smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
C[C@H]1CCC[C@@H](CCBr)C1	70567433	SHDXMKOFILDWNS-IUCAKERBSA-N	205.139	3.598	50	30	BHGC	
C[C@H]1CC(O[Si](C)(C)C)C[C@H](C)C1	195771966	RNBPOOCUZHNIIM-NXEZZACHSA-N	200.398	3.663	50	30	BHGC	
CC(C)CCCCCC(=O)OOC(C)(C)C	100236270	ZUSDEBDNDIJDMZ-UHFFFAOYSA-N	230.348	3.866	50	30	BHGC	
C[C@H](Br)c1c[nH]c2ccccc12	142356870	VFTVULRWXJQVKS-ZETCQYMHSA-N	224.101	3.624	50	30	BHGC	
CCC1(CBr)CCCCC1	85051269	AVSQBPUGRVOQMJ-UHFFFAOYSA-N	205.139	3.742	50	30	BHGC	
CC[C@@H](Br)c1cccc(OC)c1	118237530	XEECGKOBNORGAY-SNVBAGLBSA-N	229.117	3.541	50	30	BHGC	
Cc1cc(N)ccc1O[Si](C)(C)C(C)(C)C	196606693	JIZCOMYASPLXCY-UHFFFAOYSA-N	237.419	3.961	50	30	BHGC	
C[C@H](Br)c1c(F)cc(F)cc1F	58144790	QVJZQPICUDKELK-BYPYZUCNSA-N	239.034	3.560	50	30	BHGC	in-vitro
C[C@@H](Br)c1cc(F)c(F)c(F)c1	90765060	XROAACRVXSKJOP-SCSAIBSYSA-N	239.034	3.560	50	30	BHGC	
COc1ccc2cc(/C(C)=C(/O)C#N)ccc2c1	199950135	SSIKYCRSXOQTAE-XNTDXEJSSA-N	239.274	3.661	50	30	BHGC	
Fc1cccc(F)c1-c1csc(CCl)n1	61803160	FCHDOJSBKDLMCV-UHFFFAOYSA-N	245.681	3.827	50	30	BHGC	in-vitro
C[C@H](Cl)c1cccc(Br)c1	57332749	OGXGNMHKGZFHMD-LURJTMIESA-N	219.509	3.749	50	30	BHGC	
CC1=C(SSc2ccoc2C)CCO1	32163949	XHMKUMOVGFTUCW-UHFFFAOYSA-N	228.338	3.980	50	30	BHGC	
Cc1cc(F)c(Br)cc1CCl	575689596	UNUDIKSUASQYKJ-UHFFFAOYSA-N	237.499	3.635	50	30	BHGC	
ClCCC(Cl)(Cl)C(Cl)Cl	111871480	JITSWUFGPFIMFG-UHFFFAOYSA-N	230.349	3.593	50	30	BHGC	
Clc1ccc2c(c1)[C@@H](Br)CC2	58621140	UOFWMXFFQCFLBJ-VIFPVBQESA-N	231.520	3.722	50	30	BHGC	in-vitro
C[C@H](Cl)c1ncc(-c2ccc(F)cc2)o1	36903627	LUCKCSQWLOVHJS-ZETCQYMHSA-N	225.650	3.781	50	30	BHGC	
CC(=O)[C@@H](Cl)c1cccc(C(F)(F)F)c1	22013054	RXYVNNWGXQRJAC-SECBINFHSA-N	236.620	3.574	50	30	BHGC	
BrCC1(c2ccccc2)CCCC1	49783337	NQPQJJBZJGSGBS-UHFFFAOYSA-N	239.156	3.893	50	30	BHGC	in-vitro
CCOc1ccc(-c2ccc(CCl)cc2)cn1	117212574	XVDPJYHHTPZQEZ-UHFFFAOYSA-N	247.725	3.886	50	30	BHGC	
O=C(Cl)Oc1ccc(Cl)c(Cl)c1	39390111	ZDTLCBPNKGXDMA-UHFFFAOYSA-N	225.458	3.731	50	30	BHGC	
O=C(Cl)C1[C@@H]2CCCCCCCC[C@@H]12	39055904	FHDQHGIAYJFAQX-NXEZZACHSA-N	214.736	3.748	50	30	BHGC	
C[C@@H](c1cccs1)[C@@H](C)Br	85664873	PWZPZAQAXNOCPR-RNFRBKRXSA-N	219.147	3.635	50	30	BHGC	
Cc1cc(C)cc([C@H](C)Br)c1	116927726	ZQOZWFVEYFQCHD-VIFPVBQESA-N	213.118	3.759	50	30	BHGC	
Fc1ccc2ccc(CBr)cc2c1	141943625	XLDDEDRHNNWHEQ-UHFFFAOYSA-N	239.087	3.874	50	30	BHGC	
Br[C@H]1CC[C@H](Cc2ccccc2)C1	80503054	IEKSPIAEYIRCLG-NEPJUHHUSA-N	239.156	3.793	50	30	BHGC	
O=C(Cl)[C@H]1CCC2(CCCCCC2)C1	39055870	HZGJMMJPEYTLBW-JTQLQIEISA-N	214.736	3.893	50	30	BHGC	
CC(C)[C@@H](CBr)c1ccccc1	49781635	KFIMHJPLUHYGGQ-LLVKDONJSA-N	227.145	3.821	50	30	BHGC	
ClCc1ncc(-c2ccccc2Cl)o1	36903562	ZRXDUPPRTXNRJR-UHFFFAOYSA-N	228.078	3.734	50	30	BHGC	in-vitro
BrC[C@@H]1CCC2(CCCCCC2)O1	306149821	DNDWHUZYXKBGPU-JTQLQIEISA-N	247.176	3.653	50	30	BHGC	
C[C@@H](Cl)c1cccc(OC(F)(F)F)c1	300803557	WTDDHNGSXVJYLP-ZCFIWIBFSA-N	224.609	3.885	50	30	BHGC	
Fc1c(CCl)cccc1C(F)(F)F	75898748	NLCDSGYIRRQYEA-UHFFFAOYSA-N	212.573	3.583	50	30	BHGC	
CCOc1cccc(Cl)c1CBr	125062838	FUHJIKLNSUEHPW-UHFFFAOYSA-N	249.535	3.634	50	30	BHGC	
CC1(C)C2CCC1(CBr)CC2	958632430	STAMXIXVXYCICG-UHFFFAOYSA-N	217.150	3.598	50	30	BHGC	
O=C(Cl)[C@H]1C/C=C\CC/C=C\CCC1	39057507	POCBECWMEMOUGE-SIJPMGCUSA-N	212.720	3.835	50	30	BHGC	
O=C(CCCCl)c1c[nH]c2ccc(F)cc12	114487167	GPNSGYCDYDXWRA-UHFFFAOYSA-N	239.677	3.509	50	30	BHGC	
COc1ccc(Cl)cc1[C@H](C)Cl	123148288	DACBQMVZHIEQJZ-LURJTMIESA-N	205.084	3.648	50	30	BHGC	
Clc1ccc(C2(CBr)CC2)cc1	49783434	SYBHKKMLXSEOJV-UHFFFAOYSA-N	245.547	3.767	50	30	BHGC	
Fc1c(Cl)cc(Cl)cc1CCl	75925879	ASCWQSYZAJFEEP-UHFFFAOYSA-N	213.466	3.871	50	30	BHGC	in-vitro
BrCC[C@H]1CCc2ccccc21	138143816	BUOUZXCRZVKJNT-SNVBAGLBSA-N	225.129	3.501	50	30	BHGC	
Cc1cc(F)ccc1[C@@H](C)Br	306500870	ZFUBAPHOPDBCNN-SSDOTTSWSA-N	217.081	3.590	50	30	BHGC	
C[C@@H](Br)c1ccc2c(c1)CCC2	58145680	BOANVGUSBSJUMW-MRVPVSSYSA-N	225.129	3.631	50	30	BHGC	
CCO[Si](CC(C)C)(CC(C)C)OCC	196627753	WOZOEHNJNZTJDH-UHFFFAOYSA-N	232.440	3.814	50	30	BHGC	
ClCc1ccc2cc(Cl)ccc2n1	39246738	WLGDLQDPQBOXGD-UHFFFAOYSA-N	212.079	3.627	50	30	BHGC	
FC(F)(F)[C@H]1CCCC[C@H]1CBr	129512267	VTVDLNYWSTZKOE-BQBZGAKWSA-N	245.082	3.750	50	30	BHGC	
ClC[C@@H]1Sc2ccccc2[C@H]1Cl	195778707	YBJYDZIULVFOOA-DTWKUNHWSA-N	219.136	3.680	50	30	BHGC	
Br[C@@H]1CC[C@H](Cc2ccccc2)C1	80503063	IEKSPIAEYIRCLG-VXGBXAGGSA-N	239.156	3.793	50	30	BHGC	
[N-]=[N+]=Nc1ccccc1CBr	38302111	PWZIAXQTHQFMHZ-UHFFFAOYSA-N	212.050	3.523	50	30	BHGC	
BrC/C=C/C=C/c1ccccc1	83252722	LRGFTYLEVZIJLF-VDESZNBCSA-N	223.113	3.651	50	30	BHGC	
Br[C@H]1CC[C@@H](Cc2ccccc2)C1	80503050	IEKSPIAEYIRCLG-RYUDHWBXSA-N	239.156	3.793	50	30	BHGC	
CC(C)(C)c1cccc(OC(=O)Cl)c1	33506728	BYUPCPGESMKIBW-UHFFFAOYSA-N	212.676	3.722	50	30	BHGC	
ClCc1csc(CCc2ccccc2)n1	42406857	LHDRXQUIVHNOSQ-UHFFFAOYSA-N	237.755	3.667	50	30	BHGC	
O=C/C=C1/SSC=C1c1ccccc1	195783788	BQYGXMYQOMDRIA-IZZDOVSWSA-N	220.318	3.505	50	30	BHGC	
CCC[C@H](Br)c1ccccc1	57368728	FYLFBMCBWHXRPW-JTQLQIEISA-N	213.118	3.923	50	30	BHGC	
CC(C)C(CCBr)C(C)C	118639335	WATCPATZIOJEJV-UHFFFAOYSA-N	207.155	3.700	50	30	BHGC	
O=P(Cl)(Cl)Cc1ccccc1	100101912	MKGYMVCOXXOADK-UHFFFAOYSA-N	209.012	3.857	50	30	BHGC	
CC(C)(C)C(=O)C(C#N)=CC=Cc1ccccc1	2265239508	UULHKJBIYMWYJB-UHFFFAOYSA-N	239.318	3.765	50	30	BHGC	
C[C@H]1C[C@@H](Br)CC(C)(C)C1	57368631	QAIKVKDKYUBKQY-JGVFFNPUSA-N	205.139	3.596	50	30	BHGC	in-vitro
Cc1ccc(O[Si](C)(C)C(C)(C)C)c(N)c1	199271016	WCATVLPEPQRASK-UHFFFAOYSA-N	237.419	3.961	50	30	BHGC	
Br[C@@H]1CC[C@@H](Cc2ccccc2)C1	80503056	IEKSPIAEYIRCLG-NWDGAFQWSA-N	239.156	3.793	50	30	BHGC	
CC1(C)CCC[C@H](CCBr)C1	585143076	ZJLZMBVAFISLMU-SECBINFHSA-N	219.166	3.988	50	30	BHGC	
CCOC(CS(F)(F)(F)(F)F)OCC	1536221802	FXGUULKPUPGLFS-UHFFFAOYSA-N	244.225	3.684	50	30	BHGC	
COc1ccc2cc(CCl)ccc2c1	20077970	JYLGKVDVIPITQM-UHFFFAOYSA-N	206.672	3.587	50	30	BHGC	
C=CC(=O)[C@@H](O[Si](C)(C)C(C)(C)C)C1CC1	950757359	WYKXBFHXJYMHAQ-LBPRGKRZSA-N	240.419	3.542	50	30	BHGC	
BrC[C@@H]1CCC[C@H]2CCCC[C@@H]12	714390982	IAZUDHXWFKHRQX-OUAUKWLOSA-N	231.177	3.988	50	30	BHGC	
C[C@H]1CCC[C@H](CCBr)C1	70567431	SHDXMKOFILDWNS-DTWKUNHWSA-N	205.139	3.598	50	30	BHGC	
CC(C)(C)c1ccc(CCl)c([N+](=O)[O-])c1	1752432	GHFQQNFGCXPTLV-UHFFFAOYSA-N	227.691	3.631	50	30	BHGC	
CC1=C(CC=C(C#N)C#N)C(C)(C)CCC1	39109584	LLTYBYGYQDUTOU-UHFFFAOYSA-N	214.312	3.877	50	30	BHGC	
CCc1ccc([C@@H](C)Br)cc1	57368647	BJLUKSIUZZJFHF-MRVPVSSYSA-N	213.118	3.705	50	30	BHGC	
ClCSCc1ccc(Cl)cc1	39297879	RXWDSKLJNWPMGQ-UHFFFAOYSA-N	207.125	3.770	50	30	BHGC	in-vitro
Cc1ccc(C)c([C@@H](C)Br)c1	57368719	CLKSPDLNWMWBBO-SECBINFHSA-N	213.118	3.759	50	30	BHGC	
Clc1cccc2c1[C@H](Br)CC2	2265384808	LRMBFPBLLRVYBY-SSDOTTSWSA-N	231.520	3.722	50	30	BHGC	
C[C@H](Cl)c1ccccc1Br	57332767	JJYCAISWXYBWPK-LURJTMIESA-N	219.509	3.749	50	30	BHGC	
CC(C)O[C@@H](CBr)c1ccccc1	50479881	FICMACAJGUTHRD-NSHDSACASA-N	243.144	3.548	50	30	BHGC	
ClCc1nc(C2CCCCC2)cs1	61803038	GWCSDDRLXIZTEF-UHFFFAOYSA-N	215.749	3.930	50	30	BHGC	in-vitro
COc1ccc(Cl)cc1[C@@H](C)Cl	123148480	DACBQMVZHIEQJZ-ZCFIWIBFSA-N	205.084	3.648	50	30	BHGC	
ClCc1ccc(C#Cc2ccccc2)cc1	144024240	DRCJBPPGACJPHG-UHFFFAOYSA-N	226.706	3.825	50	30	BHGC	
CC1(C)CCCC[C@H]1CBr	86849626	IUDMLKDDOBZADK-QMMMGPOBSA-N	205.139	3.598	50	30	BHGC	in-vitro
C[C@@H](Br)c1c(F)cccc1Cl	238405262	XOQLHIDMUGDYTA-RXMQYKEDSA-N	237.499	3.935	50	30	BHGC	
CCCCCN(CCCCC)C(=O)CCCl	6042202	CPGRSOKARZSRRS-UHFFFAOYSA-N	247.810	3.824	50	30	BHGC	
CCc1c(N=C=S)ccc2cccnc12	39101790	ANEUCVKUUDWOFV-UHFFFAOYSA-N	214.293	3.532	50	30	BHGC	
O=[N+]([O-])c1ccc(Cl)c(Cl)c1CCl	33975881	ZELSTMZJPQYYOB-UHFFFAOYSA-N	240.473	3.640	50	30	BHGC	
FC(F)(F)[C@@H]1CCCC[C@@H]1CBr	129512927	VTVDLNYWSTZKOE-RNFRBKRXSA-N	245.082	3.750	50	30	BHGC	
ClCC#Cc1cccc(Cl)c1Cl	57840636	TVLIWLDLWQLHJA-UHFFFAOYSA-N	219.498	3.584	50	30	BHGC	
C[C@H](Cl)c1cccc(OC(F)(F)F)c1	300803555	WTDDHNGSXVJYLP-LURJTMIESA-N	224.609	3.885	50	30	BHGC	
Fc1c(Cl)cc(CCl)cc1Cl	306531049	ABJGYZFVLLZQJB-UHFFFAOYSA-N	213.466	3.871	50	30	BHGC	
CCOc1ccc(CBr)cc1Cl	43490402	GEPVISDPSFNIFB-UHFFFAOYSA-N	249.535	3.634	50	30	BHGC	
CC(C)CO[C@H](C)c1nc(CCl)cs1	43519559	FWYGQRBPXHUDJA-MRVPVSSYSA-N	233.764	3.616	50	30	BHGC	in-vitro
Br[C@H](c1ccccc1)c1ccccn1	36894589	ZFTRBKARTSPICK-GFCCVEGCSA-N	248.123	3.566	50	30	BHGC	in-vitro
CC(C)C1CCC(CBr)CC1	85663637	SLGIPQIZUHYPMB-UHFFFAOYSA-N	219.166	3.844	50	30	BHGC	
CCCC/C=C/CCCBr	78215312	VVEGXTQSICTWOQ-AATRIKPKSA-N	205.139	3.908	50	30	BHGC	
N#CC1=C(Cl)c2cc(Cl)ccc2SC1	107627	UQCBSAYYQAFRJJ-UHFFFAOYSA-N	242.130	3.919	50	30	BHGC	
CC(C)Oc1ccc(CCl)cc1Cl	5761003	XZECPLIMOPAQFE-UHFFFAOYSA-N	219.111	3.866	50	30	BHGC	
Fc1ccc2cc(CCCl)c(Cl)nc2c1	11985630	FOEQLOJFXVXRPG-UHFFFAOYSA-N	244.096	3.809	50	30	BHGC	
CSC(Sc1ccccc1C)=C(C#N)C#N	15444232	CZWGAWFKACRSRA-UHFFFAOYSA-N	246.360	3.709	50	30	BHGC	
C[C@H](CCCC(=O)O)O[Si](C)(C)C(C)(C)C	218217564	PANDHPGJJCZSJZ-SNVBAGLBSA-N	246.423	3.652	50	30	BHGC	
CC(C)(C)CC(C)(C)OOC(C)(C)C	79185699	POHYRDMTJGJYHH-UHFFFAOYSA-N	202.338	3.948	50	30	BHGC	
C[C@H](CBr)C1CCCCC1	84193715	WCNNMAMPZBDYJU-MRVPVSSYSA-N	205.139	3.598	50	30	BHGC	in-vitro
Cc1cnc(CCl)c(C)c1CC(F)(F)F	90500504	PNWIIMKCJYBTAU-UHFFFAOYSA-N	237.652	3.542	50	30	BHGC	
Cc1cc(F)ccc1[C@H](C)Br	306500871	ZFUBAPHOPDBCNN-ZETCQYMHSA-N	217.081	3.590	50	30	BHGC	
BrC[C@@H]1CCC[C@@H]2CCCC[C@H]21	714390980	IAZUDHXWFKHRQX-GARJFASQSA-N	231.177	3.988	50	30	BHGC	
CCCCCCCC[C@H]1C[C@@H](Cl)C(=O)O1	103843343	ZOXNPTSGQCZQGA-WDEREUQCSA-N	232.751	3.660	50	30	BHGC	
Cc1ccc(Cl)c(CBr)c1	84845538	POHFEJVKQQYINK-UHFFFAOYSA-N	219.509	3.543	50	30	BHGC	in-vitro
ClCOc1ccc(Cl)c(Cl)c1	86491169	WTHHCOROBIAQNP-UHFFFAOYSA-N	211.475	3.569	50	30	BHGC	in-vitro
CC[C@@H](Br)C1CCCCC1	86164451	OJGPQTDRLMZKFW-SECBINFHSA-N	205.139	3.740	50	30	BHGC	
F[C@@H](Cl)C(F)(F)C(Cl)(Cl)Cl	117728356	VCARXVNAFDSAFZ-PVQJCKRUSA-N	235.847	3.526	50	30	BHGC	
Cc1ccc(-c2nnc([C@H](C)Cl)o2)cc1C	35658322	RMAPOTKJMHDVEC-VIFPVBQESA-N	236.702	3.653	50	30	BHGC	in-vitro
Cc1cc(C2CC2)ccc1CBr	2265384825	UGRHDSMKHXACLI-UHFFFAOYSA-N	225.129	3.767	50	30	BHGC	
Fc1c(F)c(Cl)c(F)c(CCl)c1F	86862926	UIWJXEAMDJCNOV-UHFFFAOYSA-N	232.991	3.635	50	30	BHGC	
Fc1cccc2ccc(CBr)cc12	138070574	MJQGSFBZQHOEAA-UHFFFAOYSA-N	239.087	3.874	50	30	BHGC	
C[C@H](Br)c1ccc(Cl)c(F)c1	307674340	DRYODLAPDPIMQU-YFKPBYRVSA-N	237.499	3.935	50	30	BHGC	
N#CC(C#N)=C1C=C(O)c2cc3ccccc3cc21	2265385673	BOZRNLDJMOQKCL-UHFFFAOYSA-N	244.253	3.553	50	30	BHGC	
C[C@@H]1CC(O[Si](C)(C)C)C[C@@H](C)C1	195771965	RNBPOOCUZHNIIM-UWVGGRQHSA-N	200.398	3.663	50	30	BHGC	
Br[C@H]1CCCCc2ccccc21	57368603	IJZYOXSLTXQZMK-NSHDSACASA-N	225.129	3.849	50	30	BHGC	in-vitro
Cc1ccc(-c2csc(CCl)n2)cc1	22864460	OCCQMMOOYUNWAB-UHFFFAOYSA-N	223.728	3.857	50	30	BHGC	in-vitro
Cc1ccc([C@H](C)Br)c(C)c1	57368574	YGMTVRMSZMAJAB-VIFPVBQESA-N	213.118	3.759	50	30	BHGC	in-vitro
BrCCCCCCC1CC1	139792225	ZKQLRWWYLPHVKH-UHFFFAOYSA-N	205.139	3.742	50	30	BHGC	
Cc1nc2ccccc2n1CCCCCCl	37393689	USXHHDVZYBPRFT-UHFFFAOYSA-N	236.746	3.754	50	30	BHGC	in-vitro
O=C(F)c1ccc(C2CCCCC2)cc1	39057264	UXNCJHMRWYHGGL-UHFFFAOYSA-N	206.260	3.844	50	30	BHGC	
ClCCSc1ccccc1Cl	1737172	HYBSVQIBUYRISZ-UHFFFAOYSA-N	207.125	3.671	50	30	BHGC	
CCCSc1cccc(CCl)c1	225923582	NMCIJTZSNNQZEM-UHFFFAOYSA-N	200.734	3.928	50	30	BHGC	
CC[C@@H](C)c1ccccc1OC(=O)Cl	33506664	HHRQQKZGRTXSHV-MRVPVSSYSA-N	212.676	3.938	50	30	BHGC	
CCCN(CCC)C(Cl)(Cl)[C@H](C)Cl	223655892	CWXWOQXRKBZXRR-QMMMGPOBSA-N	246.609	3.867	50	30	BHGC	
CCc1ccc([C@H](C)Br)cc1	57368649	BJLUKSIUZZJFHF-QMMMGPOBSA-N	213.118	3.705	50	30	BHGC	
BrC[C@H]1CCC=CCCC1	204955049	HGTVLUGMSRTWIB-VIFPVBQESA-N	203.123	3.518	50	30	BHGC	
Cc1nc([C@H](Cl)c2ccccc2)oc1C	30678476	HJTHRYJGVOYVAN-LLVKDONJSA-N	221.687	3.620	50	30	BHGC	
CC1(C)CCCC[C@@H]1CBr	86849625	IUDMLKDDOBZADK-MRVPVSSYSA-N	205.139	3.598	50	30	BHGC	in-vitro
Cc1ccc([C@@H](C)Br)cc1C	57368659	IVLRQCRVLIXRFV-SECBINFHSA-N	213.118	3.759	50	30	BHGC	
Fc1ccc(-c2csc(CCl)n2)cc1	45206553	OGWDYEQKXRUKQT-UHFFFAOYSA-N	227.691	3.688	50	30	BHGC	
Cl[C@H]1CCc2c(Br)cccc21	82420092	NRJRPZZLWBIXEK-VIFPVBQESA-N	231.520	3.675	50	30	BHGC	in-vitro
O=C=Nc1ccccc1Sc1ccccc1	22008750	OBIGPOGFLBZPFB-UHFFFAOYSA-N	227.288	3.805	50	30	BHGC	
C[C@@H](Cl)c1ncc(-c2ccc(F)cc2)o1	36903628	LUCKCSQWLOVHJS-SSDOTTSWSA-N	225.650	3.781	50	30	BHGC	
Cc1cc(OC(=O)Cl)cc(C(C)C)c1	38171397	BBPDRHBZXDFJBM-UHFFFAOYSA-N	212.676	3.856	50	30	BHGC	
Cc1ccc(CBr)cc1Cl	63022189	UUSSRNTYMIAEKD-UHFFFAOYSA-N	219.509	3.543	50	30	BHGC	in-vitro
C[C@H](Br)Cc1cccc(Cl)c1	59978114	DGLUSFUOBLYDBJ-ZETCQYMHSA-N	233.536	3.666	50	30	BHGC	
C[C@@H](Br)c1c(F)cc(F)cc1F	58144797	QVJZQPICUDKELK-SCSAIBSYSA-N	239.034	3.560	50	30	BHGC	in-vitro
C[C@@H](Cl)c1ncc(-c2ccccc2)o1	36903596	RVYHBDYRUCDABI-MRVPVSSYSA-N	207.660	3.641	50	30	BHGC	in-vitro
BrCCC1C2CC3CC(C2)CC1C3	237976047	IAUQFFPEHLZWAW-UHFFFAOYSA-N	243.188	3.844	50	30	BHGC	
C[C@H](Br)[C@@H](C)c1cccs1	85664880	PWZPZAQAXNOCPR-RQJHMYQMSA-N	219.147	3.635	50	30	BHGC	
ClCc1ccnc(Oc2ccccc2)c1	40886806	OXGJRPFCJDFPJL-UHFFFAOYSA-N	219.671	3.613	50	30	BHGC	
C[C@@H](CCCC(=O)O)O[Si](C)(C)C(C)(C)C	218370290	PANDHPGJJCZSJZ-JTQLQIEISA-N	246.423	3.652	50	30	BHGC	
BrCCCCOC1CCCCC1	36949703	UEFLTNYXNXMBOL-UHFFFAOYSA-N	235.165	3.511	50	30	BHGC	
ClCc1cc(-c2cccc(Cl)c2)on1	84198999	ZBQRBMNCZWHELX-UHFFFAOYSA-N	228.078	3.734	50	30	BHGC	
ClCCCCc1ccc(Cl)cc1	49701586	KKLHXEZIZGHURP-UHFFFAOYSA-N	203.112	3.902	50	30	BHGC	
Cc1cc(C(C)(C)C)ccc1/C=C/C=O	38611186	CYWMBZBRXXZCFS-AATRIKPKSA-N	202.297	3.505	50	30	BHGC	
BrC[C@@H]1CCC[C@@H]2CCCC[C@@H]21	714390979	IAZUDHXWFKHRQX-DCAQKATOSA-N	231.177	3.988	50	30	BHGC	
Cc1ccc2c(C(=O)Cl)cccc2c1	39057292	TWEBOZKXUXHQEX-UHFFFAOYSA-N	204.656	3.527	50	30	BHGC	
CCCCC[C@H](Br)C1CC1	71008409	VXBZBFPNAOCQBY-VIFPVBQESA-N	205.139	3.740	50	30	BHGC	
CCCN(CCC)C(Cl)(Cl)[C@@H](C)Cl	223655837	CWXWOQXRKBZXRR-MRVPVSSYSA-N	246.609	3.867	50	30	BHGC	
ClC1=NC(Cl)=NP(Cl)(Cl)=N1	100120594	BTFHFFNLENSKQC-UHFFFAOYSA-N	238.829	3.613	50	30	BHGC	
CN(C(=O)Cl)c1ccc(C(F)(F)F)cc1	138296892	GTIVZCWEXGXSGT-UHFFFAOYSA-N	237.608	3.500	50	30	BHGC	
CC(C)(F)c1ccccc1CBr	107268589	JRCBAYUVVKOSBJ-UHFFFAOYSA-N	231.108	3.786	50	30	BHGC	
BrCC/C=C/CCc1ccccc1	86570091	DMQWIYJNNSABEW-OWOJBTEDSA-N	239.156	3.960	50	30	BHGC	
BrC[C@@H]1CCC=CCCC1	204955078	HGTVLUGMSRTWIB-SECBINFHSA-N	203.123	3.518	50	30	BHGC	
C[C@@H](Cl)c1ccc(Br)cc1	49707253	GRBCXCXQMLHBTA-ZCFIWIBFSA-N	219.509	3.749	50	30	BHGC	in-vitro
FC(F)(F)C1CCC(Br)CC1	82862633	CTEBWBSBKSFIMN-UHFFFAOYSA-N	231.055	3.502	50	30	BHGC	
CCC1CCC(CBr)CC1	59087099	GTTAKDFRWSHWKT-UHFFFAOYSA-N	205.139	3.598	50	30	BHGC	
BrC[C@@H]1CCC[C@H]2CCCC[C@H]12	714390983	IAZUDHXWFKHRQX-VWYCJHECSA-N	231.177	3.988	50	30	BHGC	
C[C@H](Cl)c1nnc(-c2ccccc2)s1	84097374	WLIBZUFUBAZOAJ-ZETCQYMHSA-N	224.716	3.505	50	30	BHGC	
FC(F)(F)C1(CBr)CCCCC1	409425098	JWEZCCBUISMUCB-UHFFFAOYSA-N	245.082	3.894	50	30	BHGC	
C=CCC1(CBr)CCCC1	237972109	SWYBYXKJBKFOLT-UHFFFAOYSA-N	203.123	3.518	50	30	BHGC	
CCCC1CCC(CBr)CC1	66352112	FNUWTRXUMODLEK-UHFFFAOYSA-N	219.166	3.988	50	30	BHGC	in-vitro
FC(F)(F)Oc1ccc(Cl)c(CCl)c1	238534835	NSYFZJSOVVWENA-UHFFFAOYSA-N	245.027	3.977	50	30	BHGC	
CCC/C(=N/NC(=O)OC(C)(C)C)C(C)(C)C	642880613	AEJUKOHGKAAZHP-UVTDQMKNSA-N	242.363	3.713	50	30	BHGC	
CCOC(=O)CCCCCCCCCCl	33605815	GTKQAXQUIOBEBP-UHFFFAOYSA-N	234.767	3.909	50	30	BHGC	
ClCc1nc2cc(Cl)cc(Cl)c2[nH]1	238536568	RRJAYWWECNYGRS-UHFFFAOYSA-N	235.501	3.609	50	30	BHGC	
Fc1cc(CBr)cc2ccccc12	238586616	UJKZXFBULXGGIC-UHFFFAOYSA-N	239.087	3.874	50	30	BHGC	
CCCCN(CCCl)c1ccccc1	5138939	NBTVRDMLLMEWOF-UHFFFAOYSA-N	211.736	3.532	50	30	BHGC	
C[C@@H]1CCC[C@@H](CCBr)C1	70567432	SHDXMKOFILDWNS-BDAKNGLRSA-N	205.139	3.598	50	30	BHGC	
FC(F)(F)c1csc(CCl)c1	584646431	TXMQIXZANVWTNS-UHFFFAOYSA-N	200.612	3.506	50	30	BHGC	
CC(C)(C)[Si](C)(C)Oc1ccccc1CO	195999829	QGLGKWGDMQCBHP-UHFFFAOYSA-N	238.403	3.563	50	30	BHGC	
Cl[C@@H]1CCc2c(Br)cccc21	82420094	NRJRPZZLWBIXEK-SECBINFHSA-N	231.520	3.675	50	30	BHGC	in-vitro
ClCc1ccc(Br)c(Cl)c1	84192663	YFEABSOSDPYMCL-UHFFFAOYSA-N	239.927	3.841	50	30	BHGC	
CCC1=C(C)C(=C(C#N)C#N)C(C)=C(CC)O1	39102806	LMRBTJXTDRXQTD-UHFFFAOYSA-N	228.295	3.728	50	30	BHGC	
O=C(Cl)c1ccccc1C(Cl)Cl	111890299	ZEPFJTAUOKYKKX-UHFFFAOYSA-N	223.486	3.542	50	30	BHGC	
OCCc1ccc(-c2ccccc2)c(CCl)c1	2265362256	VTTUFJQEQUDBMT-UHFFFAOYSA-N	246.737	3.627	50	30	BHGC	
C[C@H](Br)[C@H](C)c1cccs1	85664882	PWZPZAQAXNOCPR-BQBZGAKWSA-N	219.147	3.635	50	30	BHGC	
CCc1nc(C(C)C)ccc1CBr	95949980	FDCUIBBAWDCAMF-UHFFFAOYSA-N	242.160	3.662	50	30	BHGC	in-vitro
Fc1cc2ccccc2cc1CBr	238545559	PNVMKRRIUGJHLP-UHFFFAOYSA-N	239.087	3.874	50	30	BHGC	
BrCC[C@@H]1CCc2ccccc21	138143934	BUOUZXCRZVKJNT-JTQLQIEISA-N	225.129	3.501	50	30	BHGC	
FC(F)(F)c1sccc1CCl	306838185	WSXPREOMIXIPCG-UHFFFAOYSA-N	200.612	3.506	50	30	BHGC	
CC[C@@H](Br)c1ccc(F)cc1F	58145159	VVVIEAMNBUJAAP-MRVPVSSYSA-N	235.071	3.811	50	30	BHGC	in-vitro
C[C@H](CBr)c1cccc(Cl)c1	84192416	JRRLIRVSHWJACG-SSDOTTSWSA-N	233.536	3.838	50	30	BHGC	in-vitro
Clc1cccc2c1[C@@H](Br)CC2	2265384809	LRMBFPBLLRVYBY-ZETCQYMHSA-N	231.520	3.722	50	30	BHGC	
ClCc1ccc2c3c(cccc13)CC2	83230311	NEEMSAQTCUNZJD-UHFFFAOYSA-N	202.684	3.677	50	30	BHGC	
Fc1cc(C(F)(F)F)c(F)cc1CCl	238853096	IJQSHVIPDFBCDF-UHFFFAOYSA-N	230.563	3.722	50	30	BHGC	in-vitro
ClCc1cc(Br)c(Cl)s1	227839466	JPRCENJCMQTBGD-UHFFFAOYSA-N	245.956	3.903	50	30	BHGC	
CC(C)[C@H]1CC[C@@H](C)C[C@H]1Br	57368680	MPVONIMKFUZRQI-OPRDCNLKSA-N	219.166	3.842	50	30	BHGC	
FC(F)(F)c1ccc(CCl)s1	141150608	ZYZQOSHCVOEGJN-UHFFFAOYSA-N	200.612	3.506	50	30	BHGC	
C=C(C#N)C(=O)OCCCCCCCCCC	100312092	KWKVJEUILVQMRR-UHFFFAOYSA-N	237.343	3.750	50	30	BHGC	
Cc1cc(C)cc([C@@H](C)Br)c1	116927724	ZQOZWFVEYFQCHD-SECBINFHSA-N	213.118	3.759	50	30	BHGC	
CC(C)[C@H](Br)c1ccccc1	57898079	RHGAFWACIZXDNF-JTQLQIEISA-N	213.118	3.779	50	30	BHGC	in-vitro
CC1(C)CCC[C@@H](CBr)C1	85663607	PRSPXBUWKALTAA-MRVPVSSYSA-N	205.139	3.598	50	30	BHGC	
CCC/C(C=O)=C(/Cl)c1ccc(C)cc1	38635647	RQGOMHKBUMWEHS-SEYXRHQNSA-N	222.715	3.944	50	30	BHGC	
Fc1cccc2scc(CBr)c12	196232310	DAXBQSUETMJEHT-UHFFFAOYSA-N	245.116	3.935	50	30	BHGC	
Cc1ccc([C@H](C)Br)cc1F	59430846	DFCXORLZUNYZKU-ZETCQYMHSA-N	217.081	3.590	50	30	BHGC	
C[C@H](Cl)c1ncc(-c2ccccc2)o1	36903595	RVYHBDYRUCDABI-QMMMGPOBSA-N	207.660	3.641	50	30	BHGC	in-vitro
CCC[Si](OC(C)C)(OC(C)C)OC(C)C	196510179	MQVCTPXBBSKLFS-UHFFFAOYSA-N	248.439	3.610	50	30	BHGC	
C[C@H]1C[C@H](Br)CC(C)(C)C1	57368626	QAIKVKDKYUBKQY-YUMQZZPRSA-N	205.139	3.596	50	30	BHGC	in-vitro
O=C(Cl)Oc1cc(Cl)cc(Cl)c1	95829678	HRINFEIZZPVYIB-UHFFFAOYSA-N	225.458	3.731	50	30	BHGC	
C/C(C=O)=C\CC[C@@]1(C)C2C[C@H]3[C@@H](C2)C31C	96332060	SHEUEEZGXLCROM-BMQZFBHHSA-N	218.340	3.594	50	30	BHGC	
CC(=O)[C@H](Cl)c1cccc(C(F)(F)F)c1	22013059	RXYVNNWGXQRJAC-VIFPVBQESA-N	236.620	3.574	50	30	BHGC	
Cc1sc(CCl)cc1Br	227823446	RCTYNQFXEYUELB-UHFFFAOYSA-N	225.538	3.558	50	30	BHGC	
C[C@H](Br)CCSc1ccccc1	75767563	OSLOPHWGPPAUMM-VIFPVBQESA-N	245.185	3.952	50	30	BHGC	in-vitro
FC(F)(F)[C@H]1CCC[C@@H](Br)C1	82863023	VGLLQVQRQBLTMP-NTSWFWBYSA-N	231.055	3.502	50	30	BHGC	
CCCCC[C@@H](Br)C1CC1	71008411	VXBZBFPNAOCQBY-SECBINFHSA-N	205.139	3.740	50	30	BHGC	
CSC(SC)=C(C#N)c1ccccc1	79586	RZAGRLQAPVTYSB-UHFFFAOYSA-N	221.350	3.605	50	30	BHGC	
C[C@H](Br)c1ccc2c(c1)CCC2	58145673	BOANVGUSBSJUMW-QMMMGPOBSA-N	225.129	3.631	50	30	BHGC	
C[C@H](Br)c1ccc(F)c(F)c1F	221299966	QMTCCHAQLOEYBT-BYPYZUCNSA-N	239.034	3.560	50	30	BHGC	
BrC[C@@H]1CC[C@@H](c2ccccc2)C1	299805382	LMAGRRQDKLESNL-ZYHUDNBSSA-N	239.156	3.965	50	30	BHGC	
C[C@@H](Cl)c1nnc(-c2cccc(F)c2)s1	84097372	OLTWIJTXBDLEPI-ZCFIWIBFSA-N	242.706	3.644	50	30	BHGC	in-vitro
ClCc1cnoc1-c1ccc(Cl)s1	82164043	MOWXKEIRBCMEBE-UHFFFAOYSA-N	234.107	3.795	50	30	BHGC	
ClCc1cnoc1-c1ccc(Cl)cc1	82164097	ZXUYYBNMKWMNHQ-UHFFFAOYSA-N	228.078	3.734	50	30	BHGC	in-vitro
C[C@@H](Br)c1ccc(Cl)c(F)c1	307674339	DRYODLAPDPIMQU-RXMQYKEDSA-N	237.499	3.935	50	30	BHGC	
CC(C)(C)c1ccc(CCBr)cc1	60712477	AZDUTYBFMRTGFJ-UHFFFAOYSA-N	241.172	3.922	50	30	BHGC	
CC(C)(C)[Si](C)(C)Oc1ccccc1N	197920125	XEGANPFFEYCJEM-UHFFFAOYSA-N	223.392	3.653	50	30	BHGC	
ClC[C@H]1Sc2ccccc2[C@H]1Cl	195778710	YBJYDZIULVFOOA-RKDXNWHRSA-N	219.136	3.680	50	30	BHGC	
C[C@@H]1C[C@@H](Br)CC(C)(C)C1	57368628	QAIKVKDKYUBKQY-HTQZYQBOSA-N	205.139	3.596	50	30	BHGC	in-vitro
BrC[C@H]1CCCCc2ccccc21	85663673	SKYFBQBTOJFAAH-LLVKDONJSA-N	239.156	3.892	50	30	BHGC	
CC(=O)c1cc(-c2ccccc2)oc1CCl	36373599	VNKATXNPMLRQQQ-UHFFFAOYSA-N	234.682	3.888	50	30	BHGC	
CCC[C@H]1CC[C@H](C(=O)Cl)[C@@H](C)C1	39057158	SZIZQSQCYGTZCJ-GUBZILKMSA-N	202.725	3.604	50	30	BHGC	
Cc1nc([C@@H](Cl)Cc2ccccc2)oc1C	30678479	BEFCPDZTRABISB-LBPRGKRZSA-N	235.714	3.814	50	30	BHGC	
C=C(C)C(=O)[C@H](C)O[Si](C)(C)C(C)(C)C	299805351	JYLKRVNTPRUTRK-JTQLQIEISA-N	228.408	3.542	50	30	BHGC	
C[C@@H](Cl)c1ccccc1Br	57332769	JJYCAISWXYBWPK-ZCFIWIBFSA-N	219.509	3.749	50	30	BHGC	
FC(F)(F)Oc1ccc(CCl)c(Cl)c1	87489305	AXUGZCDBBXQJIE-UHFFFAOYSA-N	245.027	3.977	50	30	BHGC	
CC(C)(C)[Si](C)(C)Oc1cccc(CO)c1	195995535	SIGXMQNKJVKPQJ-UHFFFAOYSA-N	238.403	3.563	50	30	BHGC	
BrC[C@@H]1CC[C@@H]2CCCC[C@H]2C1	123524035	ZBYQKIUHQHOHLQ-VWYCJHECSA-N	231.177	3.988	50	30	BHGC	
FC(F)C[C@H](CBr)c1ccccc1	710440105	WPINRYNHNWRLPG-SECBINFHSA-N	249.098	3.820	50	30	BHGC	
O=C(Cl)[C@@H]1CCC2(CCCCCC2)C1	39055871	HZGJMMJPEYTLBW-SNVBAGLBSA-N	214.736	3.893	50	30	BHGC	
ClCSc1ccc(Br)cc1	3609648	BKWAYMAOVGORCE-UHFFFAOYSA-N	237.549	3.738	50	30	BHGC	
Cc1cc(Cl)cc(CBr)c1	84193152	CUKRIDTZJKXGKH-UHFFFAOYSA-N	219.509	3.543	50	30	BHGC	in-vitro
C=C(C)C(=O)[C@@H](C)O[Si](C)(C)C(C)(C)C	299805352	JYLKRVNTPRUTRK-SNVBAGLBSA-N	228.408	3.542	50	30	BHGC	
CC1(C)CCC[C@@H](CCBr)C1	585143079	ZJLZMBVAFISLMU-VIFPVBQESA-N	219.166	3.988	50	30	BHGC	
CC1(CBr)CCCCCC1	306975166	XXSPDBXGWYYCSW-UHFFFAOYSA-N	205.139	3.742	50	30	BHGC	
ClCc1ccc(Oc2ccccc2)nc1	39435267	QXYOFRQSODLPGJ-UHFFFAOYSA-N	219.671	3.613	50	30	BHGC	
C[C@H](Br)c1cccc(Cl)c1F	95883869	HTGPZZDWBXMVEM-YFKPBYRVSA-N	237.499	3.935	50	30	BHGC	
CC(C)O[C@H](CBr)c1ccccc1	50479882	FICMACAJGUTHRD-LLVKDONJSA-N	243.144	3.548	50	30	BHGC	
CC(C)Cc1ccccc1CBr	148713366	ZRKVSNMWWWCXCZ-UHFFFAOYSA-N	227.145	3.780	50	30	BHGC	
Clc1oc2ccccc2c1CBr	521398944	SVGKSUBDZYVPIW-UHFFFAOYSA-N	245.503	3.981	50	30	BHGC	
CCc1ccc(-c2cnc(CCl)o2)cc1	36160926	DSMWFXFAQGOAQE-UHFFFAOYSA-N	221.687	3.643	50	30	BHGC	
C#CCO[Si](C(C)C)(C(C)C)C(C)C	195918537	GDMMKNMZUUYBMK-UHFFFAOYSA-N	212.409	3.812	50	30	BHGC	in-vitro
CC(C)(C)[C@H]1CC(C=O)=C(Cl)/C(=C/O)C1	100327011	WZGNXTLANSENNA-QEHWCHDUSA-N	228.719	3.576	50	30	BHGC	
O=C(Cl)[C@@H]1C/C=C\CC/C=C\CCC1	39057508	POCBECWMEMOUGE-GBFLRDACSA-N	212.720	3.835	50	30	BHGC	
[N-]=[N+]=Nc1ccc(CBr)cc1	36456467	ZEGXJLLXAKNJOU-UHFFFAOYSA-N	212.050	3.523	50	30	BHGC	in-vitro
BrC[C@H]1CCC2(CCCCCC2)O1	306149825	DNDWHUZYXKBGPU-SNVBAGLBSA-N	247.176	3.653	50	30	BHGC	
C[C@@H](Br)c1cccc2cccnc12	22149278	GINONTIZGMCESK-MRVPVSSYSA-N	236.112	3.691	50	30	BHGC	
C[C@H](Br)c1cc(F)c(F)c(F)c1	90765057	XROAACRVXSKJOP-BYPYZUCNSA-N	239.034	3.560	50	30	BHGC	
Clc1nc(Cl)c(C(Cl)Cl)s1	101652029	ZCBQZOIVVNSAOK-UHFFFAOYSA-N	236.938	3.926	50	30	BHGC	
FC1(F)CCC(CCBr)CC1	409426320	QABKBGHWPXATLT-UHFFFAOYSA-N	227.092	3.597	50	30	BHGC	
CCCC[C@H](Cl)c1nc(C)c(C)o1	30678492	YJJIQVYIJQBNIK-VIFPVBQESA-N	201.697	3.762	50	30	BHGC	
Clc1ccc2c(c1)CC[C@@H]2Br	90493790	ZBEIEMMSBLROPG-VIFPVBQESA-N	231.520	3.722	50	30	BHGC	
CCCCCCCCOC(=O)C(Cl)Cl	111893495	HBWBXXRQGCFPRB-UHFFFAOYSA-N	241.158	3.694	50	30	BHGC	
CCCC(=O)CCO[Si](C)(C)C(C)(C)C	202937966	XBQPANOEZAITIW-UHFFFAOYSA-N	230.424	3.768	50	30	BHGC	
CCCCCCCCOCBr	2539393	PMGWYOXUKDCMNK-UHFFFAOYSA-N	223.154	3.716	50	30	BHGC	
FC(F)(F)[C@@H]1CCC[C@@H](Br)C1	82863024	VGLLQVQRQBLTMP-PHDIDXHHSA-N	231.055	3.502	50	30	BHGC	
Cc1cn(CCCCl)c2ccccc12	5331160	RYWLWFUOTCVHFQ-UHFFFAOYSA-N	207.704	3.579	50	30	BHGC	
CC(C)[C@H](CBr)c1ccccc1	49781636	KFIMHJPLUHYGGQ-NSHDSACASA-N	227.145	3.821	50	30	BHGC	
CCCCCC/C=C\CBr	51943825	LEFZUVORTWHIMT-FPLPWBNLSA-N	205.139	3.908	50	30	BHGC	
Cc1nc([C@H](Cl)Cc2ccccc2)oc1C	30678481	BEFCPDZTRABISB-GFCCVEGCSA-N	235.714	3.814	50	30	BHGC	
C[C@@H]1CCC[C@H](CCBr)C1	70567430	SHDXMKOFILDWNS-RKDXNWHRSA-N	205.139	3.598	50	30	BHGC	
FC(F)(F)[C@@H]1CCC[C@H](Br)C1	82863026	VGLLQVQRQBLTMP-RITPCOANSA-N	231.055	3.502	50	30	BHGC	
Fc1ccc2cc(CBr)ccc2c1	118549886	FQNISYMJARSLPX-UHFFFAOYSA-N	239.087	3.874	50	30	BHGC	
CC(C)[C@@H](Br)C1CCCCC1	86185231	MROSTGLYKMSTLB-SNVBAGLBSA-N	219.166	3.986	50	30	BHGC	
C[C@@H](Br)CCSc1ccccc1	75767565	OSLOPHWGPPAUMM-SECBINFHSA-N	245.185	3.952	50	30	BHGC	in-vitro
CCCN(CCC)P(=O)(Cl)Cl	100003961	QGTICFYFHGGDJW-UHFFFAOYSA-N	218.064	3.694	50	30	BHGC	
O=C(Cl)c1cccc(COc2ccccc2)c1	12370743	SLHJSNXMTGDBFG-UHFFFAOYSA-N	246.693	3.645	50	30	BHGC	
CC(C)c1ccccc1OOC(C)(C)C	60185207	WVGXBYVKFQJQGN-UHFFFAOYSA-N	208.301	3.919	50	30	BHGC	
C[Si](C)(C)OCc1ccc(Cl)cc1	195768076	NZPAKJILUKYAQV-UHFFFAOYSA-N	214.768	3.692	50	30	BHGC	
ClCCCCOc1cccc2[nH]ccc12	35837470	DBPIEDRTKPMPSN-UHFFFAOYSA-N	223.703	3.566	50	30	BHGC	
ClCc1cc2ccccc2c(Cl)n1	95942565	OCQPIHOCLGAIFB-UHFFFAOYSA-N	212.079	3.627	50	30	BHGC	
CC1=CCCC(C)(C)[C@@H]1CBr	137470158	VHCXFNJDEABDNX-SECBINFHSA-N	217.150	3.764	50	30	BHGC	
O=C/C(=C/Cc1ccccc1)c1ccccc1	6095942	AXZDPAXJQHIRTE-VBKFSLOCSA-N	222.287	3.512	50	30	BHGC	
C[C@@H](Br)Cc1cccc(Cl)c1	59978115	DGLUSFUOBLYDBJ-SSDOTTSWSA-N	233.536	3.666	50	30	BHGC	
ClCc1cc(Cl)c2ccccc2n1	44460303	BEDVIIYPOFMZRE-UHFFFAOYSA-N	212.079	3.627	50	30	BHGC	
O=C(c1ccccc1)c1cccc(CCl)c1	39264223	RKKKOHVIEUYSGK-UHFFFAOYSA-N	230.694	3.656	50	30	BHGC	
CCCCCCCC[C@@H]1C[C@@H](Cl)C(=O)O1	103843338	ZOXNPTSGQCZQGA-GHMZBOCLSA-N	232.751	3.660	50	30	BHGC	
Cc1c(C(=O)Cl)sc2ccccc12	67172045	ZZMQSRGDKWFBJT-UHFFFAOYSA-N	210.685	3.589	50	30	BHGC	
Cc1ccc([C@@H](C)Br)c(C)c1	57368571	YGMTVRMSZMAJAB-SECBINFHSA-N	213.118	3.759	50	30	BHGC	in-vitro
CCC/C(C=O)=C(/Cl)c1ccccc1	38635870	MUMFVCMDWBXRMP-QXMHVHEDSA-N	208.688	3.636	50	30	BHGC	
FC1(F)CCC2(CC1)C[C@H]2CBr	575520009	BXYBFVOFLFIJJA-ZETCQYMHSA-N	239.103	3.597	50	30	BHGC	
CC(C)CO[C@@H](C)c1nc(CCl)cs1	43519557	FWYGQRBPXHUDJA-QMMMGPOBSA-N	233.764	3.616	50	30	BHGC	in-vitro
CC1=CCCC(C)(C)[C@H]1CBr	135884113	VHCXFNJDEABDNX-VIFPVBQESA-N	217.150	3.764	50	30	BHGC	
O=C(Cl)c1ccc(COc2ccccc2)cc1	12370752	FBEGSQLMWXIKQS-UHFFFAOYSA-N	246.693	3.645	50	30	BHGC	
CC(C)Sc1ccc(CCl)cc1	82531404	RVZMKOWZVXAGLT-UHFFFAOYSA-N	200.734	3.926	50	30	BHGC	in-vitro
C[C@@H](Br)c1cccc(Cl)c1F	95883870	HTGPZZDWBXMVEM-RXMQYKEDSA-N	237.499	3.935	50	30	BHGC	
BrC[C@@H]1CC[C@@H]2CCCC[C@@H]2C1	123523785	ZBYQKIUHQHOHLQ-OUAUKWLOSA-N	231.177	3.988	50	30	BHGC	
CC[Si](CC)(CC)O[Si](C)(C)C	195919121	LQCJNLRBPWMYFX-UHFFFAOYSA-N	204.462	3.843	50	30	BHGC	
O=C(Cl)c1ccc(C(Cl)Cl)cc1	104813694	WZAMWGWVEFRVRU-UHFFFAOYSA-N	223.486	3.542	50	30	BHGC	
C[C@@H](Cl)c1nnc(-c2ccccc2F)s1	84097074	OBNLVZRQAJHPEF-ZCFIWIBFSA-N	242.706	3.644	50	30	BHGC	in-vitro
C[C@H](Cl)c1nnc(-c2ccccc2F)s1	84097071	OBNLVZRQAJHPEF-LURJTMIESA-N	242.706	3.644	50	30	BHGC	in-vitro
COc1cc2ccc(CCl)cc2cc1OC	39311975	IFVDZRJPWHFXJV-UHFFFAOYSA-N	236.698	3.596	50	30	BHGC	
Cc1cc(CCl)ccc1N1CCCCC1	50562697	XDTKSZQTUUESND-UHFFFAOYSA-N	223.747	3.724	50	30	BHGC	
FC(F)(F)[C@H]1CCC[C@H](Br)C1	82863025	VGLLQVQRQBLTMP-WDSKDSINSA-N	231.055	3.502	50	30	BHGC	
CC(C)(C)[C@@H]1CC(C=O)=C(Cl)/C(=C/O)C1	100327007	WZGNXTLANSENNA-PCGIRMHASA-N	228.719	3.576	50	30	BHGC	
F[C@H](Cl)C(F)(F)C(Cl)(Cl)Cl	117728359	VCARXVNAFDSAFZ-SFOWXEAESA-N	235.847	3.526	50	30	BHGC	
ClCc1ccc(-c2nccs2)cc1	12370252	BFAWMDHRKPPXSO-UHFFFAOYSA-N	209.701	3.549	50	30	BHGC	in-vitro
CC(C)C1CCC(Br)CC1	54557493	OIRPJYOKZSGEFN-UHFFFAOYSA-N	205.139	3.596	50	30	BHGC	
CCCc1ccccc1CBr	204322960	SFJPMPUBUQLQTE-UHFFFAOYSA-N	213.118	3.534	50	30	BHGC	
Cc1ccc(-c2nnc([C@@H](C)Cl)o2)cc1C	35658321	RMAPOTKJMHDVEC-SECBINFHSA-N	236.702	3.653	50	30	BHGC	in-vitro
ClC[C@@H]1Sc2ccccc2[C@@H]1Cl	195778706	YBJYDZIULVFOOA-IUCAKERBSA-N	219.136	3.680	50	30	BHGC	
C[C@H](Cl)c1nnc(-c2cccc(F)c2)s1	84097368	OLTWIJTXBDLEPI-LURJTMIESA-N	242.706	3.644	50	30	BHGC	in-vitro
Fc1c(F)c(CCl)c(F)c(F)c1Cl	86863197	JFJHGLHUIPYFAE-UHFFFAOYSA-N	232.991	3.635	50	30	BHGC	
BrCC1CC2(C1)CC1(CCC1)C2	1537963501	IBCDLDKLQLLKFP-UHFFFAOYSA-N	229.161	3.742	50	30	BHGC	
O=C(Cl)[C@@H]1[C@H]2CCCCCCCC[C@H]21	256415605	FHDQHGIAYJFAQX-URLYPYJESA-N	214.736	3.748	50	30	BHGC	
CC1(C)CCC(F)(CBr)CC1	1537958175	WSMKUWHOLKZXKP-UHFFFAOYSA-N	223.129	3.690	50	30	BHGC	
C[C@@H](Cl)c1cccc(Br)c1	57332752	OGXGNMHKGZFHMD-ZCFIWIBFSA-N	219.509	3.749	50	30	BHGC	
C[C@H](Br)c1cccc2cccnc12	22149282	GINONTIZGMCESK-QMMMGPOBSA-N	236.112	3.691	50	30	BHGC	
FC(F)(F)[C@@H]1CCCC[C@H]1CBr	129512491	VTVDLNYWSTZKOE-NKWVEPMBSA-N	245.082	3.750	50	30	BHGC	
C[C@H](Br)c1c(F)cccc1Cl	238409168	XOQLHIDMUGDYTA-YFKPBYRVSA-N	237.499	3.935	50	30	BHGC	
C/C(C=O)=C\CC[C@]1(C)C2C[C@H]3[C@@H](C2)C31C	70455037	SHEUEEZGXLCROM-JTGDCOGOSA-N	218.340	3.594	50	30	BHGC	biogenic,in-vitro
C[C@]12C=C[C@@](C)(C(=O)Cl)[C@@]1(C)CCC2	39057490	UPXHKNRQJAPFED-SRVKXCTJSA-N	212.720	3.524	50	30	BHGC	
C[C@@H]1C[C@H](Br)CC(C)(C)C1	57368624	QAIKVKDKYUBKQY-SFYZADRCSA-N	205.139	3.596	50	30	BHGC	in-vitro
C[C@H]1C[C@@H](C)C[C@H](O[Si](C)(C)C)C1	306914454	RNBPOOCUZHNIIM-URLYPYJESA-N	200.398	3.663	50	30	BHGC	
N#C/C(=C\c1cccs1)C(=O)c1cccs1	4322773	HEIVEXHMQZYUID-VQHVLOKHSA-N	245.328	3.599	50	30	BHGC	
Cc1ccc([C@H](C)Br)cc1C	57368661	IVLRQCRVLIXRFV-VIFPVBQESA-N	213.118	3.759	50	30	BHGC	
C[C@@H](Cl)c1nnc(-c2ccccc2)s1	84097378	WLIBZUFUBAZOAJ-SSDOTTSWSA-N	224.716	3.505	50	30	BHGC	
Clc1ccccc1C1(CBr)CC1	49783432	AJBIUZWSIINVHF-UHFFFAOYSA-N	245.547	3.767	50	30	BHGC	
CC(C)[C@@H](Br)c1ccccc1	57898081	RHGAFWACIZXDNF-SNVBAGLBSA-N	213.118	3.779	50	30	BHGC	in-vitro
Clc1ccc2c(c1)CC[C@H]2Br	90493791	ZBEIEMMSBLROPG-SECBINFHSA-N	231.520	3.722	50	30	BHGC	
CCSC(=O)CCO[Si](C)(C)C(C)(C)C	1774020903	ZKJIEFGMORXWIC-UHFFFAOYSA-N	248.464	3.678	50	30	BHGC	
ClCc1cnc(-c2ccc(Cl)cc2)nc1	54857173	HQFCPXMNKKWWCD-UHFFFAOYSA-N	239.105	3.536	50	30	BHGC	in-vitro
BrC[C@@H]1CC[C@H]2CCCC[C@@H]2C1	142722841	ZBYQKIUHQHOHLQ-GMTAPVOTSA-N	231.177	3.988	50	30	BHGC	
CC(C)(C)[Si](C)(C)O[C@@H]1CCCC[C@H]1CO	197303282	RRLGSESJSQXNHX-NWDGAFQWSA-N	244.451	3.559	50	30	BHGC	
Cc1cccc(C)c1[C@@H](C)Br	147653421	VIVJYYUZZPKBCK-SECBINFHSA-N	213.118	3.759	50	30	BHGC	
CC(C)[C@H](Br)C1CCCCC1	86185229	MROSTGLYKMSTLB-JTQLQIEISA-N	219.166	3.986	50	30	BHGC	
Br[C@@H]1CCCCc2ccccc21	57368605	IJZYOXSLTXQZMK-LLVKDONJSA-N	225.129	3.849	50	30	BHGC	in-vitro
FC(F)(F)c1cscc1CCl	307706697	XWFWIKUWYXPNDF-UHFFFAOYSA-N	200.612	3.506	50	30	BHGC	
C[C@H](Br)c1ccc(F)cc1Cl	70602685	QYPROEQDBPKELP-YFKPBYRVSA-N	237.499	3.935	50	30	BHGC	
Fc1cccc2c(CBr)csc12	74942408	WMPVWVRMDCAQGD-UHFFFAOYSA-N	245.116	3.935	50	30	BHGC	
Fc1ccc(-c2cccc(CCl)n2)cc1	95757510	MLSSSJGUWKEASL-UHFFFAOYSA-N	221.662	3.627	50	30	BHGC	
CC(C)(C)[Si](C)(C)O[C@@H]1CCCC[C@@H]1C=O	196122990	HTTWFXHZXOETLO-VXGBXAGGSA-N	242.435	3.766	50	30	BHGC	
CC[C@H](C)c1ccccc1OC(=O)Cl	33506665	HHRQQKZGRTXSHV-QMMMGPOBSA-N	212.676	3.938	50	30	BHGC	
Cc1ccc(C)c([C@H](C)Br)c1	57368722	CLKSPDLNWMWBBO-VIFPVBQESA-N	213.118	3.759	50	30	BHGC	
CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1Br	95930012	MPVONIMKFUZRQI-UTLUCORTSA-N	219.166	3.842	50	30	BHGC	
FC(F)(F)c1ccc(CBr)s1	217597182	RQMHQBOANGFZLA-UHFFFAOYSA-N	245.063	3.662	50	30	BHGC	
FC1(F)CCC2(CC1)C[C@@H]2CBr	575520008	BXYBFVOFLFIJJA-SSDOTTSWSA-N	239.103	3.597	50	30	BHGC	
CN(Cc1cccc2ccccc12)C(=O)Cl	258796523	QRFISVCTUOUECE-UHFFFAOYSA-N	233.698	3.630	50	30	BHGC	
ClCCCCCOc1cccc2[nH]ccc12	138404768	XNELKZGRTJPRRG-UHFFFAOYSA-N	237.730	3.956	50	30	BHGC	
CC[C@H](Br)C1CCCCC1	86164448	OJGPQTDRLMZKFW-VIFPVBQESA-N	205.139	3.740	50	30	BHGC	
BrC[C@@H]1CC[C@H]2CCCC[C@H]2C1	250939874	ZBYQKIUHQHOHLQ-MXWKQRLJSA-N	231.177	3.988	50	30	BHGC	
BrC[C@@H]1CCCCc2ccccc21	85663676	SKYFBQBTOJFAAH-NSHDSACASA-N	239.156	3.892	50	30	BHGC	
C[C@@H](Br)c1ccc(F)cc1Cl	70602686	QYPROEQDBPKELP-RXMQYKEDSA-N	237.499	3.935	50	30	BHGC	
CC1(C)CCC[C@H](CBr)C1	85663605	PRSPXBUWKALTAA-QMMMGPOBSA-N	205.139	3.598	50	30	BHGC	
C=CC(=O)[C@H](O[Si](C)(C)C(C)(C)C)C1CC1	950757358	WYKXBFHXJYMHAQ-GFCCVEGCSA-N	240.419	3.542	50	30	BHGC	
FC(F)(F)[C@H]1CCCC[C@@H]1CBr	129512712	VTVDLNYWSTZKOE-RQJHMYQMSA-N	245.082	3.750	50	30	BHGC	
O=C(Cl)c1ccc(Cc2cccs2)cc1	36047152	AOHWXUBTRWZCOZ-UHFFFAOYSA-N	236.723	3.718	50	30	BHGC	in-vitro
Cc1cccc(C)c1[C@H](C)Br	147653641	VIVJYYUZZPKBCK-VIFPVBQESA-N	213.118	3.759	50	30	BHGC	
CCCC[C@@H](Cl)c1nc(C)c(C)o1	30678490	YJJIQVYIJQBNIK-SECBINFHSA-N	201.697	3.762	50	30	BHGC	
Cc1nc([C@@H](Cl)c2ccccc2)oc1C	30678473	HJTHRYJGVOYVAN-NSHDSACASA-N	221.687	3.620	50	30	BHGC	
ClC1=C(Cl)C(Cl)C(Cl)=C1Cl	2004102	SPEJYXWMSKCTFT-UHFFFAOYSA-N	238.328	3.986	50	30	BHGC	
C[C@@H](CBr)c1cccc(Cl)c1	84192414	JRRLIRVSHWJACG-ZETCQYMHSA-N	233.536	3.838	50	30	BHGC	in-vitro
CC(C)(C)CCCCCBr	2392149	ZUFVFHCSIZGUDV-UHFFFAOYSA-N	207.155	3.988	50	30	BHGC	
C[C@@H](Br)[C@H](C)c1cccs1	85664875	PWZPZAQAXNOCPR-NKWVEPMBSA-N	219.147	3.635	50	30	BHGC	
Br[C@@H](c1ccccc1)c1ccccn1	36894588	ZFTRBKARTSPICK-LBPRGKRZSA-N	248.123	3.566	50	30	BHGC	in-vitro
C[C@@H](Br)c1ccc(F)c(F)c1F	306380043	QMTCCHAQLOEYBT-SCSAIBSYSA-N	239.034	3.560	50	30	BHGC	
ClCCCc1ccccc1Br	60711157	DHDIKCHDLQSPLG-UHFFFAOYSA-N	233.536	3.621	50	30	BHGC	
C[C@H](CCl)OC(=O)Nc1cccc(Cl)c1	2038853	WLKSPGHQGFFKGE-SSDOTTSWSA-N	248.109	3.516	50	30	BHGC	
COc1ccc(C(C)C)cc1CBr	108235418	QQDZACQBEVRYAD-UHFFFAOYSA-N	243.144	3.714	50	30	BHGC	
Clc1cc(CBr)c(Cl)s1	69803750	ZBCJBLZAQDLWHT-UHFFFAOYSA-N	245.956	3.950	50	30	BHGC	
C[C@H](Cl)c1ccc(Br)cc1	49707252	GRBCXCXQMLHBTA-LURJTMIESA-N	219.509	3.749	50	30	BHGC	in-vitro
CCC[C@@H](Br)c1ccccc1	57368730	FYLFBMCBWHXRPW-SNVBAGLBSA-N	213.118	3.923	50	30	BHGC	
ClC[C@H]1Sc2ccccc2[C@@H]1Cl	195778708	YBJYDZIULVFOOA-BDAKNGLRSA-N	219.136	3.680	50	30	BHGC	
Cc1ccc([C@@H](C)Br)cc1F	59430845	DFCXORLZUNYZKU-SSDOTTSWSA-N	217.081	3.590	50	30	BHGC	
C[C@@H](Br)c1c[nH]c2ccccc12	142357073	VFTVULRWXJQVKS-SSDOTTSWSA-N	224.101	3.624	50	30	BHGC	
CC(C)(C)[Si](C)(C)OCCCCCCCO	196045742	JACCIGDFZIRSAH-UHFFFAOYSA-N	246.467	3.951	50	30	BHGC	
CC[C@H](Br)c1cccc(OC)c1	118237531	XEECGKOBNORGAY-JTQLQIEISA-N	229.117	3.541	50	30	BHGC	
Clc1ccc2c(c1)[C@H](Br)CC2	58621138	UOFWMXFFQCFLBJ-SECBINFHSA-N	231.520	3.722	50	30	BHGC	in-vitro
FC(Cl)(Cl)C(F)(F)C(Cl)Cl	78215309	VSPRXIMPHWEJMN-UHFFFAOYSA-N	235.847	3.526	50	30	BHGC	
[N-]=[N+]=Nc1cccc(CBr)c1	196444517	OLSFONZMRDMQLU-UHFFFAOYSA-N	212.050	3.523	50	30	BHGC	
FC(F)C[C@@H](CBr)c1ccccc1	710440106	WPINRYNHNWRLPG-VIFPVBQESA-N	249.098	3.820	50	30	BHGC	
CC1(C)CC2(CC(CBr)C2)C1	1537962849	GJUYTIHTBVMVTO-UHFFFAOYSA-N	217.150	3.598	50	30	BHGC	
C[C@@H](CBr)C1CCCCC1	84193713	WCNNMAMPZBDYJU-QMMMGPOBSA-N	205.139	3.598	50	30	BHGC	in-vitro
O=C(Cl)C1[C@H]2CCCCCCCC[C@H]12	39055903	FHDQHGIAYJFAQX-UWVGGRQHSA-N	214.736	3.748	50	30	BHGC	
CC[C@H](Br)c1ccc(F)cc1F	58145150	VVVIEAMNBUJAAP-QMMMGPOBSA-N	235.071	3.811	50	30	BHGC	in-vitro
C[C@@H](CCl)OC(=O)Nc1cccc(Cl)c1	2038852	WLKSPGHQGFFKGE-ZETCQYMHSA-N	248.109	3.516	50	30	BHGC