smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
PCCP(c1ccccc1)c1ccccc1	100535375	XWJKRFKGNPZFPE-UHFFFAOYSA-N	246.230	2.994	50	30	BFGC	
C[C@H]1CC[C@H](C)N1CCCBr	33637154	ORHLQGXHGDUTKI-IUCAKERBSA-N	220.154	2.644	50	30	BFGC	
Cc1ccc(C(=O)Cl)c2cccnc12	39057243	VMCWEVYZYNAXOK-UHFFFAOYSA-N	205.644	2.922	50	30	BFGC	
Cc1cc(CC(=O)O)ccc1CBr	238473382	ZJJGEZCRQRVGBK-UHFFFAOYSA-N	243.100	2.517	50	30	BFGC	
CC1(C)C[C@@H](CBr)C(C)(C)O1	86928441	FQOXUQMZKUPLIC-ZETCQYMHSA-N	221.138	2.975	50	30	BFGC	
COC(=O)/C(C#N)=C/c1ccc(SC)s1	109221	GKCBCFGGTDEPAP-FNORWQNLSA-N	239.321	2.550	50	30	BFGC	
COc1cc(Br)ncc1CCl	238460820	LJXGPNTUXQJTJK-UHFFFAOYSA-N	236.496	2.592	50	30	BFGC	
C[C@H](Br)CO[Si](C)(C)C	238523271	KCWYLWYVFLTTJV-LURJTMIESA-N	211.175	2.621	50	30	BFGC	
CCN(CC)C(Cl)(Cl)CCl	33985833	HXWGFDJJELILJP-UHFFFAOYSA-N	204.528	2.698	50	30	BFGC	
O=C=Nc1cccc(Oc2ccccn2)c1	12370413	ZPKUFUFOFBEHPG-UHFFFAOYSA-N	212.208	2.841	50	30	BFGC	
CC1(C)[C@@H]2CC[C@@H](C2)[C@]1(C)NC(=O)CCl	100831527	FLUMHSYXYCELKC-PTRXPTGYSA-N	229.751	2.556	50	30	BFGC	
Cn1cccc1C(=O)/C(C#N)=C/c1cccs1	4323381	UCFZFORQSJQEIH-CSKARUKUSA-N	242.303	2.876	50	30	BFGC	
C=CCC1=C(CCCCCC)C(=O)OC1=O	100252632	MRPYBMFALDUJLQ-UHFFFAOYSA-N	222.284	2.913	50	30	BFGC	
CC(C)(C)OC(=O)[C@H](Br)C1CC1	584879945	BDENKGSMYVURLT-SSDOTTSWSA-N	235.121	2.502	50	30	BFGC	
O=C1C[C@@H]2CCCC[C@@H]2C[C@@H]1Br	105179331	UHWFJMIIIQHSRW-VGMNWLOBSA-N	231.133	2.919	50	30	BFGC	
BrCCC1SCCS1	38846516	FBDKRVBTKUEMTH-UHFFFAOYSA-N	213.165	2.578	50	30	BFGC	
O=C=Nc1c(F)c(F)c(Cl)c(N=C=O)c1F	111875341	RDSWPXZXPBCUPU-UHFFFAOYSA-N	248.547	2.692	50	30	BFGC	
CCOC(=O)N/N=C(\C)c1ccc(Cl)cc1	4390068	NHJKBSHBPAFKCG-MDWZMJQESA-N	240.690	2.810	50	30	BFGC	
O[C@H](CCl)COc1cccc2ccccc12	4071878	ZVVJOJMCXYDDEW-LLVKDONJSA-N	236.698	2.818	50	30	BFGC	
Cc1cccc(C#CCBr)c1	95633177	TUWRDUQOXDZGFL-UHFFFAOYSA-N	209.086	2.741	50	30	BFGC	
N#C[C@H](O)c1c(Cl)cccc1Cl	100450733	PQZULIDMYBWYFO-ZETCQYMHSA-N	202.040	2.550	50	30	BFGC	in-vitro
FC1(F)CC12CC(CBr)C2	409433555	SNNLQVNCIURNSI-UHFFFAOYSA-N	211.049	2.817	50	30	BFGC	
FC(F)(F)CCn1ccc(CCl)n1	1554770376	FBXXTWYKDVCVLO-UHFFFAOYSA-N	212.602	2.574	50	30	BFGC	
C=C(Br)CCBr	136538829	AJBMCYZPJQVMEM-UHFFFAOYSA-N	213.900	2.680	50	30	BFGC	
O=C=Nc1cccc(OC(F)(F)C(F)F)c1	33506843	QIGRBWQBVSSVQX-UHFFFAOYSA-N	235.136	2.891	50	30	BFGC	
CC(=O)Sc1ccc(C(=O)Cl)cc1	39055853	LZIMZHBYBYQWJZ-UHFFFAOYSA-N	214.673	2.704	50	30	BFGC	
N#C/C(=C\c1ccccn1)c1ccccn1	4347851	ZKZCIHVRHVCXSX-PKNBQFBNSA-N	207.236	2.541	50	30	BFGC	
S=C=NCc1ccc(CN=C=S)cc1	118143364	IZZIFFOYWBHUEQ-UHFFFAOYSA-N	220.322	2.892	50	30	BFGC	
CCC=CCCI	2265326429	PEZZEOHNSDWFOS-UHFFFAOYSA-N	210.058	2.778	50	30	BFGC	
COC(=O)[C@H](C)[C@@H](C)CCCCCl	199929972	AYQGRCBERLVTSR-DTWKUNHWSA-N	206.713	2.841	50	30	BFGC	
BrC[C@H]1CCC2(CCCC2)O1	96034502	HGXVTGSQNLKFAK-MRVPVSSYSA-N	219.122	2.873	50	30	BFGC	in-vitro
O=[S@@](Cl)c1nc2ccccc2s1	100295605	HEZHHILXQNYPGN-LBPRGKRZSA-N	217.702	2.558	50	30	BFGC	
O=C1C[C@H](CCBr)C12CCC2	2265384650	FMGXKKCWEYXHJB-ZETCQYMHSA-N	217.106	2.531	50	30	BFGC	
C[C@H](Cc1ccc(Br)cc1)N=C=O	19784236	AWXDJSIOMUEASQ-MRVPVSSYSA-N	240.100	2.716	50	30	BFGC	in-vitro
Br[C@H]1CCO[C@@H](c2cccnc2)C1	307055149	YKRRLBRBTLEKED-VHSXEESVSA-N	242.116	2.697	50	30	BFGC	
ClCc1ncc(Br)s1	85352215	OEWLMHYIBRHMBK-UHFFFAOYSA-N	212.499	2.644	50	30	BFGC	in-vitro
FC(F)(F)[C@@H](Br)[C@@H]1CCCOC1	725269072	CMHLUSDQFBRQMT-RITPCOANSA-N	247.054	2.739	50	30	BFGC	
O[C@H](CCBr)c1ccccc1	34089763	BDPYJUFDDFXDTO-SECBINFHSA-N	215.090	2.505	50	30	BFGC	
O=C(Cl)N1CCC(C(F)(F)F)CC1	86894428	LTABPCGEHHURFG-UHFFFAOYSA-N	215.602	2.620	50	30	BFGC	
N#CC(C(=O)c1ccco1)=C1SCCS1	94784	IFJCFBBMNPZRIK-UHFFFAOYSA-N	237.305	2.677	50	30	BFGC	
O=C(CCBr)c1ccc(F)cc1	34195816	HFSYJZRWNVAYIG-UHFFFAOYSA-N	231.064	2.793	50	30	BFGC	in-vitro
COc1ccc(CBr)cc1C	34410120	LUAPVXVRGYPASS-UHFFFAOYSA-N	215.090	2.899	50	30	BFGC	in-vitro
C[C@H](Br)C(=O)C1CCCCC1	40845237	BKMKMXLHLLWKTQ-ZETCQYMHSA-N	219.122	2.919	50	30	BFGC	
N#CSCc1nc2cc(O)ccc2s1	45237123	AELRCMOKRQCWMR-UHFFFAOYSA-N	222.294	2.716	50	30	BFGC	
Fc1ccc(Cl)nc1CBr	88613657	NWQRHFURSUUQOD-UHFFFAOYSA-N	224.460	2.769	50	30	BFGC	
N#CCc1ccc(CBr)cc1	34276041	ZXWFTUPJHKAEHY-UHFFFAOYSA-N	210.074	2.648	50	30	BFGC	in-vitro
O=C=Nc1cccc(CC(F)(F)F)c1	107466230	UGHNHSGNFJJMIQ-UHFFFAOYSA-N	201.147	2.759	50	30	BFGC	
COC(=O)c1cccc(CBr)c1C	88190155	DSQFMTAUGZXHOG-UHFFFAOYSA-N	243.100	2.677	50	30	BFGC	
Cc1ncc(CCl)c(CCl)c1O	73372276	PGRGBTRGXLKHEC-UHFFFAOYSA-N	206.072	2.573	50	30	BFGC	
C[C@@H](Cl)c1cn(-c2ccccc2)nn1	75772321	FCWWQZQKCZWZMS-MRVPVSSYSA-N	207.664	2.567	50	30	BFGC	in-vitro
N#Cc1ccc(-c2cnc(CCl)o2)cc1	36903575	DRIHTYRPTAJGOS-UHFFFAOYSA-N	218.643	2.952	50	30	BFGC	in-vitro
O[C@@H](CCBr)c1ccccc1	34089764	BDPYJUFDDFXDTO-VIFPVBQESA-N	215.090	2.505	50	30	BFGC	
FC(F)(F)c1nc(CCl)cs1	40177148	VTLLCMVJMVJQTJ-UHFFFAOYSA-N	201.600	2.901	50	30	BFGC	in-vitro
CC(C)c1cnc(CBr)o1	575465798	WSSLEWPLIXYKKY-UHFFFAOYSA-N	204.067	2.693	50	30	BFGC	
BrCC1([C@@H]2CCCCO2)CC1	667355202	YNNPCDZFEHZPBF-QMMMGPOBSA-N	219.122	2.731	50	30	BFGC	
O=C(NNc1ccccc1)c1cccs1	131863	OQPTVLAHBORPHI-UHFFFAOYSA-N	218.281	2.505	50	30	BFGC	
CO[C@@](C)(CBr)c1ccccc1	59367637	VFOYFMNCGSJADN-JTQLQIEISA-N	229.117	2.943	50	30	BFGC	
O=C1CCCC[C@H]1CCBr	142932399	UHAAWAUFULWVAB-ZETCQYMHSA-N	205.095	2.531	50	30	BFGC	
N#C[C@@H](O)c1c(Cl)cccc1Cl	100450727	PQZULIDMYBWYFO-SSDOTTSWSA-N	202.040	2.550	50	30	BFGC	in-vitro
OC(CCl)(CCl)c1ccc(F)cc1F	136194236	NRCNSTHCKMDNIJ-UHFFFAOYSA-N	241.064	2.630	50	30	BFGC	
CC(C)(C)OC(=O)NC12CC(CCl)(C1)C2	1384380644	DMBGPSVIGXWHQF-UHFFFAOYSA-N	231.723	2.673	50	30	BFGC	
Cc1ccc(Br)c(N=C=O)c1	84193133	DYIJPGHSYAIMTR-UHFFFAOYSA-N	212.046	2.725	50	30	BFGC	
C[C@]1(CBr)CC(=O)C12CCC2	2265385120	DGINFMGVQFDUJV-MRVPVSSYSA-N	217.106	2.531	50	30	BFGC	
CC1(C(=O)CBr)CCCCC1	39055813	NGKXBCKUMZSAEB-UHFFFAOYSA-N	219.122	2.921	50	30	BFGC	
BrC[C@@H]1CCC2(CCC2)CO1	616582973	RQVHZQSCRLKNBQ-QMMMGPOBSA-N	219.122	2.731	50	30	BFGC	
CO[C@@H](CBr)c1ccc(F)cc1	50479708	HDOOWEISFUCYOU-VIFPVBQESA-N	233.080	2.908	50	30	BFGC	
Cc1ccc(C(=O)CBr)s1	2576093	WIEZPKHDQRZMCI-UHFFFAOYSA-N	219.103	2.634	50	30	BFGC	
Cc1noc(-c2ccco2)c1C(=O)Cl	39057510	BMRMMPVPESEVBE-UHFFFAOYSA-N	211.604	2.622	50	30	BFGC	
COCC1(CBr)CCCC1	83164847	BMWJOVKCWFVEDW-UHFFFAOYSA-N	207.111	2.588	50	30	BFGC	
CC(C)(C)c1cc(CBr)no1	87547898	SBUTZONQNYFZQO-UHFFFAOYSA-N	218.094	2.867	50	30	BFGC	in-vitro
Clc1ccncc1CBr	238508085	LQPSTIJNSDWPLK-UHFFFAOYSA-N	206.470	2.630	50	30	BFGC	
N#Cc1ccc(C(=O)Cl)c(CCl)c1	39055828	YCVPVOVXBNWPLO-UHFFFAOYSA-N	214.051	2.676	50	30	BFGC	
CCOC(C[C@H](Cl)C(F)(F)F)OCC	1535640480	MHAGBBDZQWYOFN-LURJTMIESA-N	234.645	2.945	50	30	BFGC	
O=C(CCl)c1ccc(F)c(C(=O)CCl)c1	675050056	GNAPEEGPLMRUPO-UHFFFAOYSA-N	249.068	2.669	50	30	BFGC	
COc1cc(-c2noc(CCl)n2)ccc1C	82162698	ZAJWENMOTITTER-UHFFFAOYSA-N	238.674	2.792	50	30	BFGC	in-vitro
O=C=Nc1ccccc1N1CCCCC1	12370165	KYBLFIQZSMHBII-UHFFFAOYSA-N	202.257	2.644	50	30	BFGC	
COOC(=O)c1ccc(N)cc1-c1ccccc1	585138962	XZMMAFZOFHEWSF-UHFFFAOYSA-N	243.262	2.654	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC[C@H]1CCC(=O)CO1	216242890	MSXQNPGCJIQANM-LLVKDONJSA-N	244.407	2.756	50	30	BFGC	
COC(=O)[C@@H](C)[C@@H](C)CCCCCl	199930031	AYQGRCBERLVTSR-IUCAKERBSA-N	206.713	2.841	50	30	BFGC	
CC(C)(C)OC(=O)[C@@H](Br)C1CC1	584879948	BDENKGSMYVURLT-ZETCQYMHSA-N	235.121	2.502	50	30	BFGC	
CO[Si](OC)(OC)[C@@H]1CCC=CCCC1	216685007	KZPUVYZACVLAQO-LLVKDONJSA-N	230.380	2.755	50	30	BFGC	
O[C@@H](CCl)COc1cccc2ccccc12	1592416	ZVVJOJMCXYDDEW-NSHDSACASA-N	236.698	2.818	50	30	BFGC	
ClCCc1ccncc1Br	575587239	CWESVZHXFPWTLN-UHFFFAOYSA-N	220.497	2.625	50	30	BFGC	
CC(C)(C)c1noc(C(Cl)Cl)n1	97957416	CGPMIGSWDWXIJK-UHFFFAOYSA-N	209.076	2.843	50	30	BFGC	
CC(=O)[C@@H](Br)Cc1ccccc1	32302431	VVSQAKKEJGMRSP-JTQLQIEISA-N	227.101	2.582	50	30	BFGC	
CCC(C)(C)OOC(=O)COc1ccccc1	59259580	PQACISFNSXHXIP-UHFFFAOYSA-N	238.283	2.729	50	30	BFGC	
F[C@@H](Cl)C(F)(F)OC(Cl)Cl	111853906	FTIQRZXWIUQTJF-PVQJCKRUSA-N	217.401	2.891	50	30	BFGC	
O=C(Cl)c1sccc1OC(F)F	38283891	ZAJVQSCWINVAGG-UHFFFAOYSA-N	212.604	2.729	50	30	BFGC	
C[C@H]1C[C@@H](CCBr)CCN1C	39110239	YBWVWNCRYIZHKI-IUCAKERBSA-N	220.154	2.502	50	30	BFGC	
Cc1ccc(-n2ccc(CCl)n2)cc1	84179460	OVCSMCLERXGOTQ-UHFFFAOYSA-N	206.676	2.920	50	30	BFGC	
C[C@H]1CCCC[C@H]1C(=O)CBr	39055808	YBNDUMHJNRWGBF-JGVFFNPUSA-N	219.122	2.777	50	30	BFGC	
O=C1CCCC[C@@H]1CCBr	142932617	UHAAWAUFULWVAB-SSDOTTSWSA-N	205.095	2.531	50	30	BFGC	
COc1nc(Cl)ccc1CBr	306908594	GFVMLGNVSFCOJV-UHFFFAOYSA-N	236.496	2.639	50	30	BFGC	
N#C/C(=C\O)c1nc2ccccc2s1	100236965	DJQZHZCSWSNQDJ-VOTSOKGWSA-N	202.238	2.719	50	30	BFGC	
C[C@H](Cc1ccccc1Br)N=C=O	75769057	UBSKKEZRIWMXBO-MRVPVSSYSA-N	240.100	2.716	50	30	BFGC	in-vitro
Cn1c(N=C=O)cc2cc(Cl)ccc21	107148159	RUCDOBYUYRPMDW-UHFFFAOYSA-N	206.632	2.799	50	30	BFGC	
C[C@@H](C=O)CO[Si](C)(C)C(C)(C)C	195965089	OGQRYCJBALFGOQ-VIFPVBQESA-N	202.370	2.843	50	30	BFGC	
ClCc1nc(Cl)cc(Br)n1	238524523	KGWODZUFTLTNJO-UHFFFAOYSA-N	241.903	2.631	50	30	BFGC	
N#CC1(O)CCC(c2ccccc2)CC1	101854390	ROWBHDYTWCPXNC-UHFFFAOYSA-N	201.269	2.599	50	30	BFGC	
Cc1ncsc1CCCBr	82162617	APCNNTOKNOFMSS-UHFFFAOYSA-N	220.135	2.779	50	30	BFGC	
Cc1ccccc1C#CCBr	95633745	PKHGEZFXHQXARI-UHFFFAOYSA-N	209.086	2.741	50	30	BFGC	
CC(C)CO[C@@H](C)c1noc(CCl)n1	71790855	YYMSMGUSGDGKRX-ZETCQYMHSA-N	218.684	2.542	50	30	BFGC	in-vitro
CC1(C)C[C@H](Br)C(C)(C)O1	86927835	OPEWXPZVQAEICL-LURJTMIESA-N	207.111	2.727	50	30	BFGC	
O=C(OCC1CC1)Oc1ccc([N+](=O)[O-])cc1	135895343	MFEOUENFAXRSKP-UHFFFAOYSA-N	237.211	2.520	50	30	BFGC	
ClCC1CCN(Cc2ccco2)CC1	12370839	VKOXQJUAMYIBRW-UHFFFAOYSA-N	213.708	2.730	50	30	BFGC	
CC1=C[C@H]1COC(=O)Oc1ccc([N+](=O)[O-])cc1	218913158	AYKFZTGRZMVSEY-VIFPVBQESA-N	249.222	2.686	50	30	BFGC	
COc1ccc(C(=O)[C@@H](F)Cl)cc1C	39055722	VPEMKGMQSPYZKC-SNVBAGLBSA-N	216.639	2.721	50	30	BFGC	
C[C@H](Br)C(=O)c1ccsc1	39055817	DYYYRVLXWCYBPK-YFKPBYRVSA-N	219.103	2.714	50	30	BFGC	
O[C@H](CBr)c1ccccc1Cl	12506194	ZASGHPFWAAEKAD-MRVPVSSYSA-N	235.508	2.768	50	30	BFGC	in-vitro
C[Si](C)(C)OC(=O)CCOc1ccccc1	195773830	SXIAXOPQUSKNJY-UHFFFAOYSA-N	238.359	2.834	50	30	BFGC	
C[C@H](Cl)c1nc(Cc2ccccc2)no1	26514898	IBXQJDXJNODHKZ-QMMMGPOBSA-N	222.675	2.960	50	30	BFGC	in-vitro
CC(C)CO[C@H](C)c1noc(CCl)n1	71790856	YYMSMGUSGDGKRX-SSDOTTSWSA-N	218.684	2.542	50	30	BFGC	in-vitro
CC(C)=NN(CCF)C(=O)OC(C)(C)C	238175712	PEJWKNBOYBVJSR-UHFFFAOYSA-N	218.272	2.589	50	30	BFGC	
C[C@@H](Cl)[C@H]1CC(c2ccccc2)=NO1	88611600	SWUWNDHGDIMKJS-LDYMZIIASA-N	209.676	2.807	50	30	BFGC	in-vitro
CC(C)=CC[C@@H]1C(C)=CC[C@H]2C(=O)OC(=O)[C@H]12	111395145	KPKSFNJCYGUOHN-IJLUTSLNSA-N	234.295	2.625	50	30	BFGC	
COc1cccc(C(=O)Cl)c1Cl	39057297	JYCVIMNYXDSFJH-UHFFFAOYSA-N	205.040	2.728	50	30	BFGC	
O=C(O)c1ccc(SCl)c([N+](=O)[O-])c1	76945635	UUVOHMQWLRUWAU-UHFFFAOYSA-N	233.632	2.539	50	30	BFGC	
N#C/C(=C\c1ccc([N+](=O)[O-])s1)C(=O)C1CC1	166010	QSCOYIKVZNRTPU-VMPITWQZSA-N	248.263	2.542	50	30	BFGC	
C[C@H]1CCC[C@H](C(=O)CBr)C1	39055761	ODLBURIROQYTMI-YUMQZZPRSA-N	219.122	2.777	50	30	BFGC	
O[C@@H](CCCCl)c1ccc(F)cc1	4072018	YTEUQGXRCFYPSA-JTQLQIEISA-N	202.656	2.878	50	30	BFGC	in-vitro
O=C(F)c1cc(Cl)c(F)c(F)c1F	34090720	HDPODBQAFOAFJY-UHFFFAOYSA-N	212.529	2.867	50	30	BFGC	
C[C@H](Cl)[C@@H]1CC(c2ccccc2)=NO1	88611592	SWUWNDHGDIMKJS-KWQFWETISA-N	209.676	2.807	50	30	BFGC	in-vitro
CCOC(=O)c1ccc(F)c(CCl)c1	238263447	IXRPMYDWGSJPST-UHFFFAOYSA-N	216.639	2.741	50	30	BFGC	
Fc1ccc(C2=NO[C@@H](CCl)C2)cc1	69969719	WCZFVCMOANNSEE-SECBINFHSA-N	213.639	2.558	50	30	BFGC	in-vitro
O[C@H]1C[C@@H]2CCCC[C@@H]2C[C@H]1Br	2265364118	APHARBZZYBGGFC-RGOKHQFPSA-N	233.149	2.711	50	30	BFGC	
O=C(F)c1ccc(Br)cc1	39057191	SPKVPJFPBBPGDP-UHFFFAOYSA-N	203.010	2.559	50	30	BFGC	
Cc1nc(C(F)F)c(C(=O)Cl)s1	38855737	HWENYBAJCFKJIN-UHFFFAOYSA-N	211.620	2.768	50	30	BFGC	
Cc1ccc(/C=C(\C#N)C(=O)C2CC2)cc1	12366894	AEVVNPXEILMRIT-MDWZMJQESA-N	211.264	2.881	50	30	BFGC	
N#C[C@@H](Br)c1ccc(F)cc1	59788799	SOMMSAPOMZNYMY-MRVPVSSYSA-N	214.037	2.785	50	30	BFGC	
ClCc1nnc(C2CC2)n1-c1ccccc1	107836530	JLRTZGNPDISBML-UHFFFAOYSA-N	233.702	2.884	50	30	BFGC	
CC(C)(C)OC(=O)/C(C#N)=C/c1cccs1	101061	UAHKDVDNWQUOMA-VQHVLOKHSA-N	235.308	2.997	50	30	BFGC	
O=C(NNc1ccc(Cl)cc1)C1CCC1	152306	DTFDVTSEFOHQHK-UHFFFAOYSA-N	224.691	2.583	50	30	BFGC	
CC(C)=CC[C@@H]1C(C)=CC[C@H]2C(=O)OC(=O)[C@@H]12	111395149	KPKSFNJCYGUOHN-UTUOFQBUSA-N	234.295	2.625	50	30	BFGC	
C/C(=C\c1ccc(SC#N)cc1)[N+](=O)[O-]	34097828	UHRMSMOCULMYMJ-SOFGYWHQSA-N	220.253	2.897	50	30	BFGC	
CC(C)C[C@H](Br)C(=O)Cl	2507465	IQGRVWSONWFJJD-YFKPBYRVSA-N	213.502	2.561	50	30	BFGC	
CCCCOC(=O)N(CCl)CCl	5821401	SGGDXVVDVKMMSO-UHFFFAOYSA-N	214.092	2.618	50	30	BFGC	
COc1cc(C)cc(CBr)c1	32173478	MKSIZXUATJUOTA-UHFFFAOYSA-N	215.090	2.899	50	30	BFGC	
CCO[C@@H](C)OCCC/C=C/CCl	5860584	MUXGAZFAAQWFLD-DFVUYQKZSA-N	206.713	2.961	50	30	BFGC	
Cc1cc(CCl)nn1-c1ccccc1	57494322	LTOCWGQWDIVOIT-UHFFFAOYSA-N	206.676	2.920	50	30	BFGC	
CC(C)(C)[Si](C)(C)OCCC#CC=O	197113224	JRAGDQSEYMJYRC-UHFFFAOYSA-N	212.365	2.601	50	30	BFGC	
CCCc1cccc(CBr)n1	89228920	QJYGQKXCMTZKPG-UHFFFAOYSA-N	214.106	2.929	50	30	BFGC	
CSc1ccccc1C(=O)CBr	87224454	AUNZTDLSWWLACK-UHFFFAOYSA-N	245.141	2.986	50	30	BFGC	
Cc1cc(C)c(N=C=O)c(C)c1N=C=O	2568128	OSVNEGAPNXBADJ-UHFFFAOYSA-N	202.213	2.546	50	30	BFGC	
N#C/C(=C\c1cccnc1)c1ccccn1	4347860	PVWFGDMPXANTOE-XYOKQWHBSA-N	207.236	2.541	50	30	BFGC	
CO[C@H](CBr)c1ccc(F)cc1	50479710	HDOOWEISFUCYOU-SECBINFHSA-N	233.080	2.908	50	30	BFGC	
BrC[C@H]1COc2ccccc2C1	54711042	WEIMSLNSKYVNAV-QMMMGPOBSA-N	227.101	2.633	50	30	BFGC	
N#C/C(=C\Nc1ccc(F)cc1)C(=O)C1CC1	3083006	HZBHZVSXZFCDJC-CSKARUKUSA-N	230.242	2.624	50	30	BFGC	
Cc1cccc(N=C=O)c1Br	89064416	KMFRDJQHUIBYBY-UHFFFAOYSA-N	212.046	2.725	50	30	BFGC	
COC(=O)[C@@H](Br)c1cccc(C)c1	82550693	OCWPHTQJGJMISM-VIFPVBQESA-N	243.100	2.604	50	30	BFGC	
CC(C)c1ccc(N)c(C(=O)CCl)c1	39055558	ZVRODRPQRMISGC-UHFFFAOYSA-N	211.692	2.814	50	30	BFGC	
ClCc1nccc(-c2ccccc2)n1	83728599	NVDNLIQAZZNRRS-UHFFFAOYSA-N	204.660	2.882	50	30	BFGC	
CC(C)(C)OC(=O)N(CCCl)C1CC1	136529213	ODZAKGHQEOJHRP-UHFFFAOYSA-N	219.712	2.625	50	30	BFGC	
O=C(c1ccccc1)C(F)(F)CBr	199791758	BUNGICKCBOYJNZ-UHFFFAOYSA-N	249.054	2.900	50	30	BFGC	
Cc1occ(C(F)(F)F)c1C(=O)Cl	675050401	STLAONYMTMTOAO-UHFFFAOYSA-N	212.554	2.986	50	30	BFGC	
CC(=O)[C@H](Br)Cc1ccccc1	52229016	VVSQAKKEJGMRSP-SNVBAGLBSA-N	227.101	2.582	50	30	BFGC	
C[Si](C)(C)c1ccccc1C(=O)Cl	196798917	CLMNKQSTJHNSMB-UHFFFAOYSA-N	212.752	2.611	50	30	BFGC	
O=C(NNc1ccccc1F)c1cccs1	151480	ONDVUKOCPVKNNR-UHFFFAOYSA-N	236.271	2.644	50	30	BFGC	
N#C/C(=C\Nc1ccc(F)cc1F)C(=O)C1CC1	3083010	AJJYGPYSGHPSQM-VQHVLOKHSA-N	248.232	2.763	50	30	BFGC	
Cc1cc(C(F)(F)F)nc(CCl)n1	84198695	AWLKASJLKLQGLY-UHFFFAOYSA-N	210.586	2.543	50	30	BFGC	
C[C@@H]1CCCC[C@@H]1C(=O)CBr	39055805	YBNDUMHJNRWGBF-SFYZADRCSA-N	219.122	2.777	50	30	BFGC	
CC[C@@H](C)CC(=O)OC(=O)C[C@H](C)CC	100068291	CDWXQSOCLQJWKK-NXEZZACHSA-N	214.305	2.929	50	30	BFGC	
CCOC(=O)[C@H](Cl)c1ccc(F)cc1	50978515	LQIRIDDDKVDRFD-SECBINFHSA-N	216.639	2.669	50	30	BFGC	
ClC[C@@H]1CC1(Br)Br	135781115	SWIPJVZSGRVWTM-VKHMYHEASA-N	248.345	2.731	50	30	BFGC	
COC(=O)c1c(C)cccc1CBr	38436582	UDNSKBMNXZVXKW-UHFFFAOYSA-N	243.100	2.677	50	30	BFGC	
COC(=O)[C@H](Br)c1cccc(C)c1	82550694	OCWPHTQJGJMISM-SECBINFHSA-N	243.100	2.604	50	30	BFGC	
Cc1nc2ccc(N)c(SC#N)c2s1	45238125	IBVUFGAQFZRLGC-UHFFFAOYSA-N	221.310	2.760	50	30	BFGC	
CCC[C@@H](C)C(=O)OOC(=O)[C@H](C)CCC	100065747	RNXKQMBYNVOCNC-NXEZZACHSA-N	230.304	2.860	50	30	BFGC	
O=C(N=C=S)c1sccc1Br	82614137	BQECXOBHUFFGHJ-UHFFFAOYSA-N	248.126	2.754	50	30	BFGC	in-vitro
CC(C)(C)[Si](C)(C)OCC/C=C/CO	195942692	XPMXAAGISRJZIU-VOTSOKGWSA-N	216.397	2.947	50	30	BFGC	
C[C@@H](Br)C(=O)C1CCCCC1	40845238	BKMKMXLHLLWKTQ-SSDOTTSWSA-N	219.122	2.919	50	30	BFGC	
N#C[C@H](Br)CCc1ccccc1	127654667	HSUPLFJIPJPDEH-SNVBAGLBSA-N	224.101	2.906	50	30	BFGC	
CC1(C)CCC[C@H](CBr)O1	306276263	LUMCRRAGIXQCBJ-SSDOTTSWSA-N	207.111	2.729	50	30	BFGC	
C[C@H](Br)c1ccc(F)nc1	113151393	QFUSNVQYUWJDPB-YFKPBYRVSA-N	204.042	2.677	50	30	BFGC	
Clc1ccc(CCBr)cn1	34222606	SPFWUODXHKZRAI-UHFFFAOYSA-N	220.497	2.672	50	30	BFGC	in-vitro
Cc1ccncc1CCCBr	85443096	TUXIESANLAVTBW-UHFFFAOYSA-N	214.106	2.718	50	30	BFGC	
O=C1CCCCCC[C@H]1Br	142908106	NOOBPZPTDOIEMT-SSDOTTSWSA-N	205.095	2.673	50	30	BFGC	
Cc1ccc(N)cc1C(=O)C(Cl)Cl	100197975	IUKBKJHVUAZWGH-UHFFFAOYSA-N	218.083	2.564	50	30	BFGC	
CN(C)c1ccc(/C=C(\C#N)C(=O)C2CC2)cc1	165509	HURNBJPRUZJJPB-UKTHLTGXSA-N	240.306	2.639	50	30	BFGC	
O=C(Cl)c1ccc(Cl)cc1[N+](=O)[O-]	20578426	MMJYSVRCFSCVCI-UHFFFAOYSA-N	220.011	2.627	50	30	BFGC	in-vitro
CSc1ccccc1NC=C(C#N)C#N	167616	KWTPSOSZEVZQPV-UHFFFAOYSA-N	215.281	2.751	50	30	BFGC	
Cn1c(CCl)nnc1-c1ccc(Cl)cc1	95883567	ZMYWAVNTUVNPMI-UHFFFAOYSA-N	242.109	2.874	50	30	BFGC	
CCCCCCC/C=C/C=NNC(N)=O	383971985	ORVFBYVGLHGIGF-SABKRDHFSA-N	211.309	2.557	50	30	BFGC	
C[C@H]1C[C@H](CCBr)CCN1C	39110235	YBWVWNCRYIZHKI-DTWKUNHWSA-N	220.154	2.502	50	30	BFGC	
O=C1[C@@H](Br)CCCCC1(F)F	1535421474	ZYHCUKSJEUOVTH-YFKPBYRVSA-N	227.048	2.528	50	30	BFGC	
FC(F)(F)[C@@H]1C[C@@H]1CBr	57218877	DDNFMRMLLSCYSF-QWWZWVQMSA-N	203.001	2.580	50	30	BFGC	
Cc1ccc([C@H](Br)C(=O)O)cc1	71973185	PNPMVQRILWFYCW-QMMMGPOBSA-N	229.073	2.516	50	30	BFGC	in-vitro
O=C(Cl)[C@@H]1CC[C@H]2C=CC[C@H]1S2	256066434	BKMAIUCIMORVOF-BWZBUEFSSA-N	202.706	2.592	50	30	BFGC	
O=C(Cl)[C@H](Br)C1CCCC1	138421445	NLFYPILXYRGBFK-ZCFIWIBFSA-N	225.513	2.706	50	30	BFGC	
O=C(c1ccccc1)[C@@H](F)Br	39055734	CBLLCYODFDSRQA-MRVPVSSYSA-N	217.037	2.560	50	30	BFGC	
CCOC(=O)N(C[C@H](C)Cl)C[C@H](C)Cl	1684320	AMZPPCYQXDTKCJ-YUMQZZPRSA-N	242.146	2.700	50	30	BFGC	
ClCCCCCO[C@@H]1CCCCO1	5133882	WLHOOFDTKPBKIY-JTQLQIEISA-N	206.713	2.939	50	30	BFGC	
BrC[C@@H]1C[C@@H]2C=C[C@H]1CC2	390822153	MUDWRNMAPPGUIA-VGMNWLOBSA-N	201.107	2.984	50	30	BFGC	
CCC#CCCC1=C(CC)S(=O)(=O)S1	39102962	BZEUKZVULXYIQO-UHFFFAOYSA-N	230.354	2.878	50	30	BFGC	
CC1(C)CCC[C@@H](CBr)O1	306276264	LUMCRRAGIXQCBJ-ZETCQYMHSA-N	207.111	2.729	50	30	BFGC	
Cc1ccc(CBr)cc1[N+](=O)[O-]	39255779	FWTHBBJFYJTYHI-UHFFFAOYSA-N	230.061	2.798	50	30	BFGC	
CCCOC(=O)/C(C#N)=C/c1ccc(OC)cc1	3159550	MAZUUFMIUTXWHD-FMIVXFBMSA-N	245.278	2.555	50	30	BFGC	
O=C=NC1(c2ccc(F)cc2)CCCC1	41213359	LLVKJBKKMUMUKZ-UHFFFAOYSA-N	205.232	2.931	50	30	BFGC	
Cc1ccnc(C(Cl)Cl)c1[N+](=O)[O-]	100272581	WZSLSMYRMDDMGT-UHFFFAOYSA-N	221.043	2.774	50	30	BFGC	
COc1ncc(CCl)c2ccccc12	234938087	HMLOWMRLVRAOAY-UHFFFAOYSA-N	207.660	2.982	50	30	BFGC	in-vitro
CCOC(=O)N(C[C@H](C)Cl)C[C@@H](C)Cl	1684318	AMZPPCYQXDTKCJ-OCAPTIKFSA-N	242.146	2.700	50	30	BFGC	
C=C1CC[C@@H](CC(=O)O)[C@@]1(C)CBr	4243120	IACANXNJBCAXBM-WPRPVWTQSA-N	247.132	2.829	50	30	BFGC	
ClCc1ncc(Br)c(Cl)n1	84192604	OYBLBEOTQQUOAB-UHFFFAOYSA-N	241.903	2.631	50	30	BFGC	
CC(C)c1cccc(OC(=O)N(C)N=O)c1	5447549	AJHKCJXLTDAPCQ-UHFFFAOYSA-N	222.244	2.922	50	30	BFGC	
COCCOc1ccccc1CBr	36894700	YQCJTBBPOZKHDD-UHFFFAOYSA-N	245.116	2.607	50	30	BFGC	
CC(C)N1CCCC[C@H]1CBr	87755723	XLBCWUMABVWKDG-VIFPVBQESA-N	220.154	2.644	50	30	BFGC	
CO[Si](C)(CCc1ccc(C)cc1)OC	203535134	PYPWODPIJMONCS-UHFFFAOYSA-N	224.376	2.902	50	30	BFGC	
COc1ccc2onc(CBr)c2c1	307302260	NHXSPPCAKXACLR-UHFFFAOYSA-N	242.072	2.731	50	30	BFGC	
ClCc1cnc(Br)s1	34381113	VWMDVTRSZOQPEU-UHFFFAOYSA-N	212.499	2.644	50	30	BFGC	
FC(F)(F)c1ncc(CCl)s1	34492483	BKPIMPPWENQHIS-UHFFFAOYSA-N	201.600	2.901	50	30	BFGC	
COc1cc(CBr)ccc1C	54711034	HOMQOZDFTLOMCR-UHFFFAOYSA-N	215.090	2.899	50	30	BFGC	in-vitro
O=C1C[C@@H](c2ccc(Cl)cc2Cl)C(=O)O1	104669877	CLWZVLBRHGVATF-ZETCQYMHSA-N	245.061	2.551	50	30	BFGC	
CC#CC1=CC=C(C#CC#C[C@H]2CO2)SS1	3930261	UNABNUQQYPYJEQ-NSHDSACASA-N	244.340	2.578	50	30	BFGC	biogenic
F[C@H](CBr)CCBr	88260762	BMCLXWHPEBSQRQ-BYPYZUCNSA-N	233.906	2.504	50	30	BFGC	in-vitro
O=C1Nc2ccc(Br)cc2[C@@H]1Cl	205062061	NYSUUBCKDUOOJD-ZETCQYMHSA-N	246.491	2.681	50	30	BFGC	
C[C@@H]1CC(=O)[C@@H](Br)C(C)(C)C1	238413590	QCJDDOXLUJWMDA-HTRCEHHLSA-N	219.122	2.775	50	30	BFGC	
CN(/C=C/C=C(C#N)C#N)c1ccccc1	3126338	QQUSZXFQFAFNPO-WEVVVXLNSA-N	209.252	2.610	50	30	BFGC	
C=C1CC[C@H](CC(=O)O)[C@]1(C)CBr	4243123	IACANXNJBCAXBM-PSASIEDQSA-N	247.132	2.829	50	30	BFGC	
C[C@H]1CC[C@@H](C)N1CCCBr	33637152	ORHLQGXHGDUTKI-DTORHVGOSA-N	220.154	2.644	50	30	BFGC	
N#Cc1sccc1CBr	34087608	XUWKRXZHYHXSBI-UHFFFAOYSA-N	202.076	2.515	50	30	BFGC	
CC1(C)COC(C(C)(C)CCl)OC1	78210782	DXAKMRIDVPBZIA-UHFFFAOYSA-N	206.713	2.651	50	30	BFGC	in-vitro
CC(C)(C)[Si](C)(C)O[C@H]1CCC1=O	195909287	DRXPFRAWBNXHLO-VIFPVBQESA-N	200.354	2.740	50	30	BFGC	
Cc1ccnc(CCl)c1Br	307113389	RHXAVHOWNSOVQY-UHFFFAOYSA-N	220.497	2.891	50	30	BFGC	
CC(=O)/C(C#N)=C1\NC(C(C)(C)C)=CS1	12340004	GZXZBZNUZUSNQL-CSKARUKUSA-N	222.313	2.534	50	30	BFGC	
O=C(O)[C@H](Cl)c1cccc(Cl)c1	71509220	KTDVGGSTOFEZKZ-SSDOTTSWSA-N	205.040	2.705	50	30	BFGC	
COC(=O)[C@@H](C)[C@H](C)CCCCCl	199930059	AYQGRCBERLVTSR-BDAKNGLRSA-N	206.713	2.841	50	30	BFGC	
O=C1c2cc(Cl)ccc2C[C@H]1Br	19727219	AXZQGZAKEHWUSJ-MRVPVSSYSA-N	245.503	2.842	50	30	BFGC	
N#Cc1ccc(C(=O)Cl)cc1Cl	96300585	SYACXSOGYNXRBG-UHFFFAOYSA-N	200.024	2.591	50	30	BFGC	in-vitro
C[C@H](Br)COCc1ccccc1	238523254	SATHPABQWQPWIF-VIFPVBQESA-N	229.117	2.987	50	30	BFGC	
O=C(CCl)N[C@H]1CCc2cc3c(cc21)CCC3	33872331	CSQLKECBJSJIKI-ZDUSSCGKSA-N	249.741	2.518	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC1(CO)CC1	196315294	QEDXOKBWAUZWAL-UHFFFAOYSA-N	202.370	2.533	50	30	BFGC	
CC1=C[C@@H]1COC(=O)Oc1ccc([N+](=O)[O-])cc1	218913082	AYKFZTGRZMVSEY-SECBINFHSA-N	249.222	2.686	50	30	BFGC	
O=C(O)[C@H](Cl)c1ccccc1Cl	71509218	ZHNSTEQFVQPSMQ-SSDOTTSWSA-N	205.040	2.705	50	30	BFGC	
Cc1nc(C2CC2)c(C(=O)Cl)s1	39057156	MQUYUQXGPTVJOW-UHFFFAOYSA-N	201.678	2.708	50	30	BFGC	
CC(C)(C)OC(=O)NC1(CCl)CCC1	129723547	XOWWOCWENCBRHV-UHFFFAOYSA-N	219.712	2.673	50	30	BFGC	
CCC[C@H](O)C#C[Si](C)(C)C(Cl)Cl	195752828	QIAUEGMSDLCASN-QMMMGPOBSA-N	239.218	2.741	50	30	BFGC	
CCCCCCC(=O)C(=O)O[Si](C)(C)C	195766076	QFYWLKHRYDIOSX-UHFFFAOYSA-N	230.380	2.904	50	30	BFGC	
COc1ccc([C@H](Br)C#N)cc1	82292836	UMNFYLUEMMQTIP-SECBINFHSA-N	226.073	2.655	50	30	BFGC	
CO[Si](OC)(OC)[C@H]1CCC=CCCC1	216684918	KZPUVYZACVLAQO-NSHDSACASA-N	230.380	2.755	50	30	BFGC	
O=C(Cl)c1ccc(CCl)c(F)c1	34431104	ASFIRYPFAOUXFB-UHFFFAOYSA-N	207.031	2.944	50	30	BFGC	
CC(C)(C)[Si]1(C(C)(C)C)OCC(CO)CO1	196150916	ZEFFCLUNHXZJCC-UHFFFAOYSA-N	246.423	2.684	50	30	BFGC	
O[C@@H](CCl)c1cccc(Br)c1	34139890	FSNYFQPYJRBWNX-QMMMGPOBSA-N	235.508	2.721	50	30	BFGC	
CC(C)(C=O)O[Si](C)(C)C(C)(C)C	197757950	OQAQVPLXSFLMKL-UHFFFAOYSA-N	202.370	2.986	50	30	BFGC	
CC(F)(F)C1(CBr)CCOCC1	950757449	FKCHKEPOSQJGGA-UHFFFAOYSA-N	243.091	2.833	50	30	BFGC	
CCO[C@@H](C)c1ccc(C(=O)Cl)o1	39057178	QAQRAXYODVQGTD-LURJTMIESA-N	202.637	2.756	50	30	BFGC	
FC1(F)CC[C@@H]2C[C@@]21CBr	2265385541	IEWAQLFCFIMVML-PHDIDXHHSA-N	211.049	2.817	50	30	BFGC	
C[C@@H](Cl)c1nc(Cc2ccccc2)no1	26514896	IBXQJDXJNODHKZ-MRVPVSSYSA-N	222.675	2.960	50	30	BFGC	in-vitro
C[C@@H]1CC[C@@H](C)N1CCCBr	33637156	ORHLQGXHGDUTKI-RKDXNWHRSA-N	220.154	2.644	50	30	BFGC	
O=C(Cl)c1nc(Cl)sc1Cl	34318662	XPPODAHAHGTVBP-UHFFFAOYSA-N	216.476	2.829	50	30	BFGC	
ClCc1ncsc1Br	306636230	AXDKVTCLZYPCGD-UHFFFAOYSA-N	212.499	2.644	50	30	BFGC	
CO[C@H](CBr)Cc1ccc(F)cc1	521399617	NPNIAXSAEFMJGM-JTQLQIEISA-N	247.107	2.778	50	30	BFGC	
CCO[C@H](C)c1ccc(C(=O)Cl)o1	39057179	QAQRAXYODVQGTD-ZCFIWIBFSA-N	202.637	2.756	50	30	BFGC	
CCOP(=O)(CCCCl)OCC	39600833	XVLSVVVQJFTZNJ-UHFFFAOYSA-N	214.629	2.881	50	30	BFGC	
Cc1ccc(S(=O)(=O)O[Si](C)(C)C)cc1	195785152	GDEWVMDXPUXBKU-UHFFFAOYSA-N	244.388	2.535	50	30	BFGC	
C[C@H](C=O)CO[Si](C)(C)C(C)(C)C	195965081	OGQRYCJBALFGOQ-SECBINFHSA-N	202.370	2.843	50	30	BFGC	
CCN(CC)P(=O)(F)N(CC)CC	95704155	CLBUXACREGVPRZ-UHFFFAOYSA-N	210.233	2.748	50	30	BFGC	
CO[C@](C)(CBr)c1ccccc1	59367636	VFOYFMNCGSJADN-SNVBAGLBSA-N	229.117	2.943	50	30	BFGC	
CCOC(C[C@@H](Cl)C(F)(F)F)OCC	1535640482	MHAGBBDZQWYOFN-ZCFIWIBFSA-N	234.645	2.945	50	30	BFGC	
CCCCC[C@H](Br)C(C)=O	33506965	RXVLGSOXBONDHK-QMMMGPOBSA-N	207.111	2.919	50	30	BFGC	
CN(C)/C=C(\C#N)c1nc2ccccc2s1	80568	QZTAKHWWHZILEF-CMDGGOBGSA-N	229.308	2.722	50	30	BFGC	
CCn1c(CCl)nc2c(F)cccc21	37421808	CWAWHVSUOVPSSU-UHFFFAOYSA-N	212.655	2.934	50	30	BFGC	in-vitro
Clc1ncsc1CBr	114721086	UZOYFRYWWVKMAD-UHFFFAOYSA-N	212.499	2.691	50	30	BFGC	
ClC1(Cl)C[C@@H]1CCBr	197291328	FGEFGEHGRNIRQZ-BYPYZUCNSA-N	217.921	2.965	50	30	BFGC	
FC(F)(Cl)CCI	306174395	VNNGBUPQGBCOHK-UHFFFAOYSA-N	240.418	2.643	50	30	BFGC	
CO[C@@H](CBr)Cc1ccc(F)cc1	521399618	NPNIAXSAEFMJGM-SNVBAGLBSA-N	247.107	2.778	50	30	BFGC	
C[C@@H]1CCC[C@@H](C(=O)CBr)C1	39055762	ODLBURIROQYTMI-HTQZYQBOSA-N	219.122	2.777	50	30	BFGC	
O=C=NCc1cccc(C(F)(F)F)c1	62821980	NMHKJLDUKBCONC-UHFFFAOYSA-N	201.147	2.541	50	30	BFGC	in-vitro
CC(C)(N[Si](C)(C)C)C(=O)O[Si](C)(C)C	195789121	JBRYJRJOTQZDML-UHFFFAOYSA-N	247.487	2.568	50	30	BFGC	
O=C(NNc1ccccc1F)c1ccccc1	151494	MPOQIRAADPDYIU-UHFFFAOYSA-N	230.242	2.583	50	30	BFGC	
COC(=O)NN=C(C)c1ccc2ccccc2c1	254814984	WNPXERAJUZOZFV-UHFFFAOYSA-N	242.278	2.920	50	30	BFGC	
FC(F)COCc1nc(CCl)cs1	130700909	IWIKYMXPCIFXMH-UHFFFAOYSA-N	227.663	2.664	50	30	BFGC	
COC(=O)[C@@H](Cl)c1cc(F)c(F)c(F)c1	62707294	TWGMTJOJAIOEGA-ZETCQYMHSA-N	238.592	2.557	50	30	BFGC	
Fc1nc(CCl)ccc1C(F)(F)F	306758228	UALGYCJVCCRDLJ-UHFFFAOYSA-N	213.561	2.978	50	30	BFGC	
O=[N+]([O-])c1cc(Cl)cc(CCl)c1	1845489	QBIQAXWMONJLNW-UHFFFAOYSA-N	206.028	2.987	50	30	BFGC	
O[C@H](CCCCl)c1ccc(F)cc1	4072017	YTEUQGXRCFYPSA-SNVBAGLBSA-N	202.656	2.878	50	30	BFGC	in-vitro
CN(C)C=C(C=O)c1cccc(C(F)(F)F)c1	12861182	KFCUNHHGLYPCDW-UHFFFAOYSA-N	243.228	2.807	50	30	BFGC	
CO[C@H]1c2ccccc2OC[C@@H]1Br	299805495	QEFNHIIYXHHJES-WPRPVWTQSA-N	243.100	2.530	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC1(C=O)CCOCC1	669372179	LGFQQWYBLGSQFZ-UHFFFAOYSA-N	244.407	2.756	50	30	BFGC	
COc1ccc(C(=O)[C@H](F)Cl)cc1C	39055723	VPEMKGMQSPYZKC-JTQLQIEISA-N	216.639	2.721	50	30	BFGC	
O=C(CCCCl)c1cc(F)ccc1O	71464703	SXBSEPVUQCAIQD-UHFFFAOYSA-N	216.639	2.733	50	30	BFGC	in-vitro
Br[C@@H]1CCO[C@@H](c2cccnc2)C1	307055147	YKRRLBRBTLEKED-NXEZZACHSA-N	242.116	2.697	50	30	BFGC	
COC(=O)c1[nH]c2ccccc2c1SC#N	1535644404	GZIAEFNREPRTJG-UHFFFAOYSA-N	232.264	2.528	50	30	BFGC	
CC(C)c1ccc([C@@]2(C)CC(=O)OC2=O)cc1	59093956	OVEOPWLAPTZYDG-CQSZACIVSA-N	232.279	2.541	50	30	BFGC	in-vitro
CC(C)(C)OC(=O)c1ccc(N=C=O)cc1	96300687	RVYPZXSBYFJLDZ-UHFFFAOYSA-N	219.240	2.609	50	30	BFGC	in-vitro
CCNC(=O)NNc1c(Cl)cccc1Cl	115234	LODRGIZVDVUZRJ-UHFFFAOYSA-N	248.113	2.639	50	30	BFGC	
Cn1c(CCl)cnc1SC(F)(F)F	123290402	YLPJEWOTDCYDGN-UHFFFAOYSA-N	230.642	2.771	50	30	BFGC	
C[C@H]1CC(=O)[C@H](Br)C(C)(C)C1	238457312	QCJDDOXLUJWMDA-XPUUQOCRSA-N	219.122	2.775	50	30	BFGC	
Br[C@@H]1CCO[C@H](c2cccnc2)C1	307055150	YKRRLBRBTLEKED-ZJUUUORDSA-N	242.116	2.697	50	30	BFGC	
F[C@@H](CBr)CCBr	88260763	BMCLXWHPEBSQRQ-SCSAIBSYSA-N	233.906	2.504	50	30	BFGC	in-vitro
CCOC(COCc1ccccc1)=C(C#N)C#N	95930049	WOSFIKLUWDUPNN-UHFFFAOYSA-N	242.278	2.541	50	30	BFGC	
COC(=O)c1cc(CCl)c(Cl)s1	950757312	SFNYEXYYNLDDSF-UHFFFAOYSA-N	225.096	2.927	50	30	BFGC	
O=C=NCc1ccccc1C(F)(F)F	62822085	YSFIDUZQUVVVLY-UHFFFAOYSA-N	201.147	2.541	50	30	BFGC	in-vitro
C[C@@]1(CBr)C[C@H]1Br	307135537	RHKKJPVXVNWTTN-UHNVWZDZSA-N	227.927	2.555	50	30	BFGC	
CC(C)c1ccc(NNC(=O)c2ccno2)cc1	147728	KBIRMHUQGDTEBP-UHFFFAOYSA-N	245.282	2.555	50	30	BFGC	
Cc1cc(CCl)cc(Br)n1	95761932	DPQZUKALVPILNN-UHFFFAOYSA-N	220.497	2.891	50	30	BFGC	
ICCCC1CC1	221659663	VVWFXXSZVSSHHH-UHFFFAOYSA-N	210.058	2.612	50	30	BFGC	
CCCCC[C@@H](Br)C(C)=O	33506962	RXVLGSOXBONDHK-MRVPVSSYSA-N	207.111	2.919	50	30	BFGC	
O=C(O)[C@@H](Cl)c1cccc(Br)c1	71571452	ZGXWYKCWNADYQR-ZETCQYMHSA-N	249.491	2.814	50	30	BFGC	in-vitro
CC1=C[C@H](C=O)C(C=O)=C[C@H]2CC(C)(C)C[C@H]12	111400104	HIQBNLOFFXWCPW-OUCADQQQSA-N	232.323	2.939	50	30	BFGC	biogenic
COC(=O)c1oc([C@H](C)Cl)cc1C	82163140	LSDNHZRRFUVZKR-LURJTMIESA-N	202.637	2.674	50	30	BFGC	in-vitro
FC(F)c1nc(CBr)co1	642884527	LHDUBLOHWGTTLF-UHFFFAOYSA-N	211.993	2.507	50	30	BFGC	
CC[C@](Br)(C(=O)Cl)C(C)C	1535639590	SGMCEKCQFOOJLL-SSDOTTSWSA-N	227.529	2.952	50	30	BFGC	
COOC(=O)c1csc2ccccc12	100072095	NWGZAPWPWFERML-UHFFFAOYSA-N	208.238	2.620	50	30	BFGC	
FC1(F)[C@H]2C[C@H](CBr)C[C@H]21	307522525	HVJUHLMGAMROFL-STNDOWJSSA-N	211.049	2.673	50	30	BFGC	
CC[C@@H](Br)C(=O)c1ccc(O)cc1	223533346	MYJZGZFNWVQGHX-SECBINFHSA-N	243.100	2.748	50	30	BFGC	
N#CC1CCC(CBr)CC1	60228966	QYQXSDNRTNJKHA-UHFFFAOYSA-N	202.095	2.711	50	30	BFGC	in-vitro
COc1ccccc1P(C)c1ccccc1	2572435	WLPVFKXJHBTYJG-UHFFFAOYSA-N	230.247	2.758	50	30	BFGC	
BrC[C@H]1CCCC2(CCC2)O1	306210229	GLRJSIDPVZFEDT-MRVPVSSYSA-N	219.122	2.873	50	30	BFGC	
O=C(Cl)[C@H](Br)CCCCCl	196559806	ZAXUDUZCKDYFPL-RXMQYKEDSA-N	247.947	2.924	50	30	BFGC	in-vitro
BrC[C@@H]1CCCC12CCOCC2	300988143	VLAMFNNUIUKOKW-VIFPVBQESA-N	233.149	2.978	50	30	BFGC	
ClCc1cnccc1Br	95642399	GJXLYUKFBKGMSU-UHFFFAOYSA-N	206.470	2.583	50	30	BFGC	
Cc1cnc(Br)c(CCl)c1	95761931	XRFFNKFRDKQLIL-UHFFFAOYSA-N	220.497	2.891	50	30	BFGC	
COc1cccc(OCCCBr)c1	19093713	KWEIDOLHJXLAKX-UHFFFAOYSA-N	245.116	2.859	50	30	BFGC	
O=C(CBr)C12CCC(CC1)C2	710976433	KCPVQDSXYDGLKE-UHFFFAOYSA-N	217.106	2.531	50	30	BFGC	
CC(C)Oc1ccnc(CBr)c1	122550814	MVPTVOXQVNVTHI-UHFFFAOYSA-N	230.105	2.764	50	30	BFGC	
CO[C@H](CBr)C1CCCCC1	407985857	OLTZMHWMEBELEV-SECBINFHSA-N	221.138	2.977	50	30	BFGC	
CC1(C)CC(=O)c2nc(CCl)oc2C1	137244197	SOSMHGHRFZWGPP-UHFFFAOYSA-N	213.664	2.569	50	30	BFGC	in-vitro
O=C(Cl)N(CC(F)(F)F)CC(F)(F)F	219011283	PMOHCPXREIEFHF-UHFFFAOYSA-N	243.534	2.772	50	30	BFGC	
C[C@H](CCBr)C(F)(F)F	139280494	UBOUWYQHZBPKBQ-SCSAIBSYSA-N	205.017	2.970	50	30	BFGC	
Cc1nc2ccccc2n1C(=O)C(Cl)Cl	51075587	LWLUBBBLZLKJCA-UHFFFAOYSA-N	243.093	2.789	50	30	BFGC	
Cc1nc(CBr)c(C)s1	197076158	DOICGMYPJGJZJY-UHFFFAOYSA-N	206.108	2.655	50	30	BFGC	
Cc1ccc(C(=O)C(Cl)Cl)c(O)c1	100197888	HZRNHOPSZTVLBM-UHFFFAOYSA-N	219.067	2.687	50	30	BFGC	
C[C@H](Cl)c1cn(-c2ccccc2)nn1	75772319	FCWWQZQKCZWZMS-QMMMGPOBSA-N	207.664	2.567	50	30	BFGC	in-vitro
Cc1nc(-c2ccncc2)sc1C(=O)Cl	12370599	RABMJRMSTJUPEX-UHFFFAOYSA-N	238.699	2.893	50	30	BFGC	
O=C1C[C@@H]2CCCC[C@@H]2C[C@H]1Br	105179327	UHWFJMIIIQHSRW-HRDYMLBCSA-N	231.133	2.919	50	30	BFGC	
CCOC(=O)/C(C#N)=C\c1ccc(Cl)s1	4709810	PTUMZNNUVNFPHT-ALCCZGGFSA-N	241.699	2.872	50	30	BFGC	
O=C(O)c1cccc(CCl)c1Cl	125127094	VYTHYTHQDZFUNN-UHFFFAOYSA-N	205.040	2.777	50	30	BFGC	
Cc1cccc(NNC(=O)c2ccccc2)c1	151825	UMIBNWHWLJMMAJ-UHFFFAOYSA-N	226.279	2.752	50	30	BFGC	
CC[C@](C)(Br)CBr	71602638	GWFLFLQACQDTLD-YFKPBYRVSA-N	229.943	2.945	50	30	BFGC	
COC(=O)C12C[C@@H]3CC(C[C@H](C3)C1)[C@H]2Cl	263590108	YBOYZNLGOLWXPZ-UFKIKTHBSA-N	228.719	2.593	50	30	BFGC	
C[C@@H](CCBr)C(F)(F)F	139280385	UBOUWYQHZBPKBQ-BYPYZUCNSA-N	205.017	2.970	50	30	BFGC	
CC(C)N1CCCC[C@@H]1CBr	87755721	XLBCWUMABVWKDG-SECBINFHSA-N	220.154	2.644	50	30	BFGC	
N#Cc1cc(CBr)c(F)cc1F	238598009	OBSGQNHKKXVLHC-UHFFFAOYSA-N	232.027	2.731	50	30	BFGC	
COc1cc(CBr)cc(OC)c1C	136532102	CYVUSDVVLUCOTQ-UHFFFAOYSA-N	245.116	2.907	50	30	BFGC	
CCOC(=O)[C@@H](Cl)c1ccc(F)cc1	50978518	LQIRIDDDKVDRFD-VIFPVBQESA-N	216.639	2.669	50	30	BFGC	
CCC[C@H](C)C(=O)OOC(=O)[C@@H](C)CCC	100065744	RNXKQMBYNVOCNC-UWVGGRQHSA-N	230.304	2.860	50	30	BFGC	
CSc1ccc(C=C(C#N)C#N)s1	109217	BUXGKRDRBIGSFW-UHFFFAOYSA-N	206.295	2.901	50	30	BFGC	
ClC[C@@H]1[C@H]2CN(Cc3ccccc3)C[C@H]21	584641223	SDWJOFQWLNAKPM-XYYAHUGASA-N	221.731	2.603	50	30	BFGC	
CC(=O)c1ccc(OCC#CCCl)cc1	43465098	SHYFTRIVFDLORP-UHFFFAOYSA-N	222.671	2.510	50	30	BFGC	
BrC[C@@H]1CCC2(CCCC2)O1	96034503	HGXVTGSQNLKFAK-QMMMGPOBSA-N	219.122	2.873	50	30	BFGC	in-vitro
ClCc1ccc(-c2ccccn2)nc1	143937507	UWTQKKXRVWJVSY-UHFFFAOYSA-N	204.660	2.882	50	30	BFGC	
CC(=O)Nc1cccc(CCBr)c1	71423647	YLLCXWCDLGRQJK-UHFFFAOYSA-N	242.116	2.582	50	30	BFGC	
COc1ccc(C(=O)O[Si](C)(C)C)cc1	195781414	AYGQUFGXOJWAHD-UHFFFAOYSA-N	224.332	2.687	50	30	BFGC	
CC1(C)CC[C@@H](CBr)OC1	584880237	NWWOFDDZNBWTTJ-ZETCQYMHSA-N	207.111	2.587	50	30	BFGC	in-vitro
Clc1nc(CBr)cs1	223037328	DRSACQLXZFTVBL-UHFFFAOYSA-N	212.499	2.691	50	30	BFGC	
FC1(F)[C@@H]2CC(CBr)C[C@H]21	103611043	HVJUHLMGAMROFL-PHDIDXHHSA-N	211.049	2.673	50	30	BFGC	
CCCN(CCC)CCBr	37624012	FGCAKJQRXQLMEA-UHFFFAOYSA-N	208.143	2.503	50	30	BFGC	
CCCC(C)(C)C[C@]1(C)OOOC(=O)O1	263584470	UIWRKSUOGIAAMQ-JTQLQIEISA-N	218.249	2.949	50	30	BFGC	
O[C@H]1C[C@H]2CCCC[C@@H]2C[C@H]1Br	2265364116	APHARBZZYBGGFC-KYXWUPHJSA-N	233.149	2.711	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC[C@@H]1CC[C@H](O)CO1	195968228	ZSMXKOXSMIVAQR-QWRGUYRKSA-N	246.423	2.548	50	30	BFGC	
FC(F)(F)[C@H](Br)[C@@H]1CCCOC1	725269071	CMHLUSDQFBRQMT-PHDIDXHHSA-N	247.054	2.739	50	30	BFGC	
Fc1ccc(C2=NO[C@H](CCl)C2)cc1	69969718	WCZFVCMOANNSEE-VIFPVBQESA-N	213.639	2.558	50	30	BFGC	in-vitro
COc1nc2ccccc2cc1CCl	20469240	NAVYHPAMBVAVQA-UHFFFAOYSA-N	207.660	2.982	50	30	BFGC	
C[C@@H](Br)c1ccc(F)nc1	113151390	QFUSNVQYUWJDPB-RXMQYKEDSA-N	204.042	2.677	50	30	BFGC	
ClCCCCCO[C@H]1CCCCO1	5133899	WLHOOFDTKPBKIY-SNVBAGLBSA-N	206.713	2.939	50	30	BFGC	
Br[C@H]1C[C@@H](Oc2ccccc2)C1	521399819	UZKVQJRHVMXOPX-WAAGHKOSSA-N	227.101	2.991	50	30	BFGC	
CC(=O)OCCO[Si](C)(C)C(C)(C)C	585666523	XEEZLGZJXJUDTA-UHFFFAOYSA-N	218.369	2.571	50	30	BFGC	
CC[C@@](Br)(C(=O)Cl)C(C)C	1535639594	SGMCEKCQFOOJLL-ZETCQYMHSA-N	227.529	2.952	50	30	BFGC	
CC(C)(C)[Si](C)(C)OCc1cccc[n+]1[O-]	382683667	CRRWTSSOTLCXRR-UHFFFAOYSA-N	239.391	2.842	50	30	BFGC	in-vitro
COC(=O)[C@@H](Cl)c1ccc(F)c(Cl)c1	82548661	VQSALKGMVWNVCK-QMMMGPOBSA-N	237.057	2.932	50	30	BFGC	
O[C@@H](CBr)c1ccccc1Cl	12506196	ZASGHPFWAAEKAD-QMMMGPOBSA-N	235.508	2.768	50	30	BFGC	
CC(=O)Nc1ccc(CCBr)cc1	60120891	PTMFXPFUQJDWFO-UHFFFAOYSA-N	242.116	2.582	50	30	BFGC	
Cc1noc(C2CC2)c1CBr	148761363	PDPNJUCAENRVGW-UHFFFAOYSA-N	216.078	2.755	50	30	BFGC	
ClCc1csc(COC2CCC2)n1	50520837	AUHLUBPAFLIFGY-UHFFFAOYSA-N	217.721	2.951	50	30	BFGC	
ClCc1csc(Cc2ccccn2)n1	36888893	MFPXVNFEFOPNCU-UHFFFAOYSA-N	224.716	2.868	50	30	BFGC	
Cc1ccc([C@@H](Br)C(=O)O)cc1	71973186	PNPMVQRILWFYCW-MRVPVSSYSA-N	229.073	2.516	50	30	BFGC	in-vitro
COC(=O)C1CCC(CCBr)CC1	2265384992	OIKOJEDBZVJKKB-UHFFFAOYSA-N	249.148	2.751	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC[C@@H]1CCC(=O)CO1	195949187	MSXQNPGCJIQANM-NSHDSACASA-N	244.407	2.756	50	30	BFGC	
O=[S@](Cl)c1nc2ccccc2s1	100295601	HEZHHILXQNYPGN-GFCCVEGCSA-N	217.702	2.558	50	30	BFGC	
CC(C)c1cc(CBr)on1	34384534	XPGUOAQTTSKMGE-UHFFFAOYSA-N	204.067	2.693	50	30	BFGC	
CCOC(=O)[C@@H](Cl)CCc1ccccc1	44564049	RDLGEYYAZNBHHJ-NSHDSACASA-N	226.703	2.790	50	30	BFGC	
CC(C)(C)c1coc(CBr)n1	667361958	YQAZZKUJFFRPES-UHFFFAOYSA-N	218.094	2.867	50	30	BFGC	
C=CCC1(CBr)CCOCC1	306359064	BWZXJVLPGVASOO-UHFFFAOYSA-N	219.122	2.754	50	30	BFGC	
C[C@H](Cl)[C@H]1CC(c2ccccc2)=NO1	88611597	SWUWNDHGDIMKJS-GZMMTYOYSA-N	209.676	2.807	50	30	BFGC	in-vitro
Clc1ncnc2c1[C@@H](Br)N=N2	2265362040	FTJOSEHMJHQHOP-VKHMYHEASA-N	233.456	2.621	50	30	BFGC	
O=C(F)C1(F)C(F)=C(F)C(F)=C1F	39057190	BSDHWGUZWZLJDB-UHFFFAOYSA-N	202.053	2.506	50	30	BFGC	
Cc1cc(C)c(CBr)cn1	231384748	GNIFZXLTPFQMPB-UHFFFAOYSA-N	200.079	2.593	50	30	BFGC	
ClCc1c[nH]c(CCc2ccccc2)n1	62820664	PJPSQYPITKVYDN-UHFFFAOYSA-N	220.703	2.934	50	30	BFGC	in-vitro
O=C(CCCl)c1ccc(F)cc1F	1671529	XQSNRAJSOXNDGV-UHFFFAOYSA-N	204.603	2.776	50	30	BFGC	in-vitro
Clc1ncnc2c1[C@H](Br)N=N2	2265362039	FTJOSEHMJHQHOP-GSVOUGTGSA-N	233.456	2.621	50	30	BFGC	
C[C@@H](CBr)CN1CCCCC1	83156839	MEKQJGGKSZDYQX-VIFPVBQESA-N	220.154	2.503	50	30	BFGC	
CN(C)C=C(C#N)c1ccc(-n2cccc2)cc1	2265270115	YQWIBMUHHRKKOI-UHFFFAOYSA-N	237.306	2.903	50	30	BFGC	
CC1(C)OC[C@@H](C(C)(C)CBr)O1	1536179641	BOKKYNDUNICYSP-ZETCQYMHSA-N	237.137	2.559	50	30	BFGC	
COC(=O)Nc1ccc(CBr)cc1	258101940	XUKIVPRPJHTDHK-UHFFFAOYSA-N	244.088	2.760	50	30	BFGC	
CC[C@H](C)N(C)CCCBr	40990697	AXKWAWDMRDPEFA-QMMMGPOBSA-N	208.143	2.502	50	30	BFGC	
Fc1cccc(F)c1-n1ccc(CCl)n1	83255056	AUJDOLJKHPAHSG-UHFFFAOYSA-N	228.629	2.889	50	30	BFGC	in-vitro
C/C(=N/NC(N)=O)[C@]12CCCC=C1CCCC2	5566030	ICOVNGHKWQHBFJ-NWFCWYBLSA-N	235.331	2.701	50	30	BFGC	
C[C@@H]1CC(CCBr)C[C@@H](C)N1	39110223	PUTOZQUWLIEWCZ-HTQZYQBOSA-N	220.154	2.548	50	30	BFGC	
BrCCC1CCC2(CC1)OCCO2	90129463	GAVAWVLUBOFGGV-UHFFFAOYSA-N	249.148	2.705	50	30	BFGC	
Cl[C@H]1CC2(c3ccccc3)CCN1CC2	32167514	NLLKUNTTXKUARA-GFCCVEGCSA-N	221.731	2.989	50	30	BFGC	
O=C(c1c[nH]c2ccccc12)[C@@H](F)Cl	45787471	PRPZERJSAJABNU-SNVBAGLBSA-N	211.623	2.885	50	30	BFGC	
CC(C)C[C@@H]1C[C@H](C)[C@H](C)[C@@H]2C(=O)OC(=O)[C@@H]21	255983864	KRJWZSVZTBPCNN-HHHUOAJASA-N	238.327	2.640	50	30	BFGC	
N#CSCC(=O)c1c[nH]c2ccccc12	35245678	MDNHLLQPPYPBBL-UHFFFAOYSA-N	216.265	2.565	50	30	BFGC	
Fc1cnc(C(F)(F)F)cc1CCl	306917383	ZBUKWHMEPKUXDB-UHFFFAOYSA-N	213.561	2.978	50	30	BFGC	
COc1ccc([C@@H](Br)C#N)cc1	82292837	UMNFYLUEMMQTIP-VIFPVBQESA-N	226.073	2.655	50	30	BFGC	
C[C@H](CBr)CN1CCCCC1	83156838	MEKQJGGKSZDYQX-SECBINFHSA-N	220.154	2.503	50	30	BFGC	
BrC[C@@H]1O[C@H]1c1ccccc1	135734455	CBGMFGUNEQKSGF-IUCAKERBSA-N	213.074	2.521	50	30	BFGC	
Cc1nnc(-c2ccc(CCl)cc2)o1	95931576	CLTPTRKSYKZWDD-UHFFFAOYSA-N	208.648	2.784	50	30	BFGC	
Cl[C@H]1C[C@@H](Cl)[C@H](Cl)[C@@H]1Cl	101694539	ZFMWDTNZPKDVBU-YPVPKEFPSA-N	207.915	2.820	50	30	BFGC	
CC1(C)C[C@@H](Br)C(C)(C)O1	86927838	OPEWXPZVQAEICL-ZCFIWIBFSA-N	207.111	2.727	50	30	BFGC	
F[C@H](Cl)C(F)(F)OC(Cl)Cl	111853908	FTIQRZXWIUQTJF-SFOWXEAESA-N	217.401	2.891	50	30	BFGC	
CC1(C)C[C@H](CBr)C(C)(C)O1	86928438	FQOXUQMZKUPLIC-SSDOTTSWSA-N	221.138	2.975	50	30	BFGC	
C[Si](C)O[Si](C)(C)O[Si](C)(C)C	195815195	GDDVTIGTERZVBW-UHFFFAOYSA-N	221.501	2.807	50	30	BFGC	
N#CC(C#N)=Cc1sccc1Br	110955	FTNOTDCASXIJBO-UHFFFAOYSA-N	239.097	2.941	50	30	BFGC	
ClCc1ccc(O[C@@H]2CCOC2)cc1	69623716	FUUOAIKCEFOQRM-LLVKDONJSA-N	212.676	2.593	50	30	BFGC	
O=C1CCCCCC[C@@H]1Br	142908336	NOOBPZPTDOIEMT-ZETCQYMHSA-N	205.095	2.673	50	30	BFGC	
C[C@H](O[Si](C)(C)C)C(=O)O[Si](C)(C)C	195781273	HXRGKEOWDNVHPA-QMMMGPOBSA-N	234.444	2.605	50	30	BFGC	
CC1(C)C(I)C1(C)C	199899619	LFHCFQXGOKJEMZ-UHFFFAOYSA-N	224.085	2.856	50	30	BFGC	
CCc1ccc(CBr)nc1	238358702	PKBDFXUNCVJHKS-UHFFFAOYSA-N	200.079	2.539	50	30	BFGC	
CCCCOC(=O)CCCBr	2580755	DOIADMYDAWSCKD-UHFFFAOYSA-N	223.110	2.505	50	30	BFGC	in-vitro
Fc1ncc(Br)cc1CCl	238594045	BRBBUNAIOJHELV-UHFFFAOYSA-N	224.460	2.722	50	30	BFGC	
BrC[C@H]1COc2ccccc21	69910588	LGXKHJGWWLOXMI-ZETCQYMHSA-N	213.074	2.558	50	30	BFGC	in-vitro
CC(C)C[C@@H]1C[C@H](C)[C@H](C)[C@@H]2C(=O)OC(=O)[C@H]21	255983866	KRJWZSVZTBPCNN-SVNGYHJRSA-N	238.327	2.640	50	30	BFGC	
CC(C)(N=C=O)c1ccc(C(C)(C)N=C=O)cc1	95851800	AGJCSCSSMFRMFQ-UHFFFAOYSA-N	244.294	2.828	50	30	BFGC	
O=C(Cl)c1cccc(-c2ncccn2)c1	12370555	QCFDCOOCAWCFFV-UHFFFAOYSA-N	218.643	2.523	50	30	BFGC	
CCCC(CCC)[C@H](C)NC(=O)CCl	33755743	XSCQBMDVQIGAMV-VIFPVBQESA-N	219.756	2.946	50	30	BFGC	
O=[N+]([O-])c1ccc(CCl)cc1Cl	114072211	CWZFCODXQLRLSI-UHFFFAOYSA-N	206.028	2.987	50	30	BFGC	
ClCCc1c[nH]c2nc(Cl)ccc12	34556879	HQEAWDBYRKZEHE-UHFFFAOYSA-N	215.083	2.998	50	30	BFGC	
C[Si](C)(C)OC1CN(Cc2ccccc2)C1	195801159	GGTBVKOJUABMSG-UHFFFAOYSA-N	235.403	2.722	50	30	BFGC	
COC1(CBr)CCCCC1	50479685	QZEDTANNGGHAKC-UHFFFAOYSA-N	207.111	2.731	50	30	BFGC	
N#C[C@@H]1CCc2ccc(C(=O)Cl)cc21	39057309	YZVFQWWARVKPAL-VIFPVBQESA-N	205.644	2.619	50	30	BFGC	
Fc1ccccc1-n1ccc(CCl)n1	84179474	UTKNPMLLJQPUJI-UHFFFAOYSA-N	210.639	2.750	50	30	BFGC	in-vitro
CC[C@H](C)CC(=O)OC(=O)C[C@H](C)CC	100068283	CDWXQSOCLQJWKK-AOOOYVTPSA-N	214.305	2.929	50	30	BFGC	
O=C(Nc1ccccc1F)C(Cl)Cl	138702	QTWULMASGKOCHL-UHFFFAOYSA-N	222.046	2.568	50	30	BFGC	
C[C@H](CBr)OCc1ccccc1	34385848	SOWXYALCNFHLEQ-SECBINFHSA-N	229.117	2.987	50	30	BFGC	
BrC[C@@H]1COc2ccccc2C1	54711041	WEIMSLNSKYVNAV-MRVPVSSYSA-N	227.101	2.633	50	30	BFGC	
COc1ccc(OC)c(CCBr)c1	55234973	OMALKMWOCZAJEA-UHFFFAOYSA-N	245.116	2.641	50	30	BFGC	
C[C@@H](Br)C(=O)c1ccsc1	39055818	DYYYRVLXWCYBPK-RXMQYKEDSA-N	219.103	2.714	50	30	BFGC	
BrCC(CBr)C1CC1	536948506	SVLFWQMFMKSSGH-UHFFFAOYSA-N	241.954	2.802	50	30	BFGC	
CC(C)(O)C#CCO[Si](C)(C)C(C)(C)C	396049238	BCOOHOFAFOLFMF-UHFFFAOYSA-N	228.408	2.783	50	30	BFGC	in-vitro
COC(=O)[C@H](C)[C@H](C)CCCCCl	199929996	AYQGRCBERLVTSR-RKDXNWHRSA-N	206.713	2.841	50	30	BFGC	
C[C@@H](Br)CO[Si](C)(C)C	238403079	KCWYLWYVFLTTJV-ZCFIWIBFSA-N	211.175	2.621	50	30	BFGC	
O=C(Cl)[C@@H](Br)CCCCCl	196559798	ZAXUDUZCKDYFPL-YFKPBYRVSA-N	247.947	2.924	50	30	BFGC	in-vitro
CCC1(CBr)CCOCC1	84193077	IOFJLSXFUGBEFL-UHFFFAOYSA-N	207.111	2.588	50	30	BFGC	
Cc1ccccc1CNCCCBr	95829363	IHMOXVXKYIGOAE-UHFFFAOYSA-N	242.160	2.870	50	30	BFGC	in-vitro
ClCc1cccc(Cn2cccn2)c1	223706763	WJAYNHQTQPFENJ-UHFFFAOYSA-N	206.676	2.670	50	30	BFGC	
O=[N+]([O-])c1ccc2nc(CCl)ccc2c1	39261292	BWRZMNAKJWZHKT-UHFFFAOYSA-N	222.631	2.882	50	30	BFGC	
C[C@@H](Cl)c1ncc(Br)cn1	87736122	XCXUCFNAELZPCB-SCSAIBSYSA-N	221.485	2.539	50	30	BFGC	in-vitro
CC(C)C[C@@H]1C[C@H](C)[C@H](C)[C@H]2C(=O)OC(=O)[C@H]12	255983865	KRJWZSVZTBPCNN-PREPNJAASA-N	238.327	2.640	50	30	BFGC	
BrCC1([C@H]2CCCCO2)CC1	667355201	YNNPCDZFEHZPBF-MRVPVSSYSA-N	219.122	2.731	50	30	BFGC	
CC(C)(C)O[C@H]1C[C@@H](CBr)C1	1535645574	JGOAYDOOCRZIFD-OCAPTIKFSA-N	221.138	2.975	50	30	BFGC	
ClCCn1cc(-c2ccccc2)cn1	54961095	JYEPRDOOVHQEEK-UHFFFAOYSA-N	206.676	2.789	50	30	BFGC	in-vitro
Cc1ccc(C(F)(F)F)cc1N=C=O	84193205	JYTRCTAWJLPNDL-UHFFFAOYSA-N	201.147	2.981	50	30	BFGC	
O=C(Cc1ccc(Cl)cc1)N=C=S	35660174	BQSWVPRCAJICIY-UHFFFAOYSA-N	211.673	2.512	50	30	BFGC	
O=C(O)[C@@H](Br)c1cccc(Cl)c1	116669781	YXFVWXWKXCZRTF-ZETCQYMHSA-N	249.491	2.861	50	30	BFGC	
C[Si](C)(CCl)CCBr	238456064	IUSSMXZKYHRCAX-UHFFFAOYSA-N	215.594	2.868	50	30	BFGC	
CCOC(=O)N/N=C(\CC)c1ccccc1	4709786	KRRSHWAJLXJURK-ACCUITESSA-N	220.272	2.547	50	30	BFGC	
CC(=O)Oc1cc(C)cc(CBr)c1	95938307	PNDWCHUISBCRIV-UHFFFAOYSA-N	243.100	2.815	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC[C@H]1CC[C@H](O)CO1	214928605	ZSMXKOXSMIVAQR-WDEREUQCSA-N	246.423	2.548	50	30	BFGC	
CCCC(C)(C)C[C@@]1(C)OOOC(=O)O1	263584471	UIWRKSUOGIAAMQ-SNVBAGLBSA-N	218.249	2.949	50	30	BFGC	
Cc1cc(C)c(C#N)c(SCC=CC#N)n1	2265233833	IIXGUGRSXRLTDN-UHFFFAOYSA-N	229.308	2.742	50	30	BFGC	
CCN(CCCBr)CC(F)(F)F	42779529	VSTMIKYZOHFMFG-UHFFFAOYSA-N	248.086	2.656	50	30	BFGC	in-vitro
O=C(O)[C@H](Cl)c1cccc(Br)c1	71571454	ZGXWYKCWNADYQR-SSDOTTSWSA-N	249.491	2.814	50	30	BFGC	in-vitro
COC(OC)[C@@H](Cl)CCc1ccccc1	616582998	SPUGGFKYDKGUBJ-NSHDSACASA-N	228.719	2.846	50	30	BFGC	
Cc1ccc(NNC(=O)C2CCC2)cc1C	152127	NTTDSDVSBFFWKA-UHFFFAOYSA-N	218.300	2.547	50	30	BFGC	
O=C(CCCCl)c1ccnc(Cl)c1	95931701	CLEIGVVCPBVOGR-UHFFFAOYSA-N	218.083	2.937	50	30	BFGC	
CCC[C@@H](O)C#C[Si](C)(C)C(Cl)Cl	195752829	QIAUEGMSDLCASN-MRVPVSSYSA-N	239.218	2.741	50	30	BFGC	
CC#CC(=O)[C@H](C)O[Si](C)(C)C(C)(C)C	238856572	WHLAMDQNZQFMLM-JTQLQIEISA-N	226.392	2.989	50	30	BFGC	in-vitro
FC(F)(F)Oc1ccc(CCl)nc1	238534574	WTXDLQCNOZMUBG-UHFFFAOYSA-N	211.570	2.719	50	30	BFGC	
Fc1ccc2nc(CCl)[nH]c2c1F	76041054	COFYXFSSDRHBSB-UHFFFAOYSA-N	202.591	2.580	50	30	BFGC	
CC(C)S(=O)(=O)c1ccc(CCl)cc1	82546826	ZNDHXUBWMCJHSS-UHFFFAOYSA-N	232.732	2.608	50	30	BFGC	in-vitro
FCCCCCCI	2040706	NOXBILFYPISOMD-UHFFFAOYSA-N	230.064	2.951	50	30	BFGC	
ClCc1ccn(CCc2ccccc2)n1	238854630	OPFONDVFAHVQLK-UHFFFAOYSA-N	220.703	2.865	50	30	BFGC	
Cc1ccc(Br)nc1CCl	238540115	XSZNGXXLXIWVIH-UHFFFAOYSA-N	220.497	2.891	50	30	BFGC	
FC(F)(F)[C@@H]1C[C@H]1CBr	57218878	DDNFMRMLLSCYSF-IUYQGCFVSA-N	203.001	2.580	50	30	BFGC	
CO[C@@H](CBr)C1CCCCC1	407985862	OLTZMHWMEBELEV-VIFPVBQESA-N	221.138	2.977	50	30	BFGC	
N#C[C@H](Br)c1ccc(F)cc1	59788800	SOMMSAPOMZNYMY-QMMMGPOBSA-N	214.037	2.785	50	30	BFGC	
O=C=NCc1ccc(Br)cc1Cl	238566413	XTUYHNQXBHGZRD-UHFFFAOYSA-N	246.491	2.938	50	30	BFGC	
C/C(=C\CCl)CS(=O)(=O)c1ccccc1	22007542	ZFPKVGLCPNFQJH-JXMROGBWSA-N	244.743	2.645	50	30	BFGC	
N#CC1=Cc2cccc(Br)c2OC1	198649851	LPHYJHGOGPSBMP-UHFFFAOYSA-N	236.068	2.748	50	30	BFGC	
CO[C@@H](CBr)C1CCCC1	238374139	LDKRXSVVYQCAFO-QMMMGPOBSA-N	207.111	2.587	50	30	BFGC	
FC(F)(F)[C@H](Br)[C@H]1CCCOC1	725269069	CMHLUSDQFBRQMT-NTSWFWBYSA-N	247.054	2.739	50	30	BFGC	
COC(=O)[C@@H](Br)c1ccccc1C	39273923	NDDRCRIJXMICQS-VIFPVBQESA-N	243.100	2.604	50	30	BFGC	
C[C@@H]1C[C@@H](CCBr)CCN1C	39110237	YBWVWNCRYIZHKI-BDAKNGLRSA-N	220.154	2.502	50	30	BFGC	
CCc1cncc(CBr)c1	39120783	XKFHZDPSVYEWJS-UHFFFAOYSA-N	200.079	2.539	50	30	BFGC	
BrCCSc1ccncc1	87110092	ZUXNSAWDSDMHQO-UHFFFAOYSA-N	218.119	2.569	50	30	BFGC	
C=C(O[Si](C)(C)C)C(=O)O[Si](C)(C)C	195781967	WRBWZWGIWNGSRX-UHFFFAOYSA-N	232.428	2.730	50	30	BFGC	
O=P(CS)(c1ccccc1)c1ccccc1	221093548	CMBCUMGRFICDHC-UHFFFAOYSA-N	248.287	2.888	50	30	BFGC	
CC[C@@](C)(Br)CBr	71602640	GWFLFLQACQDTLD-RXMQYKEDSA-N	229.943	2.945	50	30	BFGC	
C[P@](=O)(F)c1c(F)c(F)c(F)c(F)c1F	222088007	CLGZENXRNXBZGC-OAHLLOKOSA-N	248.062	2.885	50	30	BFGC	
COC(=O)[C@@H](Br)c1ccc(C)cc1	22010876	FCYCFLODHZGXDV-VIFPVBQESA-N	243.100	2.604	50	30	BFGC	
CC(=O)[C@H](Br)Cc1ccccc1F	52228429	BGERWDDYWDRTKN-SECBINFHSA-N	245.091	2.721	50	30	BFGC	in-vitro
CC1(C)COC(CCCBr)OC1	2516074	XRPHKETWWXGCAT-UHFFFAOYSA-N	237.137	2.561	50	30	BFGC	
Fc1ccc(Cc2noc(CCl)n2)cc1	34974092	URRYAPDXDYWJLI-UHFFFAOYSA-N	226.638	2.538	50	30	BFGC	in-vitro
BrC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	675072540	DOFZHJPKLUBFRU-ABXGFROZSA-N	201.107	2.673	50	30	BFGC	
FC(F)(F)c1nc(CBr)co1	642884576	NLFBNKJPMXFAHU-UHFFFAOYSA-N	229.983	2.588	50	30	BFGC	
CCOC(=O)[C@H](Cl)CCc1ccccc1	44564047	RDLGEYYAZNBHHJ-LLVKDONJSA-N	226.703	2.790	50	30	BFGC	
BrC[C@@H]1Cc2ccccc2CO1	90394397	PEYMTLILTINUML-JTQLQIEISA-N	227.101	2.523	50	30	BFGC	
O=C(CBr)CCC1CCCC1	38549183	VLWWDRCISXMLLG-UHFFFAOYSA-N	219.122	2.921	50	30	BFGC	in-vitro
CC1(C)[C@H]2CC[C@]1(C)C(=NNC(=O)CCl)C2	252581839	OBYXIOFDPWYYST-QPUJVOFHSA-N	242.750	2.544	50	30	BFGC	
Cc1ccnc(C)c1CBr	201047826	JUMWAELARWKCAX-UHFFFAOYSA-N	200.079	2.593	50	30	BFGC	
O[C@@H](CCl)c1ccc(Br)cc1	12506175	NGBKYBZRHPFKQX-QMMMGPOBSA-N	235.508	2.721	50	30	BFGC	in-vitro
Cc1ccc(CCBr)s1	82955101	GYGABVLGQGREHG-UHFFFAOYSA-N	205.120	2.994	50	30	BFGC	
O=C=Nc1ccc(C(F)(F)F)c(F)c1	34239134	LZQASWKDHGNIHY-UHFFFAOYSA-N	205.110	2.812	50	30	BFGC	
COC(=O)[C@H](Cl)c1ccc(F)c(Cl)c1	82548660	VQSALKGMVWNVCK-MRVPVSSYSA-N	237.057	2.932	50	30	BFGC	
BrC[C@@H]1CCCC2(CCC2)O1	306210231	GLRJSIDPVZFEDT-QMMMGPOBSA-N	219.122	2.873	50	30	BFGC	
COC[C@H](Br)c1ccccc1	114580514	FUAVWPFMMGDSHF-VIFPVBQESA-N	215.090	2.769	50	30	BFGC	
COc1ccc(Cl)c(C(=O)Cl)c1	39057283	KETKGSXSUASDMR-UHFFFAOYSA-N	205.040	2.728	50	30	BFGC	
FC1(F)[C@H]2CC(CBr)C[C@@H]21	103611052	HVJUHLMGAMROFL-WDSKDSINSA-N	211.049	2.673	50	30	BFGC	
COC(=O)C12C[C@@H]3CC(C[C@H](C3)C1)[C@@H]2Cl	100077284	YBOYZNLGOLWXPZ-LVTSGBCKSA-N	228.719	2.593	50	30	BFGC	
Cc1cccc(NNC(=O)c2cccs2)c1	151815	IXWUKKIIQYDXLH-UHFFFAOYSA-N	232.308	2.813	50	30	BFGC	
Oc1c(F)c(F)c(CCl)c(F)c1F	149029527	FYYDZKXCDSFSEK-UHFFFAOYSA-N	214.545	2.687	50	30	BFGC	
CC(C)(C(=O)CBr)c1ccccc1	87224513	CTLIUECECLLPLN-UHFFFAOYSA-N	241.128	2.928	50	30	BFGC	
Cl[C@H]1C[C@@H](Cl)[C@H](Cl)[C@H]1Cl	2001309	ZFMWDTNZPKDVBU-QTBDOELSSA-N	207.915	2.820	50	30	BFGC	
O=C(Cl)c1ccc(OC2CCOCC2)cc1	12370467	YTRCHFVXEUWTFK-UHFFFAOYSA-N	240.686	2.623	50	30	BFGC	
Oc1cccc(CCl)c1Br	238724160	ICYGSBQQYGUDQQ-UHFFFAOYSA-N	221.481	2.894	50	30	BFGC	
COCCOc1cccc(CBr)c1	36894810	XVTRFVQEOUESFM-UHFFFAOYSA-N	245.116	2.607	50	30	BFGC	
C=C1CC[C@H](CC(=O)O)[C@@]1(C)CBr	4243125	IACANXNJBCAXBM-SCZZXKLOSA-N	247.132	2.829	50	30	BFGC	
C[C@@H]1CCCC[C@H]1C(=O)CBr	39055807	YBNDUMHJNRWGBF-HTQZYQBOSA-N	219.122	2.777	50	30	BFGC	
Cl[C@H]1C[C@@H](Cl)[C@@H](Cl)[C@@H]1Cl	95817270	ZFMWDTNZPKDVBU-KKQCNMDGSA-N	207.915	2.820	50	30	BFGC	
CC1(C)CC[C@H](CBr)OC1	584880236	NWWOFDDZNBWTTJ-SSDOTTSWSA-N	207.111	2.587	50	30	BFGC	in-vitro
C[C@@H](Br)COCc1ccccc1	238403062	SATHPABQWQPWIF-SECBINFHSA-N	229.117	2.987	50	30	BFGC	
CO[C@H]1c2ccccc2C[C@@H]1Br	39254908	SRWWVPVOMXSKQR-UWVGGRQHSA-N	227.101	2.694	50	30	BFGC	
N#Cc1csc(CBr)c1	118643710	PFHFDZCJGDWQGF-UHFFFAOYSA-N	202.076	2.515	50	30	BFGC	
CC(C)(COC(=O)Cl)COC(=O)Cl	100351655	ROPHHOGKCLJYID-UHFFFAOYSA-N	229.059	2.763	50	30	BFGC	
C[C@H]1CC(=O)[C@@H](Br)C(C)(C)C1	238455568	QCJDDOXLUJWMDA-POYBYMJQSA-N	219.122	2.775	50	30	BFGC	
Cc1ccc(NNC(=O)C2CCC2)cc1Cl	147471	XKGOVSBETJTFPR-UHFFFAOYSA-N	238.718	2.892	50	30	BFGC	
CC(C)OC(=O)c1ccc(CCl)cc1	82164117	NWGIOTOSMYVEKY-UHFFFAOYSA-N	212.676	2.991	50	30	BFGC	in-vitro
CC1(C)OC[C@H](C(C)(C)CBr)O1	1536179640	BOKKYNDUNICYSP-SSDOTTSWSA-N	237.137	2.559	50	30	BFGC	
COC(=O)[C@H](C)CO[Si](C)(C)C(C)(C)C	195808210	GDTYFCRFIVSEIF-SECBINFHSA-N	232.396	2.817	50	30	BFGC	in-vitro
CCO[Si](C)(CNC1CCCCC1)OCC	196836652	REODOQPOCJZARG-UHFFFAOYSA-N	245.439	2.593	50	30	BFGC	
CO[C@H](CBr)Cc1ccccc1	205005238	JUUJOROAHMBPCH-JTQLQIEISA-N	229.117	2.639	50	30	BFGC	
CC[C@H](Br)C(=O)c1ccc(O)cc1	223533289	MYJZGZFNWVQGHX-VIFPVBQESA-N	243.100	2.748	50	30	BFGC	
COC1=C(C=O)COc2c1ccc1ccccc21	44138643	LDQRJFRDACUNSY-UHFFFAOYSA-N	240.258	2.789	50	30	BFGC	
Fc1cnc(Br)cc1CCl	238576270	UXKDZNGVWGODSY-UHFFFAOYSA-N	224.460	2.722	50	30	BFGC	
COC(=O)[C@@H](Cl)c1ccc(Cl)c(F)c1	50978226	ZTBRZTZDFFKBSM-QMMMGPOBSA-N	237.057	2.932	50	30	BFGC	
COC[C@@H](Br)c1ccccc1	114580513	FUAVWPFMMGDSHF-SECBINFHSA-N	215.090	2.769	50	30	BFGC	
O[C@H]1C[C@@H]2CCCC[C@H]2C[C@H]1Br	2265364117	APHARBZZYBGGFC-QEYWKRMJSA-N	233.149	2.711	50	30	BFGC	
ClCc1cc2c(cc1Cl)OCCO2	36926063	QZNUTAJVRZNVNQ-UHFFFAOYSA-N	219.067	2.850	50	30	BFGC	in-vitro
O=C(CCl)c1c(O)ccc2ccccc12	4204455	UBPWUQXSRLJODP-UHFFFAOYSA-N	220.655	2.967	50	30	BFGC	
C[C@@H]1CC(=O)[C@H](Br)C(C)(C)C1	238415595	QCJDDOXLUJWMDA-SVRRBLITSA-N	219.122	2.775	50	30	BFGC	
CC(C)(C)OC(=O)[C@@H](Cl)[Si](C)(C)C	196449360	REVBFXGFKCMPSR-ZETCQYMHSA-N	222.788	2.813	50	30	BFGC	
COC(=C(C#N)C#N)c1cccc(Cl)c1	38580711	NBGDOTGLJHBTGD-UHFFFAOYSA-N	218.643	2.745	50	30	BFGC	
C[C@@H](Cc1ccccc1Br)N=C=O	75769056	UBSKKEZRIWMXBO-QMMMGPOBSA-N	240.100	2.716	50	30	BFGC	in-vitro
N#C/C(=C\c1cccs1)C(=O)C1CC1	165474	UOHQRTZOCVXOSZ-RMKNXTFCSA-N	203.266	2.634	50	30	BFGC	
O=C(Cl)CS[C@H](Cl)C(F)(F)F	4204955	GZUKOCXFGXRNJZ-VKHMYHEASA-N	227.034	2.612	50	30	BFGC	in-vitro
C[C@@H](Cl)[C@@H]1CC(c2ccccc2)=NO1	88611594	SWUWNDHGDIMKJS-KCJUWKMLSA-N	209.676	2.807	50	30	BFGC	in-vitro
CCO[Si]1(OCC)CCCN1[Si](C)(C)C	195767447	IDVJQEHLTBUQAQ-UHFFFAOYSA-N	247.487	2.539	50	30	BFGC	
C/C(=N/NC(N)=O)[C@@]12CCCC=C1CCCC2	5566033	ICOVNGHKWQHBFJ-OJNRTJSBSA-N	235.331	2.701	50	30	BFGC	
FC(Cl)(Cl)C(F)(F)OCCl	5131688	NHUGIBLDSYCOAQ-UHFFFAOYSA-N	217.401	2.893	50	30	BFGC	
C[C@H](CBr)O[Si](C)(C)C	238445307	BFNFAWZKEPPNTD-ZCFIWIBFSA-N	211.175	2.621	50	30	BFGC	
Cn1nc(CCl)c(Br)c1Cl	1535543898	YHXNEGUEFHAJRH-UHFFFAOYSA-N	243.919	2.575	50	30	BFGC	
C=C(C#N)C1CCN(C(=O)OC(C)(C)C)CC1	725262407	FWJKADYAWGZXTO-UHFFFAOYSA-N	236.315	2.713	50	30	BFGC	
Cc1c(OCCCl)ccnc1CCl	81147804	AWLZGTDOLIPFTQ-UHFFFAOYSA-N	220.099	2.746	50	30	BFGC	
Cc1c(O)cccc1CBr	98179541	CVKUTECBPPMFLK-UHFFFAOYSA-N	201.063	2.596	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC[C@@H]1CC[C@@H](O)CO1	196002372	ZSMXKOXSMIVAQR-MNOVXSKESA-N	246.423	2.548	50	30	BFGC	
CCOc1cc(CCl)ccc1[N+](=O)[O-]	50517995	QRYUROFBJONFBR-UHFFFAOYSA-N	215.636	2.732	50	30	BFGC	in-vitro
FC(F)(F)C1CC(Br)C1	1772715580	LHJMYJBLOMVORH-UHFFFAOYSA-N	203.001	2.722	50	30	BFGC	
C[C@H]1CC[C@H](C(=O)CBr)CC1	306469401	UQBOLSQYJRJSOL-ZKCHVHJHSA-N	219.122	2.777	50	30	BFGC	
CCC[C@H](C)C(=O)OOC(=O)[C@H](C)CCC	100065740	RNXKQMBYNVOCNC-AOOOYVTPSA-N	230.304	2.860	50	30	BFGC	
COC(=O)[C@@H](Cl)c1cc(F)c(F)cc1F	140606247	VTTLWAISVWFQJX-QMMMGPOBSA-N	238.592	2.557	50	30	BFGC	
CC(C)(C)C(=O)C(C#N)=C1SCCS1	94780	CDYKWRXPCYYENX-UHFFFAOYSA-N	227.354	2.817	50	30	BFGC	
ICCC1CCC1	205118659	LQTOFXKBSLHXFT-UHFFFAOYSA-N	210.058	2.612	50	30	BFGC	
COc1ccccc1NNC(=O)C1CCCCC1	152150	NXVHIUJRDKKYCV-UHFFFAOYSA-N	248.326	2.719	50	30	BFGC	
ClCc1nnc(-c2ccc(Cl)cn2)o1	70657584	RFUPSMVMTLALFF-UHFFFAOYSA-N	230.054	2.524	50	30	BFGC	
ClCc1ccc(Cl)cc1-n1cncn1	98210142	JAXZMKQZFZWETG-UHFFFAOYSA-N	228.082	2.660	50	30	BFGC	in-vitro
CC[C@@H](C)N(C)CCCBr	40990694	AXKWAWDMRDPEFA-MRVPVSSYSA-N	208.143	2.502	50	30	BFGC	
CC(C)C[C@@H]1C[C@H](C)[C@H](C)[C@H]2C(=O)OC(=O)[C@@H]12	255983863	KRJWZSVZTBPCNN-HGCLJGPKSA-N	238.327	2.640	50	30	BFGC	
O[C@H]1C[C@H]2CCCC[C@H]2C[C@H]1Br	2265364115	APHARBZZYBGGFC-JLIMGVALSA-N	233.149	2.711	50	30	BFGC	
BrC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	675072543	DOFZHJPKLUBFRU-VRGHQRLXSA-N	201.107	2.673	50	30	BFGC	
O=C1C[C@H](c2ccc(Cl)cc2Cl)C(=O)O1	104669880	CLWZVLBRHGVATF-SSDOTTSWSA-N	245.061	2.551	50	30	BFGC	
CC(C)(C)[Si](C)(C)OC[C@H]1CC[C@@H](O)CO1	214928659	ZSMXKOXSMIVAQR-GHMZBOCLSA-N	246.423	2.548	50	30	BFGC	
O=[N+]([O-])c1c(Cl)cccc1CCl	95930405	HSHFNZYZSHJQQH-UHFFFAOYSA-N	206.028	2.987	50	30	BFGC	
C[C@H](Cl)c1ncc(Br)cn1	87736121	XCXUCFNAELZPCB-BYPYZUCNSA-N	221.485	2.539	50	30	BFGC	in-vitro
CCc1nc(CBr)cs1	88107940	JWUSMAHZPJIXPM-UHFFFAOYSA-N	206.108	2.600	50	30	BFGC	
O=C1Nc2ccc(Br)cc2[C@H]1Cl	205062069	NYSUUBCKDUOOJD-SSDOTTSWSA-N	246.491	2.681	50	30	BFGC	
Cc1cc(CBr)cc(C)n1	44831860	JTXKZBVTKKMCEV-UHFFFAOYSA-N	200.079	2.593	50	30	BFGC	
ClCc1ccc(O[C@H]2CCOC2)cc1	69623719	FUUOAIKCEFOQRM-NSHDSACASA-N	212.676	2.593	50	30	BFGC	
C[C@@]1(CBr)CC(=O)C12CCC2	2265385121	DGINFMGVQFDUJV-QMMMGPOBSA-N	217.106	2.531	50	30	BFGC	
Cl[C@H]1C[C@@H](Cl)[C@@H](Cl)[C@H]1Cl	95817268	ZFMWDTNZPKDVBU-VERZDPOYSA-N	207.915	2.820	50	30	BFGC	
O=C(NNc1ccc(F)cc1)c1ccccc1	151449	AULHOFBAEPCLEN-UHFFFAOYSA-N	230.242	2.583	50	30	BFGC	
CCOC1(CBr)CCCC1	50479618	CFCSCADAYXYNPE-UHFFFAOYSA-N	207.111	2.731	50	30	BFGC	in-vitro
CO[C@H](CBr)C1CCCC1	238398684	LDKRXSVVYQCAFO-MRVPVSSYSA-N	207.111	2.587	50	30	BFGC	
O=C=NCc1c(Cl)cccc1Cl	238604990	OAQBDSNJVMPOSU-UHFFFAOYSA-N	202.040	2.829	50	30	BFGC	
CCOC(=O)N(C[C@@H](C)Cl)C[C@@H](C)Cl	1684317	AMZPPCYQXDTKCJ-HTQZYQBOSA-N	242.146	2.700	50	30	BFGC	
Cc1ccc(NC=C(C#N)C=CC#N)cc1	2265222008	OCOLJZGNDCDRCE-UHFFFAOYSA-N	209.252	2.894	50	30	BFGC	
Cn1cc(CCl)c(-c2ccc(C#N)cc2)n1	95348010	JMHMAMAIEVDBQZ-UHFFFAOYSA-N	231.686	2.698	50	30	BFGC	in-vitro
FCC1(CBr)CC(F)(F)C1	2242469779	FOSCLMQCZLIMBL-UHFFFAOYSA-N	217.028	2.766	50	30	BFGC	
O=C(Cl)c1snc(Cl)c1Cl	34586248	MSSXWKAJMRSAGF-UHFFFAOYSA-N	216.476	2.829	50	30	BFGC	
CCC/C=C/C(=O)OC(=O)/C=C/CCC	100061176	LCZFHJDUNXXOHE-FIFLTTCUSA-N	210.273	2.769	50	30	BFGC	
COc1cnc(Br)cc1CCl	238390419	OSGUZVINANFPOF-UHFFFAOYSA-N	236.496	2.592	50	30	BFGC	
CC(C)CCCC/C=C/[C@@H]1CC(=O)OC1=O	114459459	JNBOXLYOTWAJDE-LXSSAFMLSA-N	224.300	2.849	50	30	BFGC	
CCC1CCC(NC(=O)N(CCF)N=O)CC1	5119283	GNUJKJSZLXIUOB-UHFFFAOYSA-N	245.298	2.618	50	30	BFGC	
COc1cc(CBr)cc(Cl)n1	21987811	ZODLIXQRAVICAH-UHFFFAOYSA-N	236.496	2.639	50	30	BFGC	
BrCCN1CCCc2ccccc21	40990009	QRFNPYDGSZOAJR-UHFFFAOYSA-N	240.144	2.834	50	30	BFGC	
Fc1ccc(-n2ccc(CCl)n2)cc1	71373490	AYSJFTYZJXSDOW-UHFFFAOYSA-N	210.639	2.750	50	30	BFGC	in-vitro
Cc1cc(-n2ccnc2)ccc1CCl	50585068	MEVKZPYHQJFKAJ-UHFFFAOYSA-N	206.676	2.920	50	30	BFGC	
FC(F)(F)c1cc(CBr)no1	145447750	MROPCOIWGYJMQS-UHFFFAOYSA-N	229.983	2.588	50	30	BFGC	
O=C(CBr)C1(c2ccccc2)CC1	87224550	LJPQWRZZAIPDQU-UHFFFAOYSA-N	239.112	2.682	50	30	BFGC	
O=P(Cl)(Cl)N(CCF)CCF	95704395	UPUKIMVAPLOYTP-UHFFFAOYSA-N	225.990	2.813	50	30	BFGC	
BrCc1ccc2c(c1)COC2	69625826	CIRVAEJDKAWZIA-UHFFFAOYSA-N	213.074	2.612	50	30	BFGC	in-vitro
O=C=NCSc1nc2ccccc2s1	45237060	SGVINURPXZYECK-UHFFFAOYSA-N	222.294	2.682	50	30	BFGC	
COc1ccc(CCBr)cc1F	55265046	XZVCZATZZWKEQJ-UHFFFAOYSA-N	233.080	2.772	50	30	BFGC	
O=C(Cl)c1cc(F)ccc1CCl	39057324	YCTOKSVCIGHDEV-UHFFFAOYSA-N	207.031	2.944	50	30	BFGC	
Clc1ccnc(CCBr)c1	1536038083	UDTDEKYTSGCKJD-UHFFFAOYSA-N	220.497	2.672	50	30	BFGC	
BrC[C@H]1CCCC12CCOCC2	300988141	VLAMFNNUIUKOKW-SECBINFHSA-N	233.149	2.978	50	30	BFGC	
CC(C)(C)O[C@H]1C[C@@H](Br)C1	390822142	KPSLXTOCYSMBTR-KNVOCYPGSA-N	207.111	2.727	50	30	BFGC	
O=C(Cl)N1CCC[C@@H]2CCCC[C@@H]21	86889855	HYRPDMOJNQURHZ-IUCAKERBSA-N	201.697	3.000	50	30	BFGC	
N#C[C@@H](Br)CCc1ccccc1	127654475	HSUPLFJIPJPDEH-JTQLQIEISA-N	224.101	2.906	50	30	BFGC	
Cc1cc(CCl)nc(C(F)(F)F)n1	238480654	FLGRXAIGCSQRIA-UHFFFAOYSA-N	210.586	2.543	50	30	BFGC	
CC(=O)Nc1ccc(CBr)cc1	5160732	JGMURBFZECPJFF-UHFFFAOYSA-N	228.089	2.540	50	30	BFGC	
N#CC(C(=O)C1CC1)=C1SCCCS1	94678	GEJLXWQQXJJGBS-UHFFFAOYSA-N	225.338	2.571	50	30	BFGC	
BrC[C@H]1CCC2(CCC2)CO1	616582969	RQVHZQSCRLKNBQ-MRVPVSSYSA-N	219.122	2.731	50	30	BFGC	
O=CC(=CO)c1ccc(Br)cc1	2265224239	SVVXHEWHAILJMI-UHFFFAOYSA-N	227.057	2.547	50	30	BFGC	
O=C(C(Cl)Cl)C(Cl)(Cl)Cl	2039260	RVSIFWBAGVMQKT-UHFFFAOYSA-N	230.305	2.729	50	30	BFGC	in-vitro
C[Si](C)(C)OC(=O)CCc1ccco1	195760699	RQMGMQXANVHACS-UHFFFAOYSA-N	212.321	2.590	50	30	BFGC	
COC(=O)[C@H](Cl)c1cc(F)c(F)cc1F	140606440	VTTLWAISVWFQJX-MRVPVSSYSA-N	238.592	2.557	50	30	BFGC	
FC1(F)Oc2ccc(N=C=S)cc2O1	22148303	PKCOTODGEAJGQZ-UHFFFAOYSA-N	215.180	2.742	50	30	BFGC	in-vitro
COCc1ccccc1CBr	83969134	JQIZZNGLTGKXOD-UHFFFAOYSA-N	215.090	2.728	50	30	BFGC	
COC(=O)NN=Cc1cccc(Cl)c1Cl	254878062	VCHSODXIKSNGGR-UHFFFAOYSA-N	247.081	2.683	50	30	BFGC	
BrC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	675072542	DOFZHJPKLUBFRU-PQFOHKHZSA-N	201.107	2.673	50	30	BFGC	
BrCc1ccc2c(c1)CCOC2	725244237	GGLKCBKWJTXLMD-UHFFFAOYSA-N	227.101	2.654	50	30	BFGC	
CC(C)(C)OCCCCBr	32297163	ZKUZDZQYIUIECM-UHFFFAOYSA-N	209.127	2.977	50	30	BFGC	in-vitro
CCOP(=O)(Br)OCC	82110895	SBPUMPCKAMRWQN-UHFFFAOYSA-N	216.999	2.562	50	30	BFGC	
O=C(NN=Cc1ccccc1)Nc1ccccc1	254819493	SXCIVFODNMDTER-UHFFFAOYSA-N	239.278	2.842	50	30	BFGC	
COc1ccc2nc(CCl)ccc2c1	34359998	IFOZFMPOHZGLBK-UHFFFAOYSA-N	207.660	2.982	50	30	BFGC	
O=C(CCCl)Oc1ccc(Cl)cc1	1614871	ZDYLPZMZZFQGMJ-UHFFFAOYSA-N	219.067	2.874	50	30	BFGC	
O=C(CCl)N[C@@H]1CCc2cc3c(cc21)CCC3	33872333	CSQLKECBJSJIKI-CYBMUJFWSA-N	249.741	2.518	50	30	BFGC	
C[C@H]1CCC[C@@H](C(=O)CBr)C1	39055763	ODLBURIROQYTMI-JGVFFNPUSA-N	219.122	2.777	50	30	BFGC	
COC(=O)Cc1ccc(O[Si](C)(C)C)cc1	195778397	PJYMTPVMHGKBNM-UHFFFAOYSA-N	238.359	2.616	50	30	BFGC	
ClCCOP(Cl)OCCCl	59187034	QBOBFSGHAHQYNU-UHFFFAOYSA-N	225.439	2.963	50	30	BFGC	
CC(C)[C@@H](/N=C(/O)CCl)C(=O)OC(C)(C)C	328579498	LOFMXZVMZREBOY-SECBINFHSA-N	249.738	2.548	50	30	BFGC	
O=C(F)c1ccc(F)c(C(F)(F)F)c1	39057431	LUWRKDCBHVRKOA-UHFFFAOYSA-N	210.101	2.954	50	30	BFGC	
CC(=O)[C@@H](Br)Cc1ccccc1F	52228431	BGERWDDYWDRTKN-VIFPVBQESA-N	245.091	2.721	50	30	BFGC	in-vitro
CCN(Cc1ccccc1)C(=O)CCCl	5708555	RSNMMIYYIDZPFZ-UHFFFAOYSA-N	225.719	2.664	50	30	BFGC	
Cc1cc(F)c(CCl)cc1[N+](=O)[O-]	307432843	ZBTCIUGHRKIPON-UHFFFAOYSA-N	203.600	2.781	50	30	BFGC	
BrC[C@H]1CC2(CCCC2)CO1	536957529	HLRPTEGWVTVURG-MRVPVSSYSA-N	219.122	2.731	50	30	BFGC	
COC(=O)[C@H](Br)c1ccccc1C	39273924	NDDRCRIJXMICQS-SECBINFHSA-N	243.100	2.604	50	30	BFGC	
O=C(O)[C@H](Br)c1cccc(Cl)c1	116669783	YXFVWXWKXCZRTF-SSDOTTSWSA-N	249.491	2.861	50	30	BFGC	
C[Si]1(C)C[Si](C)(C)O[Si](C)(C)O1	195781728	WMNLFMGSPJGZEL-UHFFFAOYSA-N	220.493	2.684	50	30	BFGC	
C[P@@](=O)(F)c1c(F)c(F)c(F)c(F)c1F	222088051	CLGZENXRNXBZGC-HNNXBMFYSA-N	248.062	2.885	50	30	BFGC	
O=C(Cl)c1cccc2c1=c1ccccc1=2	4277311	NLSBARINANPMGB-UHFFFAOYSA-N	214.651	2.953	50	30	BFGC	
COC(=O)[C@H](Cl)c1cc(F)c(F)c(F)c1	62707292	TWGMTJOJAIOEGA-SSDOTTSWSA-N	238.592	2.557	50	30	BFGC	
CC(C)(C)OC(=O)[C@H](Cl)[Si](C)(C)C	196449348	REVBFXGFKCMPSR-SSDOTTSWSA-N	222.788	2.813	50	30	BFGC	
CCc1ccccc1C(=O)CBr	39102726	QAYCTBUGKWGQKZ-UHFFFAOYSA-N	227.101	2.827	50	30	BFGC	
O=C(Cl)c1ccccc1CCCl	39208894	PKRRIFLRGGRFQO-UHFFFAOYSA-N	203.068	2.847	50	30	BFGC	in-vitro
C/C=C/CCCI	135730483	WWRXMKQRGARTAB-NSCUHMNNSA-N	210.058	2.778	50	30	BFGC	
C[C@H](O)c1ccccc1CCBr	39120392	NBFGTXWPTHWWIE-QMMMGPOBSA-N	229.117	2.677	50	30	BFGC	
ClCc1nc(-c2cccnc2)cs1	61802925	NJXZQWXMQPDNIP-UHFFFAOYSA-N	210.689	2.944	50	30	BFGC	in-vitro
O=C(NNc1ccccc1)c1ccc(F)cc1	2039525	PGKDUKIHKGXXIY-UHFFFAOYSA-N	230.242	2.583	50	30	BFGC	
O=C=Nc1cc(Cl)nc2ccccc12	95763581	LUUUATZGGWEEDV-UHFFFAOYSA-N	204.616	2.856	50	30	BFGC	
O=[N+]([O-])c1cc(F)c(CCl)c(F)c1	82864451	NLMBHJGUMXZHHE-UHFFFAOYSA-N	207.563	2.612	50	30	BFGC	in-vitro
CN1Cc2ccc(CBr)cc2C1	1536221917	UYJLTZMADZJWIA-UHFFFAOYSA-N	226.117	2.527	50	30	BFGC	
CCOC(=O)CCc1ccc(CCl)cc1	38254479	XZWKWKHEMBGWKX-UHFFFAOYSA-N	226.703	2.921	50	30	BFGC	
COC(=O)[C@H](Cl)c1ccc(Cl)c(F)c1	50978222	ZTBRZTZDFFKBSM-MRVPVSSYSA-N	237.057	2.932	50	30	BFGC	
O=C(Cl)N1CCC[C@H]2CCCC[C@H]21	39057217	HYRPDMOJNQURHZ-RKDXNWHRSA-N	201.697	3.000	50	30	BFGC	
O=[N+]([O-])c1cc(F)c(F)cc1CCl	306388436	NZTNNXUNDDNFIS-UHFFFAOYSA-N	207.563	2.612	50	30	BFGC	
O=C(Cl)CCCc1ccc([N+](=O)[O-])cc1	5840574	LQGNQUFFXKOHBQ-UHFFFAOYSA-N	227.647	2.683	50	30	BFGC	
C=C[Si](C)(C)O[Si](C)(C)CCl	197096789	RDGCOJHKQYOHIH-UHFFFAOYSA-N	208.837	2.916	50	30	BFGC	
COCc1ccc(CBr)cc1	83969645	CPGGWEMHYNBPPD-UHFFFAOYSA-N	215.090	2.728	50	30	BFGC	
ClCc1nc(Cl)ncc1Br	238524650	QAUCPXOHEAZKDL-UHFFFAOYSA-N	241.903	2.631	50	30	BFGC	
CC(C)C[C@@H](Br)C(=O)Cl	34079000	IQGRVWSONWFJJD-RXMQYKEDSA-N	213.502	2.561	50	30	BFGC	
CCS[C@H](C)c1noc(CCl)n1	82163118	PDHBYUKLXUKRRI-RXMQYKEDSA-N	206.698	2.623	50	30	BFGC	
Cc1ccc([C@H](Br)C#N)cc1	35606013	YBIQPQMYTPHDFH-SECBINFHSA-N	210.074	2.955	50	30	BFGC	
S=C=NC1CCN(Cc2ccccc2)CC1	19840536	JFOUWVXAAZNJDB-UHFFFAOYSA-N	232.352	2.754	50	30	BFGC	
COC(=O)c1cc(Cl)cc(CCl)c1	95764374	QVKCSUXJGSNIDC-UHFFFAOYSA-N	219.067	2.865	50	30	BFGC	
BrC[C@@H]1CC2(CCCC2)CO1	536957530	HLRPTEGWVTVURG-QMMMGPOBSA-N	219.122	2.731	50	30	BFGC	
Cc1cccc(C)c1C(=O)CBr	34413727	YSICJHNHYWMNBM-UHFFFAOYSA-N	227.101	2.881	50	30	BFGC	
CC[C@H](C)CC(=O)OC(=O)C[C@@H](C)CC	100068287	CDWXQSOCLQJWKK-UWVGGRQHSA-N	214.305	2.929	50	30	BFGC	
CCC(=C(C#N)C#N)c1ccc([N+](=O)[O-])cc1	34604808	PLUUMTDNGZMWQV-UHFFFAOYSA-N	227.223	2.806	50	30	BFGC	
O=C(c1ccccc1)[C@H](F)Br	39055735	CBLLCYODFDSRQA-QMMMGPOBSA-N	217.037	2.560	50	30	BFGC	
BrCc1ccc2c(c1)COCC2	1535641937	RYECFMPGACQUAL-UHFFFAOYSA-N	227.101	2.654	50	30	BFGC	
Cc1cc(Cl)ccc1NNC(=O)C1CCC1	147518	MHHXEFZULFSCQC-UHFFFAOYSA-N	238.718	2.892	50	30	BFGC	
C[Si](C)(C)O[Si](C)(CCl)CCl	196670137	UTFVHGDIJZRFJV-UHFFFAOYSA-N	231.271	2.969	50	30	BFGC	
O=C=Nc1c[nH]c2ccc(Br)cc12	215583576	YFPAZTNXORFGRY-UHFFFAOYSA-N	237.056	2.898	50	30	BFGC	
IC[C@@H]1C[C@@H]2CC[C@H]1C2	223724064	CVFNHQHHCQFJDT-CSMHCCOUSA-N	236.096	2.858	50	30	BFGC	
ClC1(Cl)C[C@H]1CCBr	197291338	FGEFGEHGRNIRQZ-SCSAIBSYSA-N	217.921	2.965	50	30	BFGC	
FC(F)(F)[C@@H](Br)[C@H]1CCCOC1	725269073	CMHLUSDQFBRQMT-WDSKDSINSA-N	247.054	2.739	50	30	BFGC	
CC(=O)Cc1ccccc1CBr	149123345	XZDWBIBJQWDQOV-UHFFFAOYSA-N	227.101	2.713	50	30	BFGC	
COC1=C(C=O)COc2ccc3ccccc3c21	44138645	PPIJBQSJHJSECH-UHFFFAOYSA-N	240.258	2.789	50	30	BFGC	
O=C(Cl)CS[C@@H](Cl)C(F)(F)F	4204957	GZUKOCXFGXRNJZ-GSVOUGTGSA-N	227.034	2.612	50	30	BFGC	in-vitro
COc1ccc(N=C=O)c(C(F)(F)F)c1	238369056	FRAZMSPOJOFXHB-UHFFFAOYSA-N	217.146	2.681	50	30	BFGC	
COc1cccc(CCC(=O)Cl)c1F	75902166	KKHRHIXYCMQYTN-UHFFFAOYSA-N	216.639	2.532	50	30	BFGC	in-vitro
O=C(Cl)[C@@H](Br)C1CCCC1	138421342	NLFYPILXYRGBFK-LURJTMIESA-N	225.513	2.706	50	30	BFGC	
C[C@@H]1C[C@H](CCBr)CCN1C	39110233	YBWVWNCRYIZHKI-RKDXNWHRSA-N	220.154	2.502	50	30	BFGC	
CC(C)=CC[C@@H]1C(C)=CC[C@@H]2C(=O)OC(=O)[C@@H]21	111395147	KPKSFNJCYGUOHN-GRYCIOLGSA-N	234.295	2.625	50	30	BFGC	
COCC1(CBr)CCCCC1	83165783	KGBDZGFLUUKHOO-UHFFFAOYSA-N	221.138	2.978	50	30	BFGC	
Cc1ccccc1C(=O)[C@H](F)Br	1535639429	BCTMTWCLOJPGME-VIFPVBQESA-N	231.064	2.868	50	30	BFGC	
COc1ccc(/C=C(\C#N)C(=O)C2CC2)cc1	165458	RTFZQYVTFNHQLU-XYOKQWHBSA-N	227.263	2.581	50	30	BFGC	
CC(C)(C)SS(=O)(=O)c1ccccc1	34624642	RYJGCCONEKNWIL-UHFFFAOYSA-N	230.354	2.907	50	30	BFGC	
O=C(c1c[nH]c2ccccc12)[C@H](F)Cl	45787474	PRPZERJSAJABNU-JTQLQIEISA-N	211.623	2.885	50	30	BFGC	
Fc1ccc(-n2cc(CCl)nn2)cc1Cl	52225204	LFRONVXGXQDPSL-UHFFFAOYSA-N	246.072	2.799	50	30	BFGC	in-vitro
Fc1ccc(-n2ccc(CCl)n2)c(F)c1	84179462	SCZXWYJYSFWQKP-UHFFFAOYSA-N	228.629	2.889	50	30	BFGC	in-vitro
CCO[C@H](C)OCCC/C=C/CCl	5861115	MUXGAZFAAQWFLD-RWCYGVJQSA-N	206.713	2.961	50	30	BFGC	
O=C(O)[C@@H](Cl)c1ccccc1Cl	71509217	ZHNSTEQFVQPSMQ-ZETCQYMHSA-N	205.040	2.705	50	30	BFGC	
COC(=O)C(=Cc1ccc(F)cc1)CCl	2265263989	HLDYPEYBJDRQPE-UHFFFAOYSA-N	228.650	2.621	50	30	BFGC	
COc1ccc(NNC(=O)c2cccs2)cc1	148597	BMBMSZIDWDRFHN-UHFFFAOYSA-N	248.307	2.514	50	30	BFGC	
COOC(=O)c1c(C)sc2ccccc12	238790687	HTEHWMHSLRZSOK-UHFFFAOYSA-N	222.265	2.928	50	30	BFGC	
Cl[C@@H]1CC2(c3ccccc3)CCN1CC2	32167511	NLLKUNTTXKUARA-LBPRGKRZSA-N	221.731	2.989	50	30	BFGC	
CC(C)(C)c1ncc(CBr)cn1	34295133	XSZMKTJVYYBRHQ-UHFFFAOYSA-N	229.121	2.669	50	30	BFGC	
O=C(CCl)c1c(F)cc(F)cc1F	19267912	XSVXZERBVBHQFO-UHFFFAOYSA-N	208.566	2.525	50	30	BFGC	
CCCC1(CCCBr)OCCO1	199427746	INRNFOINQWRSFI-UHFFFAOYSA-N	237.137	2.705	50	30	BFGC	
Cc1ccc(F)cc1C(=O)CBr	87224674	JZNZBWWMHSBAEK-UHFFFAOYSA-N	231.064	2.712	50	30	BFGC	
Fc1c(Cl)ccnc1CBr	238561439	DWUZDPSAXHINTJ-UHFFFAOYSA-N	224.460	2.769	50	30	BFGC	
N#CC(C#N)=CNc1c(F)cccc1Cl	139304	PPGRWKHOWPGNLU-UHFFFAOYSA-N	221.622	2.822	50	30	BFGC	
O=C1OC(=O)c2c(Cl)ccc3cccc1c23	111875846	ORYGDXAYCHIBLC-UHFFFAOYSA-N	232.622	2.804	50	30	BFGC	
O=C(F)c1cccc(OC(F)(F)F)c1	1845851	XRRBDBIQJMJLJV-UHFFFAOYSA-N	208.110	2.695	50	30	BFGC	
FC(F)(F)COc1ccc(CCl)cn1	40886164	UYAYWTOMHKANJM-UHFFFAOYSA-N	225.597	2.762	50	30	BFGC	in-vitro
N#CSCCc1c[nH]c2ccccc12	28090226	YQAYFJPGYPUGDY-UHFFFAOYSA-N	202.282	2.925	50	30	BFGC	
Clc1cncc(OCCBr)c1	81698556	AMVWYTOVXLIRDK-UHFFFAOYSA-N	236.496	2.509	50	30	BFGC	
O=C1C[C@@H](CCBr)C12CCC2	2265384649	FMGXKKCWEYXHJB-SSDOTTSWSA-N	217.106	2.531	50	30	BFGC	
Cc1ccc2c(c1)SC(=C(C#N)C#N)N2	45237761	LACCITDMJISDSS-UHFFFAOYSA-N	213.265	2.771	50	30	BFGC	
O=C(CBr)[C@@H]1C[C@H]1c1ccccc1	96373483	BLDDRMXZVRTVMO-VHSXEESVSA-N	239.112	2.754	50	30	BFGC	
COc1ccc(C(C)=O)cc1CSC#N	3161776	BCJJBBQPUYFYLJ-UHFFFAOYSA-N	221.281	2.612	50	30	BFGC	
N#C/C(=C\c1ccncc1)c1ccccn1	4347861	CVRARXQSJXGYBH-FMIVXFBMSA-N	207.236	2.541	50	30	BFGC	
ClCc1ccnc([C@@H]2Cc3ccccc3O2)n1	125339899	QBEDYTZKPARYQG-LBPRGKRZSA-N	246.697	2.892	50	30	BFGC	
N#Cc1cccc(-c2nc(CCl)co2)c1	37933923	ACIOLUROVVRODE-UHFFFAOYSA-N	218.643	2.952	50	30	BFGC	
COc1cccc(CCN(C)CCCCl)c1	38652011	JNMDLBJXCBDOME-UHFFFAOYSA-N	241.762	2.798	50	30	BFGC	
CC(C)=CC[C@@H]1C(C)=CC[C@@H]2C(=O)OC(=O)[C@H]21	111395152	KPKSFNJCYGUOHN-WOPDTQHZSA-N	234.295	2.625	50	30	BFGC	
CC#CC(=O)[C@@H](C)O[Si](C)(C)C(C)(C)C	238856573	WHLAMDQNZQFMLM-SNVBAGLBSA-N	226.392	2.989	50	30	BFGC	in-vitro
C[C@@H](CBr)OCc1ccccc1	34385847	SOWXYALCNFHLEQ-VIFPVBQESA-N	229.117	2.987	50	30	BFGC	
O=C(OO)C1c2ccccc2-c2ccccc21	100038651	HQMLXVRUEZPOCC-UHFFFAOYSA-N	226.231	2.815	50	30	BFGC	
CC1=C[C@@H](C=O)C(C=O)=C[C@H]2CC(C)(C)C[C@H]12	111400106	HIQBNLOFFXWCPW-SGMGOOAPSA-N	232.323	2.939	50	30	BFGC	
O=C(NNc1ccc(F)cc1)c1cccs1	151436	KSLGNEGRXFYKHV-UHFFFAOYSA-N	236.271	2.644	50	30	BFGC	
CCOC(=O)C(C)(C)c1nc(CCl)cs1	2265364040	GMXNVTITMYMKTP-UHFFFAOYSA-N	247.747	2.723	50	30	BFGC	
BrCC1CC2(CCCCO2)C1	2265383621	FRKQRIWKMGEQBB-UHFFFAOYSA-N	219.122	2.731	50	30	BFGC	
C[C@@H]1CCC[C@H](C(=O)CBr)C1	39055760	ODLBURIROQYTMI-SFYZADRCSA-N	219.122	2.777	50	30	BFGC	
CC(C)O[C@@H]1CCC[C@H]1Br	50502520	LHKYTKOMTZFCMT-HTQZYQBOSA-N	207.111	2.727	50	30	BFGC	
ClC[C@H]1CC1(Br)Br	135781082	SWIPJVZSGRVWTM-GSVOUGTGSA-N	248.345	2.731	50	30	BFGC	
C[C@@H](CBr)O[Si](C)(C)C	238383044	BFNFAWZKEPPNTD-LURJTMIESA-N	211.175	2.621	50	30	BFGC	
Cc1ccccc1C(=O)[C@@H](F)Br	1535639421	BCTMTWCLOJPGME-SECBINFHSA-N	231.064	2.868	50	30	BFGC	
BrC[C@H]1Cc2ccccc2CO1	90394396	PEYMTLILTINUML-SNVBAGLBSA-N	227.101	2.523	50	30	BFGC	
O=C(Cl)[C@H]1CC[C@H]2C=CC[C@H]1S2	256066437	BKMAIUCIMORVOF-GJMOJQLCSA-N	202.706	2.592	50	30	BFGC	
C[C@H]1CCCC[C@@H]1C(=O)CBr	39055806	YBNDUMHJNRWGBF-YUMQZZPRSA-N	219.122	2.777	50	30	BFGC	
O=C(O)[C@@H](Cl)c1cccc(Cl)c1	71509219	KTDVGGSTOFEZKZ-ZETCQYMHSA-N	205.040	2.705	50	30	BFGC	
CC(C)(C)OC(=O)OOC(=O)OC(C)(C)C	113337231	PFADVMKRWMHNTC-UHFFFAOYSA-N	234.248	2.805	50	30	BFGC	in-vitro
ClCc1ccnc([C@H]2Cc3ccccc3O2)n1	125339650	QBEDYTZKPARYQG-GFCCVEGCSA-N	246.697	2.892	50	30	BFGC	
C[C@@H](O[Si](C)(C)C)C(=O)O[Si](C)(C)C	195781274	HXRGKEOWDNVHPA-MRVPVSSYSA-N	234.444	2.605	50	30	BFGC	
C[C@H]1C[C@@H](CBr)C[C@@H](C)O1	675050680	HQTDLPJLQXNLEL-JIGDXULJSA-N	207.111	2.585	50	30	BFGC	
C[C@@H](O)c1ccccc1CCBr	39120393	NBFGTXWPTHWWIE-MRVPVSSYSA-N	229.117	2.677	50	30	BFGC	
CO[C@@H](CBr)Cc1ccccc1	205005255	JUUJOROAHMBPCH-SNVBAGLBSA-N	229.117	2.639	50	30	BFGC	
O=C=Nc1ccc2nc(-c3cscn3)[nH]c2c1	198659020	JYOWCWRYAQVQBL-UHFFFAOYSA-N	242.263	2.654	50	30	BFGC	
ClCc1nc2ccccn2c1Br	307013813	MBUGYLFFIDOVCW-UHFFFAOYSA-N	245.507	2.836	50	30	BFGC	
Br[C@H]1CCO[C@H](c2cccnc2)C1	307055148	YKRRLBRBTLEKED-UWVGGRQHSA-N	242.116	2.697	50	30	BFGC	
O=C1c2cc(Cl)ccc2C[C@@H]1Br	19727220	AXZQGZAKEHWUSJ-QMMMGPOBSA-N	245.503	2.842	50	30	BFGC	
COC(=O)c1oc([C@@H](C)Cl)cc1C	82163138	LSDNHZRRFUVZKR-ZCFIWIBFSA-N	202.637	2.674	50	30	BFGC	in-vitro
C=CCC(I)CC=C	59371852	JZLNWJVJFSFPLC-UHFFFAOYSA-N	222.069	2.942	50	30	BFGC	
O=C1[C@H](Br)CCCCC1(F)F	1535421473	ZYHCUKSJEUOVTH-RXMQYKEDSA-N	227.048	2.528	50	30	BFGC	
CCCCCCC(=O)CBr	13544119	YVQBIERXAUCGHI-UHFFFAOYSA-N	207.111	2.921	50	30	BFGC	in-vitro
CCCC(CCC)[C@@H](C)NC(=O)CCl	33755742	XSCQBMDVQIGAMV-SECBINFHSA-N	219.756	2.946	50	30	BFGC	
CC(C)(C)[Si](C)(C)O[C@@H]1CCC1=O	195909285	DRXPFRAWBNXHLO-SECBINFHSA-N	200.354	2.740	50	30	BFGC	
C[C@@H](Cc1ccc(Br)cc1)N=C=O	19784235	AWXDJSIOMUEASQ-QMMMGPOBSA-N	240.100	2.716	50	30	BFGC	in-vitro
C[C@H]1c2ccccc2O[C@H]1CBr	2265385521	DTWJGTYRLLCCFP-XVKPBYJWSA-N	227.101	2.946	50	30	BFGC	
BrC[C@@H]1COc2ccccc21	69910586	LGXKHJGWWLOXMI-SSDOTTSWSA-N	213.074	2.558	50	30	BFGC	in-vitro
COC(=O)c1cc(C)ccc1CBr	95642706	YAVYGGJWTNTFAT-UHFFFAOYSA-N	243.100	2.677	50	30	BFGC	
Cc1cc(OC(F)(F)F)ccc1N=C=O	34293777	MSOUQYOVSHGYMF-UHFFFAOYSA-N	217.146	2.861	50	30	BFGC	
N#C/C=C1/C=C(c2ccccc2)N=C2C=NC=CN21	39124295	WTNWFNROTDRXAF-MLPAPPSSSA-N	246.273	2.705	50	30	BFGC	
CC(C)c1ccc([C@]2(C)CC(=O)OC2=O)cc1	59093954	OVEOPWLAPTZYDG-AWEZNQCLSA-N	232.279	2.541	50	30	BFGC	in-vitro
BrC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	675072541	DOFZHJPKLUBFRU-OFPUPOEVSA-N	201.107	2.673	50	30	BFGC	
CCOC(=O)/C(C#N)=C/Nc1cc(F)ccc1C	13658884	LUZPXQZTFCZTLE-CSKARUKUSA-N	248.257	2.517	50	30	BFGC	
COC(OC)[C@H](Cl)CCc1ccccc1	616582995	SPUGGFKYDKGUBJ-LLVKDONJSA-N	228.719	2.846	50	30	BFGC	
CSC(SC)=C(C#N)c1ccccn1	69040	WMDXYHIKZCHDMX-UHFFFAOYSA-N	222.338	3.000	50	30	BFGC	
CC(C)(CCl)NC(=O)OC(C)(C)C	136700299	OSZCIICEKCMEJX-UHFFFAOYSA-N	207.701	2.529	50	30	BFGC	
N#C[C@H]1CCc2ccc(C(=O)Cl)cc21	39057310	YZVFQWWARVKPAL-SECBINFHSA-N	205.644	2.619	50	30	BFGC	
CCCC(C)(C)COC(=O)CBr	1602758	GVGCMOPMQGVNLP-UHFFFAOYSA-N	237.137	2.751	50	30	BFGC	
CCS[C@@H](C)c1noc(CCl)n1	82163117	PDHBYUKLXUKRRI-YFKPBYRVSA-N	206.698	2.623	50	30	BFGC	
CC(C)CCCC/C=C/[C@H]1CC(=O)OC1=O	114459463	JNBOXLYOTWAJDE-IOCXFXADSA-N	224.300	2.849	50	30	BFGC	
COC(=O)[C@H](Br)c1ccc(C)cc1	22010878	FCYCFLODHZGXDV-SECBINFHSA-N	243.100	2.604	50	30	BFGC	
O=[N+]([O-])c1ccc(-c2nc(CCl)co2)cc1	37933899	JDNZYRXCPGOUJI-UHFFFAOYSA-N	238.630	2.989	50	30	BFGC	
O=C=Nc1ccccc1SC(F)F	62821992	RLXZZTBOLFRPKN-UHFFFAOYSA-N	201.197	2.969	50	30	BFGC