smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
O=C(OCc1ccccc1)N1C[C@H]2CCC[C@H]1[C@@H]2CS(=O)(=O)Cl	1536221929	LGKWYJGMNHQOTB-KFWWJZLASA-N	357.859	2.992	70	30	FFIC	
O=C(OCc1ccccc1)N1CCC(F)(F)[C@H](CS(=O)(=O)Cl)C1	757175386	NHUXQFZLWRASOK-LBPRGKRZSA-N	367.801	2.849	70	30	FFIC	
O=C(OCc1ccccc1)N1CC(F)(F)C[C@H]1CS(=O)(=O)Cl	757175218	JQWIMCWPBUYWTJ-NSHDSACASA-N	353.774	2.601	70	30	FFIC	
O=C1CCC(=P(c2ccccc2)(c2ccccc2)c2ccccc2)C(=O)N1	197256333	LQIQVBSIUIGZRU-UHFFFAOYSA-N	373.392	2.590	70	30	FFIC	
O=S(=O)(Cl)c1cc(Br)cc(Br)c1O	216537149	XECJZAWXETVBER-UHFFFAOYSA-N	350.415	2.845	70	30	FFIC	
O=C(OCc1ccccc1)N1C[C@H]2CCC[C@H]1[C@H]2CS(=O)(=O)Cl	1536221928	LGKWYJGMNHQOTB-ILXRZTDVSA-N	357.859	2.992	70	30	FFIC	
C[SiH](C)O[Si](CCC(F)(F)F)(O[SiH](C)C)O[SiH](C)C	199931774	AJXAWLRVWUAJME-UHFFFAOYSA-N	350.634	2.878	70	30	FFIC	
O=S(=O)(Cl)c1cnn(Cc2ccc(Br)c(F)c2)c1	721935075	MLCGYAPXUHSLSS-UHFFFAOYSA-N	353.600	2.761	70	30	FFIC	
CC(C)(C)OC(=O)N1CCN(c2cccc(S(=O)(=O)Cl)c2)CC1	2265383638	ISOUZITUVCKKQQ-UHFFFAOYSA-N	360.863	2.671	70	30	FFIC	
CCOc1cc(N2C(=O)c3ccccc3C2=O)ccc1S(=O)(=O)Cl	100138677	XJQKSQWWEGHFQF-UHFFFAOYSA-N	365.794	2.813	70	30	FFIC	
CCOC(=O)c1cc(Br)c(OC)c(S(=O)(=O)Cl)c1	59228137	OUNCQJNECXLVNL-UHFFFAOYSA-N	357.609	2.562	70	30	FFIC	in-vitro
O=C(OCc1ccccc1)N1CCC(F)(F)[C@@H](CS(=O)(=O)Cl)C1	757175384	NHUXQFZLWRASOK-GFCCVEGCSA-N	367.801	2.849	70	30	FFIC	
O=C(OCc1ccccc1)N1CC(F)(F)C[C@@H]1CS(=O)(=O)Cl	757175217	JQWIMCWPBUYWTJ-LLVKDONJSA-N	353.774	2.601	70	30	FFIC	
O=C(N[C@H](CCS(=O)(=O)Cl)C(F)(F)F)OCc1ccccc1	757175740	WLPAHUUTJKYHFP-SNVBAGLBSA-N	359.753	2.802	70	30	FFIC	
O=C(N[C@@H](CCS(=O)(=O)Cl)C(F)(F)F)OCc1ccccc1	757175739	WLPAHUUTJKYHFP-JTQLQIEISA-N	359.753	2.802	70	30	FFIC