smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
O=C(NCc1ccccc1)O[C@H]1CO[C@@H]2[C@H](OC(=O)OS(=O)(=O)C(F)(F)F)CO[C@H]12	49881496	WOSIHMSPFKVEAI-UMSGYPCISA-N	455.363	1.450	70	1	JDIF	in-vivo
CCCn1c(=O)c2[nH]c(CNC(=O)c3cccc(S(=O)(=O)F)c3)nc2n(CCC)c1=O	12405650	VDVSSKIIVMPSPR-UHFFFAOYSA-N	451.480	1.295	70	1	JDIF	
CCCn1c(=O)c2[nH]c(CNC(=O)c3ccc(S(=O)(=O)F)cc3)nc2n(CCC)c1=O	12405654	IWKAWXIFWZOYGS-UHFFFAOYSA-N	451.480	1.295	70	1	JDIF	
N=c1[nH]c(=NCCCCCNC(=O)c2ccc(S(=O)(=O)F)cc2)[nH]c2nc(-c3ccco3)nn12	1857630835	IJFJBEYLUQTMCS-UHFFFAOYSA-N	488.505	1.284	70	1	JDIF	
CCCn1c(=O)c2[nH]c(CCNC(=O)c3ccc(S(=O)(=O)F)cc3)nc2n(CCC)c1=O	12405655	PZMBKGJZSFEIOM-UHFFFAOYSA-N	465.507	1.337	70	1	JDIF	
CCCn1c(=O)c2[nH]c(CCCNC(=O)c3ccc(S(=O)(=O)F)cc3)nc2n(CCC)c1=O	12405656	NTTROYHIODZBSX-UHFFFAOYSA-N	479.534	1.727	70	1	JDIF	
CCCn1c(=O)c2[nH]c(CCNC(=O)c3cccc(S(=O)(=O)F)c3)nc2n(CCC)c1=O	12405651	QNIVOVVBDSGOEM-UHFFFAOYSA-N	465.507	1.337	70	1	JDIF	
CCCn1c(=O)c2[nH]c(CCCNC(=O)c3cccc(S(=O)(=O)F)c3)nc2n(CCC)c1=O	12405652	NDOXGECHRSCPAH-UHFFFAOYSA-N	479.534	1.727	70	1	JDIF