	1196536	WAJZTMPUCDZATP-LCYFTJDESA-N	353.330	3.593	10	50	FHCA	
COc1cc(/C=C2\SC(c3ccccc3)=NC2=O)cc(OC)c1OC	15015385	BCAGGCUVKAYREQ-WJDWOHSUSA-N	355.415	3.774	10	50	FHCA	
Cc1cc(/C=C2\NC(=O)NC2=O)c(C)n1-c1ccc(Cl)c(Cl)c1	16116019	WBWDKBFGHJVMFE-NSIKDUERSA-N	350.205	3.581	10	50	FHCA	
CCN(CC)c1ccc(/C=C/c2nc(N)nc(-c3ccccc3O)n2)cc1	4757846	JUXADMUTBVUKCN-SDNWHVSQSA-N	361.449	3.843	10	50	FHCA	
C[C@H]1CCCN(c2ccc(CNS(=O)(=O)c3ccc(F)cc3)cc2)C1	71376300	HMXNFMXIMFRJRO-HNNXBMFYSA-N	362.470	3.541	10	50	FHCA	
Cc1ccc(C2=NN3C(=N)/C(=C/c4cccc(C)c4)C(=O)N=C3S2)cc1	1178825	JRAZEMZRGLPVOH-XGMUFTHNSA-N	360.442	3.971	10	50	FHCA	
CC(C)c1ccc(N2C(=O)NC(=O)/C(=C/c3cccc(F)c3)C2=O)cc1	5061744	BNIVGPSAOAOPDG-BOPFTXTBSA-N	352.365	3.616	10	50	FHCA	
c1cnc(-n2cnc3ccccc32)c(CNCc2ccc3c(c2)CCO3)c1	20543163	VNWVNLNUVCLXHR-UHFFFAOYSA-N	356.429	3.645	10	50	FHCA	
CCOc1cccc(CN2CCC(CO)(Cc3ccccc3)CC2)c1O	12432953	VDXFNXKWKICGQF-UHFFFAOYSA-N	355.478	3.608	10	50	FHCA	
COc1cccc(-c2ccc(O)c(CNCCc3ccccc3F)c2)n1	14974278	PRQLGTDSVKICGE-UHFFFAOYSA-N	352.409	3.934	10	50	FHCA	
CCN(CC)Cc1c(O)ccc2cc(-c3nc4ccccc4[nH]3)c(=O)oc12	848454	PGMWYXYEIOIGHC-UHFFFAOYSA-N	363.417	3.884	10	50	FHCA	
O=S(=O)(Nc1cc(Cl)c(O)c(Br)c1)c1ccccc1	1234492	FVBXGZVMKYRZFG-UHFFFAOYSA-N	362.632	3.609	10	50	FHCA	
CCCn1cc(C(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)c(C)n1	215448375	ZTDMNNNKRBEXBD-MRXNPFEDSA-N	354.498	3.768	10	50	FHCA	
COC[C@@H](NC1CCN(c2ccc3c(c2)CCC3)CC1)c1ccccn1	1506407882	LVIDNUXSWOTCOU-JOCHJYFZSA-N	351.494	3.516	10	50	FHCA	
Cc1cc(NS(=O)(=O)c2ccccc2)c(Br)c(C)c1O	947553	XNNXLQIHZBDMIX-UHFFFAOYSA-N	356.241	3.572	10	50	FHCA	
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@H](O)C[C@@H]1C1CCCCC1	1875263351	SCECZGCEBDZPAZ-NHCUHLMSSA-N	371.525	3.512	10	50	FHCA	
O=C1N=C(O)/C(=C/c2c[nH]c3ccccc23)C(=O)N1Cc1ccc(F)cc1	1301981	VOQZYTSAXLDQQZ-SXGWCWSVSA-N	363.348	3.809	10	50	FHCA	
O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(CN2CCCC2)cc1	13646917	IOSGPYPMKCFNPE-UHFFFAOYSA-N	363.505	3.813	10	50	FHCA	
O=C1NC(=O)N(Cc2ccccc2)C(=O)/C1=C/c1cccc2ccccc12	1162999	XYSOKAQOSUQDDS-CPNJWEJPSA-N	356.381	3.502	10	50	FHCA	
Cc1cccc(N2C(=O)N=C(O)/C(=C\c3cnn(-c4ccccc4)c3)C2=O)c1	1180665	IZYLJRRYKPUHJW-WOJGMQOQSA-N	372.384	3.687	10	50	FHCA	
Cc1ccccc1N1C(=O)N=C(O)/C(=C/c2cn(C)c3ccccc23)C1=O	8974696	PBQBRCZQEZICCW-WJDWOHSUSA-N	359.385	3.993	10	50	FHCA	biogenic
CC(C)(C)c1cccc(CN2CCc3[nH]cnc3[C@@H]2c2ccncc2)c1O	67756954	ILEKBWNEGKTEAS-FQEVSTJZSA-N	362.477	3.956	10	50	FHCA	
COc1ccccc1N1C(=O)/C(=C/c2ccc([N+](=O)[O-])o2)SC1=S	1136085	XFSLJGWWUFLKEX-WQLSENKSSA-N	362.388	3.602	10	50	FHCA	
CSc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1	1214785	KYXMCXXETANAIO-XNTDXEJSSA-N	372.833	3.728	10	50	FHCA	
O=C1N=C(N2CCC[C@H](CO)C2)S/C1=C/c1cccc2ccccc12	6886041	OAUQMIGBWFRPQG-BGARDKSCSA-N	352.459	3.514	10	50	FHCA	
COc1ccc(Br)cc1/C=C1\SC(N2CCCC2)=NC1=O	15745857	HYRXZHYFHQWNJH-LCYFTJDESA-N	367.268	3.524	10	50	FHCA	
CCN1C(=O)/C(=C2\SC(=S)N(c3ccccc3)C2=O)c2ccccc21	1090101	AIRCDZAHUSKZOP-NXVVXOECSA-N	366.467	3.829	10	50	FHCA	
O=C(C[C@H](NCc1ccccc1)c1ccccc1O)NCc1ccccc1	754631	DSSKCJOISIONHW-NRFANRHFSA-N	360.457	3.930	10	50	FHCA	
CCc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(SC)cc3)C2=O)cc1	4845718	GDKXZYPYYXRAGD-ATVHPVEESA-N	366.442	3.637	10	50	FHCA	
CCn1c(C)cc(/C=C2/C(=O)N(c3ccccc3C)C(=O)N=C2O)c1C	1129403	AFLPLDYQJDPQNN-LFIBNONCSA-N	351.406	3.940	10	50	FHCA	
COc1ccc(N2CCN([C@@H]3CCCN(C4CCCCC4)C3)CC2)cc1	23375178	DXSVSILYRYXTMA-OAQYLSRUSA-N	357.542	3.614	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3ccn(C(C)(C)C)c3)[C@H](C)C2)cc1	72433770	GVVPUYVAZHAKMI-MRXNPFEDSA-N	355.482	3.603	10	50	FHCA	
Cc1ccc(C2=NN3C(=N)/C(=C/c4ccc(F)cc4)C(=O)N=C3S2)cc1	1177037	MTAWJAAOIZCAMC-ACXWOISZSA-N	364.405	3.802	10	50	FHCA	
COc1ccc([C@@H]2CC(c3cc(Cl)ccc3O)=NN2C(C)=O)cc1OC	1121538	CBYBEJXTZIFQBY-INIZCTEOSA-N	374.824	3.760	10	50	FHCA	
Cc1ccc(C)n1-c1ccccc1CNS(=O)(=O)Cc1ccccc1	4050961	IKBCHUKSYPZCJN-UHFFFAOYSA-N	354.475	3.714	10	50	FHCA	
COc1cccc(N2C(=O)/C(=C/c3ccc(O)c(O)c3)SC2=S)c1	1800397	QKGNJZAPNZOXMQ-NVNXTCNLSA-N	359.428	3.512	10	50	FHCA	
CC(C)C(=O)N[C@@H](c1ccc(N(C)C)cc1)c1ccc2cccnc2c1O	2484229	ZMPRXGIKEBLOJN-IBGZPJMESA-N	363.461	3.868	10	50	FHCA	
Cc1ccc(N2C(=O)/C(=C/c3cc(C)n(C)c3C)C(O)=NC2=S)c(C)c1	8743342	DITNNDAAQSTKRH-MHWRWJLKSA-N	367.474	3.930	10	50	FHCA	
O=C1[C@@H]2C[C@@H](CN2Cc2c(O)ccc3ccccc23)N1c1ccccc1F	20110052	SPZKYJGKTAZAEH-YWZLYKJASA-N	362.404	3.674	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C1/C(=O)Nc2c1ccc(Cl)c2C	15015670	XUEAEICRGOWSPD-FOCLMDBBSA-N	351.793	3.777	10	50	FHCA	
COc1ccc(/C=C2\SC(=S)N(Nc3ccccc3)C2=O)cc1OC	16677500	UBWNVHGYPVRQLR-WJDWOHSUSA-N	372.471	3.932	10	50	FHCA	
CCOc1cccc(CN[C@@H]2CCCN(Cc3cccc(OC)c3)C2)c1O	20515631	RLEBJTSEOAWJJS-LJQANCHMSA-N	370.493	3.554	10	50	FHCA	
COc1ccc([N+](=O)[O-])cc1NCc1cc(Br)ccc1O	732349	YDDXDTUSNBXATP-UHFFFAOYSA-N	353.172	3.684	10	50	FHCA	
O=C1N=C(N2CCN(Cc3ccccc3)CC2)S/C1=C/c1cccs1	20029215	GKNDBXRLKYNHNN-GHRIWEEISA-N	369.515	3.536	10	50	FHCA	
O=C1/C(=C/c2ccccc2F)SC(=S)N1Cc1ccc2c(c1)OCO2	16193364	ASOAWFFVSAKZSN-PXNMLYILSA-N	373.430	3.956	10	50	FHCA	
Cc1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(C)cc3)C2=O)cc1	1446711	RSKBVVNEMATDBQ-LFIBNONCSA-N	368.483	3.850	10	50	FHCA	
CCOc1ccc(CNCc2cccc3[nH]ccc23)cc1COC(C)=O	67895092	VEZLQKSOXQSTNP-UHFFFAOYSA-N	352.434	3.920	10	50	FHCA	
COc1cccc(C(=O)[C@@H]2CCCN(Cc3cccc(OC)c3O)C2)c1	12582997	JWYSABMMTSUXPE-MRXNPFEDSA-N	355.434	3.504	10	50	FHCA	
Cc1ccc2c(c1)/C(=C1/SC(=S)N(c3ccccc3)C1=O)C(=O)N2	1085920	HRXZLTBGEIDQJY-PFONDFGASA-N	352.440	3.723	10	50	FHCA	
Cc1cccc(N2C(=O)/C(=C3/C(=O)N(C)c4ccccc43)SC2=S)c1	2277951	SNMRYQKJYFYWAK-NXVVXOECSA-N	366.467	3.747	10	50	FHCA	
COc1ccc(N2C(=O)N=C(O)/C(=C/c3c[nH]c4ccccc34)C2=O)cc1	19335044	GFIIXPMEWGTEQK-YBEGLDIGSA-N	361.357	3.683	10	50	FHCA	biogenic
CCOC(=O)[C@H](C)Oc1ccc2c(-c3ccc(OC)cc3)cc(=O)oc2c1	1170442	OETZZXPGZYTRSU-ZDUSSCGKSA-N	368.385	3.799	10	50	FHCA	biogenic
Cc1cc(C(=O)N[C@H]2CCOC3(CCOCC3)C2)c(C)n1-c1ccccc1	77357145	SXMAIISKXLRLLY-SFHVURJKSA-N	368.477	3.552	10	50	FHCA	
O=C(CN1CCCCC1)N1N=C(c2ccccc2O)C[C@@H]1c1cccs1	170612666	BMQXYFXKMKZNNK-QGZVFWFLSA-N	369.490	3.617	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C\Nc1cc([N+](=O)[O-])ccc1Cl	100148631	AYTWVQSPJDUZIA-UVTDQMKNSA-N	356.769	3.967	10	50	FHCA	
CSC[C@](C)(O)CNCc1ccc(N(C)Cc2cccs2)cc1	823921475	GSSYGKSOZODNDT-GOSISDBHSA-N	350.553	3.588	10	50	FHCA	
CCC(=O)N[C@@H](c1ccc(OC)c(OC)c1)c1ccc2cccnc2c1O	1197087	QNPSQPFPEUYCEM-IBGZPJMESA-N	366.417	3.573	10	50	FHCA	biogenic
CCOC(=O)c1cccc(N2C(=O)/C(=C\c3ccco3)SC2=S)c1	4482844	BMYXJLRLMMPVQA-GXDHUFHOSA-N	359.428	3.862	10	50	FHCA	
O=C(O)c1cc(/C=C/c2ccc(N3CCOCC3)cc2)nc2ccccc12	4710050	AIZKGCWIXTVRGO-VMPITWQZSA-N	360.413	3.940	10	50	FHCA	
Cc1cccc(N2CCN(C3=NC(=O)C(=C4CCCCC4)S3)CC2)c1	1182524	KBTLXVASGKDGNL-UHFFFAOYSA-N	355.507	3.965	10	50	FHCA	
N=C1/C(=C\c2ccc(Sc3ccccc3)o2)C(=O)N=C2SC=NN12	4644054	PUTIXNVOVNFQSY-CBYQKHDWSA-N	354.416	3.680	10	50	FHCA	
COc1ccc(OC)c(/C=C2\SC(=S)N(Cc3cccnc3)C2=O)c1	12419786	NEDNDIYDDWKDSM-SXGWCWSVSA-N	372.471	3.500	10	50	FHCA	
O=C(CSc1ccccn1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	4904088	ILCDHEBYNAUTNC-UHFFFAOYSA-N	374.421	3.588	10	50	FHCA	aggregator
Cc1ccc(N2CCN(C(=O)c3cc(C)n(-c4ccccn4)c3C)CC2)cc1	752140493	NTGSMCOORBOJNX-UHFFFAOYSA-N	374.488	3.760	10	50	FHCA	
O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1cccc(Cl)c1	1214213	FPUNLASCYRHLJA-NTEUORMPSA-N	361.184	3.660	10	50	FHCA	
Cn1cc(/C=C2\C(=O)N(C3CCCCC3)C(=S)N=C2O)c2ccccc21	16944788	LLZKGHNDBDRIKG-WJDWOHSUSA-N	367.474	3.978	10	50	FHCA	
COc1ccc2c(c1)c(/C=C/c1nc3ccccc3c(=O)n1C)c(C)n2C	3894045	RJLHERBVQQIVFM-ZRDIBKRKSA-N	359.429	3.913	10	50	FHCA	biogenic
COc1ccc(N2CCN(c3nc(C)nc4sccc34)[C@H](C)C2)cc1	1704313079	MYAZUPYYVOPYIY-CYBMUJFWSA-N	354.479	3.723	10	50	FHCA	
O=C(CCN1C(=O)/C(=C\c2cccs2)SC1=S)Nc1ccccc1	4844241	CPCMESXITDCWCE-SDNWHVSQSA-N	374.512	3.978	10	50	FHCA	
Cc1ccc(O)c(CN2CCc3[nH]cnc3[C@@H]2C2CCN(C(C)C)CC2)c1	72422392	WAHRKCZCYWRFJV-QFIPXVFZSA-N	368.525	3.644	10	50	FHCA	
COc1cccc(C(=O)[C@H]2CCCN(Cc3cccc(OC)c3O)C2)c1	12583003	JWYSABMMTSUXPE-INIZCTEOSA-N	355.434	3.504	10	50	FHCA	
COc1ccc(N2CCOCC2)c(NC(=O)c2cc3ccccc3o2)c1	4973750	XQEDOXWUFPYNQB-UHFFFAOYSA-N	352.390	3.530	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3cccc4cnccc34)[C@@H](C)C2)cc1	72432436	QNAVKHVATXLBLC-INIZCTEOSA-N	361.445	3.594	10	50	FHCA	
CCCC1=NN(c2ccccc2)C(=O)/C1=C\c1ccccc1OCC(=O)O	15010987	DJFOZOULCBVXPX-LGMDPLHJSA-N	364.401	3.736	10	50	FHCA	
Cc1nn(C)c2c1[C@@H](NC1CCN(c3ccc4c(c3)CCC4)CC1)CCC2	1857678069	RPXHOECQIPERRF-NRFANRHFSA-N	364.537	3.853	10	50	FHCA	
Cc1cc(C(=O)N2CCC[C@@H](Cn3ccnc3)C2)c(C)n1-c1ccccc1	95372612	OIXUSUOKFCXPQA-IBGZPJMESA-N	362.477	3.843	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3c(Cl)cccc3Cl)CC2)cc1	13331671	BMBMQFBKFHTDDD-UHFFFAOYSA-N	365.260	3.964	10	50	FHCA	
O=C(CCc1cccc(F)c1F)NCc1cc(Br)ccc1O	253417754	FTXBJPZMXBGLQS-UHFFFAOYSA-N	370.193	3.682	10	50	FHCA	
CC(C)(C)C1(C)OC(=O)C(=Cc2cc(Cl)c(O)c(Cl)c2)C(=O)O1	1183988	HEMBYZUWXAKRTO-UHFFFAOYSA-N	359.205	3.945	10	50	FHCA	
Cc1ccc(NC(=O)c2ccc3c(c2O)C(=O)c2ccccc2C3=O)cc1	4891435	RKOJXKDFSRUBHR-UHFFFAOYSA-N	357.365	3.728	10	50	FHCA	
CCn1ccnc1[C@H]1OCCC[C@@H]1NCc1ccc(N2CCCCC2)cc1	190430983	BWFZCWGVPHZTCV-SFTDATJTSA-N	368.525	3.903	10	50	FHCA	
COc1ccc([C@H]2c3nc[nH]c3CCN2Cc2cc(C)ccc2O)c(F)c1	67784965	VWROQESXKUMYRM-NRFANRHFSA-N	367.424	3.719	10	50	FHCA	
O=C1C(c2ccccc2)=S=C2c3ccccc3C(c3ccccc3)=NN12	334158879	ZHOIQKJBBKBYSJ-UHFFFAOYSA-N	354.434	3.727	10	50	FHCA	
COc1ccccc1/C=C1/SC(=S)N(CCCCCC(=O)O)C1=O	1916885	BFXVGOWNUZLOQR-SDNWHVSQSA-N	365.476	3.541	10	50	FHCA	
COc1ccc(N2CCC(N(C)Cc3nc4cccc(C)c4[nH]3)CC2)cc1	952984820	SMBRTCFOMNDLPY-UHFFFAOYSA-N	364.493	3.981	10	50	FHCA	
O=C(Cc1ccccc1)N[C@H](c1ccco1)c1ccc2cccnc2c1O	3894220	HNPYDBOZQIKEOR-NRFANRHFSA-N	358.397	3.982	10	50	FHCA	
COc1ccc(N2CCN([C@H]3CCCN(C4CCCCC4)C3)CC2)cc1	23375180	DXSVSILYRYXTMA-NRFANRHFSA-N	357.542	3.614	10	50	FHCA	
CCCN1C(=O)/C(=C/c2nc3ccccc3c(=O)n2CC)c2ccccc21	32617996	XYLVXTSWOJTIDZ-SAPNQHFASA-N	359.429	3.714	10	50	FHCA	
O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1Nc1ccccc1	1221269	LNKPWWPNXGRRII-UVTDQMKNSA-N	357.416	3.823	10	50	FHCA	
COc1ccc(OC)c(-c2ccc(O)c(CN3CCCC[C@@H]3CCO)c2)c1	20536913	XXWIMXOQONAEKV-GOSISDBHSA-N	371.477	3.813	10	50	FHCA	
O=C1c2ccccc2C(=O)c2cc(NC(=O)C(Cl)(Cl)Cl)ccc21	5094715	ROQNKYFCEHBUIO-UHFFFAOYSA-N	368.603	3.771	10	50	FHCA	
O=C1/C(=C/c2c(F)cccc2Cl)SC(=S)N1C[C@H]1CCCO1	13590976	OETQYFVQDFZDDV-VAENJDROSA-N	357.859	3.859	10	50	FHCA	
Cc1nc(C)c(CC(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)s1	215920296	FWVTZNKMCHRKCC-AWEZNQCLSA-N	357.523	3.855	10	50	FHCA	
Cc1c(O)ccc2c1oc1c(-c3ccc(O)c(O)c3)c3cnn(C)c3nc12	253396405	BBVMGDDGUWUDHP-UHFFFAOYSA-N	361.357	3.960	10	50	FHCA	biogenic
Cn1ccnc1[C@H](NC1CCN(c2ccc3c(c2)CCC3)CC1)C1CC1	1506424584	BAIJDEKOXFEECI-OAQYLSRUSA-N	350.510	3.619	10	50	FHCA	
CC(C)C(=O)N[C@H](c1ccc([N+](=O)[O-])cc1)c1ccc2cccnc2c1O	1197066	MANXRJHVXKIOPP-QGZVFWFLSA-N	365.389	3.710	10	50	FHCA	
CCCOc1ccccc1/C=C1/SC(N2C[C@H](C)O[C@@H](C)C2)=NC1=O	3904260	SDNHXAQJWCGRNO-JUACWREWSA-N	360.479	3.555	10	50	FHCA	
COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccc(O)cc1	1163660	BFTSHPAAKSQSAX-UNOMPAQXSA-N	363.413	3.886	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3ccc(Cl)c(Cl)c3)CC2)cc1	1140874	WEYOXHSIWPKHGX-UHFFFAOYSA-N	365.260	3.964	10	50	FHCA	
CC1=NN(c2ccc(Cl)c(C(=O)O)c2)C(=O)/C1=C/c1cccc(F)c1	106444113	VEOLZPJASDKDQI-RIYZIHGNSA-N	358.756	3.983	10	50	FHCA	
CN(C)c1ccc(/C=C/CN2CCc3nnc(-c4ccccc4)n3CC2)cc1	14983679	HIOCLEHIVGVVFH-VOTSOKGWSA-N	373.504	3.583	10	50	FHCA	
CC(=O)[C@@H](/N=N/c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1	111409596	KBNQUAQMTGZQGJ-FZFLATATSA-N	360.757	3.928	10	50	FHCA	
COc1ccc(-c2nc(COc3cccnc3N)c(C)o2)c(OC)c1C	67967697	OJLRVJKLFHYSJH-UHFFFAOYSA-N	355.394	3.532	10	50	FHCA	
O=C1Nc2ccc(F)cc2/C1=C1/SC(=S)N(Cc2ccccc2)C1=O	2830501	CHSGEKAWWFHAOY-PFONDFGASA-N	370.430	3.549	10	50	FHCA	
Cc1ccc(N2NC(=O)/C(=C\c3ccccc3OC(C)C)C2=O)cc1Cl	207341881	NETSHMJZESJOMG-MHWRWJLKSA-N	370.836	3.897	10	50	FHCA	
CN(C)c1ccc(/C=C2\N=C(c3cccc(Br)c3)OC2=O)cc1	1231203	MVJJZPPSEQLHPE-YBEGLDIGSA-N	371.234	3.860	10	50	FHCA	
Cc1ccc(C(=O)c2coc3ccc(O)c(CN4CCOCC4)c23)cc1	19782250	WBPYVAMOCJSDSK-UHFFFAOYSA-N	351.402	3.510	10	50	FHCA	
CCOc1ccc(N2C(=O)/C(=C/c3ccc(C)o3)C(O)=NC2=S)cc1	753701	STMMESPXOHBTOU-XNTDXEJSSA-N	356.403	3.658	10	50	FHCA	
COc1cccc(-c2cc3ccc(O)c(CN4CCCC4)c3oc2=O)c1	13722436	KPPQXEPXCPOZAE-UHFFFAOYSA-N	351.402	3.770	10	50	FHCA	biogenic
CCc1nc(N2CCN(c3ccc(OC)cc3)CC2)c2cc(C)sc2n1	41090679	UMQPHDNTJUKGEU-UHFFFAOYSA-N	368.506	3.897	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3oc4ccccc4c3C)CC2)cc1	3350066	WBHYFSNIOHYKKH-UHFFFAOYSA-N	350.418	3.712	10	50	FHCA	
Cc1ccc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)cc3)C2=O)cc1C	1170630	XNPSSNKIOBAXAB-MHWRWJLKSA-N	354.793	3.623	10	50	FHCA	
COCc1cc(CNC2CCN(c3cccc(C)c3)CC2)ccc1OC	952983054	NTSHQFCANZIQSC-UHFFFAOYSA-N	354.494	3.909	10	50	FHCA	
CN(Cc1ccc(N2CCOCC2)cc1)c1nccc2ccc(F)cc12	769833466	OXIKBSCLOVHORL-UHFFFAOYSA-N	351.425	3.847	10	50	FHCA	
COc1ccccc1C(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	4151776	KBKNJTHUIFNTIO-UHFFFAOYSA-N	357.365	3.723	10	50	FHCA	
COC(=O)c1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1	1238466	DJPNZSHBSNJBID-RVDMUPIBSA-N	355.440	3.879	10	50	FHCA	
COc1cc(/C=C2/SC(=S)NC2=O)ccc1OCCc1ccccc1	1122132	NDNAEMFCURBEDJ-SFQUDFHCSA-N	371.483	3.806	10	50	FHCA	
COc1ccc(O)c(CN2CCC[C@@H](C(=O)c3cc(F)ccc3F)C2)c1	12058058	ACNSACAFQDCKCJ-CYBMUJFWSA-N	361.388	3.774	10	50	FHCA	
CN1C(=O)/C(=C2\SC(=S)N(C3CCCCC3)C2=O)c2ccccc21	13615179	XWJQBKMRUDBSJG-PFONDFGASA-N	358.488	3.567	10	50	FHCA	
COc1cc(/C=C2\C(=O)N(c3ccccc3)C(=O)N=C2O)cc(Cl)c1O	15722788	WZYIOHZSGJYBRO-GHXNOFRVSA-N	372.764	3.561	10	50	FHCA	
COc1ccc(N2CCN([C@@H]3CCCN(CCC=C(C)C)C3)CC2)cc1	72151678	YPOPDSHBZXRDAF-OAQYLSRUSA-N	357.542	3.638	10	50	FHCA	
O=C(O)CCCCCN1C(=O)/C(=C/c2cccc(F)c2)SC1=S	1916910	RUIWSEPECAXYLH-RAXLEYEMSA-N	353.440	3.672	10	50	FHCA	
COc1ccc([C@H](NC(=O)C(C)C)c2ccc3cccnc3c2O)cc1	37867414	RVEFWDFDCPPOIN-SFHVURJKSA-N	350.418	3.811	10	50	FHCA	biogenic
c1ccc([C@H]2CCCN2C2CCN(c3ccc4c(c3)OCO4)CC2)nc1	65493676	CBAPKOVKHXASAE-LJQANCHMSA-N	351.450	3.616	10	50	FHCA	
COc1ccc(N2CCN(C(=O)CCc3scnc3C)CC2(C)C)cc1	82083534	ZOJGPKAFNMEZRI-UHFFFAOYSA-N	373.522	3.520	10	50	FHCA	
C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@H]1CCNC[C@@H]1F	888101873	QDDVXMAOISBHSF-POAQFYNOSA-N	370.468	3.820	10	50	FHCA	
O=C1N=C(N2CCCCC2)S/C1=C/c1ccc(Br)cc1	825400	QPDCUEASNOXEPJ-JLHYYAGUSA-N	351.269	3.905	10	50	FHCA	
COc1ccc(N2CCN(C(=S)Nc3cc(C)cc(C)c3)CC2)cc1	13471667	MHAPSBFWPUIDIU-UHFFFAOYSA-N	355.507	3.831	10	50	FHCA	
O=C(NCc1ccc(N2CCOCC2)cc1)c1ccc(Cl)cc1Cl	13667488	QSIDMKHDMXRQJS-UHFFFAOYSA-N	365.260	3.760	10	50	FHCA	
O=C(O)[C@@H](c1cc(-c2ccccc2)ccc1O)N1Cc2ccccc2C1=O	2356134282	HQRJUZSCOAKIKB-HXUWFJFHSA-N	359.381	3.841	10	50	FHCA	
COc1ccc(NCc2cc(Br)cc(OC)c2O)c(OC)c1	629142	OUOPRNABNAIKGP-UHFFFAOYSA-N	368.227	3.793	10	50	FHCA	
COc1ccc(CN2C(=O)/C(=C/c3ccccc3O)SC2=S)cc1	4803639	ZHLRZJUPPJIZBA-YBEGLDIGSA-N	357.456	3.802	10	50	FHCA	
C[C@H]1CN(Cc2c(O)ccc3c(=O)c(-c4ccccc4)coc23)C[C@@H](C)O1	13450982	CGKRXLVATORLPE-GASCZTMLSA-N	365.429	3.775	10	50	FHCA	biogenic
CCCOc1ccccc1/C=C1/SC(N2C[C@H](C)O[C@H](C)C2)=NC1=O	16212835	SDNHXAQJWCGRNO-ZJLQCSDHSA-N	360.479	3.555	10	50	FHCA	
O=C1c2ccccc2C(=O)c2c1ccc1[nH]c(-c3ccc([N+](=O)[O-])cc3)nc21	38249130	BBOLSULWGUNYTC-UHFFFAOYSA-N	369.336	3.914	10	50	FHCA	
COc1ccc2c(c1)c(=O)oc1c(C)c(OCC(=O)OC(C)C)ccc12	1155903	CCJOMLXIHMWOOP-UHFFFAOYSA-N	356.374	3.594	10	50	FHCA	biogenic
Cc1ccc(/C=C2\SC(=S)N(CCC(=O)NC(C)(C)C)C2=O)cc1	13799714	BCJAAMFIPAFAFE-KAMYIIQDSA-N	362.520	3.501	10	50	FHCA	
COc1cccc(N2C(=O)/C(=C/C=C/c3ccco3)C(O)=NC2=S)c1	1197553	MKHHXEBLYKQVOL-AYRRQIOMSA-N	354.387	3.516	10	50	FHCA	
O=C1N=C(O)/C(=C\c2ccco2)C(=O)N1c1ccc(Br)cc1	17028336	PNQXUDBQKZDLRB-XYOKQWHBSA-N	361.151	3.549	10	50	FHCA	
O=C1/C(=C/c2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1Cc1ccccc1	36385991	KSNBAPVKBUESBE-DHDCSXOGSA-N	372.427	3.702	10	50	FHCA	
C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@@H]1CCNC[C@H]1F	888101870	QDDVXMAOISBHSF-IMFGXOCKSA-N	370.468	3.820	10	50	FHCA	
COc1ccc(CCN2CCC(CN(C)Cc3ccccc3O)CC2)cc1	12572816	ZFGBCJXHXDPPOM-UHFFFAOYSA-N	368.521	3.787	10	50	FHCA	
CC(/C=C1\SC(=S)N([C@@H](C(=O)O)C(C)C)C1=O)=C\c1ccccc1	4192888	WZSFHXDLBDYXPF-KYQAKJIHSA-N	361.488	3.943	10	50	FHCA	
Cc1cc(-c2ccc(/C=C3\SC(=S)N(C)C3=O)o2)ccc1[N+](=O)[O-]	15219869	YARSSIPSUFZPJS-ZSOIEALJSA-N	360.416	3.994	10	50	FHCA	
O=C1/C(=C/c2ccc3c(c2)OCO3)SC(=S)N1Cc1ccc(F)cc1	1104047	IHMMPWTXALIVMO-PXNMLYILSA-N	373.430	3.956	10	50	FHCA	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)C2=O	1815745	WHJPRSOZOUDYPN-SJORKVTESA-N	354.233	3.896	10	50	FHCA	
COc1ccc(N2CC3(CN(Cc4cc5c(cc4OC)CCC5)C3)C2)cc1	2100544597	AIJYMGAIXUYBAJ-UHFFFAOYSA-N	364.489	3.515	10	50	FHCA	
O=C1NC(=S)N(c2ccc(Cl)cc2)C(=O)/C1=C/C=C/c1ccccc1	1206659	BLDHQAMNZPHZNF-LHQXNBGVSA-N	368.845	3.728	10	50	FHCA	
CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S	1300968	KMGMFRUEPBZCGG-RDQDRAATSA-N	355.868	3.650	10	50	FHCA	
CCCOc1ccccc1/C=C1/SC(N2C[C@@H](C)O[C@H](C)C2)=NC1=O	3904259	SDNHXAQJWCGRNO-DPOBWDHUSA-N	360.479	3.555	10	50	FHCA	
O=C(O)CCCN1C(=O)/C(=C/c2cccc3ccccc23)SC1=S	1207822	NMYDPSCPARBVHD-PTNGSMBKSA-N	357.456	3.906	10	50	FHCA	
CC(C)COc1ccc(/C=C2/C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1	15836732	SZWWDLFFLBNIJP-PDGQHHTCSA-N	370.449	3.516	10	50	FHCA	
CCC(=O)N[C@@H](c1cccs1)c1cc([N+](=O)[O-])c2cccnc2c1O	4844909	DEXNORPUTBBNSC-OAHLLOKOSA-N	357.391	3.526	10	50	FHCA	
CCCCC(=O)N[C@H](c1ccco1)c1cc([N+](=O)[O-])c2cccnc2c1O	2470730	WOPMNHIPUZXLPC-KRWDZBQOSA-N	369.377	3.837	10	50	FHCA	
Cc1ccc(OCCOc2cccc(/C=C3/SC(=S)NC3=O)c2)cc1	2998653	OZCKTLCOJCXXMR-SFQUDFHCSA-N	371.483	3.942	10	50	FHCA	
CCc1ccc(N2C(=O)/C(=C/c3ccc(C)s3)C(=O)N(C)C2=S)cc1	1185153	DAFDNOXRYZMKSV-LFIBNONCSA-N	370.499	3.792	10	50	FHCA	
CN(Cc1ccccc1O)CC1CCN(CCc2ccc(F)cc2)CC1	15080428	IINWBUXLDMCKFE-UHFFFAOYSA-N	356.485	3.918	10	50	FHCA	
COc1ccc(OC)c(N2C(=O)N=C(O)/C(=C/c3ccc(C)s3)C2=O)c1	17027791	IUMDIRSOTMHWFH-LCYFTJDESA-N	372.402	3.580	10	50	FHCA	
O=C([C@@H]1Nc2ccccc2[C@H]2C=CC[C@@H]21)N1CCc2[nH]nc(C3CCC3)c2C1	42987487	GBFJMYKVPPZMJP-ULYRPOKDSA-N	374.488	3.716	10	50	FHCA	
CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\Nc1ccc([N+](=O)[O-])cc1	16160779	WGMJZHIZIFYOLJ-YBEGLDIGSA-N	356.769	3.967	10	50	FHCA	
COc1ccc(/C=C2/SC(=S)N(C(=O)c3ccccc3F)C2=O)cc1	408822742	VCTDGKVPGHQNQR-XNTDXEJSSA-N	373.430	3.876	10	50	FHCA	
CCN1C(=O)S/C(=C/c2ccc(N(C)C)c(Br)c2)C1=O	4688016	RVIDCNMLSQEALJ-XYOKQWHBSA-N	355.257	3.571	10	50	FHCA	
COCCCN1C(=O)/C(=C\c2cccc(Br)c2)SC1=S	5669753	KQKXGVHTGNPODL-FMIVXFBMSA-N	372.309	3.687	10	50	FHCA	
Cc1ncsc1CCC(=O)NCc1ccc(N2CCC[C@H](C)C2)cc1	82134008	PYEUJBFBLNULGP-HNNXBMFYSA-N	357.523	3.937	10	50	FHCA	
O=C(O)[C@H](c1ccccc1)N1C(=O)/C(=C/c2ccc(F)cc2)SC1=S	966721	VOSYPXSHMLLTKA-LTBFUDJGSA-N	373.430	3.853	10	50	FHCA	
COC(=O)C1=C(C)N(Cc2ccccc2)C(=O)/C1=C\c1ccc(F)cc1	1163373	QGDZORVQDNXMMT-PDGQHHTCSA-N	351.377	3.699	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccc(OC)c(Cl)c2)C(=O)/C1=C\c1ccco1	1160588	ODEXZKZCCLNHGV-UVTDQMKNSA-N	373.792	3.819	10	50	FHCA	
COc1cccc(CN(C)[C@H]2CCCN(CCc3ccccc3)C2)c1O	20235232	UOJKRLWTUCTFBX-FQEVSTJZSA-N	354.494	3.540	10	50	FHCA	
COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccccc1O	1179967	BVWMWIKWYFMFGN-PDGQHHTCSA-N	363.413	3.573	10	50	FHCA	
COc1ccc2c(c1)CC[C@@H]1C2=NN(C(C)=O)[C@H]1c1ccc(N(C)C)cc1	4168130	ABCOZFPPGDRJAT-IRLDBZIGSA-N	363.461	3.631	10	50	FHCA	
C[C@@H](N=[N+]=[N-])[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O	108644302	LLJMYBCJYQGZOS-DIFFPNOSSA-N	366.377	3.677	10	50	FHCA	
COc1ccc(OC)c(C2=C/C(=C/c3ccccc3[N+](=O)[O-])C(=O)O2)c1	2915794	MMPMUDASAKOIHY-LCYFTJDESA-N	353.330	3.593	10	50	FHCA	
O=C1/C(=C/c2cc(Cl)ccc2O)SC(=S)N1Cc1cccnc1	1164722	YJTBWEGKQOXMQV-AUWJEWJLSA-N	362.863	3.842	10	50	FHCA	
CN1C(=O)S/C(=C/c2ccc(-c3cc(C(=O)O)ccc3Cl)o2)C1=O	4599062	CTJCEFNFCHGOJR-NTUHNPAUSA-N	363.778	3.964	10	50	FHCA	
CCCOC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CC[C@@H](CC)C2	5952048	GJQPHNWDOYPKTM-LLVKDONJSA-N	367.467	3.633	10	50	FHCA	
CC(C)(C)n1cccc1/C=C1/C(=O)N(c2cccc(F)c2)C(=O)N=C1O	32666600	BEEUZQUPGZRLNF-RVDMUPIBSA-N	355.369	3.889	10	50	FHCA	
C[C@@H]1CN(C2=NC(=O)/C(=C/c3c(F)cccc3Cl)S2)C[C@@H](C)O1	858315	GPBCXKZKMKDYAP-UOZBKBOTSA-N	354.834	3.559	10	50	FHCA	
CCN(CC)c1ccc(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1	2878937	SALGPPOYYMXZGI-PDGQHHTCSA-N	365.389	3.786	10	50	FHCA	
COc1cc([N+](=O)[O-])ccc1N/C=C1\C(=O)N(c2ccc(C)cc2)N=C1C	100296110	CJGGNTJPTFWCCP-WJDWOHSUSA-N	366.377	3.630	10	50	FHCA	
CN(C)c1ccc(/C=C2/C(=O)N(c3ccccc3F)C(=S)N=C2O)cc1	17163360	MTZOXFWDKHNLEB-SDNWHVSQSA-N	369.421	3.563	10	50	FHCA	
COc1ccc(OC)c(C2=C/C(=C/c3ccc(OC)c(OC)c3)C(=O)O2)c1	843818	GVJITNYJGPJGRH-ZROIWOOFSA-N	368.385	3.702	10	50	FHCA	
COc1ccc(/C=C2\SC(=S)N(CCc3ccccc3)C2=O)cc1O	15010727	MZLABMZLLOIIAJ-ATVHPVEESA-N	371.483	3.845	10	50	FHCA	
CC(C)Cc1noc(CC2(c3ccccc3)C(=O)c3ccccc3C2=O)n1	20455982	APTHFCGNMMSYPT-UHFFFAOYSA-N	360.413	3.828	10	50	FHCA	
COCCOc1ccc(N2CCN(C[C@@H]3CC[C@H]4C[C@@H]3C4(C)C)CC2)cc1	2325872279	PUDWCMVOXVPKAZ-IPJJNNNSSA-N	372.553	3.906	10	50	FHCA	
C[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S	1190692	NYFNZROPRHZBME-DZTYSLMWSA-N	362.259	3.668	10	50	FHCA	
COc1ccc2c(c1)CCCCN2CC(=O)Nc1cc([N+](=O)[O-])ccc1C	170591226	SINCTMMIYCMWHS-UHFFFAOYSA-N	369.421	3.693	10	50	FHCA	
Fc1c(F)c(N2CCCCC2)c(F)c(F)c1/C=C/CN1CCOCC1	20406448	NKLOCYZMCZPHDZ-SNAWJCMRSA-N	358.379	3.579	10	50	FHCA	
CCN1C(=O)/C(=C\c2cccn2-c2cccc([N+](=O)[O-])c2)SC1=S	4818921	NTNKPTZANZZZNX-GXDHUFHOSA-N	359.432	3.607	10	50	FHCA	
O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1c1ccccc1	13841708	YLKOCKIMSAOAIF-NTEUORMPSA-N	358.400	3.706	10	50	FHCA	
COc1ccc(N2CCOCC2)c(NC(=O)c2cccc(OC(C)C)c2)c1	7496684	VVUDKXAYZYZXEC-UHFFFAOYSA-N	370.449	3.571	10	50	FHCA	
Cc1ccc(S(=O)(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)cc1	71376505	WWVLTHSBIGOJFW-QGZVFWFLSA-N	358.507	3.710	10	50	FHCA	
COC(=O)C1=C(C)NC(=O)/C1=C\c1cc(C)n(-c2cccc(Cl)c2)c1C	13940912	WEJUOTUZWZSGSF-MFOYZWKCSA-N	370.836	3.708	10	50	FHCA	
COCCCN1C(=O)/C(=C/C2=Cc3ccccc3O[C@H]2C)SC1=S	1818598	DMYLSUFHRMMFLE-IEMQHYRPSA-N	361.488	3.632	10	50	FHCA	
O=C1N=C(O)/C(=C\c2ccccc2OCc2ccccc2Cl)C(=O)N1	8856617	UBVUILNVPQVKBS-UHFFFAOYSA-N	356.765	3.509	10	50	FHCA	
COc1cccc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)c1O	23281686	CJZWQPLUFHFFPM-UHFFFAOYSA-N	366.383	3.742	10	50	FHCA	
CCc1ccc([C@H]2c3nc[nH]c3CCN2Cc2ccc(N(C)C)cc2)nc1	72423254	PTVUXDWDHSACDN-QFIPXVFZSA-N	361.493	3.581	10	50	FHCA	
Oc1ccc(-c2ccc(F)cc2)cc1CN1CCN(c2ccccn2)CC1	12034296	UUIQXEOLRYRFKN-UHFFFAOYSA-N	363.436	3.916	10	50	FHCA	
CC(C)[C@@H]1CN(Cc2ccccc2O)CCC(=O)N1Cc1ccc(F)cc1	71745888	KFHMOTJEVPMSGJ-FQEVSTJZSA-N	370.468	3.790	10	50	FHCA	
CCCCC1=NN2C(=N)/C(=C/c3ccc(O)c(OCC)c3)C(=O)N=C2S1	4725358	ZGNMKTKVJRKVJX-KXKVSBCVSA-N	372.450	3.600	10	50	FHCA	
Cc1cccc(/C=C2/C(=N)N3N=C(c4ccccc4C)SC3=NC2=O)c1	15837967	IRRKJJODLMUYAG-XGMUFTHNSA-N	360.442	3.971	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\c3ccc(O)c(O)c3)SC2=S)cc1	4456498	TWPHOLDJGIAXPX-OQLLNIDSSA-N	359.428	3.512	10	50	FHCA	
COc1ccc(/C=C2/SC(=S)N(c3ccc(F)cc3)C2=O)cc1O	1131387	AIMNWXCZYHIMQY-OQLLNIDSSA-N	361.419	3.946	10	50	FHCA	
Cc1noc([C@@H](NCc2ccc(N3CCCCC3)cc2)C2CCOCC2)n1	328628755	OBCZYZNKHUIGKW-FQEVSTJZSA-N	370.497	3.626	10	50	FHCA	
O=C([C@@H]1Nc2ccccc2[C@@H]2C=CC[C@H]12)N1CCc2[nH]nc(C3CCC3)c2C1	42987485	GBFJMYKVPPZMJP-GIMINZRKSA-N	374.488	3.716	10	50	FHCA	
CC(=O)[C@H](N=Nc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1	256169216	KBNQUAQMTGZQGJ-HNNXBMFYSA-N	360.757	3.928	10	50	FHCA	
C[C@@H]1CN(Cc2c(O)ccc3c(=O)c(-c4ccccc4)coc23)C[C@@H](C)O1	19497513	CGKRXLVATORLPE-HUUCEWRRSA-N	365.429	3.775	10	50	FHCA	biogenic
Cc1cc(C(=O)N[C@@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1ccc(F)cc1	1875354397	GKHACDOBGVSMCU-DOTOQJQBSA-N	372.440	3.997	10	50	FHCA	
Cc1ccc(C)c(-n2[nH]c3c4c(ccc3c2=O)C(=O)c2ccccc2C4=O)c1	100432906	YLEZXSKABRLMNO-UHFFFAOYSA-N	368.392	3.711	10	50	FHCA	
[N-]=[N+]=NCC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O	104841323	CLEZARXVEABQBI-QGZVFWFLSA-N	366.377	3.679	10	50	FHCA	
CCOC(=O)c1ccc(NCc2cc(Br)ccc2O)cc1	847307	SWEOKIGHFFOGLZ-UHFFFAOYSA-N	350.212	3.944	10	50	FHCA	
O=C(O)c1ccc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)cc1	2124225	LAVHHMWKUVBWIF-GDNBJRDFSA-N	355.440	3.786	10	50	FHCA	
CC(=O)N[C@H](c1ccc(Br)cc1)c1ccc2cccnc2c1O	1218938	DXYUFSXQDXVFAO-MRXNPFEDSA-N	371.234	3.928	10	50	FHCA	
O=C1C(=Cc2ccco2)C(=O)N(c2ccccc2)C(=O)N1c1ccccc1	2990282	UDOWDRWBIHPTLP-UHFFFAOYSA-N	358.353	3.863	10	50	FHCA	
C[C@@H](Cc1ccc(N)cc1)C(=O)OCc1cc(Cl)cc2c1OCOC2	225604769	GZECJPQLTZASGS-LBPRGKRZSA-N	361.825	3.711	10	50	FHCA	
Cc1ccc(C(=O)Oc2ccc(/C=C3\SC(=S)NC3=O)cc2)cc1	22184642	YKKDTEIQEZBSGH-GDNBJRDFSA-N	355.440	3.703	10	50	FHCA	
CN(Cc1cccs1)c1ccc(CNCC2(O)CCSCC2)cc1	1875265544	COHHJZJGQZKZSP-UHFFFAOYSA-N	362.564	3.732	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(F)cc1	657299	ZGWXJCVKGKGLFM-BOPFTXTBSA-N	355.340	3.842	10	50	FHCA	
Cc1ccc(-n2c(C)cc(/C=C3/NC(=O)N(c4ccccc4)C3=O)c2C)nc1	1115716	GPQIXHOBDLESIY-XDHOZWIPSA-N	372.428	3.895	10	50	FHCA	
COc1ccc(N2CCN(C(=S)Nc3cccc(Cl)c3)CC2)cc1	1144605	KWNKWOKIEORKGB-UHFFFAOYSA-N	361.898	3.868	10	50	FHCA	
NC1=NC(=O)/C(=C/c2cccc(OCCOc3ccccc3Cl)c2)S1	7003994	SYXUYVNBNVEOME-WJDWOHSUSA-N	374.849	3.727	10	50	FHCA	
Cc1cc(C)c(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)c(C)c1	10113598	NSGRRSCBOFHGLL-UHFFFAOYSA-N	358.507	3.691	10	50	FHCA	
COCCn1c(CCC(=O)O)ccc1-c1ccc(Br)cc1	2880775	QQMQZBJYPTYBOB-UHFFFAOYSA-N	352.228	3.581	10	50	FHCA	
Cc1ccc(C)c(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1	72119384	XPUGWAGXQDFHNL-SFHVURJKSA-N	352.478	3.560	10	50	FHCA	
C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@@H]1CCNC[C@@H]1F	888101872	QDDVXMAOISBHSF-KPFFTGBYSA-N	370.468	3.820	10	50	FHCA	
CC(C)c1ccc(C=C2C(=O)NC(=O)N(c3ccccc3F)C2=O)cc1	2049286337	RFACVFKUTANMDI-UHFFFAOYSA-N	352.365	3.616	10	50	FHCA	
COc1cc(/C=C2/C(=O)N(c3ccc(C)cc3)N=C2C)ccc1OC(C)=O	1123023	OUQZWAUVMDANNG-WOJGMQOQSA-N	364.401	3.735	10	50	FHCA	
Cc1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)c(C(C)C)cc1O	4148283	XFMBWIGHMWXBAF-UHFFFAOYSA-N	350.396	3.533	10	50	FHCA	
CCO[C@H](CC)C(O)(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1	2043340	RMNLSRHTDYZQMF-OAQYLSRUSA-N	356.510	3.870	10	50	FHCA	
CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\Nc1cc([N+](=O)[O-])ccc1O	16672090	QSPJYEVJGCYROP-ZROIWOOFSA-N	372.768	3.672	10	50	FHCA	
O=C([C@@H]1Nc2ccccc2[C@H]2C=CC[C@H]21)N1CCc2[nH]nc(C3CCC3)c2C1	23337270	GBFJMYKVPPZMJP-ZDPZECHZSA-N	374.488	3.716	10	50	FHCA	
CCCn1ccnc1[C@H]1c2nc[nH]c2CCN1Cc1cc(Cl)ccc1O	72421675	CIWMYAIXNSEXPO-GOSISDBHSA-N	371.872	3.523	10	50	FHCA	
Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccccc3C)C2=O)cc1Cl	1160860	SBDYXSPCWRZMFW-DHDCSXOGSA-N	354.793	3.623	10	50	FHCA	
CCN(Cc1cc(Br)ccc1O)C(=O)c1cccnc1S	120986867	KQVQQTKMENLUJD-UHFFFAOYSA-N	367.268	3.501	10	50	FHCA	
CCOC(=O)C1=C(C)N(CCOC)C(=O)/C1=C\c1ccc(C(C)C)cc1	97831236	ZUAOALXALMUBLG-AQTBWJFISA-N	357.450	3.519	10	50	FHCA	
O=c1oc2c(CN3CCOCC3)c(O)ccc2cc1-c1ccc(Cl)cc1	20419238	CNVMEXDFYMXAFA-UHFFFAOYSA-N	371.820	3.651	10	50	FHCA	biogenic
COc1cc(/C=C2\SC(=S)N(CC(C)C)C2=O)cc(Cl)c1O	1112158	BOYDPHFTSCSJLS-SDQBBNPISA-N	357.884	3.911	10	50	FHCA	
CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1cncc(Cl)c1O	170607870	ACHDPZSEYQXULY-UHFFFAOYSA-N	359.857	3.703	10	50	FHCA	
COC(=O)C1=C(C)N(Cc2cccnc2)C(=O)/C1=C\c1ccc(Cl)cc1	1196826	RSXXDKXGVSANPG-YVLHZVERSA-N	368.820	3.608	10	50	FHCA	
O=C(O)c1cccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)c1	15012039	ZRQFNDIQVSXCCC-XNTDXEJSSA-N	355.440	3.786	10	50	FHCA	
O=C1NC(=S)S/C1=C/c1cccn1-c1ccc(Br)cc1	2735759	JQQAPUNZTKUGSM-XYOKQWHBSA-N	365.277	3.729	10	50	FHCA	
Oc1ccc(Br)cc1CN1CCN(c2ccccc2F)CC1	55065478	QMYRVALMMQKCPL-UHFFFAOYSA-N	365.246	3.616	10	50	FHCA	
O=C(NCc1c(O)ccc2c1CCCC2)c1ccc(-c2cnccn2)cc1	151378724	PQTQMMPRAUQBAU-UHFFFAOYSA-N	359.429	3.658	10	50	FHCA	
CCOC(=O)C1(Cc2cccc(F)c2)CCN(Cc2ccccc2O)CC1	11843775	QIUDWZPLQGLNSQ-UHFFFAOYSA-N	371.452	3.919	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C\Nc1ccc(Br)cn1	22023084	RMZFCFXRXZNCCX-UVTDQMKNSA-N	357.211	3.563	10	50	FHCA	
O=C1NC(=O)/C(=C/c2ccc(N3CCC(C(F)(F)F)CC3)cc2)S1	263640007	SMOXSGFATCVGFA-LCYFTJDESA-N	356.369	3.789	10	50	FHCA	
O=C(CSc1nc(-c2ccccc2Cl)n[nH]1)c1ccc(O)c(O)c1	5636997	WJSDXVCIEJFLPM-UHFFFAOYSA-N	361.810	3.511	10	50	FHCA	
COc1ccc(/C=C2/C=C(c3ccc(OC)c(OC)c3)OC2=O)cc1OC	15163142	YBLQWSNWASKHJP-DHDCSXOGSA-N	368.385	3.702	10	50	FHCA	
O=S(=O)(Nc1ccc(O)c(Br)c1)c1ccc(Cl)cc1	762987	QKOJOSJRCLQDAW-UHFFFAOYSA-N	362.632	3.609	10	50	FHCA	
COc1cc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)ccc1O	13689071	OCWCCBHCFFOBPI-NVNXTCNLSA-N	361.419	3.946	10	50	FHCA	
Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)c2ccc(N3CCCC3)cc2)c1	65362425	QTAJNNGZAGWZCC-KRWDZBQOSA-N	358.507	3.943	10	50	FHCA	
CN(C)c1ccc(CN2CC[C@]23CCCN(C(=O)OC(C)(C)C)C3)cc1	252509989	YZOIKHHUKZLFSW-NRFANRHFSA-N	359.514	3.728	10	50	FHCA	
O=C1CCC[C@@H]1c1cc(NS(=O)(=O)c2ccc(Cl)cc2)ccc1O	5048433	XYELBVKFSZKFGH-CQSZACIVSA-N	365.838	3.683	10	50	FHCA	
CC(=O)N1N=C(c2ccccc2O)C[C@H]1c1ccc(Br)cc1	1273623	WKODMFSPVUOZAR-INIZCTEOSA-N	359.223	3.852	10	50	FHCA	
Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3c(C)[nH]c4ccccc34)C2=O)c1	1213609	CJAMDTCIPYUWSR-WOJGMQOQSA-N	373.412	3.760	10	50	FHCA	
Cc1ccccc1/C=C1/C(=N)N2N=C(Cc3ccccc3)SC2=NC1=O	3891051	SYKVRSVNFATJFW-MWSJVPHRSA-N	360.442	3.857	10	50	FHCA	
CC1(C)[C@H]2CC[C@@]1(C(=O)Nc1cc(C(F)(F)F)ccc1Cl)C(=O)C2=O	100198371	CRTWWWQUUFRGDT-FVMDXXJSSA-N	373.758	3.872	10	50	FHCA	
O=C1N=C(O)/C(=C\c2ccc(Cl)cc2)C(=O)N1c1ccc([N+](=O)[O-])cc1	4819498	PKOZJOLYJKPKOL-NTEUORMPSA-N	371.736	3.755	10	50	FHCA	
CC(C)c1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(F)cc3)C2=O)cc1	5061532	XGUXIDPONDOCQT-BOPFTXTBSA-N	352.365	3.616	10	50	FHCA	
O=C(O)CCN1C(=O)/C(=C/c2ccc(Cl)c(Cl)c2)SC1=S	2824659	ZUPWWCFFFPOUJN-POHAHGRESA-N	362.259	3.669	10	50	FHCA	
COc1cccc(-n2c(C)cc(C(=O)CSc3nnc(N)s3)c2C)c1	10231447	MQJBJHMVNLYPBG-UHFFFAOYSA-N	374.491	3.511	10	50	FHCA	
CC(=O)c1ccc(N2CCN(C/C=C/c3ccc(N(C)C)cc3)CC2)cc1	12380100	SWQTVMMDZAQMCE-SNAWJCMRSA-N	363.505	3.791	10	50	FHCA	
CCOc1ccc(Cl)cc1/C=C1\C(=N)N2N=C(CC)SC2=NC1=O	15799175	ALLXLSFUPJBGNR-PKNOWDFQSA-N	362.842	3.768	10	50	FHCA	
C[C@@H]1[C@@H](c2ccc(N(C)C)cc2)N[C@@H](c2ccc(N(C)C)cc2)[C@@H](C)[C@@H]1O	248063667	QTSVDXZTCFEZTA-ORDITMOKSA-N	367.537	3.837	10	50	FHCA	
CCOc1cccc(CN[C@H]2CCCN(Cc3cccc(OC)c3)C2)c1O	20515635	RLEBJTSEOAWJJS-IBGZPJMESA-N	370.493	3.554	10	50	FHCA	
COc1ccc(-c2ccc(CCC(=O)O)n2-c2ccc(C(=O)O)cc2)cc1	4151202	VWAMZCOBWIBCOA-UHFFFAOYSA-N	365.385	3.868	10	50	FHCA	biogenic
CCc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1	1208233	SNESXJKTMJGOCU-LFIBNONCSA-N	354.793	3.569	10	50	FHCA	
Cc1noc(C)c1CCCNC1CCN(c2ccc3c(c2)CCC3)CC1	1506401174	MSHJMFNLABOKPE-UHFFFAOYSA-N	353.510	3.971	10	50	FHCA	
COc1ccc(OC)c(C2=C/C(=C/c3ccc(N(C)C)cc3)C(=O)O2)c1	1161735	KVHMRQYMTBUJSY-PTNGSMBKSA-N	351.402	3.751	10	50	FHCA	
O=S(=O)(O)c1ccc(O)c(N=Nc2ccc3c(O)cccc3c2O)c1	257347407	HETKNRGJVSOOEF-UHFFFAOYSA-N	360.347	3.619	10	50	FHCA	
CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cc2cc(F)ccc2s1	1875260765	BJPKBOQCVJVQGL-UHFFFAOYSA-N	365.407	3.749	10	50	FHCA	
CC1=NN(c2ccc(C)cc2)C(=O)/C1=C\Nc1ccc(C)cc1[N+](=O)[O-]	100148542	GYKCXXOHMUPLKD-WJDWOHSUSA-N	350.378	3.930	10	50	FHCA	
Cc1ncsc1CCC(=O)NCc1ccc(N2CCC[C@@H](C)C2)cc1	82134010	PYEUJBFBLNULGP-OAHLLOKOSA-N	357.523	3.937	10	50	FHCA	
Cc1ccc(-n2c(C)cc(/C=C3/C(=O)N(C)C(=O)N=C3O)c2C)cc1C	1176549	ZLWLGDPVSRFLKF-LICLKQGHSA-N	351.406	3.643	10	50	FHCA	aggregator
Cc1cc(C)c(N2C(=O)NC(=O)/C(=C\c3ccccc3Cl)C2=O)c(C)c1	1228533	YSGHALOWRPRNEJ-XNTDXEJSSA-N	368.820	3.932	10	50	FHCA	
COc1ccc(N2CCOCC2)c(NC(=O)c2cccc3ccccc23)c1	6672158	CBZHKXNTKPCGOG-UHFFFAOYSA-N	362.429	3.937	10	50	FHCA	
COc1ccc(O)c([C@H](C)NCc2cc(OC)c(OC)cc2SC)c1	328595059	JQDQIAQDMARZLC-LBPRGKRZSA-N	363.479	3.991	10	50	FHCA	
O=C(O)c1ccc2c(c1)C(=O)N(c1ccc(Oc3ccccc3)cc1)C2=O	629812	QTHWHQRIDHRQNT-UHFFFAOYSA-N	359.337	3.978	10	50	FHCA	
CCOc1ccc(/C=C2\SC(=S)N(CC(C)C)C2=O)cc1OC	15011080	HSJKSIXSZRTYSR-DHDCSXOGSA-N	351.493	3.951	10	50	FHCA	
CN1CCN(C(=O)/C=C2/c3ccccc3CSc3sccc32)CC1	211138084	SJAMKFQZOQQNKX-ATVHPVEESA-N	356.516	3.560	10	50	FHCA	
COc1ccccc1[C@@H](NC(=O)C(C)C)c1ccc2cccnc2c1O	855784	LKTAHGUJCBIECB-LJQANCHMSA-N	350.418	3.811	10	50	FHCA	
CCN(Cc1ccccc1)C(=O)C1CCN(Cc2ccccc2O)CC1	2828212	SFHBUOLLULJPGV-UHFFFAOYSA-N	352.478	3.653	10	50	FHCA	
COc1ccc(N2CCN(C(=O)CCSc3ccccc3)CC2)cc1	6368896	ASXZVDIXQKHCHN-UHFFFAOYSA-N	356.491	3.526	10	50	FHCA	
COc1cc(N2Cc3ccccc3C2)ccc1/C=C1\SC(=S)NC1=O	15799335	KZJQFTHPZHPSPK-IUXPMGMMSA-N	368.483	3.704	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C\Nc1nnc(-c2ccccc2)s1	100501317	AYYSWTMPRCWCTK-VBKFSLOCSA-N	361.430	3.924	10	50	FHCA	
Cc1c(Cl)cccc1N1C(=O)/C(=C/c2cccs2)C(=O)NC1=S	1126912	XYRQEIIXJLKCTK-DHZHZOJOSA-N	362.863	3.541	10	50	FHCA	
Cc1ccc(C(=O)NN2C(=O)/C(=C\c3cccs3)SC2=S)cc1	5682578	IQYUIUSEKZADRY-UKTHLTGXSA-N	360.485	3.603	10	50	FHCA	
Cc1[nH]c2ccccc2c1/C=C1\C(=N)N2N=C(C(C)C)SC2=NC1=O	19799201	SQQAVIKTEUFIMR-OTXQKAJQSA-N	351.435	3.751	10	50	FHCA	
COc1ccc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)c(O)c1	23282074	RMRWBLJJIDINCX-UHFFFAOYSA-N	366.383	3.742	10	50	FHCA	
CCOc1cccc(CN2CCC(C(=O)NC3CCCCCC3)CC2)c1O	22241668	DHEPMQBIFNPEMZ-UHFFFAOYSA-N	374.525	3.842	10	50	FHCA	
Cc1cccc(N2NC(=O)/C(=C/c3ccc(-c4ccccc4F)o3)C2=O)c1	4470683	BMWSFCOIWKFNTM-ATVHPVEESA-N	362.360	3.856	10	50	FHCA	
COc1ccc(N2CCN(C(=O)Nc3ccc(Cl)cc3F)CC2)cc1	20249041	SKVNQGNSIDTDTC-UHFFFAOYSA-N	363.820	3.842	10	50	FHCA	
C[C@@H](c1ccon1)N(C)Cc1cc(-c2ccc3c(c2)OCO3)ccc1O	823653333	NVIXEDKWFBORRM-ZDUSSCGKSA-N	352.390	3.969	10	50	FHCA	
CCN(CC)C(=O)CCCN1C(=O)/C(=C/c2ccccc2)SC1=S	975281	JGDMWZPEEYXYMK-SQFISAMPSA-N	362.520	3.536	10	50	FHCA	
CC(=O)N1N=C(c2ccccc2O)C[C@@H]1c1ccc(Br)cc1	1273622	WKODMFSPVUOZAR-MRXNPFEDSA-N	359.223	3.852	10	50	FHCA	
COCCN(Cc1ccncc1)C(=O)c1cc(C)n(-c2ccccc2)c1C	215736936	FUMCLNNMPXXKSQ-UHFFFAOYSA-N	363.461	3.778	10	50	FHCA	
CCOC(=O)C(=CNc1ccc(Nc2ccccc2)cc1)C(=O)OCC	2949300	RFLFKOXVZYYEPT-UHFFFAOYSA-N	354.406	3.852	10	50	FHCA	
O=c1cc2oc3cc(O)c(O)cc3c(-c3ccccc3[N+](=O)[O-])c-2cc1O	4016936	ZULBKXYQNMBEJG-UHFFFAOYSA-N	365.297	3.590	10	50	FHCA	
CCN(CC)C(=O)COc1ccc2c(oc(=O)c3cc(OC)ccc32)c1C	780105	RDVLTRZYIHCVOE-UHFFFAOYSA-N	369.417	3.510	10	50	FHCA	
CCOC(=O)C1=NN(c2ccccc2)C(=O)/C1=C\C1=CC[C@H]2C[C@H]1C2(C)C	254823344	FJPIKMNDLIKORX-KTMFNDIVSA-N	364.445	3.871	10	50	FHCA	
NC(=O)[C@@H]1CCCN(CCC=C2c3ccccc3CCc3ccccc32)C1	140980365	BNJRGBGMOJJNOQ-HXUWFJFHSA-N	360.501	3.804	10	50	FHCA	
CCn1c(C)cc(/C=C2\NC(=O)N(Cc3ccc(Cl)cc3)C2=O)c1C	12731623	BHGFKQBXKQVOKX-YVLHZVERSA-N	357.841	3.871	10	50	FHCA	aggregator
N=C1/C(=C/c2cccs2)C(=O)N=C2SC(Cc3ccccc3)=NN12	1179272	WTUDKENLUMVKFX-JADYNCEHSA-N	352.444	3.610	10	50	FHCA	
O=C1/C(=C/c2cccs2)SC(=S)N1Cc1ccc2c(c1)OCO2	1160428	JCCRONHGEKYXOT-AUWJEWJLSA-N	361.469	3.878	10	50	FHCA	
COc1ccccc1N1C(=O)/C(=C/c2ccc(C(=O)O)cc2)SC1=S	2834237	YYZYXABBFPZMGA-GDNBJRDFSA-N	371.439	3.799	10	50	FHCA	
COC[C@H](NC1CCN(c2ccc3c(c2)CCC3)CC1)c1ccccn1	1506407888	LVIDNUXSWOTCOU-QFIPXVFZSA-N	351.494	3.516	10	50	FHCA	
CN1C(=O)N=C(O)/C(=C/c2cn(Cc3ccccc3)c3ccccc23)C1=O	9015886	DIVBRVULNGTEDM-BOPFTXTBSA-N	359.385	3.622	10	50	FHCA	
CCn1ccc2c([C@@H]3CC(=O)NCc4nc5ccc(C)cn5c43)cccc21	65403421	WBZSQPGXPPQIDI-KRWDZBQOSA-N	358.445	3.769	10	50	FHCA	
O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1c1cccc(O)c1	1208410	HTJOXTOQNBAYGO-ZSOIEALJSA-N	358.400	3.706	10	50	FHCA	
COc1cccc(C(=O)[C@@H]2CCCN(Cc3ccc(OC)cc3O)C2)c1	12595037	REKMWRWPKPTDFJ-QGZVFWFLSA-N	355.434	3.504	10	50	FHCA	
O=C1/C(=C/c2ccc3c(c2)OCO3)SC(=S)N1c1ccc(F)cc1	1212894	CPWDTLQPFVCQPM-NVNXTCNLSA-N	359.403	3.960	10	50	FHCA	
CC(C)[C@@H](C(=O)O)N1C(=O)/C(=C/c2ccccc2Cl)SC1=S	2571702	KGXHVHSLPHBMDE-RDQDRAATSA-N	355.868	3.650	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3csc(C(C)C)n3)[C@@H](C)C2)cc1	72406831	YPTNWTVZXNOIGR-AWEZNQCLSA-N	359.495	3.626	10	50	FHCA	
O=C1NC(=S)S/C1=C/c1cccc(OCc2ccccc2[N+](=O)[O-])c1	223208289	ZCJZWTYZYREFKO-OQLLNIDSSA-N	372.427	3.663	10	50	FHCA	
CN(CCc1ccccn1)Cc1cc(-c2ccc3c(c2)OCO3)ccc1O	12149387	PIGQJEQUWOAZJT-UHFFFAOYSA-N	362.429	3.857	10	50	FHCA	
O=C1NC(=S)S/C1=C\c1ccc(-c2cc(C(=O)O)ccc2Cl)o1	12428459	KGMMIKDTDKZXDL-SDQBBNPISA-N	365.819	3.787	10	50	FHCA	
COc1ccc(/C=C2/C=C(c3cc(OC)ccc3OC)OC2=O)c(OC)c1	843812	BMQCAVVQFHEOJJ-ZROIWOOFSA-N	368.385	3.702	10	50	FHCA	
COc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1O	15011470	LXEHYFPFHDMAHZ-MHWRWJLKSA-N	357.456	3.802	10	50	FHCA	
CC(C)CCCN1C(=O)NC(=O)/C(=C\c2ccc(Cl)cc2Cl)C1=O	756225	KGYIATSZHJSOKK-MDWZMJQESA-N	369.248	3.891	10	50	FHCA	
COc1cccc([C@H](C)N[C@@H](c2ccccc2F)c2nccn2C)c1O	846137225	CIDPIMANHVWWER-UGSOOPFHSA-N	355.413	3.714	10	50	FHCA	
COc1cc(/C=C2\SC(=S)N(C)C2=O)ccc1OCCC(C)C	13800679	AJCBATULKFTFHX-GDNBJRDFSA-N	351.493	3.951	10	50	FHCA	
Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\SC(=S)N(C)C2=O)o1	15219469	NWGDNZHZWDQIFM-ZSOIEALJSA-N	360.416	3.994	10	50	FHCA	
COc1ccc(CC(=O)NCc2ccc(N3CCCCC3)cc2)cc1C	72446632	CJUYADFMNQYUKA-UHFFFAOYSA-N	352.478	3.853	10	50	FHCA	
CC1(C)[C@]2(C)CC[C@@]1(C(=O)Nc1ccc(SC(F)F)cc1)C(=O)C2=O	2207922	WCBNEJJRKZLWEM-MSOLQXFVSA-N	367.417	3.904	10	50	FHCA	
CC1=NN(c2ccccc2Cl)C(=O)/C1=C\c1ccccc1OCC(=O)O	13914567	AAQWNEYVTCIJCO-UVTDQMKNSA-N	370.792	3.610	10	50	FHCA	
O=C1C(c2ccccc2)=S=C2N=C(c3ccccc3)c3ccccc3N12	334157882	NHMRPLCMDQBNSJ-UHFFFAOYSA-N	354.434	3.926	10	50	FHCA	
Cc1cc(/C=C2/NC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccccn1	1161664	UDLDPZFBIHXWPN-QGOAFFKASA-N	358.401	3.586	10	50	FHCA	
CCn1nc(C)c(CNC2CCN(c3ccc4c(c3)CCC4)CC2)c1C	1506413738	UQGPSJNYWVHEHU-UHFFFAOYSA-N	352.526	3.767	10	50	FHCA	
Cc1cc(NS(=O)(=O)c2ccc(Br)cc2)c(C)cc1O	2815469	LPXXYKULHQGFFF-UHFFFAOYSA-N	356.241	3.572	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cccc(OC2CSC2)c1	100147894	VMAVTLARQJQLRL-YBFXNURJSA-N	350.443	3.987	10	50	FHCA	
Cc1cc(C(=O)N[C@@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1ccc(F)cc1	1875354398	GKHACDOBGVSMCU-NVXWUHKLSA-N	372.440	3.997	10	50	FHCA	
CN(C)c1ccc(/C=C/C=C2\C(=O)N(c3ccccc3)C(=O)N=C2O)cc1	1202780	WSBFTODMEZTVBC-WNQIWMROSA-N	361.401	3.816	10	50	FHCA	
Cn1cc(C(=O)N2C[C@H](C(C)(C)C)c3ccccc32)c([C@H]2CCCNC2)n1	333320983	UMONSPUSPUDGIM-YJBOKZPZSA-N	366.509	3.677	10	50	FHCA	
CCOC(=O)[C@@H](C)Oc1ccc2c(-c3ccc(OC)cc3)cc(=O)oc2c1	1170441	OETZZXPGZYTRSU-CYBMUJFWSA-N	368.385	3.799	10	50	FHCA	biogenic
Cc1cccc(N2CCN(C3=NC(=O)/C(=C\c4cccs4)S3)CC2)c1	4754576	JQDQNJXOOTWGLN-GHRIWEEISA-N	369.515	3.849	10	50	FHCA	
COc1ccc2c(c1)C1=NN(C(C)=O)[C@@H](c3ccc(N(C)C)cc3)[C@H]1CC2	984340	DSMFEJUJISYLBI-UGKGYDQZSA-N	363.461	3.631	10	50	FHCA	
C[C@H](NS(=O)(=O)c1ccc(F)cc1)c1ccc(N2CCCCC2)cc1	71375733	QWQSLRRFCRXQPE-HNNXBMFYSA-N	362.470	3.856	10	50	FHCA	
CCOC(=O)c1ccc(-n2c(C)cc(/C=C3\SC(=O)NC3=O)c2C)cc1	15723600	SBRHXUZVAYQNAS-YBEGLDIGSA-N	370.430	3.595	10	50	FHCA	
COc1cccc(-n2c(C)cc(C(=O)O[C@@H](C)c3nc(C)no3)c2C)c1	170602195	KLIFCSNBIILQEA-ZDUSSCGKSA-N	355.394	3.712	10	50	FHCA	
COc1cc(/C=C2\SC(=S)N(c3ccc(F)cc3)C2=O)ccc1O	13617954	QMOJTGWRHCRXAU-DHDCSXOGSA-N	361.419	3.946	10	50	FHCA	
S=C(NCc1ccccn1)Nc1ccc(Br)cc1Cl	37867468	GQOJNANEHBJQSV-UHFFFAOYSA-N	356.676	3.984	10	50	FHCA	
COc1ccc(C(=O)[C@H]2CCCN(Cc3ccccc3O)C2)c(OC)c1	12701257	OOTDKQQRWIQFBH-INIZCTEOSA-N	355.434	3.504	10	50	FHCA	
Cc1ccc(N2C(=O)NC(=O)/C(=C/C=C/c3ccccc3)C2=O)cc1Cl	15013100	PCFVJWZLYSNAGT-FJGPGAONSA-N	366.804	3.871	10	50	FHCA	
O=C1C(=Cc2ccc[nH]2)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1	1147658	LXZYTZQGIXLDFU-UHFFFAOYSA-N	373.437	3.763	10	50	FHCA	
COc1cccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)SC2=S)c1	1205373	PTCMUIDDZCXFLR-PXNMLYILSA-N	371.439	3.830	10	50	FHCA	
c1ccc(-c2cnc(SCc3nncs3)n2C[C@H]2CCCO2)cc1	916534775	XUUWINUNXIAAFV-CQSZACIVSA-N	358.492	3.873	10	50	FHCA	
COc1cc(/C=C2\SC(=S)NC2=O)ccc1OCc1ccccc1	12419466	PNLIGOAITMKOBJ-YBEGLDIGSA-N	357.456	3.763	10	50	FHCA	
CCn1ccc2c([C@H]3CC(=O)NCc4nc5ccc(C)cn5c43)cccc21	65403422	WBZSQPGXPPQIDI-QGZVFWFLSA-N	358.445	3.769	10	50	FHCA	
O=C(O)CCN1C(=O)/C(=C/c2c(Cl)cccc2Cl)SC1=S	966936	ZHHOJDLWKZTHKF-POHAHGRESA-N	362.259	3.669	10	50	FHCA	
CCc1cc2c(=O)c(OC3=CC[C@@H](F)C=C3)c(C)oc2c(CN(C)C)c1O	4756008	PRQJWRQTUFPLSW-AWEZNQCLSA-N	373.424	3.992	10	50	FHCA	
CCn1c(C)cc(/C=C2\NC(=O)N(Cc3ccccc3Cl)C2=O)c1C	14009853	KQSBGDXCZXJRDB-YVLHZVERSA-N	357.841	3.871	10	50	FHCA	
O=C(O)c1ccc(/C=C2\SC(=S)N(c3ccccc3F)C2=O)cc1	1160543	QTXNFWOBONZVGT-ZROIWOOFSA-N	359.403	3.930	10	50	FHCA	
Cc1cc(C)cc(N2C(=O)NC(=O)/C(=C\c3ccc(Cl)cc3)C2=O)c1	1205084	WNRZKMSQCSKVAL-MHWRWJLKSA-N	354.793	3.623	10	50	FHCA	
O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc2c3c(cccc13)CC2	5060537	IWMKIGYWGYFFMA-UYRXBGFRSA-N	368.392	3.605	10	50	FHCA	
COc1ccc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)cc1O	13602638	HZHYZDIHRZUERA-NVNXTCNLSA-N	361.419	3.946	10	50	FHCA	
O=C1/C(=C/c2ccccc2Cl)SC(=S)N1CN1CCCCC1	334162907	GWFZQQVWTHMMOR-UVTDQMKNSA-N	352.912	3.985	10	50	FHCA	
COc1ccc([C@H](NC(C)=O)c2c(O)ccc3ccccc23)cc1OC	1197079	IIDLZHSTJAXEIU-NRFANRHFSA-N	351.402	3.788	10	50	FHCA	
CCOc1ccccc1/C=C1\SC(=S)N(Cc2cccnc2)C1=O	13896522	XLHIPOGILMEYBP-YBEGLDIGSA-N	356.472	3.882	10	50	FHCA	
CCN(CC)c1ccc(CN2CCN(c3ccccc3OC)CC2)cc1	55292121	ICBYBOAKIFQBAU-UHFFFAOYSA-N	353.510	3.864	10	50	FHCA	
Cc1noc(C)c1[C@H]1CCCN1C1CCN(c2ccc3c(c2)OCO3)CC1	65498559	DOGHWHKTGIJSKV-GOSISDBHSA-N	369.465	3.826	10	50	FHCA	
COc1ccc(N2CCN(C(=O)Nc3ccccc3SC)CC2)cc1	43319533	QHLCIOGYPBKCFA-UHFFFAOYSA-N	357.479	3.771	10	50	FHCA	
CCN1C(=O)/C(=C/c2ccc(OC(=O)c3ccco3)cc2)SC1=S	1122485	OLMLWSLCQSQRJW-UVTDQMKNSA-N	359.428	3.720	10	50	FHCA	
C[C@H]1CN(Cc2c(O)ccc3c(-c4ccccc4)cc(=O)oc23)C[C@@H](C)O1	13402142	WFVKUPXLIMZXQM-GASCZTMLSA-N	365.429	3.775	10	50	FHCA	
O=C1NC(=O)N(c2cccc3ccccc23)C(=O)/C1=C\c1ccc(F)cc1	16309465	CPJLEXXPSVXDOZ-ATVHPVEESA-N	360.344	3.645	10	50	FHCA	
CC(C)c1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)nn1C(C)(C)C	170600494	ZUDIRWCABDWLIL-UHFFFAOYSA-N	360.477	3.897	10	50	FHCA	
COc1cccc([C@@H](C)N[C@@H](c2ccccc2F)c2nccn2C)c1O	846137220	CIDPIMANHVWWER-ACJLOTCBSA-N	355.413	3.714	10	50	FHCA	
COc1ccc(CN2C(=O)/C(=C/c3cccc(O)c3)SC2=S)cc1	1164270	ONPALLLKYYWVDY-YBEGLDIGSA-N	357.456	3.802	10	50	FHCA	
COc1c(Cl)cc(Br)cc1/C=C1\SC(=S)NC1=O	15010474	SXBFOIHATASFSA-BAQGIRSFSA-N	364.673	3.600	10	50	FHCA	
Cc1nc(-c2ccco2)ccc1C(=O)N1CCOc2cc(N(C)C)ccc21	170643815	NBLHWFUKVAUHEZ-UHFFFAOYSA-N	363.417	3.755	10	50	FHCA	
CC(C)(C)NC(=O)CCCN1C(=O)/C(=C\c2cccs2)SC1=S	4746562	SPOZXHOISZMHNT-ZRDIBKRKSA-N	368.549	3.644	10	50	FHCA	
CCn1c(C)cc(/C=C2\C(=O)N=C(O)N(c3cccc(Cl)c3)C2=O)c1C	1880842	HETRWHOKKMXVCO-CXUHLZMHSA-N	371.824	3.649	10	50	FHCA	
CC1=NN(c2nc3ccccc3s2)C(=O)/C1=C(/C)NCCCOC(C)C	100152678	MCEMFLIFEBHVOS-LGMDPLHJSA-N	372.494	3.698	10	50	FHCA	
O=S(=O)(NCc1ccc(N2CCCC2)cc1)c1ccc2ccccc2c1	10113626	QZXPTSPTFNHOTF-UHFFFAOYSA-N	366.486	3.919	10	50	FHCA	
CCOC(=O)C1=C(C)N(c2ccc(OCC)cc2)C(=O)/C1=C\c1ccco1	4169903	KJCRZHOBFITEAG-AQTBWJFISA-N	367.401	3.946	10	50	FHCA	
Oc1ccc(-c2cnccn2)cc1CN1CCc2c([nH]c3ccccc23)C1	12080225	WBJDTZGCGIQVSN-UHFFFAOYSA-N	356.429	3.889	10	50	FHCA	
CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(O)cc1	16247904	ZQJLDPNCEGVZRN-UYRXBGFRSA-N	363.413	3.968	10	50	FHCA	
O=C1/C(=C/c2cccc([N+](=O)[O-])c2)SC(=S)N1c1ccc(O)cc1	1229690	PJEVLTGYBCGWEP-ZROIWOOFSA-N	358.400	3.706	10	50	FHCA	
Cc1ccccc1N1C(=O)/C(=C2/C(=O)Nc3ccccc32)SC1=S	1068598	WLKOBVYXKTUTEW-PFONDFGASA-N	352.440	3.723	10	50	FHCA	
CC1=NN(c2ccccc2)C(=S)/C1=C\Nc1ccc([N+](=O)[O-])cc1O	13774493	MCLFFRRUMQGNPP-UVTDQMKNSA-N	354.391	3.820	10	50	FHCA	
CC1(C)OC(=O)C(=S(Cc2ccccc2)Cc2ccccc2)C(=O)O1	4566226	AUGREAXEHJFQFF-UHFFFAOYSA-N	356.443	3.664	10	50	FHCA	
COc1ccc(/C=C2\SC(=S)N(Cc3ccco3)C2=O)cc1OC	13739257	AGXXUQBGXMHLFB-DHDCSXOGSA-N	361.444	3.698	10	50	FHCA	
CCOC(=O)c1ccc(N2C(=O)/C(=C\c3cccnc3)SC2=S)cc1	4461474	SLEMQNUPECRUFZ-XNTDXEJSSA-N	370.455	3.664	10	50	FHCA	
CCC[C@H](C(=O)O)N1C(=O)/C(=C/c2c[nH]c3ccccc23)SC1=S	2700212	NWQSFOUKECDTIE-HRYODUOUSA-N	360.460	3.622	10	50	FHCA	biogenic
C[C@H](N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)c1ccccc1O	783520792	ZPNSCVQVTCNMCQ-GXTWGEPZSA-N	364.367	3.867	10	50	FHCA	
O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccccc1	1174300	JHOLPHMMXGBXHS-XYOKQWHBSA-N	361.184	3.660	10	50	FHCA	
CCc1cc2c(=O)c(OC3=CC[C@H](F)C=C3)c(C)oc2c(CN(C)C)c1O	4756007	PRQJWRQTUFPLSW-CQSZACIVSA-N	373.424	3.992	10	50	FHCA	
COc1cc(-c2nc(CN(C)c3ccc4c(c3)OCO4)cs2)ccc1O	121435580	NDARKWYQPSAECC-UHFFFAOYSA-N	370.430	3.889	10	50	FHCA	
CCCOC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CC[C@H](CC)C2	5952050	GJQPHNWDOYPKTM-NSHDSACASA-N	367.467	3.633	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C/c3ccc(O)c(OC)c3)SC2=S)cc1	1089934	DMRZXGVZZLWXMJ-YBEGLDIGSA-N	373.455	3.815	10	50	FHCA	
CCSc1nnc2c(n1)O[C@@H](c1ccc(O)c(O)c1)Nc1ccccc1-2	845749	KCTGAGJZSNWGFC-INIZCTEOSA-N	368.418	3.565	10	50	FHCA	
CCn1cc(/C=C2\C(=O)N=C(O)N(c3ccccc3)C2=O)c2ccccc21	1869670	DSGBXFGEOQFETP-SFQUDFHCSA-N	359.385	3.532	10	50	FHCA	
CC(=O)c1ccc(N=N/C(C(N)=O)=C2/NC(C)(C)Cc3ccccc32)cc1	254522231	ZXSRRUROLCGTBS-ASEVQSCHSA-N	362.433	3.751	10	50	FHCA	
COc1ccc(N2CCN(c3ncnc4sc(C)c(C)c34)CC2)cc1	1803379	IOVLULIBJHNJDH-UHFFFAOYSA-N	354.479	3.643	10	50	FHCA	
CCCCS(CCCC)=C1C(=O)NC(=O)N(c2ccc(C)cc2)C1=O	16662456	ULWBCSQDCANYMH-UHFFFAOYSA-N	362.495	3.619	10	50	FHCA	
CCc1ccc([C@@H]2c3nc[nH]c3CCN2Cc2ccc(N(C)C)cc2)nc1	72423253	PTVUXDWDHSACDN-JOCHJYFZSA-N	361.493	3.581	10	50	FHCA	
CC(=O)NC1=NC(=O)/C(=C/c2ccc(OCc3ccc(C)cc3)cc2)S1	1157382	GIBGVHOYXBAYPK-WQRHYEAKSA-N	366.442	3.680	10	50	FHCA	
O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C\c2ccccc2)SC1=S	6133311	VGIFXQDHKSESDU-XYGUXCPDSA-N	369.467	3.584	10	50	FHCA	
O=C(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2)N1CCOCC1	169617626	QYWQUZCAYKXECV-WOIUINJBSA-N	360.457	3.986	10	50	FHCA	
COc1ccc2c(c1)CC[C@@H]1C2=NN(C(C)=O)[C@@H]1c1ccc(N(C)C)cc1	4168128	ABCOZFPPGDRJAT-IFMALSPDSA-N	363.461	3.631	10	50	FHCA	
Oc1nc(CNC2CCN(c3ccc4c(c3)CCC4)CC2)nc2ccccc12	1506423399	WBICWXDZTOGTDK-UHFFFAOYSA-N	374.488	3.583	10	50	FHCA	
Cn1ccnc1[C@@H](NC1CCN(c2ccc3c(c2)CCC3)CC1)C1CC1	1506424581	BAIJDEKOXFEECI-NRFANRHFSA-N	350.510	3.619	10	50	FHCA	
Cn1cc(C(=O)N2C[C@@H](C(C)(C)C)c3ccccc32)c([C@@H]2CCCNC2)n1	333320980	UMONSPUSPUDGIM-CRAIPNDOSA-N	366.509	3.677	10	50	FHCA	
COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1cccs1	1183312	MNXOJYSKFPJVBK-BOPFTXTBSA-N	353.443	3.929	10	50	FHCA	
O=C1N=C(O)/C(=C\c2ccc(-c3cccc(C(F)(F)F)c3)o2)C(=O)N1	8972230	FNLHCBUWFQQBNG-UHFFFAOYSA-N	350.252	3.555	10	50	FHCA	
Cc1c(C(=O)N2CC[C@H](Oc3ccccc3)C2)n(C)c2ccc(F)cc12	426677748	AXJXZZXGJCLNRQ-KRWDZBQOSA-N	352.409	3.919	10	50	FHCA	
COCCN1C(=O)/C(=C/c2cc(Cl)c(O)c(Cl)c2)SC1=S	2946687	USTJJMCGHNYTMV-POHAHGRESA-N	364.275	3.547	10	50	FHCA	
Cc1cccc(N2C(=O)NC(=O)/C(=C/c3cccc4ccccc34)C2=O)c1	5061400	PJIBFZZCQSMDMB-UYRXBGFRSA-N	356.381	3.815	10	50	FHCA	
CCc1ccc(/C=C2\C(=O)N(Cc3ccco3)C(C)=C2C(=O)OC)cc1	16225570	DNCFEKIZMYJJAW-PDGQHHTCSA-N	351.402	3.715	10	50	FHCA	
COc1cccc(N2C(=O)/C(=C/c3ccccc3C(=O)O)SC2=S)c1	1220071	HOBFBLVXGPEOEK-DHDCSXOGSA-N	371.439	3.799	10	50	FHCA	
Cc1ccc(N2C(=O)NC(=O)/C(=C/c3ccc(C(F)(F)F)cc3)C2=O)cc1	4471414	LBEGDEHXSIFCSW-GDNBJRDFSA-N	374.318	3.680	10	50	FHCA	
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H](O)C[C@@H]1C1CCCCC1	1875263350	SCECZGCEBDZPAZ-LEWJYISDSA-N	371.525	3.512	10	50	FHCA	
COc1ccc(OC)c(/C=C2/C=C(c3cc(OC)ccc3OC)OC2=O)c1	13616753	PLLZQGXPDXFRBU-ZROIWOOFSA-N	368.385	3.702	10	50	FHCA	
C[C@H]1CN(C2=NC(=O)/C(=C/c3c(F)cccc3Cl)S2)C[C@@H](C)O1	13774829	GPBCXKZKMKDYAP-KPHBHHIASA-N	354.834	3.559	10	50	FHCA	
COc1cccc(N2C(=O)NC(=O)/C(=C/c3cccc4ccccc34)C2=O)c1	5043821	JDZTYRTVFFMKRX-UNOMPAQXSA-N	372.380	3.515	10	50	FHCA	
Cc1cc(C(=O)N[C@@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1ccccc1F	1875354828	QBGYFGSAVDPJLY-HZPDHXFCSA-N	372.440	3.997	10	50	FHCA	
CCN(CC)c1ccc(/C=C2\N=C(c3ccccc3)OC2=O)c(OC)c1	1135919	RUENDJQCOYRVLB-AQTBWJFISA-N	350.418	3.886	10	50	FHCA	
CCOc1ccc(C=C2C(=O)OC3(CCCC3)OC2=O)c2ccccc12	4865585	HOTQJXBJWRHMQA-UHFFFAOYSA-N	352.386	3.992	10	50	FHCA	
COc1ccc(/C=C2/C=C(c3ccc(OC)cc3OC)OC2=O)c(OC)c1	13616757	QBEDGBJOEUQSGB-ZROIWOOFSA-N	368.385	3.702	10	50	FHCA	
CN(C)c1ccc(-c2c3cc(O)c(=O)cc-3oc3cc(O)c(O)cc23)cc1	4822213	JLQIGMKUPIXLLP-UHFFFAOYSA-N	363.369	3.748	10	50	FHCA	in-vitro
O=C(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1)N2)N1CCOCC1	169617625	QYWQUZCAYKXECV-XQBPLPMBSA-N	360.457	3.986	10	50	FHCA	
COc1ccc([C@@H](NC(C)=O)c2cc(Cl)c3cccnc3c2O)cc1	869261	MTDGALZWYHDFPI-QGZVFWFLSA-N	356.809	3.828	10	50	FHCA	
Oc1ccccc1CN1C[C@@H](c2cccc(F)c2F)[C@@H]2[C@H]1C1CCN2CC1	95380880	SSCZQQFDIVJARL-MTNREXPMSA-N	370.443	3.733	10	50	FHCA	
Cc1cc(S(=O)(=O)Nc2ccc(O)cc2)c(C)cc1Br	776744278	GIIQAYXKNFIHRE-UHFFFAOYSA-N	356.241	3.572	10	50	FHCA	
COc1ccc(N2CCN(c3nc(C)nc4sccc34)[C@@H](C)C2)cc1	1704313080	MYAZUPYYVOPYIY-ZDUSSCGKSA-N	354.479	3.723	10	50	FHCA	
COc1ccc(C2=C/C(=C\c3ccc(OC)c([N+](=O)[O-])c3)C(=O)O2)cc1	5072983	WIJWSDXBBLEQJD-NTEUORMPSA-N	353.330	3.593	10	50	FHCA	
CCOC(=O)CC1(Cc2ccc(Cl)cc2)C(=O)c2ccccc2C1=O	1201824	XJUXNPMUHRMTBW-UHFFFAOYSA-N	356.805	3.901	10	50	FHCA	
O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1CCc1ccccc1	4508840	XLQYQTFWJRUMAB-GZTJUZNOSA-N	369.467	3.859	10	50	FHCA	
COc1ccc(OC)c(/C=C2/SC(=S)N(Cc3ccco3)C2=O)c1	1184606	TZZKIRMXMQSYQS-OQLLNIDSSA-N	361.444	3.698	10	50	FHCA	
O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)SC(=S)N1c1ccc(O)cc1	1229686	ZBOZCTFHHHZCLZ-ZROIWOOFSA-N	358.400	3.706	10	50	FHCA	
CCc1ccc(N2NC(=O)/C(=C/c3ccc(-c4ccccc4)o3)C2=O)cc1	4471907	NKLDKEUNSNSZPL-RGEXLXHISA-N	358.397	3.970	10	50	FHCA	
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C	2325809595	MPWHPNILXORUPV-SFHVURJKSA-N	369.465	3.509	10	50	FHCA	
CCOc1cc(/C=C2\SC(=S)N(Cc3ccco3)C2=O)ccc1O	15015232	HCZTWSRCGDCAQB-DHDCSXOGSA-N	361.444	3.785	10	50	FHCA	
CC(=O)c1ccc(/N=N/C(C(N)=O)=C2/NC(C)(C)Cc3ccccc32)cc1	100389717	ZXSRRUROLCGTBS-KEYVSXKFSA-N	362.433	3.751	10	50	FHCA	in-vitro
Cc1cc(C(=O)N[C@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1ccc(F)cc1	1875354399	GKHACDOBGVSMCU-RDJZCZTQSA-N	372.440	3.997	10	50	FHCA	
O=C1NC(=O)N(c2cccc(Cl)c2)C(=O)/C1=C\C=C\c1ccccc1	1183813	YRHCBLOEOXRQJT-MAHQCVNESA-N	352.777	3.563	10	50	FHCA	
COC(=O)C1=C(C)N(Cc2cccnc2)C(=O)/C1=C\c1cccc(Cl)c1	1196193	QWBSOKHYAHHXRE-YVLHZVERSA-N	368.820	3.608	10	50	FHCA	
COc1ccc(N2C(=O)/C(=C\C=C\c3ccco3)C(O)=NC2=S)cc1	17146413	KEBBVAUQERDWIL-RPGBBNPCSA-N	354.387	3.516	10	50	FHCA	
O=S(=O)(Nc1ccccc1Oc1ccccc1)c1cccc2nonc12	1033399	ACFCAINEFSXQMT-UHFFFAOYSA-N	367.386	3.816	10	50	FHCA	
CN(C)c1ccc(C(NC(=O)c2ccccc2)NC(=O)c2ccccc2)cc1	637657	KXAZNWRBOVPBTC-UHFFFAOYSA-N	373.456	3.611	10	50	FHCA	
[N-]=[N+]=NCCN(CC(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21	307528303	MLMPWBUAQAXGFT-UHFFFAOYSA-N	366.377	3.632	10	50	FHCA	
Cc1cc(C)cc(N2C(=O)/C(=C/c3ccc(C)s3)C(=O)NC2=S)c1	1135344	MJVIOZGNIKOXDN-OQLLNIDSSA-N	356.472	3.505	10	50	FHCA	
O=C(O)CN1C(=O)/C(=C\c2cccc(Oc3ccccc3)c2)SC1=S	966883	NJNBOILPWXEYGR-XNTDXEJSSA-N	371.439	3.765	10	50	FHCA	
O=C1N=C(O)/C(=C\C=C\c2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1	1192402	MTKNFDCKXYNLDE-KVDBUQHUSA-N	363.329	3.658	10	50	FHCA	
O=C1NC(=S)S/C1=C\c1cccc(OC(=O)c2ccc(F)cc2)c1	16247467	GCUCMQXNZFEJFP-ZROIWOOFSA-N	359.403	3.534	10	50	FHCA	
COc1ccc(N2CCN(C(=O)COc3ccccc3C(C)C)CC2)cc1	8028292	PXYYARVAHYUZBC-UHFFFAOYSA-N	368.477	3.546	10	50	FHCA	
O=C(O)c1ccc(-c2c3cn[nH]c3nc3c2oc2c(O)c(O)ccc23)cc1	217908469	UNEOJETYYXHFBN-UHFFFAOYSA-N	361.313	3.634	10	50	FHCA	biogenic
COc1ccc(N2CCN(c3cc(C)c4cccc(OC)c4n3)CC2)cc1	4982256	IJYCJXZKOOEHRH-UHFFFAOYSA-N	363.461	3.887	10	50	FHCA	
COc1ccc(N2CC3(CN(CCOc4cc(C)ccc4Cl)C3)C2)cc1	2356152952	JLOASJWGFCSISI-UHFFFAOYSA-N	372.896	3.858	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3ccc(Cl)cc3Cl)CC2)cc1	1147537	BQDZNOGHXSHBOF-UHFFFAOYSA-N	365.260	3.964	10	50	FHCA	
Cc1ccccc1NC(=O)c1ccc2c(c1O)C(=O)c1ccccc1C2=O	5044362	VTEFJVLOAAFXCX-UHFFFAOYSA-N	357.365	3.728	10	50	FHCA	
CCN(CC)c1ccc([C@@H]2[C@@H]3CCCC[C@@]3(O)CCN2C(=O)OC)cc1	2107611	BAPXFDGYOLEISY-QKNQBKEWSA-N	360.498	3.967	10	50	FHCA	biogenic
COc1ccc(C2=C/C(=C/c3cccc(OC)c3OC(C)=O)C(=O)O2)cc1	1207866	LTOIZHWIXLRXDI-WJDWOHSUSA-N	366.369	3.610	10	50	FHCA	
CCC(=O)N[C@H](c1ccc(C)cc1)c1cc([N+](=O)[O-])c2cccnc2c1O	4684866	SOOZZAWHFOKELH-GOSISDBHSA-N	365.389	3.773	10	50	FHCA	
CC(C)C(=O)N[C@H](c1ccc(N(C)C)cc1)c1ccc2cccnc2c1O	2484231	ZMPRXGIKEBLOJN-LJQANCHMSA-N	363.461	3.868	10	50	FHCA	
O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1c1ccc(O)cc1	1209989	IVOPSISUXWSCGK-ZROIWOOFSA-N	358.400	3.706	10	50	FHCA	
O=C(C[C@@H](NCc1ccccc1)c1ccccc1O)NCc1ccccc1	754632	DSSKCJOISIONHW-OAQYLSRUSA-N	360.457	3.930	10	50	FHCA	
Cc1cc(Br)c2c(c1)/C(=C1\C(=O)Nc3ccccc31)C(=O)N2C	32687709	AXQDWWDFSCGRIS-CCEZHUSRSA-N	369.218	3.597	10	50	FHCA	
Cc1noc([C@H](NCc2ccc(N3CCCCC3)cc2)C2CCOCC2)n1	328628756	OBCZYZNKHUIGKW-HXUWFJFHSA-N	370.497	3.626	10	50	FHCA	
CC(=O)NC1=NC(=O)/C(=C/c2ccccc2OCc2ccccc2F)S1	1137327	SRXOYZWOJDWGFR-YVLHZVERSA-N	370.405	3.511	10	50	FHCA	
C[C@@H]1CN(Cc2c(O)ccc3c(-c4ccccc4)cc(=O)oc23)C[C@@H](C)O1	19790393	WFVKUPXLIMZXQM-HUUCEWRRSA-N	365.429	3.775	10	50	FHCA	
Nc1ccc(N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)cc1	20246986	MXQXFOBHPKEZMC-UHFFFAOYSA-N	356.779	3.663	10	50	FHCA	
CC(C)c1ccc(/C=C2/C(=O)NC(=O)N(Cc3ccc(F)cc3)C2=O)cc1	22298802	IHYHOTTVORKUSR-WQRHYEAKSA-N	366.392	3.611	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C\c1c[nH]nc1-c1cccc([N+](=O)[O-])c1	12412822	YWVZXKHVSWSRFD-WQRHYEAKSA-N	373.372	3.791	10	50	FHCA	
CCOC(=O)C1=NN(c2ccccc2)C(=O)/C1=C\c1c[nH]c2ccccc12	13576929	KYTPUDIOWBXPDY-ATVHPVEESA-N	359.385	3.517	10	50	FHCA	
COc1cc(-c2c3cn[nH]c3nc3c2oc2cc(O)ccc23)cc(O)c1O	217713654	SKBIIADYBCFZEH-UHFFFAOYSA-N	363.329	3.650	10	50	FHCA	biogenic
COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1ccccc1F	631784	RYUDMUABHUAMRI-KAMYIIQDSA-N	355.340	3.842	10	50	FHCA	
Cc1cc(/C=C2/NC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccncc1	4688434	INJWVGOFIKURJC-CPNJWEJPSA-N	358.401	3.586	10	50	FHCA	
COc1cccc(/C=C2\SC(=S)N(CCCCCC(=O)O)C2=O)c1	13343099	HYLQGWNFXDFPBC-KAMYIIQDSA-N	365.476	3.541	10	50	FHCA	
CN(C)c1ccc(CN2CC[C@@]23CCCN(C(=O)OC(C)(C)C)C3)cc1	252509990	YZOIKHHUKZLFSW-OAQYLSRUSA-N	359.514	3.728	10	50	FHCA	
C[C@H]1CN(c2ccc(CNc3cc(N)ccc3[N+](=O)[O-])cc2F)C[C@@H](C)O1	170616250	NTFCFQWOXVKXOW-BETUJISGSA-N	374.416	3.542	10	50	FHCA	
CCc1cc2c(-c3ccccc3)cc(=O)oc2cc1O[C@@H](C)C(=O)OC	5554500	ZSLVWWHUXPQLCE-ZDUSSCGKSA-N	352.386	3.963	10	50	FHCA	
Cc1cccc(N2CCN(Cc3cc(-c4ncccn4)ccc3O)CC2)c1C	64024208	YSCZRXKIGAMXFQ-UHFFFAOYSA-N	374.488	3.788	10	50	FHCA	
Cc1cc(C(=O)N[C@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1ccccc1	1875338910	PXRVWFWIHDUNEO-SJORKVTESA-N	354.450	3.857	10	50	FHCA	
O=C1CC[C@@H]2CN(Cc3ccccc3O)CC[C@@H]2N1CC1CCCCC1	15067213	PZGZDPCMDPBSME-QUCCMNQESA-N	356.510	3.785	10	50	FHCA	
Cc1ccc(N2C(=O)/C(=C/c3cc(C)n(C)c3C)C(O)=NC2=S)cc1	8742833	UFPVYIUHTBRFCY-MHWRWJLKSA-N	353.447	3.622	10	50	FHCA	
Cc1cccc(CN2CCc3onc(-c4ccc5c(c4)OCO5)c3C2)c1O	67909195	SERAFXNPOFFDAV-UHFFFAOYSA-N	364.401	3.643	10	50	FHCA	
C[C@H](Cc1ccccn1)NC1CCN(c2ccc(OC(F)F)cc2)CC1	924904253	ABXDFMDHOXGZJM-OAHLLOKOSA-N	361.436	3.873	10	50	FHCA	
CC[C@H]1CCc2c(sc(NC(=O)CCC(=O)O)c2C(=O)OC(C)C)C1	5954117	AOYPCACRACGRSF-NSHDSACASA-N	367.467	3.632	10	50	FHCA	
COc1ccc(N2CCOCC2)c(NC(=O)c2ccc(C(C)C)cc2)c1	12382933	DACJUSRSCZTZJU-UHFFFAOYSA-N	354.450	3.908	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCC(=O)O)c(Cl)c1	100221940	JCUWDKHAHUMILI-OQLLNIDSSA-N	370.792	3.610	10	50	FHCA	
Oc1ccc(Br)cc1CN1CCN(C2CCCCC2)CC1	19361420	AEWLVDGIZRZXSP-UHFFFAOYSA-N	353.304	3.605	10	50	FHCA	
COc1ccc(O)c(CN2CCN(c3nc4ccccc4cc3C)CC2)c1	65525950	RGTPUJMELAIAPN-UHFFFAOYSA-N	363.461	3.580	10	50	FHCA	
CN1C(=O)/C(=C\c2cc(Br)cc(Cl)c2O)SC1=S	4509564	NQCSIVZUPOZGSJ-FPYGCLRLSA-N	364.673	3.639	10	50	FHCA	
CCN1C(=O)/C(=C\c2ccc(-c3ccc(C(=O)OC)cc3)o2)SC1=S	4837439	WYDZDMRLRNDVBI-XNTDXEJSSA-N	373.455	3.954	10	50	FHCA	
CCCCN(c1cc(OC)c(OC)c(OC)c1)C1C[C@@H]2CC[C@H](C1)N2C	5091607	AGZPPWNXHVQWTG-SJPCQFCGSA-N	362.514	3.944	10	50	FHCA	
C[C@@H](NS(=O)(=O)c1ccc(F)cc1)c1ccc(N2CCCCC2)cc1	71375735	QWQSLRRFCRXQPE-OAHLLOKOSA-N	362.470	3.856	10	50	FHCA	
N=C1/C(=C\c2cccs2)C(=O)N=C2SC(Cc3cccs3)=NN12	4917585	MLLSLHKIBVYOGN-ZQJZDCJSSA-N	358.473	3.671	10	50	FHCA	
Fc1cc(CNC[C@H]2CCO[C@@H]2c2ccccc2)ccc1N1CCOCC1	328642312	YKRSAQHZLGMPED-DENIHFKCSA-N	370.468	3.530	10	50	FHCA	
O=S(=O)(c1cc(Cl)cc(Cl)c1O)N1CC=C(c2ccccc2)C1	1875271214	CZERXNKFPIOTAI-UHFFFAOYSA-N	370.257	3.787	10	50	FHCA	
CC(=S)/C=C1\Sc2ccc(Cl)cc2N1CCCS(=O)(=O)O	2026227	VFBVESVFBNWFFS-QPEQYQDCSA-N	363.913	3.761	10	50	FHCA	
Cc1oc(C(=O)O)cc1COc1ccc2c3c(c(=O)oc2c1C)CCC3	1150438	JDVGXAWXFUODNG-UHFFFAOYSA-N	354.358	3.769	10	50	FHCA	biogenic
CO[C@@H]1CCC[C@]12CCCN(C1CCN(c3ccc4c(c3)OCO4)CC1)C2	1704300501	XXZQXPHINPLXPJ-FGZHOGPDSA-N	372.509	3.665	10	50	FHCA	
Cc1ccc(N2C(=O)/C(=C3/C(=O)Nc4ccccc43)SC2=S)cc1	1227022	ZGFOZDUZCNSPNC-PFONDFGASA-N	352.440	3.723	10	50	FHCA	
O=C1/C(=C/c2c(F)cccc2Cl)SC(=S)N1C[C@@H]1CCCO1	13590974	OETQYFVQDFZDDV-XSHGTHSTSA-N	357.859	3.859	10	50	FHCA	
CCCCOc1ccc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1	2862817	RXGOPSRZXAIDRD-UHFFFAOYSA-N	368.477	3.837	10	50	FHCA	
CCN1C(=O)/C(=C\c2cc(Br)ccc2OC)SC1=S	4567171	FWBDBNDHGCJFBY-YRNVUSSQSA-N	358.282	3.679	10	50	FHCA	
COC(=O)c1ccc(/C=C2\SC(=S)N(Nc3ccccc3)C2=O)cc1	16901401	AWFYPXQAYCTHGE-PTNGSMBKSA-N	370.455	3.702	10	50	FHCA	
O=C(O)c1ccc(/C=C2\SC(=S)N(Nc3ccccc3)C2=O)cc1	1221260	LTGJJOLOFIAMQW-UVTDQMKNSA-N	356.428	3.613	10	50	FHCA	
O=C(NN1C(=O)/C(=C\c2ccccc2)SC1=S)c1ccccc1Cl	1227962	WTFITOCUXDTJGD-GXDHUFHOSA-N	374.874	3.886	10	50	FHCA	
COc1ccc(CN2CCC/C(=C(/O)c3ccc(N(C)C)cc3)C2=O)cc1	575419722	HVQGKAHYNAKOCA-MRCUWXFGSA-N	366.461	3.853	10	50	FHCA	
CCOc1ccc(N2C(=O)N=C(O)/C(=C/C=C/c3ccco3)C2=O)cc1	17027728	LNIJUPJRTYUVOF-JLJGJNDSSA-N	352.346	3.741	10	50	FHCA	
Cc1cccc(C2=NN3C(=N)/C(=C\c4cccs4)C(=O)N=C3S2)c1	3854691	RFDJSKVDSSTBFK-WVXZETEUSA-N	352.444	3.724	10	50	FHCA	
CCOc1ccccc1/C=C1/C(=O)NN(c2ccc(C)c(Cl)c2)C1=O	15723284	VPRWBSVIISBJPN-GDNBJRDFSA-N	356.809	3.509	10	50	FHCA	
CN(C)c1ccc(/C=C2\N=C(c3ccccc3)OC2=O)cc1Br	884989	YDLUTYCGULASIC-PTNGSMBKSA-N	371.234	3.860	10	50	FHCA	
c1c2c(cc3c1OCO3)OCN(CCOC13CC4CC(CC(C4)C1)C3)C2	54991654	JJMLDSFDOODCIR-UHFFFAOYSA-N	357.450	3.553	10	50	FHCA	
Cc1cc(C(=O)N[C@@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1ccccc1	1875338908	PXRVWFWIHDUNEO-IAGOWNOFSA-N	354.450	3.857	10	50	FHCA	
COC(=O)C1=C(C)N(c2cccc(OC)c2)C(=O)/C1=C\c1ccc(F)cc1	1161867	QSCHTCDDBLZLNC-WQRHYEAKSA-N	367.376	3.712	10	50	FHCA	
COc1ccc(O)c(CN[C@H](C)c2cnn(-c3cccc(F)c3)c2C)c1	12373215	JUGLVCNPMOBOIT-CYBMUJFWSA-N	355.413	3.885	10	50	FHCA	
COc1cccc(N2CCN(C/C=C/c3ccc(N(C)C)cc3)CC2)c1	23280236	BCZHWBRVXNFEQL-AATRIKPKSA-N	351.494	3.597	10	50	FHCA	
O=C(CN1CCCCC1)N1N=C(c2ccccc2O)C[C@H]1c1cccs1	170612665	BMQXYFXKMKZNNK-KRWDZBQOSA-N	369.490	3.617	10	50	FHCA	
COC(=O)c1ccc(-n2c(C)cc(/C=C3\SC(=O)N(C)C3=O)c2C)cc1	13881639	UIMXNWMCTGLQLN-YBEGLDIGSA-N	370.430	3.547	10	50	FHCA	
COc1ccc(-c2c3cc(O)c(=O)cc-3oc3cc(O)c(O)cc23)cc1C	4902078	BJGZVMUPMRCZKW-UHFFFAOYSA-N	364.353	3.999	10	50	FHCA	
O=C(CN1C(=O)/C(=C/c2ccccc2)SC1=S)OC1CCCCC1	1228420	MHTBOVRGORABPF-PTNGSMBKSA-N	361.488	3.764	10	50	FHCA	
COc1ccc(N2CCN(Cc3ccc(Br)cc3)CC2)cc1	55543605	JGXWMRIPLRGDET-UHFFFAOYSA-N	361.283	3.780	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3ccn(C(C)(C)C)c3)[C@@H](C)C2)cc1	72433771	GVVPUYVAZHAKMI-INIZCTEOSA-N	355.482	3.603	10	50	FHCA	
COc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc(OC)c1O	13476834	ULFLIJAGZDBSQM-XNTDXEJSSA-N	373.455	3.815	10	50	FHCA	
CCN1C(=O)/C(=C2/C(=O)Nc3ccccc32)c2cc(Br)ccc21	13125464	SXUOTFQUWLCREH-FOCLMDBBSA-N	369.218	3.679	10	50	FHCA	
O=c1c(-c2ccc(Cl)cc2)coc2c(CN3CCOCC3)c(O)ccc12	19789590	VNGKNXZGGMTAFC-UHFFFAOYSA-N	371.820	3.651	10	50	FHCA	biogenic
COc1ccc(N2CCN(C(=O)c3ccc(CSC)o3)CC2(C)C)cc1	82138793	VPAMDDJIRSMMSS-UHFFFAOYSA-N	374.506	3.892	10	50	FHCA	
COc1ccc2c(c1)CCC1=C2NC(=S)N[C@@H]1c1ccc(N(C)C)cc1	13545902	NOYBEYGHQKYHRT-LJQANCHMSA-N	365.502	3.638	10	50	FHCA	
COc1cccc(O)c1CN1CCC[C@H](N(C)CCc2ccccc2)C1	20784140	GJWFMMSNZQJSRQ-IBGZPJMESA-N	354.494	3.540	10	50	FHCA	
Cc1ccccc1N1C(=O)/C(=C2/C(=O)N(C)c3ccccc32)SC1=S	2821141	UDVVZWKWYVVSOM-NXVVXOECSA-N	366.467	3.747	10	50	FHCA	
Cc1ccc(C)c(S(=O)(=O)N[C@H](C)c2ccc(N3CCCC3)cc2)c1	65362426	QTAJNNGZAGWZCC-QGZVFWFLSA-N	358.507	3.943	10	50	FHCA	
CN1C(=O)C(=Cc2ccccc2Oc2ccc(Cl)cc2)C(=O)N(C)C1=O	4050231	XFUGFPMGSHUQLB-UHFFFAOYSA-N	370.792	3.566	10	50	FHCA	
COc1ccccc1[C@@H](NC(C)=O)c1cc(Cl)c2cccnc2c1O	869259	VBZSJOLGJVSKSW-QGZVFWFLSA-N	356.809	3.828	10	50	FHCA	
O=C1c2ccccc2C(=O)C1(Nc1ccc2c(c1)OCCO2)c1ccccc1	1430514	GRKTWNGDQUGRCO-UHFFFAOYSA-N	371.392	3.844	10	50	FHCA	
C[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S	1190696	NYFNZROPRHZBME-DKLDRGHMSA-N	362.259	3.668	10	50	FHCA	
COc1cccc(O)c1CN1CCC[C@@H](N(C)CCc2ccccc2)C1	20784137	GJWFMMSNZQJSRQ-LJQANCHMSA-N	354.494	3.540	10	50	FHCA	
COc1ccc(-c2ccc(CCC(=O)O)n2-c2cccc(C(=O)O)c2)cc1	4151212	BGOIORQGWYPXBA-UHFFFAOYSA-N	365.385	3.868	10	50	FHCA	
C[C@H]1CN(c2ccc(CNc3cc(N)ccc3[N+](=O)[O-])cc2F)C[C@H](C)O1	170616251	NTFCFQWOXVKXOW-STQMWFEESA-N	374.416	3.542	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1ccc(F)cc1	797815	BDYCOHMYKNGDFW-PTNGSMBKSA-N	355.340	3.842	10	50	FHCA	
O=C(O)CCN1C(=O)/C(=C\c2c(Cl)cccc2Cl)SC1=S	1870944	ZHHOJDLWKZTHKF-UXBLZVDNSA-N	362.259	3.669	10	50	FHCA	
Cc1cc(C(=O)N(Cc2nccn2C)C(C)C)c(C)n1-c1ccccc1	215931617	AXHKHJITJUIMSO-UHFFFAOYSA-N	350.466	3.878	10	50	FHCA	
CCOC(=O)c1cc(/N=N/c2ccc(O)c(C(=O)OCC)c2)ccc1O	71770630	FHVNCRUYCNFXNW-FMQUCBEESA-N	358.350	3.867	10	50	FHCA	
Nc1ccc(Cn2cnc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1	71775338	NUBYKGDTMRXTPB-UHFFFAOYSA-N	360.339	3.785	10	50	FHCA	
COC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccc(C)cc1	13616127	LSEWUMDMAIMODU-HKWRFOASSA-N	361.441	3.910	10	50	FHCA	
C[C@H](c1ccon1)N(C)Cc1cc(-c2ccc3c(c2)OCO3)ccc1O	823653332	NVIXEDKWFBORRM-CYBMUJFWSA-N	352.390	3.969	10	50	FHCA	
CCCCC1=NN2C(=N)/C(=C/c3c[nH]c4ccccc34)C(=O)N=C2S1	4725339	LIAUXDITIXTKBZ-NXHHHXCLSA-N	351.435	3.977	10	50	FHCA	
Cc1ccc(N2C(=O)/C(=C/c3ccc(C(C)C)cc3)C(=O)NC2=S)cc1	1195549	MBGQRUDEWCXOEU-LDADJPATSA-N	364.470	3.950	10	50	FHCA	
CC1=NN(c2ccc(C)c(C)c2)C(=O)/C1=C\Nc1ccc([N+](=O)[O-])cc1	16672133	FHZNMODRTHPLBM-WQRHYEAKSA-N	350.378	3.930	10	50	FHCA	
COc1ccc(C2=C/C(=C\c3ccc(OC(C)=O)c(OC)c3)C(=O)O2)cc1	1208387	RNMKCXNHYFJNCX-MHWRWJLKSA-N	366.369	3.610	10	50	FHCA	
C[C@H](N=[N+]=[N-])[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O	169722894	LLJMYBCJYQGZOS-GTNSWQLSSA-N	366.377	3.677	10	50	FHCA	
CC(=O)N1N=C(c2ccc(O)cc2)C[C@H]1c1ccc(Br)cc1	1200971	IAHDJIUAJOHPGF-KRWDZBQOSA-N	359.223	3.852	10	50	FHCA	
O=C1NC(=S)S/C1=C\c1ccccc1OCCOc1ccccc1	2993520	XSCCAWUGIUCJJD-VBKFSLOCSA-N	357.456	3.633	10	50	FHCA	
COc1ccc(N2CCN(Cc3ccccc3Br)CC2)cc1	55543263	DXPUQIAARRIDTM-UHFFFAOYSA-N	361.283	3.780	10	50	FHCA	
O=C(O)CC[C@@H](NC(=O)Nc1ccc(/N=N/c2ccccc2)cc1)C(=O)O	71767395	FLCMIASZWXROHD-UCMDFWOYSA-N	370.365	3.542	10	50	FHCA	
CCOC(=O)c1c(NC(=O)CCC(=O)O)sc2c1CCCCCCC2	2760519	VNHKWGAUIUDOQJ-UHFFFAOYSA-N	367.467	3.777	10	50	FHCA	
Cc1ccc(C2=C/C(=C/c3cc4c(cc3[N+](=O)[O-])OCO4)C(=O)O2)cc1	1207278	HZSJUYVWTOLHAA-NSIKDUERSA-N	351.314	3.613	10	50	FHCA	
CC(=O)c1cc(C)n(-c2ccc(C(=O)N3CC[C@](C)(O)[C@H](C)C3)cc2)c1C	92037857	WHYCRHGKOWBNOA-PEBXRYMYSA-N	368.477	3.530	10	50	FHCA	
Oc1cc(F)ccc1CN1CC(Cc2cccc(Br)c2)C1	1875331205	VCWGWEZSMYVNAI-UHFFFAOYSA-N	350.231	3.968	10	50	FHCA	
Cn1cc(/C=C2/C(=O)N(C3CCCCC3)C(=S)N=C2O)c2ccccc21	1294024	LLZKGHNDBDRIKG-LFIBNONCSA-N	367.474	3.978	10	50	FHCA	
COc1ccc(C(=O)Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1	3898689	VGSMPPZALKNNJT-UHFFFAOYSA-N	357.365	3.723	10	50	FHCA	
Cc1cc(C(=O)N[C@@H]2CCC[C@H](C(=O)O)CC2)c(C)n1-c1ccccc1F	1875354829	QBGYFGSAVDPJLY-JKSUJKDBSA-N	372.440	3.997	10	50	FHCA	
CSc1ccc(/C=C2/SC(N3CCCC[C@H]3CCO)=NC2=O)cc1	6928747	NIYYTBAGZGYGKP-AOHITCTBSA-N	362.520	3.616	10	50	FHCA	
CCCn1ccnc1[C@@H]1c2nc[nH]c2CCN1Cc1cc(Cl)ccc1O	72421674	CIWMYAIXNSEXPO-SFHVURJKSA-N	371.872	3.523	10	50	FHCA	
CCCC1=NN2C(=N)/C(=C/c3ccc(N(CC)CC)cc3)C(=O)N=C2S1	3904786	ZJPXFPGNOBNIOU-JGZHAYGJSA-N	369.494	3.952	10	50	FHCA	
CCOC(=O)[C@H](C)Oc1ccc2c(oc(=O)c3cc(OC)ccc32)c1C	1183699	FXDVPUIGILNDBQ-LBPRGKRZSA-N	356.374	3.594	10	50	FHCA	
CC[C@@H](C)N1C(=O)/C(=C/c2cn(CC)c3ccccc23)C(O)=NC1=S	16956474	CHIGNHSKDFYBGF-JXCQQFQQSA-N	355.463	3.927	10	50	FHCA	
COc1ccccc1N1C(=O)NC(=O)/C(=C/c2cccc3ccccc23)C1=O	5043590	OQWJNTWULOONCP-LGMDPLHJSA-N	372.380	3.515	10	50	FHCA	
COCC(=O)Nc1ccc(NC(=O)c2c(C)c3ccccc3n2C)cc1C	952962224	CDECNTHTVJGWAK-UHFFFAOYSA-N	365.433	3.632	10	50	FHCA	
O=C1c2ccccc2C(=O)C1c1nc2ccccc2c(Br)c1O	100045432	DVBLPJWQXDCAKU-UHFFFAOYSA-N	368.186	3.866	10	50	FHCA	in-vitro
CC(C)[C@H](C(=O)O)N1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S	1300970	KMGMFRUEPBZCGG-SEVUFMINSA-N	355.868	3.650	10	50	FHCA	
[N-]=[N+]=NCCCOc1ccc(/N=N/c2ccc(C(=O)NCCN)cc2)cc1	95100010	UVUWBMXTTDCBAK-WCWDXBQESA-N	367.413	3.870	10	50	FHCA	
O=C1C(=Cc2ccccc2O)C(=O)N(c2ccccc2)N1c1ccccc1	1696730	RIGKREBXKUGBOP-UHFFFAOYSA-N	356.381	3.771	10	50	FHCA	
C[C@@H](NCc1ccc(N2CCSCC2)cc1)c1cccc2[nH]ncc12	2325809897	YICKJYODNRDHSY-OAHLLOKOSA-N	352.507	3.967	10	50	FHCA	
O[C@@]1(C(F)(F)F)CC(c2ccccc2)=NN1C(=S)c1ccccc1	711924	RIANETHNVIQQBE-MRXNPFEDSA-N	350.365	3.723	10	50	FHCA	
Cc1cccc(N2CCN(C3=NC(=O)/C(=C/c4ccccc4)S3)CC2)c1	955364	FAWJWDYDUZBDJS-CYVLTUHYSA-N	363.486	3.788	10	50	FHCA	
CC[C@H](C)N1C(=O)/C(=C/c2cn(CC)c3ccccc23)C(O)=NC1=S	16956476	CHIGNHSKDFYBGF-XBUHWIKASA-N	355.463	3.927	10	50	FHCA	
CCCCN1C(=O)/C(=C2/C(=O)N(CCC)c3ccccc32)SC1=S	2283958	OZGKUOANPSMSRP-PFONDFGASA-N	360.504	3.815	10	50	FHCA	
COc1ccccc1N1C(=O)N=C(O)/C(=C\c2c[nH]c3ccccc23)C1=O	1302417	MKCZKJRFDCYZPU-GXDHUFHOSA-N	361.357	3.683	10	50	FHCA	
CCOC(=O)CN(/N=N\c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1	8398809	XQZUKSPLTNSKET-ZCXUNETKSA-N	373.325	3.571	10	50	FHCA	
O=C(O)c1cc(/N=N/c2ccc3cc(S(=O)(=O)O)ccc3c2)ccc1O	4571276	DCWXXNCBFBBEEN-VHEBQXMUSA-N	372.358	3.906	10	50	FHCA	in-vitro
Cc1cc(C(=O)N[C@@H]2CCC[C@@H](C(=O)O)CC2)c(C)n1-c1cccc(F)c1	1875354348	FGWKVFLVYXIGOP-NVXWUHKLSA-N	372.440	3.997	10	50	FHCA	
COc1ccc(CCN(Cc2ccccc2O)CC2CCN(C)CC2)cc1	11816828	MPBRXXQZTMKSIZ-UHFFFAOYSA-N	368.521	3.787	10	50	FHCA	
O=C1N=C(N2CCC[C@@H](CO)C2)S/C1=C/c1cccc2ccccc12	6886042	OAUQMIGBWFRPQG-XWAFYUISSA-N	352.459	3.514	10	50	FHCA	
CC(C)C(=O)N[C@@H](c1ccc([N+](=O)[O-])cc1)c1ccc2cccnc2c1O	1197064	MANXRJHVXKIOPP-KRWDZBQOSA-N	365.389	3.710	10	50	FHCA	
O=C1Nc2ccccc2/C1=C1/SC(=S)N(c2ccc(F)cc2)C1=O	1252547	NXWPTHQSZXVUQT-YPKPFQOOSA-N	356.403	3.554	10	50	FHCA	
COc1ccc(N2CCN(C(=O)c3csc4ccccc34)CC2)cc1	1116548	VILXIJPVPYAJIN-UHFFFAOYSA-N	352.459	3.872	10	50	FHCA	
COc1ccc(-c2cc3ccc(O)c(CN4CCCC4)c3oc2=O)cc1	1049669	LVYSYSPHTNXRQW-UHFFFAOYSA-N	351.402	3.770	10	50	FHCA	aggregator,biogenic
COc1ccc(N2CCN(C(=O)c3cccc(C(F)(F)F)c3)CC2)cc1	1052239	KDCCFIVJAWGRNZ-UHFFFAOYSA-N	364.367	3.676	10	50	FHCA	
COc1cc(/C=C2/C(=O)N(c3ccc(C)cc3)N=C2C)cc(OC)c1O	1408380	ANVKHBKZPMEYKM-CXUHLZMHSA-N	352.390	3.524	10	50	FHCA	
O=C(O)[C@@H](Cc1ccccc1)N1C(=O)/C(=C/c2ccccc2)SC1=S	966972	VGIFXQDHKSESDU-WMJYUBJYSA-N	369.467	3.584	10	50	FHCA	
CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(N2CCOCC2)cc1C	12468499	ASGSWFGPTPJQCR-RCCKNPSSSA-N	361.445	3.638	10	50	FHCA	
CCOc1c(Br)cc(/C=C2\SC(S)=NC2=O)cc1OC	6402450	DWGIHJSRNLEFOQ-POHAHGRESA-N	374.281	3.757	10	50	FHCA	
O=C1N=C(N2CCOCC2)S/C1=C/c1cccc(Oc2ccccc2)c1	1185722	GHCYMRWJOYVGER-NBVRZTHBSA-N	366.442	3.781	10	50	FHCA	
CCN(CC)c1ccc([C@@H]2[C@H]3CCCC[C@@]3(O)CCN2C(=O)OC)cc1	16032471	BAPXFDGYOLEISY-SFHLNBCPSA-N	360.498	3.967	10	50	FHCA	biogenic
CC(=O)N[C@@H](c1ccc(Br)cc1)c1ccc2cccnc2c1O	1218937	DXYUFSXQDXVFAO-INIZCTEOSA-N	371.234	3.928	10	50	FHCA	
COc1ccc(N2CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)CC2)cc1	4881719	RVYYTHCZMFTFCF-UHFFFAOYSA-N	368.521	3.950	10	50	FHCA	
O=C(O)CCN1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S	966931	CNGJMAUHDZUGMC-YHYXMXQVSA-N	362.259	3.669	10	50	FHCA	
CCc1ccc(CCC(=O)N2CCN(c3ccc(OC)cc3)CC2)cc1	10315345	FMRBLHXPZNVIJU-UHFFFAOYSA-N	352.478	3.539	10	50	FHCA	
O=C1/C(=C\c2ccc(O)c(O)c2)C(c2ccccc2)=NN1c1ccccc1	4894292	FXCUCKKUCRGUQI-AQTBWJFISA-N	356.381	3.932	10	50	FHCA	
COc1ccc([C@@H]2c3nc[nH]c3CCN2Cc2cc(C)ccc2O)c(F)c1	67784969	VWROQESXKUMYRM-OAQYLSRUSA-N	367.424	3.719	10	50	FHCA	
Cc1cc(C)c2nc(NC3=N[C@H](c4ccccc4)CC(=O)N3)nc(C)c2c1	887798	WJVKPOOHLWHFBA-KRWDZBQOSA-N	359.433	3.584	10	50	FHCA	
C[C@H](NCc1ccc(N2CCSCC2)cc1)c1cccc2[nH]ncc12	2325809896	YICKJYODNRDHSY-HNNXBMFYSA-N	352.507	3.967	10	50	FHCA	
Oc1cc2c(cc1CN1CCC(Oc3cncc(Cl)n3)CC1)CCCC2	777550265	CQLAXWJHAFXUSD-UHFFFAOYSA-N	373.884	3.758	10	50	FHCA	
CCOc1ccc(/C=C2\SC(=S)N(CN3CCCCC3)C2=O)cc1	334163489	UXYOWQDLSHVZDB-VBKFSLOCSA-N	362.520	3.730	10	50	FHCA	
CCCCN1C(=O)/C(=C2\SC(N3CCCCC3)=NC2=O)c2ccccc21	13772072	BFCZCDHQZPJAIG-MSUUIHNZSA-N	369.490	3.660	10	50	FHCA	
CCCN1C(=O)/C(=C2\SC(=S)N(CC(C)C)C2=O)c2ccccc21	1449338	VAJIYVNNHYQNKP-PFONDFGASA-N	360.504	3.671	10	50	FHCA	
CCOc1ccc(S(=O)(=O)NCc2ccc(N3CCCCC3)cc2)cc1	10113176	FSRDGCBOCNFVTI-UHFFFAOYSA-N	374.506	3.554	10	50	FHCA	
C/C(NC1CC1)=C1/C(=O)N(c2nc3ccccc3s2)N=C1C(F)(F)F	22107519	SHFNRKJVJYSXCD-WQLSENKSSA-N	366.368	3.587	10	50	FHCA	
COc1ccc(NC(=O)c2ccccc2)c2c1C(=O)c1ccccc1C2=O	4829914	QXYNKCDOBUKENZ-UHFFFAOYSA-N	357.365	3.723	10	50	FHCA	biogenic
c1cc(C2CCN(C3CCN(c4ccc5c(c4)OCO5)CC3)CC2)ccn1	1506427746	RYWTZFMILVJENW-UHFFFAOYSA-N	365.477	3.659	10	50	FHCA	
CCOC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccco1	13616129	HTULDZAHBVEJGK-ATVHPVEESA-N	353.374	3.556	10	50	FHCA	
CC1=NN(c2ccc(Cl)c(C(=O)O)c2)C(=O)/C1=C/c1ccccc1F	100077640	CWULPOPPJRTXKR-MDWZMJQESA-N	358.756	3.983	10	50	FHCA	
COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1cccc(OC)c1	897985	ZTWMDKSTQDBZMG-VBKFSLOCSA-N	367.376	3.712	10	50	FHCA	
O=C1N=C(NC2CCCC2)S/C1=C/c1ccc(Cl)c([N+](=O)[O-])c1	208141343	BWSYOLOVNXXPBW-MDWZMJQESA-N	351.815	3.751	10	50	FHCA	
COC[C@H](c1ccccn1)N(C)C1CCN(c2ccc3c(c2)CCC3)CC1	952862968	TWHDIIGJNWTOKG-HSZRJFAPSA-N	365.521	3.859	10	50	FHCA	
CCn1c(C)cc(/C=C2/C(=O)N(c3ccc(OC)cc3)C(=O)N=C2O)c1C	1238730	KAEJZDCMKCOSRP-GZTJUZNOSA-N	367.405	3.640	10	50	FHCA	
COc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)cc(OC)c1OC	4499174	GHZFPDRTSUNSBF-YBEGLDIGSA-N	352.390	3.519	10	50	FHCA	
COC(=O)c1ccc(/C=C2\SC(Nc3cccc(C)c3)=NC2=O)cc1	1191072	OWPLUBDSIQPNIR-WJDWOHSUSA-N	352.415	3.864	10	50	FHCA	
C[C@H]1CN(C2=NC(=O)/C(=C/c3c(F)cccc3Cl)S2)C[C@H](C)O1	4815266	GPBCXKZKMKDYAP-YCWOIXCKSA-N	354.834	3.559	10	50	FHCA	
Cc1ccc(O)c(CN2CCc3[nH]cnc3[C@H]2C2CCN(C(C)C)CC2)c1	72422393	WAHRKCZCYWRFJV-JOCHJYFZSA-N	368.525	3.644	10	50	FHCA