smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cc1nc(C)c(C(=O)NNC(=O)COc2ccc(Cl)cc2Cl)s1	1047378	YIDYUUBBRGWDKV-UHFFFAOYSA-N	374.249	2.907	50	30	FFGC	
CC(=O)OCC[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O1	199867697	YIPBVPCNPASMTO-UHFFFAOYSA-N	368.683	2.807	50	30	FFGC	
O=C(CNc1ccc(F)cc1)NN=Cc1cc(Br)ccc1O	254347936	AWXALSWQPABXAP-UHFFFAOYSA-N	366.190	2.856	50	30	FFGC	
CC(C)(O)C(C)(C)OB(O)c1cncc(CO[Si](C)(C)C(C)(C)C)c1	2265356041	VHZZWLGNZGHPOE-UHFFFAOYSA-N	367.371	2.857	50	30	FFGC	
CC(C)(C)OC(=O)N1CC[C@@]2(CO[C@H](CI)C2)C1	669371623	KSEJZIWCELFVQV-GWCFXTLKSA-N	367.227	2.838	50	30	FFGC	
COc1cc(C(=O)NNC(=O)C(C)(C)C)c(-n2c(C)ccc2C)cc1OC	1027580	SHTMUQAURWEIOA-UHFFFAOYSA-N	373.453	2.918	50	30	FFGC	
CNc1ccccc1C(=O)NNC(=O)c1cccnc1Oc1ccccc1	1036335	SAVLGOLWLOYMRY-UHFFFAOYSA-N	362.389	2.990	50	30	FFGC	
Cc1ccc(C=NNC(=O)c2c(O)c3cccc4c3n(c2=O)CCC4)cc1	254492617	GGXAXJBCBTVUKQ-UHFFFAOYSA-N	361.401	2.726	50	30	FFGC	
O=C(NNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-])c1ccco1	4322573	IABHINPLVPAGJI-UHFFFAOYSA-N	360.204	2.872	50	30	FFGC	
CCn1nc(C)cc1C(=O)NNC(=S)Nc1cccc(C(F)(F)F)c1	1047583	DYOSRVGFZVELQP-UHFFFAOYSA-N	371.388	2.862	50	30	FFGC	
Cc1ccc(C(=O)NNC(=O)Cc2csc(-c3csc(C)n3)n2)cc1	1047800	UMPQOYTZYOZDBF-UHFFFAOYSA-N	372.475	2.887	50	30	FFGC	
CC(C)(C)C(=O)NNC(=O)COc1ccc(C2SCCS2)cc1	3119901	GQHLRKQFKNTZCZ-UHFFFAOYSA-N	354.497	2.738	50	30	FFGC	
C[C@H]1CN(/C=C(\C#N)S(=O)(=O)Cc2ccc(Cl)cc2)C[C@@H](C)O1	13466018	ACNKGPHDYXJAGH-DFHVEKNXSA-N	354.859	2.729	50	30	FFGC	
C[C@H](Br)C(=O)OCCCCCOC(=O)[C@@H](C)Br	3623469	KPMRDMGYLIQKQC-DTORHVGOSA-N	374.069	2.810	50	30	FFGC	
COc1cc(/C=N/NC(=O)c2sc3nc(C)cc(C)c3c2N)ccc1O	1035451	KKMWHUNJHQIYHA-DNTJNYDQSA-N	370.434	2.973	50	30	FFGC	
COc1c(C(=O)NNC(=O)c2cccs2)csc1Br	1037360	XEDWFMHZARTJDP-UHFFFAOYSA-N	361.242	2.656	50	30	FFGC	
Cc1ccc(OCC(=O)NNC(=S)NC2CCCCC2)c2c1CCC2	1043190	AKHUWQWCZYGWOJ-UHFFFAOYSA-N	361.511	2.691	50	30	FFGC	
COc1cccc(CC(=O)NNC(=O)c2c(-c3ccccc3)noc2C)c1	1035117	PWGYPYZWSGKERE-UHFFFAOYSA-N	365.389	2.662	50	30	FFGC	
COc1cc(/C=N/NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc(OC)c1OC	1033040	VDEWEBMYNXTUDQ-VXLYETTFSA-N	373.365	2.693	50	30	FFGC	
CSC1=NC=C(C#N)C2=N[C@@](C)(c3ccc(Br)cc3)NN12	1040817	KRKCNDRRXWOSAP-CQSZACIVSA-N	362.256	2.981	50	30	FFGC	
CCOC(CBr)(OCC)C(=O)Oc1ccc([N+](=O)[O-])cc1	2539338	KJPCBBYQNDWZGC-UHFFFAOYSA-N	362.176	2.664	50	30	FFGC	
Cc1occc1C(=O)C(C#N)=C(NCc1cccnc1)NCc1cccnc1	1038776	WVOIXNDVDVAPKP-UHFFFAOYSA-N	373.416	2.876	50	30	FFGC	
CCOC(=O)/C(C#N)=C/NN(C)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	4300108	UGNQXVVBTKDJRD-CMDGGOBGSA-N	358.276	2.525	50	30	FFGC	
O=C(NNC(=O)c1c(F)cccc1F)c1ccccc1OC(F)(F)F	1047799	GCSOXHJSEFHCLP-UHFFFAOYSA-N	360.238	2.938	50	30	FFGC	
COc1ccc(/C=N/NC(=O)CSCC(=O)Nc2ccccc2)cc1	3126398	HNIBQYHIBXQSPI-YBFXNURJSA-N	357.435	2.517	50	30	FFGC	
O=C(NNC(=S)Nc1ccccc1Cl)c1cccc([N+](=O)[O-])c1	1035025	MGKRJIUIETTWMM-UHFFFAOYSA-N	350.787	2.880	50	30	FFGC	
COC(=O)c1cc(/C=C(\C#N)S(C)(=O)=O)cn1-c1ccc(Cl)cc1	1046740	PQGFHALQVQMMEU-VGOFMYFVSA-N	364.810	2.826	50	30	FFGC	
N#CC(N)=C(C#N)N=Cc1cc([N+](=O)[O-])ccc1Sc1ccccn1	2265279823	MYKQUDVIHUCYSL-UHFFFAOYSA-N	350.363	2.777	50	30	FFGC	
O=C(CN1C(=O)CSc2ccccc21)N/N=C/c1ccc(Cl)cc1	1036455	OFBCGTGIMZLLPH-DJKKODMXSA-N	359.838	2.929	50	30	FFGC	
COc1c(C(=O)NNC(=O)c2ccccc2)csc1Br	1037362	XKTCXRKKDNRJGI-UHFFFAOYSA-N	355.213	2.594	50	30	FFGC	
C=C(C)C(=O)OCC[N+](C)(C)CCC[Si](OCC)(OCC)OCC	195768071	XMQPDOQLPALUSX-UHFFFAOYSA-N	362.563	2.621	50	30	FFGC	
C[C@H](Br)C(=O)OCCCCCOC(=O)[C@H](C)Br	3623472	KPMRDMGYLIQKQC-IUCAKERBSA-N	374.069	2.810	50	30	FFGC	
Cc1cc(C)c2ccc(=O)n(CC(=O)N/N=C/c3ccccc3Cl)c2n1	1040338	KJPVMGQVLIXGFB-UFFVCSGVSA-N	368.824	2.817	50	30	FFGC	
COc1cc(OC)cc(C(=O)NNC(=S)Nc2cccc(Cl)c2)c1	1048525	PNSZTDSHOSTRTK-UHFFFAOYSA-N	365.842	2.989	50	30	FFGC	
CC(C)(C)OC(=O)N1CC[C@@]2(CO[C@@H](CI)C2)C1	669371625	KSEJZIWCELFVQV-MFKMUULPSA-N	367.227	2.838	50	30	FFGC	
CCOC(=O)/C(C#N)=C/N/C(=N/N=C/c1ccc(Cl)cc1)SC	12339216	WQCLRPXZDYVSOV-ALYWKMAQSA-N	350.831	2.953	50	30	FFGC	
CC(C)(C)OC(=O)N1CC[C@]2(CO[C@H](CI)C2)C1	669371624	KSEJZIWCELFVQV-GXFFZTMASA-N	367.227	2.838	50	30	FFGC	
CCOC(=O)C[C@@H]1CO[C@H](C/C(C)=C/C=O)[C@@H]2OC3(CCCCC3)O[C@@H]21	223664916	HFYXIVPHIZPVQO-WRBVQAHRSA-N	366.454	2.934	50	30	FFGC	
O=C(NNC(=O)c1ccc2nccnc2c1)c1ccc(C(F)(F)F)cc1	1034251	YQXJDZYIECFYEK-UHFFFAOYSA-N	360.295	2.723	50	30	FFGC	
N#C/C(=C\N1CCN(c2ccccc2)CC1)S(=O)(=O)c1ccc(F)cc1	1039940	HWAAESHRFWKACN-XDJHFCHBSA-N	371.437	2.787	50	30	FFGC	
C=C1C(=O)O[C@@H]2/C=C(/C)CC/C=C(/C=O)[C@H](OC)[C@@H](OC(=O)C(C)C)[C@@H]12	43510873	SKCDPGIEMVQDCR-VBMXKYFYSA-N	362.422	2.532	50	30	FFGC	
O=C(NNC(=O)c1ccc2c(c1)OCO2)c1ccc(C(F)(F)F)cc1	1034249	LAEOTUPKXRUGCZ-UHFFFAOYSA-N	352.268	2.509	50	30	FFGC	
O=C(CSc1ccccc1)NN=Cc1cc2c(cc1[N+](=O)[O-])OCO2	254352270	PTDSUEDWMJMDSZ-UHFFFAOYSA-N	359.363	2.566	50	30	FFGC	
CN(C)/C=N/NC(=O)c1cc(COc2cc(Cl)cc(Cl)c2)on1	4394387	WMHFGKPDUGNYNT-CAOOACKPSA-N	357.197	2.795	50	30	FFGC	
CCOC(=O)c1cnc(NNC(=O)c2ccccc2F)nc1C(F)(F)F	1027360	PDSQKKPUIVNTMX-UHFFFAOYSA-N	372.278	2.568	50	30	FFGC	
Cc1cc(C(=O)NNC(=O)Nc2ccc(F)cc2F)nn1C(C)(C)C	1028353	BQRQQRIXQXEVHA-UHFFFAOYSA-N	351.357	2.691	50	30	FFGC	
CCOC(=O)c1cnc(NNC(=O)c2cccc(C)c2)nc1C(F)(F)F	1027383	JLFOECCVWLIDOD-UHFFFAOYSA-N	368.315	2.737	50	30	FFGC	
CC(C)(C)OC(=O)N1CC2(CCC[C@@H](CI)O2)C1	606301007	KWZZNRMGYYOZPN-JTQLQIEISA-N	367.227	2.980	50	30	FFGC	
CCOC(=O)[C@@H](Br)C(=O)c1ccc(Br)cc1	100032861	DZAUDNMELBAULM-VIFPVBQESA-N	350.006	2.958	50	30	FFGC	
CC1(C)O[C@H]2[C@H](O)[C@H]3OC(C)(C)O[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O1	248154716	HUHBHQIYOLPESS-KYFQHEKYSA-N	374.550	2.792	50	30	FFGC	in-vitro
Cc1ccc2nc(OCCCNCCSS(=O)(=O)O)cc(C)c2c1	31600730	BSUIFZACDFHAMH-UHFFFAOYSA-N	370.496	2.746	50	30	FFGC	
COc1cc(C(=O)NNC(=O)C(C)C)c(-n2c(C)ccc2C)cc1OC	1027667	DFHYKANJHGEHFD-UHFFFAOYSA-N	359.426	2.528	50	30	FFGC	
COc1cc(/C=N/NC(=O)c2ccc(N(C)C)cc2)cc(OC)c1OC	1045590	LMDDGAMZAQTUFH-UDWIEESQSA-N	357.410	2.542	50	30	FFGC	
O=C(NNC(=O)c1ccc2nsnc2c1)c1ccc(C(F)(F)F)cc1	1034250	PSYWVJFLXGEKPS-UHFFFAOYSA-N	366.324	2.785	50	30	FFGC	
Cc1nc(-c2c(C(=O)NNC(=O)Nc3ccccc3)noc2C)cs1	4394530	RVPADRFSCPGSFV-UHFFFAOYSA-N	357.395	2.881	50	30	FFGC	
CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](n2ccc3c(N)ncnc32)C[C@@H]1O	2265364189	WIVQODGSJYAMRZ-BFHYXJOUSA-N	364.522	2.684	50	30	FFGC	
C[C@@H](Br)C(=O)OCCCCCOC(=O)[C@@H](C)Br	3623470	KPMRDMGYLIQKQC-RKDXNWHRSA-N	374.069	2.810	50	30	FFGC	
COc1cc(CO)c(CC(=O)N/N=C/C=C/c2ccccc2)cc1OC	3161661	DHLPTQUNSHVDPJ-DVMKSOMISA-N	354.406	2.554	50	30	FFGC	
NNC(=O)c1ccc(CNC(=O)c2ccc(-c3ccc(Cl)cc3)[nH]2)s1	725712362	BBRVWGCFDYIRTC-UHFFFAOYSA-N	374.853	2.930	50	30	FFGC	
N#CC(N)=C(C#N)N=Cc1cc(Br)c(O)c(Br)c1	2265279822	KYXWRVKZEZLYAW-UHFFFAOYSA-N	370.004	2.554	50	30	FFGC	
Cc1nn(-c2ccccc2)nc1C(=O)NNC(=O)c1cccc2ccccc12	1033534	OTPZWPUSNDVCJQ-UHFFFAOYSA-N	371.400	2.804	50	30	FFGC	
C[Si](C)(C)O[Si](C)(CCCOS(=O)(=O)O)O[Si](C)(C)C	195751176	WWBXNMFJCHSXQW-UHFFFAOYSA-N	360.653	2.971	50	30	FFGC	
Cc1cc(C(=O)NNC(=O)CSCc2cccc3ccccc23)no1	4336219	LAPXQNPIGHKTEI-UHFFFAOYSA-N	355.419	2.831	50	30	FFGC	
CC(C)(C)c1cc(C(=O)NNC(=O)C2CC2)n(Cc2ccc(F)cc2)n1	1035923	SIYYYXWHPNNLIQ-UHFFFAOYSA-N	358.417	2.539	50	30	FFGC	
N#CC1=C(N)N2C(=O)/C(=C/c3ccco3)S[C@@H]2C(C#N)=C1c1ccco1	35606184	MWHWHILVURLRJW-SPJASCBJSA-N	362.370	2.800	50	30	FFGC	
CC(C)(C)OC(=O)N1CC[C@]2(CO[C@@H](CI)C2)C1	669371626	KSEJZIWCELFVQV-ZWNOBZJWSA-N	367.227	2.838	50	30	FFGC	
CCOC(CC(=O)NNC(=O)Nc1cccc(C(F)(F)F)c1)OCC	2154470	GUSXNVRNMDINOZ-UHFFFAOYSA-N	363.336	2.647	50	30	FFGC	
CCOC(=O)c1cnc(NNC(=O)c2ccccc2C)nc1C(F)(F)F	1027335	DPANBJPGMZRZCT-UHFFFAOYSA-N	368.315	2.737	50	30	FFGC	
CCOC(=O)c1cnc(NNC(=O)c2ccc(F)cc2)nc1C(F)(F)F	1027358	ZIQZYFBQBVWFGI-UHFFFAOYSA-N	372.278	2.568	50	30	FFGC	
Cc1onc(C(=O)NN)c1-c1csc(COc2ccc(Cl)cc2)n1	1047975	YJKASRAMMWDASY-UHFFFAOYSA-N	364.814	2.942	50	30	FFGC	
CN(NC(=O)NC(=O)c1ccc(F)c(Cl)c1)c1ccccc1[N+](=O)[O-]	4300317	UOLNLRWXYXOQGM-UHFFFAOYSA-N	366.736	2.878	50	30	FFGC	
CC1(C)O[C@H]2[C@H](O)[C@H]3OC(C)(C)O[C@@H]3[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O1	248154723	HUHBHQIYOLPESS-RODWMJHOSA-N	374.550	2.792	50	30	FFGC	in-vitro
Cc1ccc(C(=O)NNC(=O)CSc2ncnc3c(C)csc23)cc1	1027145	PAXJMGAJRCHPJG-UHFFFAOYSA-N	372.475	2.861	50	30	FFGC	
Cc1cc(C(=O)N/N=C/c2coc3ccccc3c2=O)ccc1[N+](=O)[O-]	1042429	IMOCSKJPPLDVOQ-DJKKODMXSA-N	351.318	2.774	50	30	FFGC	
C=CCNC(=S)NNC(=O)CN1c2ccccc2Sc2ccccc21	4334431	UAYMXZUEOCDLNM-UHFFFAOYSA-N	370.503	2.971	50	30	FFGC	
CC(C)(CCNC(=O)Cc1ccsc1)C(=O)N/N=C/c1ccccc1	2149117	HJJPFUPHDQBCES-FYJGNVAPSA-N	357.479	2.973	50	30	FFGC	
O=C(NNC(=O)c1ccc2nonc2c1)Nc1cc(Cl)cc(Cl)c1	1040102	TXKXLHCKNODBQW-UHFFFAOYSA-N	366.164	2.996	50	30	FFGC	
Cn1nc(C(C)(C)C)cc1C(=O)NNC(=O)c1ccc(C(F)(F)F)cc1	1047720	VFPNWQBOQMOARL-UHFFFAOYSA-N	368.359	2.811	50	30	FFGC	
O=C(NNC(=S)Nc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1	1027840	GFSZHOUYGIQRRY-UHFFFAOYSA-N	350.787	2.880	50	30	FFGC	
COC(=O)c1sccc1N/C=C(\C#N)S(=O)(=O)c1cccs1	4350187	XXPKDHGZEPNFME-CMDGGOBGSA-N	354.434	2.847	50	30	FFGC	
CCCCOc1ccc(C(=O)NNC(=O)c2ccccc2[N+](=O)[O-])cc1	7610638	BFUIHKBLAOVCIU-UHFFFAOYSA-N	357.366	2.849	50	30	FFGC	
NNC(=O)c1sccc1OCc1ncc(C(F)(F)F)cc1Cl	4394770	ILCDWPWZKFSAEY-UHFFFAOYSA-N	351.737	2.998	50	30	FFGC	
COc1cc(/C=N/NC(=O)CCc2ccc(O)cc2)cc(OC)c1OC	1026779	LZBLNNNVTBTXAL-UDWIEESQSA-N	358.394	2.501	50	30	FFGC	
CC(C)(C)OC(=O)N1CC[C@@H]2O[C@@H](CI)C[C@@H]2C1	307665426	AQIMUCSSHUZPPS-MXWKQRLJSA-N	367.227	2.836	50	30	FFGC	
O=C(N/N=C/c1cc(Cl)cc(Cl)c1O)C(=O)Nc1ccc(F)cc1	3126490	ZONZPKRTIAGCCS-FBCYGCLPSA-N	370.167	2.927	50	30	FFGC	
O=C(NNC1=NCCN1Cc1ccccc1)c1cccc(C(F)(F)F)c1	4323696	SDDXNRBCDSYARF-UHFFFAOYSA-N	362.355	2.812	50	30	FFGC	
COc1ccc(-c2n[nH]cc2/C=N/NC(=O)c2cccc([N+](=O)[O-])c2)cc1	1046643	ZLLDMIKHPWSQLQ-RGVLZGJSSA-N	365.349	2.757	50	30	FFGC	
CCOC(=O)COc1ccccc1/C=C(/C#N)S(=O)(=O)c1ccccc1	33384625	FISVCEYSADEHKA-ATVHPVEESA-N	371.414	2.967	50	30	FFGC	
N#C/C(=C\c1ccccc1N1CCOCC1)S(=O)(=O)c1ccccc1	1046203	XDTNGJUOBVOBLF-NBVRZTHBSA-N	354.431	2.862	50	30	FFGC	
Cc1cc(C)c(C#N)c(SS(=O)(=O)c2nc(C)cc(C)c2C#N)n1	1042436	SQIBZUMFPCOWSF-UHFFFAOYSA-N	358.448	2.935	50	30	FFGC	
Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)COc2ccccc2)cc1	1043413	KRTCYTDMJTYGHZ-UHFFFAOYSA-N	363.417	2.934	50	30	FFGC	
CC1(C)O[C@H]2[C@H](O)[C@H]3OC(C)(C)O[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O1	248154729	HUHBHQIYOLPESS-WBUWTLPESA-N	374.550	2.792	50	30	FFGC	in-vitro
Cc1ccc(C)n1-c1ccc(C(=O)NNS(=O)(=O)c2ccccc2)cc1	1043412	MSHILDRPDDMHGP-UHFFFAOYSA-N	369.446	2.717	50	30	FFGC	
CCOC(=O)[C@H](Br)C(=O)c1ccc(Br)cc1	100032858	DZAUDNMELBAULM-SECBINFHSA-N	350.006	2.958	50	30	FFGC	
Cc1cc(C(=O)NNC(=O)c2c(-c3ccccc3Cl)noc2C)no1	1047645	FMSXIJWMYIVURV-UHFFFAOYSA-N	360.757	2.675	50	30	FFGC	
N#CC1=C(N)N2C(=O)/C(=C/c3ccco3)S[C@H]2C(C#N)=C1c1ccco1	35606182	MWHWHILVURLRJW-WMBZCPDOSA-N	362.370	2.800	50	30	FFGC	
CSC1=NC=C(C#N)C2=N[C@](C)(c3ccc(Br)cc3)NN12	1040816	KRKCNDRRXWOSAP-AWEZNQCLSA-N	362.256	2.981	50	30	FFGC	
CS/C(=C(/C#N)S(=O)(=O)c1ccc(Cl)cc1)N1CCOCC1	1037397	ZAKABVXYSWHDQY-YPKPFQOOSA-N	358.872	2.502	50	30	FFGC	
CC(C)(C)OC(=O)N1CC2(CCC[C@H](CI)O2)C1	606301008	KWZZNRMGYYOZPN-SNVBAGLBSA-N	367.227	2.980	50	30	FFGC	
C[C@H]1CN(/C=C(\C#N)S(=O)(=O)Cc2ccc(Cl)cc2)C[C@H](C)O1	4344718	ACNKGPHDYXJAGH-MUEVSNKISA-N	354.859	2.729	50	30	FFGC	
CCNC(=S)NNC(=O)CN1c2ccccc2Sc2ccccc21	4334669	STFSZILBHMYSAI-UHFFFAOYSA-N	358.492	2.805	50	30	FFGC	
CCOC(=O)NC(=O)/C(C#N)=C/Nc1sc(C)c(C)c1C(=O)OCC	4363395	OSSKXLNPUYLPQG-DHZHZOJOSA-N	365.411	2.634	50	30	FFGC	
C=C1/C(=C\CP(=O)(c2ccccc2)c2ccccc2)C[C@@H](O)C[C@@H]1O	223262866	AMOPVNZHOOKFKW-VIHBBZTNSA-N	354.386	2.999	50	30	FFGC	
CC1(C)O[C@@H]2[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]3OC(C)(C)O[C@H]3[C@H](O)[C@H]2O1	248154709	HUHBHQIYOLPESS-FJPQNQRGSA-N	374.550	2.792	50	30	FFGC	in-vitro
CSc1nc(N/C=C(\C#N)C(=O)c2cccs2)n2nc(C)cc2n1	3129110	MAPLVRASPFTNKP-CSKARUKUSA-N	356.436	2.918	50	30	FFGC	
CC(=NNC(=O)c1cn(-c2cccc(C)n2)cn1)c1ccc([N+](=O)[O-])cc1	254741288	NIMUCSVYJOKOHT-UHFFFAOYSA-N	364.365	2.638	50	30	FFGC	
C[C@@H]1CN(/C=C(\C#N)S(=O)(=O)Cc2ccc(Cl)cc2)C[C@@H](C)O1	1037430	ACNKGPHDYXJAGH-VYBIZCNCSA-N	354.859	2.729	50	30	FFGC	
CC(C)(C)OC(=O)N1CC[C@@H]2O[C@H](CI)C[C@H]2C1	307665421	AQIMUCSSHUZPPS-DCAQKATOSA-N	367.227	2.836	50	30	FFGC	
Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)c1c(C)noc1C	1043599	VZMXCSBYTQSHSV-UHFFFAOYSA-N	356.407	2.798	50	30	FFGC	
CCCCCCNC(=S)NNC(=O)COc1ccc(C)c2c1CCC2	4336038	RCWVMWQNBJHZJQ-UHFFFAOYSA-N	363.527	2.938	50	30	FFGC	
CCOC(=O)c1cnc(C(F)(F)F)nc1NNC(=O)c1ccc(C)cc1	1031659	JVABENJVGQMKQG-UHFFFAOYSA-N	368.315	2.737	50	30	FFGC	
O=C(Cc1cc(F)cc(F)c1)NNC(=O)c1cccc(C(F)(F)F)c1	1046649	IUWFTFLPXWSRIX-UHFFFAOYSA-N	358.266	2.987	50	30	FFGC	
CCOC(=O)N/N=C/c1cc(Br)cc(Br)c1O	1040475	FSWSDOYDSRGABQ-WLRTZDKTSA-N	366.009	2.997	50	30	FFGC	
O=C(NNC(=O)c1ccccc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1	1044606	AZFFBXODSRQLQH-UHFFFAOYSA-N	354.149	2.976	50	30	FFGC	
Cc1ccc(OCC(=O)NNC(=S)NCc2ccccc2)c2c1CCC2	4336037	ORKBYLVCUGYHHL-UHFFFAOYSA-N	369.490	2.558	50	30	FFGC	
N#CC(=CN1CCN(c2ccccc2)CC1)S(=O)(=O)c1ccccc1	2265272108	ZWAMPEYHWOAXKW-UHFFFAOYSA-N	353.447	2.647	50	30	FFGC	
CC(C)(C)OC(=O)N1CCC(C=O)(CI)CC1	95933586	HQVUSQKSTDVRBT-UHFFFAOYSA-N	353.200	2.638	50	30	FFGC	
O=C(CBr)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	3887575	GCIDWSKQFYHZJU-UHFFFAOYSA-N	360.273	2.829	50	30	FFGC	
CCOC(=O)CC(=NNC(=O)Cc1c[nH]c2ccccc12)C(F)(F)F	255990613	NRCSCZZCMCTKHO-UHFFFAOYSA-N	355.316	2.698	50	30	FFGC	
O=C(NNC(=O)c1ccco1)c1cc2cc(OC(F)(F)F)ccc2[nH]1	1040056	QORRGJLFTJFHCC-UHFFFAOYSA-N	353.256	2.734	50	30	FFGC	
COc1ccc(CC(=O)NNC(=S)Nc2cc(C)ccc2C)cc1OC	1045985	VDDDMGZHVQVFAV-UHFFFAOYSA-N	373.478	2.881	50	30	FFGC